NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3148 8.2644 123.5809 52.1322 20.1095 177.7176 3 R 3.8132 8.0659 123.4945 59.5991 30.1394 175.4529 4 R 3.9659 8.2417 117.3067 58.1131 31.4666 176.2693 5 R 4.6981 7.2268 116.3143 54.3222 34.5298 176.5714 6 R 4.1063 8.4068 118.2913 55.1221 28.1243 175.5043 7 A 3.9055 8.3080 123.5363 51.9634 18.9735 177.5902 8 E 4.1228 8.5533 120.6634 56.1241 30.5204 178.5249 9 V 3.8040 8.1068 122.4229 61.4111 29.2231 172.7534 10 R 3.8418 8.0036 117.3400 55.2460 28.9510 177.0891 11 Q 4.1351 8.4605 123.9984 56.2920 29.7090 175.4586 12 L 4.8912 7.9397 120.9000 52.5184 44.9717 176.6771 13 Q 4.1752 8.4323 120.2322 54.9335 29.3094 174.8335 14 P 4.6551 0.0000 0.0000 62.4049 32.2130 175.5863 15 D 4.5551 8.7634 119.4862 54.4870 41.5975 177.0109 16 L 4.5815 8.6490 123.1071 55.1808 42.2966 177.1604 17 V 4.4613 9.1427 119.4505 63.9180 35.2933 175.4420 18 Y 4.1599 9.8551 120.5600 58.8616 38.6780 176.4342 19 G 4.5407 7.8484 107.4358 46.0257 0.0000 173.1880 20 D 4.8351 8.0201 117.7262 53.1109 43.1771 176.7173 21 V 4.0482 8.1046 113.4580 62.7640 32.6996 178.1256 22 L 3.9817 8.1507 119.5624 58.2644 41.9307 178.6887 23 V 3.2293 7.8498 118.0591 66.7143 31.3578 177.5331 24 T 3.7290 8.1227 114.0788 66.8195 68.1980 175.7158 25 A 3.9518 8.4240 122.3607 55.4924 18.3292 179.4902 26 F 3.8082 8.2317 118.6563 61.4397 39.4090 177.2005 27 I 3.4475 7.4980 119.4873 64.4746 36.6569 177.9578 28 N 4.2267 8.2068 116.1045 56.4787 38.4851 177.2974 29 K 4.0014 7.7542 118.4694 59.2371 32.0960 179.3161 30 I 3.6698 7.3876 119.8041 63.5385 37.5327 176.8696 31 M 4.1648 7.4351 116.4623 55.6142 31.3237 175.7362 32 R 4.5322 7.8783 115.4705 56.0105 32.5592 175.3859 33 D 4.4862 9.2978 117.7736 54.2706 38.8449 173.4897 34 G 3.7317 7.6992 107.0212 45.9585 0.0000 174.8432 35 K 4.6067 7.2359 122.5389 53.7936 33.3567 177.4659 36 K 3.9191 8.0491 120.1753 59.2571 32.7224 176.2087 37 N 4.3125 8.6518 117.5571 54.4996 38.4898 176.1026 38 L 3.8552 8.4097 120.2353 59.1307 41.1511 179.4352 39 A 3.9126 7.7873 120.1478 54.9050 18.1606 179.1012 40 A 3.6941 7.8734 118.2250 54.9805 18.7194 179.6527 41 R 3.9413 8.8842 115.3755 57.6885 29.6134 181.3150 42 I 3.1826 6.2282 123.2498 63.5200 38.3259 176.2450 43 F 4.3189 8.3370 119.9629 61.6514 39.2656 176.7177 44 Y 4.2463 8.1964 116.5261 61.6253 37.5276 178.5877 45 D 4.3729 8.3060 118.6494 57.3727 40.3690 178.5404 46 A 4.0135 7.5551 120.3257 54.1491 18.9389 179.0155 47 C 3.7766 7.6677 114.9094 62.5822 28.3261 176.2559 48 K 4.1170 7.6870 120.1843 59.3857 30.4095 179.1767 49 I 3.9700 7.1529 119.5431 64.3264 37.0278 178.1154 50 I 3.9310 7.4498 119.1471 63.9772 37.6291 177.6776 51 Q 4.1973 8.3974 120.5903 58.5847 28.4894 178.6573 52 E 3.6692 7.3849 116.1672 58.3445 29.6552 178.0179 53 K 4.6591 7.4086 116.0673 55.6204 33.4872 175.7669 54 T 4.5191 8.8281 109.4183 60.8541 71.3792 174.4512 55 G 3.8436 8.5914 111.6790 46.2996 0.0000 173.8578 56 Q 4.2276 7.2344 118.8899 55.4952 29.5214 175.6360 57 E 4.4763 8.3819 119.5229 54.5439 32.0538 174.6177 58 P 4.3073 0.0000 0.0000 66.2047 31.2223 177.9859 59 L 3.8670 8.4021 120.4166 57.5224 41.9301 178.4582 60 K 3.8298 8.2582 118.5660 59.8625 31.9317 178.1405 61 V 3.5997 7.5240 118.1739 66.5900 31.3351 177.2587 62 F 4.2410 8.2795 119.9953 61.0437 39.1149 176.7955 63 K 3.5845 8.6626 118.0437 59.8781 31.8247 179.0002 64 Q 3.8788 8.3889 118.6024 58.9288 29.1444 177.5842 65 A 4.2076 8.0714 122.1388 55.8294 18.3004 179.0829 66 V 3.6448 7.7201 117.2785 64.9173 31.2675 176.9351 67 E 3.9660 8.2135 119.5029 57.7050 30.1551 177.0651 68 N 4.8027 8.9993 116.6441 54.3663 41.0473 175.1034 69 V 4.1045 7.2985 115.3038 62.6730 32.0051 175.6395 70 K 4.1094 7.8456 119.5626 55.8401 32.0958 175.0613 71 P 4.6658 0.0000 0.0000 