NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3861 8.3044 120.3494 54.8498 33.3623 174.9352 2 I 3.6290 8.4071 126.3296 61.2618 38.7795 173.1683 3 Q 4.8796 8.3324 124.6025 54.1787 33.7454 173.8098 4 S 5.1282 8.5013 115.7025 56.8577 66.3127 173.3359 5 Q 4.6807 8.9498 121.1725 55.1023 29.7333 175.8478 6 I 4.3966 8.4353 112.4058 60.1616 39.1030 174.7467 7 N 4.9057 7.8337 120.3391 51.0337 40.9636 174.8115 8 R 4.0593 8.6341 123.3901 59.3363 29.3669 178.4391 9 N 4.3408 8.7200 117.6074 55.9567 38.3939 177.2004 10 I 3.6800 7.3877 120.1373 64.7269 37.2353 178.6930 11 R 4.0464 7.9029 117.9615 58.8713 30.0068 178.9557 12 L 4.0035 8.1449 119.2817 57.7416 41.6849 179.1384 13 D 4.3543 8.5205 119.4166 57.1404 40.7533 178.4188 14 L 3.9304 7.9959 120.7136 58.1009 41.9716 178.7532 15 A 4.1514 8.1252 120.7407 55.5279 18.3190 179.3827 16 D 4.2934 8.1390 116.9549 57.3845 40.8870 178.9452 17 A 4.0001 7.9729 121.0724 55.0982 18.3227 179.5380 18 I 3.6532 8.2356 118.7378 64.8106 37.2603 178.7009 19 L 4.0043 8.2857 119.8958 57.4445 41.2873 179.4084 20 L 3.9142 8.0361 120.4303 58.1428 42.0102 178.8654 21 S 4.0299 8.0520 113.0649 61.2353 62.2618 175.7556 22 K 3.7144 8.3113 122.4030 59.6589 31.8344 178.4991 23 A 3.9247 7.9716 120.6659 55.1705 18.1037 179.7606 24 K 3.9393 8.1265 116.1635 59.2274 32.2178 178.9413 25 K 4.1706 8.1841 116.3207 55.6539 32.5641 176.0719 26 D 4.3209 7.6800 117.8024 55.0307 40.1282 173.4091 27 L 5.1670 8.0446 115.6576 53.1711 43.1672 177.3304 28 S 4.6323 8.1876 115.3948 56.9093 66.4327 175.3014 29 F 4.1710 8.3480 121.5093 60.5407 38.7983 177.6034 30 A 4.0635 8.2284 120.2877 55.3834 18.2251 179.4219 31 E 3.9757 8.5700 116.3478 59.5790 29.4135 179.3741 32 I 3.7071 7.6602 119.8364 64.1626 37.4802 177.9537 33 A 4.2293 8.2079 121.5086 53.4586 18.2605 177.2672 34 D 4.4576 7.3610 117.1793 56.1278 41.5011 176.7238 35 G 4.0117 9.0729 114.7119 45.5786 0.0000 173.8579 36 T 4.0527 7.7934 109.3897 61.9939 69.3653 176.3040 37 G 3.9387 8.3810 108.9138 45.3143 0.0000 172.7823 38 L 4.7390 7.5175 118.1672 51.9279 44.9021 176.9356 39 A 4.1848 8.2494 122.6893 51.8595 20.2665 178.3560 40 E 3.8836 8.9426 123.0845 59.6905 29.6788 179.5222 41 A 3.9181 7.9595 120.0775 54.8612 18.4614 179.3423 42 F 3.8808 8.1254 118.7673 61.4582 39.7216 177.4828 43 V 3.6518 8.1854 118.0868 66.2501 31.3207 178.0602 44 T 3.8044 8.1997 115.4628 66.5954 68.2127 176.2284 45 A 3.8305 7.8428 122.3427 55.1387 18.2901 179.5426 46 A 4.2298 7.5487 120.2637 54.8774 18.2648 179.7207 47 L 3.9963 7.7212 116.0833 57.7767 41.7571 178.8849 48 L 4.4922 7.6579 116.0556 54.4032 41.6401 177.3927 49 G 3.8857 8.0655 106.8951 45.8851 0.0000 174.4112 50 Q 4.5226 8.1536 115.8111 55.3361 30.0316 175.1087 51 Q 4.4019 7.4176 115.8970 54.5022 32.9223 172.6043 52 A 4.9670 8.2870 120.8743 50.6085 21.0082 176.3971 53 L 4.7732 8.7571 121.8883 52.6176 43.8629 174.9535 54 P 4.5770 0.0000 0.0000 62.5209 32.3595 177.1855 55 A 3.9884 8.8670 123.6779 55.7896 18.2219 180.0821 56 D 4.2744 8.0795 116.4980 57.2995 40.9420 178.7000 57 A 3.9860 7.9875 120.6487 55.0175 18.5094 179.1886 58 A 3.9565 8.3331 119.6745 55.6388 18.4142 180.1419 59 R 3.8986 8.2686 116.6571 59.1433 30.1692 179.1859 60 L 3.9414 8.0239 120.2436 58.3629 42.1747 179.5276 61 V 3.8171 8.1536 112.6361 64.1405 31.3471 178.8467 62 G 3.6075 8.3306 105.5890 47.5674 0.0000 175.6526 63 A 3.9926 8.2393 123.2329 55.0250 18.2274 179.8991 64 K 3.9933 7.8360 115.4937 58.8579 32.2249 178.5923 65 L 4.3971 7.7389 116.1147 53.1745 42.9940 175.4870 66 D 4.3414 7.6271 116.2609 55.0902 39.8283 173.4964 67 L 4.3410 7.9580 118.1560 53.9611 43.1050 177.8554 68 D 4.6989 8.2807 122.0164 52.8415 41.8223 