NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3151 8.3049 120.2764 53.9272 34.5719 175.4432 2 E 4.2176 7.5138 121.0852 54.3502 32.0280 175.5944 3 K 4.4452 8.7874 123.6029 54.9067 31.7337 175.9617 4 K 4.6312 7.5014 121.8904 55.9515 34.8659 176.5019 5 T 5.2873 9.2142 119.1746 61.8707 71.0648 173.6535 6 I 4.8713 8.5291 119.1517 59.0591 41.1821 174.3990 7 V 4.6251 8.7507 124.1706 61.6036 33.4839 174.3649 8 L 5.1561 8.6916 129.3760 53.5777 45.5385 175.5578 9 G 3.9985 8.1993 110.1926 46.0892 0.0000 171.4819 10 V 5.0412 8.3281 119.5163 61.0965 33.8882 174.8721 11 I 4.9323 8.5787 128.0345 59.9614 40.3798 176.4173 12 G 4.1041 8.7892 114.7454 47.4004 0.0000 175.1361 13 S 4.6167 8.8818 120.3318 58.3099 63.1375 172.8344 14 D 4.0358 7.0439 121.7053 53.2521 41.1183 176.3667 15 C 4.4735 8.3681 120.2529 57.9879 30.4112 173.4180 16 H 4.1232 8.6607 119.2353 56.4551 28.6697 174.9166 17 A 4.6568 8.4642 125.4998 51.8946 21.3689 178.2280 18 V 3.6955 7.9857 115.5765 65.9742 31.6513 178.0957 19 G 3.6372 8.0653 105.0603 47.8428 0.0000 174.8131 20 N 4.3237 8.1575 118.9706 56.4478 38.9651 176.7140 21 K 4.0116 7.8996 120.5004 59.3829 32.2923 178.9895 22 I 3.7719 7.8522 120.2978 64.2449 36.9429 178.3682 23 L 4.1560 8.4147 120.3132 57.7856 41.4078 178.9147 24 D 4.3638 8.2280 117.9362 57.7251 41.1006 177.8244 25 H 4.1165 8.4098 118.2871 59.3330 29.9057 177.1036 26 A 3.9715 8.6874 122.9022 55.2550 18.2171 179.6958 27 F 4.0513 8.8933 116.7887 60.7178 38.9762 178.0609 28 T 4.2401 8.2672 116.9930 66.3871 68.1134 176.2831 29 N 4.3094 8.2070 116.6962 56.1455 38.6145 176.6160 30 A 4.2192 7.6743 120.0428 52.1536 19.1237 177.7450 31 G 3.8297 7.8370 104.7355 44.9076 0.0000 173.8638 32 F 4.8297 8.2821 119.3908 56.6854 41.1804 174.9645 33 N 4.7865 9.4324 121.8378 53.0762 39.3852 174.0101 34 V 4.3059 8.3190 127.3524 61.6550 32.7608 175.9013 35 V 3.9505 8.7470 130.3519 61.8608 31.5581 173.6730 36 N 5.2204 8.4434 126.3638 52.1506 38.5819 174.2807 37 I 3.7454 8.7893 120.8371 61.1612 38.6272 177.7661 38 G 3.6786 8.0983 112.0586 44.9904 0.0000 173.3687 39 V 4.2142 8.0608 112.9266 60.7288 32.8674 175.0772 40 L 4.0847 7.7245 117.4181 55.0321 39.6603 175.6209 41 S 4.6334 7.9760 114.4121 56.1377 64.4092 173.2307 42 P 4.8850 0.0000 0.0000 61.9706 32.6820 176.9777 43 Q 4.1467 9.0306 118.2500 59.8134 28.4308 179.7187 44 E 4.0774 8.3149 118.5580 59.4589 29.4787 179.2454 45 L 4.0189 8.1010 118.8830 57.4286 41.7392 179.4285 46 F 4.1489 8.2423 117.9246 60.2844 38.8153 177.7702 47 I 3.8702 7.7035 119.1357 63.8671 37.0849 177.7924 48 K 3.8320 8.2962 120.5388 59.7166 31.9773 178.5932 49 A 3.9367 7.8528 120.0998 55.1430 18.4095 179.4456 50 A 3.9893 7.9809 118.9922 55.1672 18.4997 180.0865 51 I 3.6718 7.8997 118.2992 64.7254 37.1368 178.1250 52 E 4.0197 8.0856 118.4316 59.0936 29.4160 178.7538 53 T 4.4306 7.6365 105.6578 60.0088 70.0841 173.9375 54 K 3.7594 7.9675 119.2517 57.3671 30.2819 175.5066 55 A 4.2699 7.6852 119.7461 52.7113 19.3588 178.1839 56 D 4.7424 9.5321 121.3088 56.0897 42.3885 176.1680 57 A 4.8465 7.5981 118.1867 50.8341 23.0263 175.1096 58 I 4.7886 8.4022 120.6418 59.6044 39.6812 174.9791 59 L 4.8692 9.0834 128.8878 53.3805 43.2241 175.9296 60 V 4.4613 9.1488 125.9206 61.5408 33.1689 174.4633 61 S 5.1847 9.0493 123.5605 57.0508 64.2793 173.0023 62 S 4.4442 9.1760 121.5412 57.4489 64.8853 173.8106 63 L 4.5900 8.9694 127.7549 55.9960 43.2887 177.9043 64 Y 4.3626 8.7103 114.7520 57.4429 38.2651 175.7572 65 G 4.0627 7.9433 108.2454 46.0454 0.0000 174.4808 66 Q 4.4185 7.4646 117.5678 55.7109 28.9516 177.8573 67 G 3.9217 8.1723 109.9584 47.9119 0.0000 176.1216 68 E 3.8700 7.8588 119.0005 59.0103 29.5376 178.6770 69 I 3.9697 7.6620 119.4541 64.3503 37.3461 177.8893 70 D 4.5600 8.1759 118.2358 57.0947 41.0554 177.8834 71 C 4.5284 8.3968 116.3555 59.5787 28.4518 173.6179 72 K 3.8191 7.0523 121.6410 57.7907 32.3225 176.8245 73 G 3.9719 