NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.5928 8.4249 119.1791 52.7399 40.0070 176.6039 4 Q 4.1414 7.9922 109.9454 54.4719 32.6886 170.5540 5 Y 4.8835 8.2087 118.1333 56.6830 41.1372 174.9467 6 Y 4.8937 8.3341 126.5514 55.8377 41.7968 173.9286 7 G 4.6447 5.3800 116.5621 47.4748 0.0000 174.2056 8 T 3.8497 7.7198 127.1703 62.7109 67.6626 176.3905 9 G 4.3649 11.1263 117.6452 46.8095 0.0000 172.9613 10 R 4.7374 7.8005 117.7147 55.3759 32.2467 174.6454 11 R 4.0034 8.2591 114.7973 56.2934 31.9886 173.3342 12 K 3.8867 9.1298 126.7583 56.4609 29.6613 175.3886 13 S 3.9410 8.0543 112.4415 58.0107 61.6208 169.7870 14 S 5.1163 7.3418 114.8862 58.0474 66.1772 173.4861 15 A 4.4968 8.5115 121.1870 51.7439 21.4057 174.9297 16 A 4.9403 8.4407 123.7549 50.8996 21.2135 175.7962 17 R 4.2932 8.7477 119.9497 54.3730 31.8359 175.4581 18 V 4.4361 7.4635 121.9952 60.8696 34.6666 173.8654 19 F 5.4639 8.6032 125.9400 55.9203 41.6047 174.3488 20 I 4.9153 8.7411 124.9112 59.4642 39.4753 174.7222 21 K 4.7926 9.0983 128.0908 53.6111 36.0275 173.3779 22 P 4.3515 0.0000 0.0000 65.0735 31.4591 174.4924 23 G 4.3150 9.0637 116.7410 46.2270 0.0000 173.1534 24 N 5.3673 8.6355 117.2204 50.4127 44.1223 174.5999 25 G 4.0052 8.4906 106.1944 45.2262 0.0000 173.3069 26 K 4.6676 7.4004 115.7153 54.8031 35.6202 175.4641 27 I 5.0654 7.9451 119.1080 60.2373 40.7271 175.5602 28 V 4.3818 8.4595 125.0440 62.2214 31.9601 174.8758 29 I 3.9470 8.1030 117.8166 62.8146 37.8818 175.1367 30 N 4.0731 9.8211 124.5884 54.3629 36.9109 173.7817 31 Q 3.6788 8.7617 111.7666 56.4997 26.4305 173.4675 32 R 4.4427 7.9560 114.3502 55.1751 34.0219 173.7794 33 S 4.2431 8.4214 116.3102 58.2252 63.1465 175.0690 34 L 3.8617 8.4332 125.8080 58.0569 42.0881 179.1642 35 E 4.0531 7.9558 117.5485 59.1377 29.5706 177.4378 36 Q 4.3890 7.5173 117.3939 55.7400 28.6008 175.7041 37 Y 4.9737 7.6586 119.2112 57.8719 46.7940 175.1415 38 F 5.6869 6.7408 109.3888 58.7078 40.4513 174.8456 39 G 3.9653 7.8311 111.5561 44.3308 0.0000 173.8427 40 R 4.9218 7.2539 122.0932 56.3515 33.5805 174.4029 41 E 4.6834 7.7668 122.7544 57.7209 28.6887 178.0615 42 T 4.4890 8.4998 116.6085 63.6972 68.6476 174.4674 43 A 5.5314 8.0252 132.2943 52.7934 21.4457 179.6189 44 R 4.0802 8.2505 119.6709 61.2131 29.3679 177.2883 45 M 4.8323 7.7013 113.8954 54.1992 31.6941 176.7355 46 V 3.7727 7.7300 113.6740 64.2723 31.7392 178.0484 47 V 3.7783 7.6484 111.7710 64.0019 31.8274 177.7654 48 R 4.0401 7.8486 117.9131 58.6446 29.7866 178.0607 49 Q 4.0105 7.3829 117.7812 58.6106 28.8141 177.6692 50 P 4.1599 0.0000 0.0000 64.5633 32.2221 176.2905 51 L 4.6372 8.0569 119.4611 53.6551 40.1304 174.2192 52 E 4.4727 7.2624 118.6659 57.4497 32.6668 177.4070 53 L 4.5320 7.7344 118.3042 55.1080 42.4940 178.0232 54 V 4.4133 6.8822 109.5952 66.0389 32.0318 175.2348 55 D 4.3074 6.8473 117.9627 51.4242 45.8551 173.3555 56 M 4.7012 8.9035 122.5390 54.4443 36.6837 176.2812 57 V 3.5629 9.8579 122.5521 63.2574 31.8695 173.6319 58 E 4.9463 7.5082 115.5784 56.8255 31.5014 177.2106 59 K 4.1357 8.1424 121.7931 58.2986 32.6610 176.0564 60 L 5.2439 7.5842 117.4114 53.9234 43.3639 174.5228 61 D 5.7366 9.8112 121.4111 52.0783 44.4704 175.0662 62 L 5.7143 8.2368 121.9098 53.9438 44.0870 174.1116 63 Y 5.1294 8.9366 125.5879 56.2800 40.4829 174.1254 64 I 4.8635 8.1581 126.1453 59.7563 41.6753 174.4246 65 T 5.2145 8.2122 120.4346 62.1516 72.6853 173.3834 66 V 5.0851 8.5461 121.3662 61.5361 34.8460 172.6196 67 K 4.6463 8.2653 121.4940 56.0729 36.7449 176.0328 68 G 4.3800 8.5013 106.5778 46.2945 0.0000 175.0532 69 G 4.3916 7.5192 106.5366 44.6209 0.0000 171.7391 70 G 4.0410 7.8596 107.9296 43.7645 0.0000 171.4569 71 I 3.3131 7.9109 115.8461 65.9166 36.9687 177.3660 72 S 4.1715 7.7684 115.9322 60.4761 63.4055 176.9633 73 G 3.4388 7.7316 108.9022 48.0774 0.0000 175.1127 74 Q 3.9719 8.2208 121.2426 58.3934 28.7264 178.8471 75 A 3.8552 7.3827 121.2975 55.4558 18.4644 180.0810 76 G 3.5181 8.0821 103.5948 47.5095 0.0000 175.7649 77 A 3.9389 8.2315 123.4564 55.2703 18.5059 179.4875 78 I 3.5402 7.7423 117.6404 64.8544 