62.8821 32.0721 175.9171 72 R 4.4855 8.3724 114.6722 56.8970 32.4893 176.2482 73 M 5.0300 8.1709 116.7592 54.1606 35.1566 174.3027 74 E 4.7799 8.6819 121.6564 54.0291 33.4528 175.9733 75 V 3.9979 8.3706 120.4836 63.4120 33.0020 174.7419 76 R 5.0284 7.6731 125.9721 55.9897 34.6434 174.8441 77 S 5.1620 8.7388 119.0397 58.3325 63.6152 173.9113 78 R 4.7365 8.0319 117.3744 55.3979 30.9455 172.8050 79 R 4.1904 8.4127 122.7787 56.1105 31.3076 175.8625 80 V 4.0449 8.5201 124.2156 63.0909 34.2914 175.7196 81 G 4.0001 8.5166 119.2731 45.0838 0.0000 175.2724 82 G 4.3114 7.6007 115.4552 46.1076 0.0000 174.0661 83 A 4.8958 8.3925 122.9886 49.6409 23.5712 176.9574 84 N 4.7601 8.4788 116.8914 52.4714 38.4815 174.7448 85 Y 4.3298 9.0435 121.2471 57.4571 40.1340 174.8864 86 Q 4.5195 8.6902 121.6440 54.8351 29.1688 175.2012 87 V 4.4246 8.8488 125.3420 61.0853 33.8673 174.0785 88 P 5.3217 0.0000 0.0000 61.8584 33.5140 173.3579 89 M 4.1861 8.6072 112.4400 53.5761 31.1909 175.1083 90 E 4.1034 8.2098 121.7680 56.8805 30.1998 176.4148 91 V 4.3800 7.7864 118.4682 60.4394 34.2740 175.6671 92 S 4.2384 8.4877 120.8764 57.6855 63.9495 173.4648 93 P 4.2892 0.0000 0.0000 65.4681 31.3443 178.3330 94 R 4.1201 7.8747 118.7219 58.8595 30.1708 177.7639 95 R 4.2120 7.6344 116.1202 57.9631 30.3384 177.3322 96 Q 3.9562 8.3668 118.1694 58.1461 28.4868 178.1248 97 Q 3.3631 7.8828 117.3149 58.8601 29.9504 179.4556 98 S 3.9841 7.9446 113.5622 62.0103 63.0317 177.2464 99 L 3.3221 7.2234 120.4143 56.6831 41.3038 178.6833 100 A 4.0568 8.0389 121.8392 53.9624 18.5989 179.0600 101 L 3.9999 7.7442 115.4960 58.2092 41.7563 179.6303 102 R 3.8158 7.7726 117.9679 59.7454 29.6878 178.4575 103 W 4.6023 8.3844 118.7381 60.2434 28.9992 177.7796 104 L 4.3594 8.3220 119.0538 57.7098 41.1116 179.2258 105 V 3.4614 7.6476 118.6111 65.4535 31.3149 178.0041 106 Q 4.0712 7.3771 116.5982 59.1204 29.5875 177.0639 107 A 4.1239 9.0488 122.7013 55.0707 18.2498 178.9348 108 A 4.0371 8.8667 119.9430 55.7159 18.2523 179.1927 109 N 4.5965 7.6774 109.7077 54.6565 38.6022 176.4598 110 Q 4.4433 7.8634 119.4764 55.7120 29.7350 175.8642 111 R 4.3714 7.8719 119.7903 54.7119 31.2925 174.4258 112 P 4.4769 0.0000 0.0000 64.7962 31.9902 176.6535 113 E 3.8834 8.1820 116.8467 57.1351 29.7139 177.0895 114 R 3.9797 8.4456 122.7233 58.8141 30.8894 176.9712 115 R 3.8321 8.0674 123.6858 57.0540 29.7715 177.2037 116 A 3.8837 8.5717 128.9097 55.1875 19.0709 179.2560 117 A 4.0330 8.1847 117.2278 55.1157 18.1897 179.7081 118 V 3.4244 8.0991 117.2527 67.1510 31.6201 177.5976 119 R 3.8018 7.8252 115.4710 59.8200 29.7542 178.4166 120 I 3.8185 7.9080 118.2371 64.9697 37.4587 177.8967 121 A 4.0033 8.1467 121.0266 55.8139 18.3447 179.5573 122 H 4.3625 9.1173 114.8998 58.3802 28.6068 177.8618 123 E 4.0283 8.6711 122.2292 59.1551 29.4752 178.5078 124 L 4.0888 8.3926 119.4610 58.4020 41.6092 178.9653 125 M 4.2036 7.9539 118.3119 58.6719 31.8668 178.1760 126 D 4.3291 8.4566 118.2713 58.4661 40.9577 178.3077 127 A 4.1014 8.5092 120.2624 53.5296 18.1625 178.6848 128 A 4.0677 8.7760 121.7472 55.5301 19.0654 178.8906 129 E 4.0056 9.1309 117.0797 56.4346 29.5991 177.7697 130 G 5.2499 7.4061 123.8836 46.1847 0.0000 171.5626 131 K 4.4396 7.3498 118.6302 55.4219 35.5173 176.5462 132 G 4.0498 8.8816 102.3587 45.8258 0.0000 174.3757 133 G 3.8320 8.7126 105.0604 48.1401 0.0000 174.6846 134 A 4.1848 8.1656 121.5456 54.1362 18.0161 179.0358 135 V 3.6573 8.2210 113.8591 63.4836 32.2988 177.5186 136 K 3.9438 7.9590 120.3461 58.7746 31.7627 178.1941 137 K 3.5487 7.8963 122.4146 59.9169 32.0328 177.7627 138 K 4.1563 7.6903 121.0497 58.0988 31.5876 177.4291 139 E 4.0468 8.7384 118.5649 58.1486 29.8573 177.7583 140 D 4.3375 7.7376 117.4649 54.5822 41.9665 177.4024 141 V 