8.9750 114.1572 45.4024 0.0000 174.7704 74 L 3.9916 7.7255 120.8981 57.8978 42.0356 178.5447 75 R 3.6955 7.6955 118.1772 59.5050 29.9449 177.6270 76 Q 3.9125 8.0780 118.6329 59.5922 29.0018 178.9301 77 K 4.0002 7.9614 118.8404 59.5237 31.9997 179.2484 78 C 4.1757 8.3930 117.6556 62.7009 28.0486 175.7782 79 D 4.3207 8.4720 120.9088 57.6028 40.2802 178.8271 80 E 4.0363 8.2029 117.1309 58.7232 29.4765 178.2821 81 A 4.4746 7.6424 118.4300 51.7157 19.0434 177.6405 82 G 4.3646 8.3217 106.0650 45.7457 0.0000 174.1684 83 L 4.7097 8.1624 118.6088 53.5396 42.4931 176.4247 84 E 4.7069 7.6517 117.0764 57.4981 29.7714 178.8595 85 G 3.9273 8.8533 109.5053 45.5726 0.0000 173.7900 86 I 3.7797 7.3659 119.7681 60.8422 38.7691 175.2859 87 L 4.4856 8.0315 125.5308 54.8464 42.9406 176.0625 88 L 5.1729 9.8061 123.4422 53.4519 44.8013 175.0260 89 Y 5.7546 9.0626 122.2632 56.2917 41.3893 175.5494 90 V 5.4219 8.2423 121.4365 59.5127 35.1659 174.6207 91 G 4.3602 8.8099 109.7787 43.5815 0.0000 172.1834 92 G 4.4798 8.9269 105.5290 44.7013 0.0000 176.1304 93 N 5.2687 9.1922 115.5196 51.1211 38.7560 173.8965 94 I 3.9806 7.6728 113.4756 61.9405 38.7919 176.8422 95 V 4.6794 7.3604 112.9348 59.1325 35.1709 174.9562 96 V 3.7002 8.2872 121.3655 63.8717 31.3861 176.7719 97 G 3.9683 8.7073 112.5560 44.5356 0.0000 172.1061 98 K 4.0711 8.2642 120.0092 56.4026 32.3315 175.7304 99 Q 4.6219 8.3505 123.8917 53.9454 32.9521 174.0146 100 H 4.5154 8.6065 118.2219 55.5072 29.8228 175.0433 101 W 4.4400 9.1166 135.0000 60.5159 30.4282 175.6204 102 P 3.9982 0.0000 0.0000 65.8438 30.8210 178.2793 103 D 4.3020 7.9530 117.5396 57.0806 40.6583 179.0715 104 V 3.4698 7.1916 118.3633 65.8248 31.6642 177.4092 105 E 3.3498 7.2107 119.3691 58.9705 29.2975 178.8964 106 K 3.8463 7.7198 118.3552 59.5306 31.9274 179.1162 107 R 3.8511 7.4874 117.0390 59.5373 30.3472 178.0624 108 F 4.1772 8.3171 117.1153 59.7182 38.9935 178.1636 109 K 4.3616 8.1216 119.7682 59.1105 31.6473 178.9981 110 D 4.4002 8.4280 118.2423 57.1187 40.7669 177.9401 111 M 4.3218 7.6211 117.1100 55.5565 32.2535 176.9292 112 G 3.9998 8.0900 108.1019 45.2981 0.0000 173.1858 113 Y 4.2448 7.9484 117.8984 57.3110 38.9104 176.1310 114 D 4.5303 9.3367 125.6248 57.0700 41.6221 177.1261 115 R 4.5419 7.9587 115.3876 54.1735 34.7705 174.4890 116 V 4.7255 7.8181 120.8036 61.3933 33.8421 174.0245 117 Y 4.9253 9.2562 125.3380 56.0279 40.6457 175.7395 118 A 2.9702 7.9091 125.4758 50.1442 19.3602 175.1178 119 P 4.6368 0.0000 0.0000 63.6232 31.7050 177.1729 120 G 3.8209 8.7765 109.0402 46.0955 0.0000 173.5783 121 T 3.8574 7.2909 116.5305 62.6677 68.8832 172.7595 122 P 4.4119 0.0000 0.0000 61.5962 32.2673 175.5840 123 P 4.2988 0.0000 0.0000 66.0610 31.2928 178.8396 124 E 3.8338 8.1080 116.6549 59.0802 29.2945 179.4821 125 V 3.7137 7.9090 118.7706 65.9619 31.6702 178.4005 126 G 3.6891 7.8946 105.0294 47.7003 0.0000 175.5720 127 I 3.5513 7.9225 122.1867 64.1423 37.1025 178.3878 128 A 4.0769 7.9378 121.2333 55.2721 18.1636 179.4344 129 D 4.4342 8.3313 117.5218 57.5364 40.9240 178.8278 130 L 4.6151 8.3472 122.2460 57.5581 42.0215 179.1363 131 K 4.1977 8.4582 118.7210 59.2802 31.8790 179.0039 132 K 4.1406 8.1873 119.9058 59.8387 32.0090 178.4978 133 D 4.4728 8.5646 118.9023 56.8544 40.8843 178.0640 134 L 4.5166 7.7786 116.6013 53.2635 42.5659 175.8190 135 N 4.3706 8.3458 115.9207 54.9548 36.4518 174.6331 136 I 4.4672 8.0367 108.0854 60.3069 38.7547 175.3813 137 E 4.1565 8.1705 124.3952 56.8783 29.6920 176.3985 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 4.32 0.00 1.99 1.95 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 2.66 2.46 0.00 2 E 7.51 4.22 0.00 1.99 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 2.22 2.32 0.00 3 K 8.79 4.45 0.00 1.66 1.73 0.00 1.47 0.00 0.00 2.37 0.00 0.00 3.20 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.49 7.81 4 K 7.50 4.63 0.00 2.11 2.01 0.00 1.76 0.00 