36.9966 177.7792 79 R 3.6805 7.9368 118.8906 60.4069 29.6292 177.8966 80 H 4.4022 8.6242 117.6944 58.9938 29.8615 177.6947 81 G 4.0554 8.2902 108.2538 48.3889 0.0000 175.9515 82 I 3.5966 8.2379 122.6575 64.4306 37.0063 178.2680 83 T 3.9231 7.2858 109.4710 65.3512 68.5362 175.9944 84 R 4.0045 7.5913 118.7498 58.8232 30.3768 178.6411 85 A 4.8713 7.8230 121.2024 53.6728 18.0549 178.1833 86 L 4.4269 7.8546 118.2438 55.3298 42.3752 177.1167 87 M 4.2137 8.0170 116.2980 57.3701 31.5808 177.9688 88 E 3.5395 7.4402 116.9913 59.7927 29.5127 178.0736 89 Y 4.1550 8.0760 116.5555 58.6685 38.1512 176.3826 90 D 4.4846 7.1618 118.6824 53.4105 42.4050 176.6200 91 E 4.2529 7.9839 117.7116 57.0109 29.8074 178.9953 92 S 4.1481 7.7728 115.0199 61.2795 62.2313 175.4689 93 L 4.1106 9.1756 120.1961 57.3789 40.9732 176.9836 94 R 4.5036 7.0671 120.9666 55.3311 29.5097 175.7827 95 S 4.6466 7.5386 112.9713 58.9756 69.0799 176.6648 96 E 4.2602 8.0892 118.7198 57.9992 29.3217 178.0578 97 L 3.7826 7.5961 119.6409 57.0573 42.0167 178.8598 98 R 3.8971 7.4015 117.7758 59.4446 29.9408 178.1378 99 K 3.8655 7.3143 116.9431 58.6433 32.1787 177.8208 100 A 3.8061 7.0764 118.3763 52.9950 18.6286 178.3348 101 G 3.8156 8.0751 106.5733 45.3661 0.0000 175.0331 102 F 4.8067 7.1281 116.3134 58.9691 39.1260 176.3887 103 V 3.9777 7.6168 113.9807 63.4108 32.1199 176.8500 104 T 4.1131 7.4741 116.9820 62.7792 68.8309 174.2563 105 R 3.7156 8.4394 126.9216 55.6822 30.0008 176.0498 106 D 4.4354 8.5081 125.5916 54.3573 39.2904 176.7912 107 A 4.1337 8.2780 126.4852 53.2175 18.7586 178.1452 108 R 3.9682 7.3775 115.4000 56.6450 30.5879 176.1791 109 Q 4.6558 8.2777 120.0019 53.3670 32.7297 175.0412 110 V 3.5196 8.3646 112.7966 62.0227 31.8583 175.7969 111 E 4.1615 8.7030 126.2572 54.9779 29.8241 176.2994 112 R 3.9963 8.5623 123.0688 56.1922 29.8563 176.1303 113 K 4.3103 8.2785 120.1191 56.4215 33.1601 176.5187 114 K 4.5069 8.2330 121.5503 54.4401 35.3928 176.1712 115 V 3.5955 8.3983 122.7587 63.4247 31.3825 176.5661 116 G 3.9865 9.3162 112.0158 44.9286 0.0000 172.7092 117 L 4.8592 7.2958 117.9638 52.6293 45.0125 176.6788 118 R 4.0226 8.6309 120.5582 57.0877 30.1732 176.6493 119 K 4.8676 8.2473 122.4636 57.3568 32.6115 172.9400 120 A 4.0196 8.0496 129.5014 51.9768 17.3867 178.3939 121 R 4.3506 8.1532 114.1268 56.6661 32.8675 177.2951 122 R 3.7045 7.5586 116.5334 56.5131 30.3799 174.3840 123 R 4.7844 8.3306 125.0297 53.1738 32.2027 173.2328 124 P 4.1399 0.0000 0.0000 62.9133 31.2195 175.5811 125 Q 4.0206 8.8608 124.9848 56.3464 29.1180 175.4732 126 F 4.9026 8.7715 120.4702 54.6041 40.1124 175.3541 127 S 4.0824 8.1501 116.8966 57.3036 63.0839 173.4055 128 K 3.2819 7.8335 117.3377 59.8238 31.9702 176.8703 129 R 4.2058 7.8458 122.1819 55.5241 30.7731 175.5502 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 3 N 8.42 4.59 0.00 2.60 1.78 0.00 0.00 6.85 6.19 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 4 Q 7.99 4.14 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.69 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 5 Y 8.21 4.88 0.00 3.02 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 6 Y 8.33 4.89 0.00 3.22 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 7 G 5.38 4.64 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 8 T 7.72 3.85 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 1.24 0.00 0.00 9 G 11.13 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 10 R 7.80 4.74 0.00 2.09 1.87 0.00 3.07 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 11 R 8.26 4.00 0.00 1.49 1.84 0.00 3.42 0.00 0.00 3.