177.3584 69 E 3.9915 8.5458 118.4121 59.6106 29.3701 179.2026 70 D 4.3594 8.0864 118.4993 57.5046 40.8946 178.9733 71 S 4.1560 8.6896 115.9159 61.6017 62.6315 176.7041 72 I 3.7168 7.5789 121.5299 64.1402 37.1241 177.9771 73 L 4.2197 8.1677 121.2819 58.3001 41.9953 178.8974 74 L 4.0118 8.3065 119.3035 57.9950 41.5042 179.5876 75 L 4.1129 8.0351 118.3554 57.1432 41.3008 178.6778 76 Q 4.7464 7.7124 117.5552 55.5507 29.4410 175.9741 77 M 4.4963 7.2085 120.1725 54.9542 33.1092 176.3962 78 I 4.0272 8.8215 124.5347 60.7370 38.0761 174.3370 79 P 4.6969 0.0000 0.0000 62.2825 32.8525 176.2181 80 L 4.3566 8.2779 123.0479 53.9530 41.5397 176.4429 81 R 4.1649 8.2800 125.0121 55.7209 30.8738 175.1487 82 G 3.0025 8.2817 107.6571 44.9308 0.0000 173.2619 83 C 4.2677 8.0958 122.6758 58.9143 30.6430 174.3726 84 I 4.0487 7.4755 121.9875 60.3215 37.4913 174.7984 85 D 4.4689 8.8972 125.7469 57.0523 41.5150 176.5561 86 D 4.6361 7.2734 115.3669 53.1937 41.4855 174.0823 87 R 4.1746 8.2304 127.0237 56.6311 29.3372 177.0465 88 I 4.0034 7.1911 116.8144 58.2875 38.9174 173.8836 89 P 4.4145 0.0000 0.0000 62.8977 31.7992 176.5492 90 T 4.1848 8.3289 111.4301 63.3874 69.9573 175.5406 91 D 4.4449 7.9966 122.3468 53.3256 42.3896 174.3897 92 P 4.3378 0.0000 0.0000 66.2630 31.2039 178.6037 93 T 3.9453 8.0351 112.4617 67.1462 68.4048 176.1134 94 M 4.4492 8.1781 120.6069 58.5145 31.9631 178.0866 95 Y 3.9841 8.7850 120.0652 60.9035 38.9031 178.0046 96 Q 4.0031 8.2518 118.8617 59.3842 28.3487 179.4397 97 F 4.0476 7.7569 118.0609 60.5855 38.8431 177.1406 98 Y 4.0115 7.8068 118.8325 60.4624 38.5777 177.3189 99 E 3.6564 8.1641 120.7566 59.3644 29.6663 178.3688 100 M 4.0460 8.0809 118.8407 58.8193 31.9557 178.8440 101 L 4.0193 7.3944 117.4928 57.7146 41.5982 179.4171 102 Q 3.7664 7.5621 117.3601 58.5999 28.6088 178.6897 103 V 3.6522 7.6987 118.4366 65.0277 32.1193 176.7973 104 Y 4.6922 8.1507 114.0875 57.2579 38.6172 177.5873 105 G 3.7817 8.1925 109.1202 48.3907 0.0000 176.0261 106 T 4.0134 7.8362 111.9735 64.4416 68.8820 176.7287 107 T 3.8880 7.9109 118.1660 66.4235 68.5042 176.1604 108 L 3.9788 8.4586 121.2755 57.7025 41.6278 179.4248 109 K 3.7682 8.0814 119.0549 59.5116 32.1668 178.5088 110 A 4.0309 8.1525 120.9375 55.3795 18.2929 179.6830 111 L 3.9929 8.2288 117.6703 57.6935 41.5976 179.8490 112 V 3.7901 8.1899 118.7057 66.5271 30.9755 177.8827 113 H 4.9914 8.2599 117.3271 58.3663 28.2853 177.5210 114 E 3.9468 8.1748 120.3009 59.3195 29.6247 178.7137 115 K 3.9438 8.3254 117.5689 57.9382 32.1705 177.2737 116 F 4.0772 9.0703 114.9268 59.7699 41.1444 175.6784 117 G 4.1140 7.6801 104.5760 44.1573 0.0000 171.4143 118 D 4.7082 8.5548 120.0078 53.8291 42.2445 176.6854 119 G 3.6684 7.8485 112.9881 45.6163 0.0000 171.8906 120 I 4.7876 8.1275 114.5117 59.1992 41.7174 174.7420 121 I 4.5884 8.1570 123.9527 60.1336 38.0523 175.6218 122 S 4.2982 9.1406 123.4830 58.0291 63.2181 174.3249 123 A 3.7427 8.5777 128.4968 52.4555 18.8473 177.2141 124 I 4.2191 7.7902 116.3223 63.2264 38.7881 176.9508 125 N 4.7646 7.7862 123.9118 52.2594 38.0023 171.9837 126 F 5.4399 8.0226 122.6856 56.6453 42.6843 172.5494 127 K 4.4915 8.0674 123.7730 54.9727 36.2965 174.7028 128 L 5.3865 8.3553 122.2821 52.3695 45.2538 174.9818 129 D 4.8106 8.3802 122.6730 52.0171 43.2545 173.8035 130 V 4.7400 8.3326 119.4287 61.0644 33.9305 174.3960 131 K 4.6494 9.1548 129.4931 54.3960 35.1559 174.4674 132 K 4.8796 8.6502 128.3338 55.6585 33.4201 175.8315 133 V 4.5875 8.8536 126.3356 60.7463 35.2111 174.2734 134 A 4.4839 8.7325 129.1686 52.1722 19.3860 176.2706 135 D 4.5887 8.9649 122.0203 52.4437 41.9575 175.5891 136 P 4.3857 0.0000 0.0000 65.5040 