3.9970 8.6191 119.1657 65.6705 32.1671 177.0736 142 E 4.1089 8.1966 117.8219 59.9896 29.1290 179.6007 143 R 3.9659 7.3046 115.7277 59.3908 30.0865 178.6127 144 M 4.1580 8.1743 117.6089 58.7610 32.8726 176.8856 145 A 4.2948 7.8882 119.7190 52.0250 21.2404 176.7239 146 E 3.6801 8.7035 116.9525 57.1001 28.5018 174.7181 147 A 4.7073 8.0346 117.3134 52.6653 20.8047 176.8485 148 N 4.8964 7.7678 111.4197 52.8337 40.8652 175.8078 149 R 3.9510 8.0880 117.6130 57.9764 30.0285 176.8049 150 A 4.2840 7.4167 119.0165 53.3701 18.2178 177.3134 151 Y 4.9643 7.6465 115.5138 59.2608 39.2629 177.0432 152 A 4.2471 8.3578 122.4802 53.8997 18.6919 178.6846 153 H 4.7333 8.1767 110.1325 56.1205 29.4276 175.2499 154 Y 5.1251 7.4652 118.5212 57.2014 39.6511 177.6986 155 R 3.7795 8.6687 114.6984 58.8781 29.3547 176.9831 156 W 5.2957 9.1939 125.0007 58.2347 29.9972 174.2883 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 2 A 8.26 4.31 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 3 R 8.07 3.81 0.00 1.85 1.95 0.00 3.23 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 4 R 8.24 3.97 0.00 1.83 1.87 0.00 3.36 0.00 0.00 3.21 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 5 R 7.23 4.70 0.00 1.72 1.77 0.00 3.20 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 6 R 8.41 4.11 0.00 1.80 1.91 0.00 3.25 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 7 A 8.31 3.91 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 8 E 8.55 4.12 0.00 2.07 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 2.27 2.35 0.00 9 V 8.11 3.80 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 0.83 0.00 0.00 0.93 0.00 0.00 10 R 8.00 3.84 0.00 1.95 2.03 0.00 3.09 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 11 Q 8.46 4.14 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 12 L 7.94 4.89 0.00 1.63 1.52 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 13 Q 8.43 4.18 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.03 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 14 P 0.00 4.66 0.00 2.22 2.10 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 15 D 8.76 4.56 0.00 2.93 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 16 L 8.65 4.58 0.00 1.86 1.76 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17 V 9.14 4.46 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.70 0.00 0.00 18 Y 9.86 4.16 0.00 2.97 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 19 G 7.85 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.02 4.84 0.00 2.85 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 21 V 8.10 4.05 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 0.83 0.00 0.00 0.97 0.00 0.00 22 L 8.15 3.98 0.00 1.82 2.12 0.92 0.66 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 23 V 7.85 3.23 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 1.06 0.00 0.00 0.81 0.00 0.00 24 T 8.12 3.73 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 1.23 0.00 0.00 25 A 8.42 3.95 1.41 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 0.00 0.00 26 F 8.23 3.81 0.00 3.24 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 27 I 7.50 3.45 1.77 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.46 0.74 0.00 0.00 28 N 8.21 4.23 0.00 2.72 2.83 0.00 0.00 7.13 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 29 K 7.75 4.00 0.00 1.53 1.61 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.47 7.81 30 I 7.39 3.67 1.94 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.16 0.90 0.00 0.00 31 M 7.44 4.16 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.49 0.00 32 R 7.88 4.53 0.00 1.93 1.98 0.00 3.06 0.00 0.00 3.33 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 33 D 9.30 4.49 0.00 2.84 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 