0.00 1.97 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.54 1.54 7.81 5 T 9.21 5.29 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 6 I 8.53 4.87 1.60 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.89 0.56 0.00 0.00 7 V 8.75 4.63 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.96 0.00 0.00 8 L 8.69 5.16 0.00 1.56 1.35 0.78 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.20 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 10 V 8.33 5.04 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 0.98 0.00 0.00 1.00 0.00 0.00 11 I 8.58 4.93 1.91 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.63 1.03 0.00 0.00 12 G 8.79 4.10 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 0.00 0.00 0.00 13 S 8.88 4.62 0.00 4.19 4.04 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 14 D 7.04 4.04 0.00 1.58 2.14 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 15 C 8.37 4.47 0.00 3.06 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 16 H 8.66 4.12 0.00 3.20 3.31 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.46 4.66 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 18 V 7.99 3.70 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 1.04 0.00 0.00 0.94 0.00 0.00 19 G 8.07 3.64 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 0.00 0.00 0.00 20 N 8.16 4.32 0.00 2.76 3.04 0.00 0.00 6.84 6.63 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 21 K 7.90 4.01 0.00 1.88 1.92 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.48 7.81 22 I 7.85 3.77 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.63 0.94 0.00 0.00 23 L 8.41 4.16 0.00 1.81 1.72 0.90 0.98 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 24 D 8.23 4.36 0.00 2.86 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 25 H 8.41 4.12 0.00 3.37 3.58 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.69 3.97 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 27 F 8.89 4.05 0.00 3.25 3.18 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 0.00 0.00 0.00 0.00 28 T 8.27 4.24 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 1.24 0.00 0.00 29 N 8.21 4.31 0.00 2.85 2.84 0.00 0.00 7.10 7.96 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 30 A 7.67 4.22 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 G 7.84 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 32 F 8.28 4.83 0.00 3.31 3.03 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 33 N 9.43 4.79 0.00 2.82 2.94 0.00 0.00 6.89 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 8.32 4.31 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 0.78 0.00 0.00 1.04 0.00 0.00 35 V 8.75 3.95 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 0.87 0.00 0.00 0.97 0.00 0.00 36 N 8.44 5.22 0.00 2.83 2.71 0.00 0.00 7.25 7.94 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 37 I 8.79 3.75 1.61 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.24 0.74 0.00 0.00 38 G 8.10 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.06 4.21 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 0.81 0.00 0.00 0.89 0.00 0.00 40 L 7.72 4.08 0.00 1.75 1.70 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.98 4.63 0.00 3.96 3.46 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 42 P 0.00 4.88 0.00 2.46 2.23 0.00 3.73 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 43 Q 9.03 4.15 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 44 E 8.31 4.08 0.00 2.09 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 2.43 2.50 0.00 45 L 8.10 4.02 0.00 1.68 1.59 0.86 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 46 F 8.24 4.15 0.00 3.30 3.08 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 0.00 47 I 7.70 3.87 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.00 0.93 0.00 0.00 48 K 8.30 3.83 0.00 1.78 1.91 0.00 1.63 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.61 1.62 7.81 49 A 