31.4047 176.5719 137 E 4.2051 8.6245 116.8670 55.4566 29.8586 176.0121 138 G 4.0210 8.6940 107.1631 46.7682 0.0000 175.6575 139 G 3.8340 9.0261 109.6631 44.1668 0.0000 171.5983 140 E 5.2108 8.4251 116.9903 54.6624 33.3210 175.6346 141 R 4.8236 9.4239 120.5726 54.3898 34.3693 174.2229 142 A 5.0224 8.5452 122.8735 50.5903 20.9479 176.6233 143 V 4.1860 9.0076 123.5043 61.4607 33.2983 174.5246 144 I 4.8867 8.4033 129.4341 60.0279 39.1829 175.3338 145 T 4.4751 8.7467 124.9344 61.9877 70.2515 173.7370 146 L 4.7150 8.5226 127.1008 53.3454 43.3783 175.8862 147 D 4.6693 8.6456 124.1609 52.2605 43.1919 174.1948 148 G 4.7402 8.4041 111.4738 42.5933 0.0000 170.4958 149 K 4.3155 8.7955 124.4898 56.1682 33.3973 175.2907 150 Y 4.7863 8.6658 128.4135 57.4580 40.1973 173.7304 151 L 4.6132 8.5935 127.5991 52.0003 44.1052 174.4315 152 P 4.5521 0.0000 0.0000 62.8151 32.3651 175.9446 153 T 4.5279 8.8804 119.0922 62.2308 69.8554 174.1469 154 K 4.6796 8.5030 125.5204 53.4451 35.3434 174.5599 155 P 4.4506 0.0000 0.0000 63.0849 31.9694 176.5729 156 F 4.5094 7.7074 113.7009 57.3734 37.7305 174.2938 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 4.39 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.41 3.63 1.88 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.33 4.88 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.61 0.00 0.00 0.00 0.00 0.00 2.49 2.27 0.00 4 S 8.50 5.13 0.00 3.80 3.77 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 5 Q 8.95 4.68 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 6 I 8.44 4.40 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.67 0.91 0.00 0.00 7 N 7.83 4.91 0.00 2.76 2.67 0.00 0.00 6.94 7.65 0.00 0.00 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 R 8.63 4.06 0.00 2.06 2.26 0.00 3.12 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 9 N 8.72 4.34 0.00 2.84 2.91 0.00 0.00 6.84 7.28 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 10 I 7.39 3.68 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.81 0.91 0.00 0.00 11 R 7.90 4.05 0.00 1.81 1.96 0.00 3.28 0.00 0.00 3.52 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.14 4.00 0.00 1.68 1.71 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.52 4.35 0.00 2.90 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 14 L 8.00 3.93 0.00 1.77 1.85 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.13 4.15 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.14 4.29 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 17 A 7.97 4.00 1.37 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 18 I 8.24 3.65 2.05 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 1.53 0.81 0.95 0.00 0.00 19 L 8.29 4.00 0.00 1.84 1.75 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.04 3.91 0.00 1.77 1.80 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.05 4.03 0.00 3.93 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 22 K 8.31 3.71 0.00 1.82 1.87 0.00 1.11 0.00 0.00 1.17 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.24 7.81 23 A 7.97 3.92 1.37 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 24 K 8.13 3.94 0.00 1.85 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 25 K 8.18 4.17 0.00 1.67 1.82 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.54 7.81 26 D 7.68 4.32 0.00 2.78 2.68 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 27 L 8.04 5.17 0.00 1.53 1.45 0.88 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.19 4.63 0.00 4.04 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 29 F 8.35 4.17 0.00 3.30 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 30 A 8.23 4.06 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 