34 G 7.70 3.73 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 0.00 0.00 0.00 35 K 7.24 4.61 0.00 1.75 1.68 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.40 7.81 36 K 8.05 3.92 0.00 1.73 1.86 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.48 7.81 37 N 8.65 4.31 0.00 2.84 2.60 0.00 0.00 6.94 6.66 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 38 L 8.41 3.86 0.00 1.96 1.95 0.96 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.79 3.91 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 40 A 7.87 3.69 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 41 R 8.88 3.94 0.00 2.12 1.81 0.00 3.18 0.00 0.00 3.37 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.78 0.00 42 I 6.23 3.18 2.07 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 1.44 0.92 0.98 0.00 0.00 43 F 8.34 4.32 0.00 3.09 2.94 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 44 Y 8.20 4.25 0.00 3.26 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 45 D 8.31 4.37 0.00 2.94 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 46 A 7.56 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 7.67 3.78 0.00 2.94 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 48 K 7.69 4.12 0.00 1.90 1.82 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.43 7.81 49 I 7.15 3.97 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 1.40 1.02 0.91 0.00 0.00 50 I 7.45 3.93 1.86 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 1.54 1.24 1.01 0.00 0.00 51 Q 8.40 4.20 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.51 0.00 0.00 0.00 0.00 0.00 2.52 2.40 0.00 52 E 7.38 3.67 0.00 1.90 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 2.36 2.42 0.00 53 K 7.41 4.66 0.00 1.73 1.77 0.00 1.65 0.00 0.00 1.94 0.00 0.00 3.21 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.38 7.81 54 T 8.83 4.52 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 1.23 0.00 0.00 55 G 8.59 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 56 Q 7.23 4.23 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 57 E 8.38 4.48 0.00 2.06 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 2.42 2.38 0.00 58 P 0.00 4.31 0.00 2.44 2.53 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.14 0.00 59 L 8.40 3.87 0.00 2.33 1.96 0.89 0.77 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 60 K 8.26 3.83 0.00 1.91 1.87 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.56 7.81 61 V 7.52 3.60 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 1.07 0.00 0.00 1.07 0.00 0.00 62 F 8.28 4.24 0.00 3.07 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 63 K 8.66 3.58 0.00 1.94 1.85 0.00 1.73 0.00 0.00 1.54 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.73 1.69 7.81 64 Q 8.39 3.88 0.00 2.01 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 65 A 8.07 4.21 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 66 V 7.72 3.64 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 0.85 0.00 0.00 0.32 0.00 0.00 67 E 8.21 3.97 0.00 1.93 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 2.31 2.36 0.00 68 N 9.00 4.80 0.00 2.67 2.96 0.00 0.00 6.98 7.59 0.00 0.00 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 V 7.30 4.10 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 1.10 0.00 0.00 1.09 0.00 0.00 70 K 7.85 4.11 0.00 1.77 1.89 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.61 7.81 71 P 0.00 4.67 0.00 2.27 2.32 0.00 3.61 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 72 R 8.37 4.49 0.00 1.78 1.96 0.00 3.21 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 73 M 8.17 5.03 0.00 1.83 1.94 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.33 0.00 74 E 8.68 4.78 0.00 2.07 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 2.25 2.26 0.00 75 V 8.37 4.00 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 0.83 0.00 0.00 0.96 0.00 0.00 76 R 7.67 5.03 0.00 1.76 1.68 0.00 3.03 0.00 0.00 3.