7.85 3.94 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 50 A 7.98 3.99 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 51 I 7.90 3.67 1.99 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 1.53 1.11 0.92 0.00 0.00 52 E 8.09 4.02 0.00 2.11 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 2.35 2.35 0.00 53 T 7.64 4.43 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 54 K 7.97 3.76 0.00 1.94 1.91 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.37 7.81 55 A 7.69 4.27 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 56 D 9.53 4.74 0.00 2.69 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 57 A 7.60 4.85 0.94 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 58 I 8.40 4.79 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.03 1.03 0.00 0.00 59 L 9.08 4.87 0.00 1.38 1.49 0.44 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 60 V 9.15 4.46 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 0.75 0.00 0.00 0.60 0.00 0.00 61 S 9.05 5.18 0.00 3.95 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 62 S 9.18 4.44 0.00 3.91 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 63 L 8.97 4.59 0.00 1.59 1.51 0.92 0.82 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 64 Y 8.71 4.36 0.00 3.11 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 65 G 7.94 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 66 Q 7.46 4.42 0.00 1.64 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.84 0.00 0.00 0.00 0.00 0.00 2.16 1.72 0.00 67 G 8.17 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 0.00 0.00 0.00 0.00 68 E 7.86 3.87 0.00 2.21 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 2.22 2.13 0.00 69 I 7.66 3.97 2.00 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 0.99 0.93 0.00 0.00 70 D 8.18 4.56 0.00 2.80 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 71 C 8.40 4.53 0.00 3.23 3.12 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 72 K 7.05 3.82 0.00 1.82 1.72 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.32 7.81 73 G 8.98 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 74 L 7.73 3.99 0.00 1.82 1.50 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.70 3.70 0.00 1.71 1.77 0.00 3.25 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 1.61 1.68 0.00 76 Q 8.08 3.91 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 77 K 7.96 4.00 0.00 1.99 1.85 0.00 1.89 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.72 7.81 78 C 8.39 4.18 0.00 3.06 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 79 D 8.47 4.32 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 80 E 8.20 4.04 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 2.34 2.41 0.00 81 A 7.64 4.47 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 82 G 8.32 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.16 4.71 0.00 1.79 1.65 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 84 E 7.65 4.71 0.00 2.06 1.89 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 2.40 2.35 0.00 85 G 8.85 3.93 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 0.00 86 I 7.37 3.78 1.93 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 1.28 0.96 0.95 0.00 0.00 87 L 8.03 4.49 0.00 1.69 1.56 0.94 0.66 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 88 L 9.81 5.17 0.00 1.49 1.55 0.64 0.68 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 89 Y 9.06 5.75 0.00 2.95 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.24 5.42 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.66 0.00 0.00 91 G 8.81 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 G 8.93 4.48 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 0.00 0.00 0.00 93 N 9.19 5.27 0.00 2.87 2.73 0.00 0.00 6.98 7.89 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 94 I 7.67 3.98 1.18 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.38 0.76 0.00 0.00 95 V 7.36 4.68 