31 E 8.57 3.98 0.00 2.18 2.22 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 2.43 2.32 0.00 32 I 7.66 3.71 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 0.95 0.00 0.00 33 A 8.21 4.23 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.36 4.46 0.00 2.82 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 35 G 9.07 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 36 T 7.79 4.05 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 37 G 8.38 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 0.00 0.00 0.00 38 L 7.52 4.74 0.00 1.71 1.59 1.02 0.67 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 39 A 8.25 4.18 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 40 E 8.94 3.88 0.00 2.08 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 2.43 2.48 0.00 41 A 7.96 3.92 1.31 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 0.00 0.00 42 F 8.13 3.88 0.00 3.20 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 43 V 8.19 3.65 2.17 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 1.05 0.00 0.00 1.13 0.00 0.00 44 T 8.20 3.80 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 45 A 7.84 3.83 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.55 4.23 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 47 L 7.72 4.00 0.00 1.88 1.85 1.13 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.66 4.49 0.00 1.54 1.64 0.74 0.91 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 49 G 8.07 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.15 4.52 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.62 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 51 Q 7.42 4.40 0.00 1.49 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.89 0.00 0.00 0.00 0.00 0.00 1.98 1.30 0.00 52 A 8.29 4.97 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 53 L 8.76 4.77 0.00 1.63 1.65 0.96 0.98 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 54 P 0.00 4.58 0.00 2.09 1.99 0.00 3.71 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 55 A 8.87 3.99 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 56 D 8.08 4.27 0.00 2.71 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 57 A 7.99 3.99 1.37 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 58 A 8.33 3.96 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 59 R 8.27 3.90 0.00 2.01 2.00 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 60 L 8.02 3.94 0.00 1.88 1.84 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.15 3.82 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 0.77 0.00 0.00 1.04 0.00 0.00 62 G 8.33 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.24 3.99 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 64 K 7.84 3.99 0.00 1.93 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 65 L 7.74 4.40 0.00 1.71 1.68 0.96 1.06 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 66 D 7.63 4.34 0.00 2.81 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 67 L 7.96 4.34 0.00 1.67 1.58 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.28 4.70 0.00 2.95 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 69 E 8.55 3.99 0.00 2.00 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 2.40 2.34 0.00 70 D 8.09 4.36 0.00 2.72 2.72 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 71 S 8.69 4.16 0.00 4.03 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.58 3.72 2.00 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 1.57 0.55 0.96 0.00 0.00 73 L 8.17 4.22 0.00 1.87 1.90 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.31 4.01 0.00 1.87 1.71 0.92 0.54 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 75 L 8.04 4.11 