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.29 0.00 77 S 8.74 5.16 0.00 3.92 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 78 R 8.03 4.74 0.00 1.97 1.78 0.00 3.74 0.00 0.00 3.07 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.67 0.00 79 R 8.41 4.19 0.00 1.90 1.85 0.00 3.28 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 80 V 8.52 4.04 1.82 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 0.61 0.00 0.00 0.69 0.00 0.00 81 G 8.52 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 0.00 0.00 0.00 82 G 7.60 4.31 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 0.00 83 A 8.39 4.90 1.09 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 84 N 8.48 4.76 0.00 2.79 2.88 0.00 0.00 6.05 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 85 Y 9.04 4.33 0.00 2.75 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 86 Q 8.69 4.52 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 87 V 8.85 4.42 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 1.04 0.00 0.00 0.97 0.00 0.00 88 P 0.00 5.32 0.00 2.19 2.08 0.00 3.56 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 89 M 8.61 4.19 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.08 0.00 90 E 8.21 4.10 0.00 1.96 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 2.31 2.31 0.00 91 V 7.79 4.38 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 0.82 0.00 0.00 0.98 0.00 0.00 92 S 8.49 4.24 0.00 3.93 3.70 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 93 P 0.00 4.29 0.00 2.25 2.17 0.00 3.80 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 1.98 2.02 0.00 94 R 7.87 4.12 0.00 1.94 1.92 0.00 3.11 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 95 R 7.63 4.21 0.00 1.80 1.87 0.00 3.09 0.00 0.00 2.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 96 Q 8.37 3.96 0.00 2.19 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.29 0.00 0.00 0.00 0.00 0.00 2.65 2.47 0.00 97 Q 7.88 3.36 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 98 S 7.94 3.98 0.00 4.07 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 99 L 7.22 3.32 0.00 1.59 0.68 0.74 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.04 4.06 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 0.00 101 L 7.74 4.00 0.00 1.63 1.75 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.77 3.82 0.00 1.86 1.80 0.00 3.08 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 1.70 1.69 0.00 103 W 8.38 4.60 0.00 3.60 3.09 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 0.00 104 L 8.32 4.36 0.00 2.11 2.01 1.25 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.65 3.46 1.86 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 0.89 0.00 0.00 0.05 0.00 0.00 106 Q 7.38 4.07 0.00 2.54 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 107 A 9.05 4.12 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 0.00 108 A 8.87 4.04 1.41 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 0.00 0.00 109 N 7.68 4.60 0.00 2.85 2.88 0.00 0.00 7.13 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 0.00 110 Q 7.86 4.44 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 6.93 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 111 R 7.87 4.37 0.00 1.91 1.92 0.00 3.21 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 112 P 0.00 4.48 0.00 2.19 2.18 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 113 E 8.18 3.88 0.00 1.99 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 2.37 2.36 0.00 114 R 8.45 3.98 0.00 1.81 1.97 0.00 3.22 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 115 R 8.07 3.83 0.00 1.84 1.85 0.00 3.22 