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 1.01 0.00 0.00 1.07 0.00 0.00 96 V 8.29 3.70 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 0.77 0.00 0.00 0.93 0.00 0.00 97 G 8.71 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 98 K 8.26 4.07 0.00 1.75 1.77 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.49 7.81 99 Q 8.35 4.62 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 100 H 8.61 4.52 0.00 3.16 3.35 0.00 5.69 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 W 9.12 4.44 0.00 3.38 3.08 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 0.00 102 P 0.00 4.00 0.00 2.07 2.03 0.00 3.07 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.18 0.00 103 D 7.95 4.30 0.00 2.82 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 0.00 104 V 7.19 3.47 1.60 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 0.80 0.00 0.00 1.02 0.00 0.00 105 E 7.21 3.35 0.00 1.16 1.56 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 2.11 2.16 0.00 106 K 7.72 3.85 0.00 1.93 1.78 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.47 7.81 107 R 7.49 3.85 0.00 1.88 2.20 0.00 3.20 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.52 0.00 108 F 8.32 4.18 0.00 3.01 2.98 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 0.00 109 K 8.12 4.36 0.00 2.01 1.86 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.45 7.81 110 D 8.43 4.40 0.00 2.71 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 0.00 111 M 7.62 4.32 0.00 2.13 2.41 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 112 G 8.09 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 0.00 113 Y 7.95 4.24 0.00 3.34 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 D 9.34 4.53 0.00 2.92 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 0.00 115 R 7.96 4.54 0.00 0.70 0.94 0.00 2.33 0.00 0.00 2.96 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.36 0.00 116 V 7.82 4.73 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 0.63 0.00 0.00 0.94 0.00 0.00 117 Y 9.26 4.93 0.00 2.83 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 0.00 118 A 7.91 2.97 -0.08 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 0.00 0.00 0.00 119 P 0.00 4.64 0.00 1.92 1.94 0.00 3.39 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.99 0.00 120 G 8.78 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 0.00 121 T 7.29 3.86 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 1.08 0.00 0.00 122 P 0.00 4.41 0.00 2.14 1.93 0.00 3.58 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 123 P 0.00 4.30 0.00 2.12 2.19 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 124 E 8.11 3.83 0.00 2.01 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 2.37 2.37 0.00 125 V 7.91 3.71 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 1.16 0.00 0.00 0.94 0.00 0.00 126 G 7.89 3.69 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 0.00 0.00 0.00 127 I 7.92 3.55 1.66 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 0.31 -0.36 0.88 0.00 0.00 128 A 7.94 4.08 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 D 8.33 4.43 0.00 3.15 2.91 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 0.00 130 L 8.35 4.62 0.00 2.13 1.96 0.57 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.46 4.20 0.00 2.10 1.92 0.00 1.77 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.84 7.81 132 K 8.19 4.14 0.00 1.92 2.10 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.54 7.81 133 D 8.56 4.47 0.00 2.84 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 0.00 134 L 7.78 4.52 0.00 1.85 1.78 1.11 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.35 4.37 0.00 2.87 2.91 0.00 0.00 6.69 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.04 4.47 1.85 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.71 0.96 0.00 0.00 137 E 8.17 4.16 0.00 2.13 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 0.00 2.29 2.28 0.00