0.00 1.89 1.73 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.71 4.75 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.88 0.00 0.00 0.00 0.00 0.00 2.56 2.37 0.00 77 M 7.21 4.50 0.00 1.92 2.12 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.53 0.00 78 I 8.82 4.03 1.88 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 1.47 0.98 0.92 0.00 0.00 79 P 0.00 4.70 0.00 2.12 2.04 0.00 3.75 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 80 L 8.28 4.36 0.00 1.67 1.64 0.91 0.93 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 81 R 8.28 4.16 0.00 1.82 1.88 0.00 3.23 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 82 G 8.28 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.10 4.27 0.00 3.05 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 84 I 7.48 4.05 1.85 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 1.29 0.53 0.87 0.00 0.00 85 D 8.90 4.47 0.00 2.62 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 86 D 7.27 4.64 0.00 2.60 2.48 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 0.00 0.00 0.00 0.00 87 R 8.23 4.17 0.00 1.97 2.04 0.00 3.21 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.19 4.00 1.76 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.76 0.67 0.00 0.00 89 P 0.00 4.41 0.00 2.15 2.03 0.00 3.31 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 90 T 8.33 4.18 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 1.20 0.00 0.00 91 D 8.00 4.44 0.00 2.85 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.34 0.00 2.23 2.14 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 93 T 8.04 3.95 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 1.35 0.00 0.00 94 M 8.18 4.45 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 95 Y 8.78 3.98 0.00 3.18 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Q 8.25 4.00 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.63 2.53 0.00 97 F 7.76 4.05 0.00 3.36 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 98 Y 7.81 4.01 0.00 2.94 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 99 E 8.16 3.66 0.00 1.96 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 2.30 2.37 0.00 100 M 8.08 4.05 0.00 2.15 2.33 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.60 0.00 101 L 7.39 4.02 0.00 1.58 1.54 0.90 1.05 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 0.00 102 Q 7.56 3.77 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.93 0.00 0.00 0.00 0.00 0.00 1.69 2.37 0.00 103 V 7.70 3.65 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 0.86 0.00 0.00 104 Y 8.15 4.69 0.00 3.23 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 0.00 105 G 8.19 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 0.00 106 T 7.84 4.01 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 1.20 0.00 0.00 107 T 7.91 3.89 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 108 L 8.46 3.98 0.00 1.84 1.73 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.08 3.77 0.00 1.83 2.01 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.47 7.81 110 A 8.15 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.23 3.99 0.00 1.79 1.76 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.19 3.79 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 1.05 0.00 0.00 0.96 0.00 0.00 113 H 8.26 4.99 0.00 3.37 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.17 3.95 0.00 2.06 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 2.29 2.33 0.00 115 K 8.33 3.94 0.00 1.72 1.17 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.48 7.81 116 F 9.07 4.08 0.00 2.38 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 0.00 117 G 7.68 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.55 