0.00 0.00 3.34 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 116 A 8.57 3.88 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 0.00 117 A 8.18 4.03 1.41 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 0.00 0.00 118 V 8.10 3.42 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.90 0.00 0.00 119 R 7.83 3.80 0.00 2.15 1.92 0.00 3.51 0.00 0.00 3.19 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 120 I 7.91 3.82 2.01 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.80 1.29 0.00 0.00 121 A 8.15 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 0.00 122 H 9.12 4.36 0.00 3.35 3.37 0.00 5.64 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.67 4.03 0.00 2.21 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 0.00 2.42 2.52 0.00 124 L 8.39 4.09 0.00 1.78 1.80 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.95 4.20 0.00 2.03 2.31 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.63 0.00 126 D 8.46 4.33 0.00 2.94 2.97 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 0.00 127 A 8.51 4.10 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 0.00 128 A 8.78 4.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.13 4.01 0.00 2.16 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 2.33 2.49 0.00 130 G 7.41 5.25 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 0.00 131 K 7.35 4.44 0.00 1.81 1.79 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.35 7.81 132 G 8.88 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 0.00 0.00 0.00 133 G 8.71 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 0.00 134 A 8.17 4.18 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 0.00 135 V 8.22 3.66 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 0.85 0.00 0.00 1.06 0.00 0.00 136 K 7.96 3.94 0.00 1.97 1.76 0.00 1.56 0.00 0.00 1.47 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.53 7.81 137 K 7.90 3.55 0.00 1.35 1.01 0.00 0.61 0.00 0.00 0.99 0.00 0.00 2.69 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.30 0.91 7.81 138 K 7.69 4.16 0.00 1.97 1.80 0.00 1.77 0.00 0.00 1.81 0.00 0.00 3.11 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.64 1.88 7.81 139 E 8.74 4.05 0.00 2.07 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 2.51 0.00 140 D 7.74 4.34 0.00 2.72 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 0.00 141 V 8.62 4.00 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 1.09 0.00 0.00 1.02 0.00 0.00 142 E 8.20 4.11 0.00 2.06 2.02 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 2.45 2.48 0.00 143 R 7.30 3.97 0.00 1.72 2.00 0.00 3.14 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 144 M 8.17 4.16 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 145 A 7.89 4.29 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 0.00 146 E 8.70 3.68 0.00 2.07 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 2.18 2.22 0.00 147 A 8.03 4.71 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 0.00 148 N 7.77 4.90 0.00 2.79 2.94 0.00 0.00 6.76 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 0.00 149 R 8.09 3.95 0.00 1.80 1.85 0.00 3.13 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 150 A 7.42 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.65 4.96 0.00 3.06 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 0.00 152 A 8.36 4.25 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 0.00 153 H 8.18 4.73 0.00 3.28 3.35 0.00 5.50 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.47 5.13 0.00 2.93 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 0.00 155 R 8.67 3.78 0.00 1.91 1.84 0.00 3.43 0.00 0.00 3.22 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.69 0.00 156 W 9.19 5.30 0.00 3.16 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