4.71 0.00 2.76 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 0.00 119 G 7.85 3.67 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 0.00 0.00 0.00 120 I 8.13 4.79 1.86 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 1.19 1.21 0.92 0.00 0.00 121 I 8.16 4.59 1.81 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.62 0.93 0.00 0.00 122 S 9.14 4.30 0.00 3.86 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 0.00 123 A 8.58 3.74 0.93 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 0.00 0.00 124 I 7.79 4.22 1.87 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 1.15 0.93 0.93 0.00 0.00 125 N 7.79 4.76 0.00 2.80 2.75 0.00 0.00 6.50 7.71 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 0.00 126 F 8.02 5.44 0.00 3.13 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 0.00 127 K 8.07 4.49 0.00 1.65 1.66 0.00 1.21 0.00 0.00 1.48 0.00 0.00 2.73 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.13 1.12 7.81 128 L 8.36 5.39 0.00 1.54 1.49 1.04 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.38 4.81 0.00 2.68 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 0.00 130 V 8.33 4.74 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 0.84 0.00 0.00 0.90 0.00 0.00 131 K 9.15 4.65 0.00 1.81 1.60 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.34 7.81 132 K 8.65 4.88 0.00 1.83 1.70 0.00 1.94 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.45 7.81 133 V 8.85 4.59 2.09 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 0.90 0.00 0.00 0.94 0.00 0.00 134 A 8.73 4.48 1.24 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 0.00 0.00 0.00 135 D 8.96 4.59 0.00 2.70 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 0.00 136 P 0.00 4.39 0.00 2.08 2.13 0.00 3.72 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 2.04 2.10 0.00 137 E 8.62 4.21 0.00 2.03 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 2.29 2.25 0.00 138 G 8.69 4.02 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 0.00 0.00 0.00 139 G 9.03 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 0.00 140 E 8.43 5.21 0.00 1.82 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 2.21 2.31 0.00 141 R 9.42 4.82 0.00 1.69 1.78 0.00 3.25 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 142 A 8.55 5.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 V 9.01 4.19 2.09 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 1.03 0.00 0.00 0.94 0.00 0.00 144 I 8.40 4.89 1.99 0.00 0.00 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 1.43 0.70 0.93 0.00 0.00 145 T 8.75 4.48 4.40 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 1.18 0.00 0.00 146 L 8.52 4.72 0.00 1.64 1.94 1.01 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.65 4.67 0.00 2.58 2.41 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 0.00 148 G 8.40 4.74 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 0.00 0.00 0.00 149 K 8.80 4.32 0.00 1.94 1.70 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.45 7.81 150 Y 8.67 4.79 0.00 2.75 2.93 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 0.00 151 L 8.59 4.61 0.00 1.43 1.39 0.87 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.55 0.00 2.03 1.92 0.00 3.47 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 153 T 8.88 4.53 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 1.32 0.00 0.00 154 K 8.50 4.68 0.00 1.76 1.73 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.44 7.81 155 P 0.00 4.45 0.00 2.03 1.93 0.00 3.69 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 2.03 2.08 0.00 156 F 7.71 4.51 0.00 3.09 2.95 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