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 12 K 9.13 3.89 0.00 1.93 1.70 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.34 7.81 13 S 8.05 3.94 0.00 4.06 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 14 S 7.34 5.12 0.00 3.85 3.71 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 15 A 8.51 4.50 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 16 A 8.44 4.94 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.75 4.29 0.00 2.00 2.21 0.00 2.79 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.42 0.00 18 V 7.46 4.44 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 0.89 0.00 0.00 0.76 0.00 0.00 19 F 8.60 5.46 0.00 3.32 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 20 I 8.74 4.92 2.08 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 1.18 1.31 1.04 0.00 0.00 21 K 9.10 4.79 0.00 1.73 1.61 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.29 1.47 7.81 22 P 0.00 4.35 0.00 2.14 2.10 0.00 3.84 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 1.99 1.99 0.00 23 G 9.06 4.32 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 0.00 24 N 8.64 5.37 0.00 2.71 2.91 0.00 0.00 7.52 7.61 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 25 G 8.49 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 26 K 7.40 4.67 0.00 2.00 1.93 0.00 1.28 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.82 7.81 27 I 7.95 5.07 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 1.28 0.48 0.90 0.00 0.00 28 V 8.46 4.38 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 1.00 0.00 0.00 1.05 0.00 0.00 29 I 8.10 3.95 1.86 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 1.66 1.23 0.96 0.00 0.00 30 N 9.82 4.07 0.00 3.01 2.88 0.00 0.00 7.11 7.43 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 31 Q 8.76 3.68 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 32 R 7.96 4.44 0.00 1.73 1.74 0.00 3.25 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 33 S 8.42 4.24 0.00 3.89 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 34 L 8.43 3.86 0.00 1.68 1.58 0.62 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.96 4.05 0.00 2.01 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 2.32 2.41 0.00 36 Q 7.52 4.39 0.00 2.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 37 Y 7.66 4.97 0.00 2.75 2.37 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 38 F 6.74 5.69 0.00 3.19 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 7.83 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 40 R 7.25 4.92 0.00 1.79 1.94 0.00 3.24 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.45 0.00 41 E 7.77 4.68 0.00 2.41 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 42 T 8.50 4.49 4.21 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 1.20 0.00 0.00 43 A 8.03 5.53 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 44 R 8.25 4.08 0.00 1.95 2.15 0.00 3.04 0.00 0.00 3.54 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.69 0.00 45 M 7.70 4.83 0.00 2.13 2.22 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 2.55 2.50 0.00 46 V 7.73 3.77 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 0.76 0.00 0.00 0.89 0.00 0.00 47 V 7.65 3.78 2.07 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 0.88 0.00 0.00 0.98 0.00 0.00 48 R 7.85 4.04 0.00 1.82 2.04 0.00 3.38 0.00 0.00 3.31 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 49 Q 7.38 4.01 0.00 1.65 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.66 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 50 P 0.00 4.16 0.00 2.14 2.06 0.00 3.44 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 51 L 8.06 4.64 0.00 1.72 1.66 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.26 4.47 0.00 2.16 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 2.33 2.40 0.00 53 L 7.73 4.53 0.00 1.64 1.68 0.97 0.81 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 54 V 6.88 4.41 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 0.68 0.00 0.00 1.03 0.00 0.00 55 D 6.85 4.31 0.00 2.67 2.63 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 56 M 8.90 4.70 0.00 2.26 1.96 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.60 0.00 57 V 9.86 3.56 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 0.96 0.00 0.00 0.94 0.00 0.00 58 E 7.51 4.95 0.00 2.00 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 0.00 2.31 2.25 0.00 59 K 8.14 4.14 0.00 2.01 1.84 0.00 1.73 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.43 7.81 60 L 7.58 5.24 0.00 1.81 1.64 1.01 0.74 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 61 D 9.81 5.74 0.00 2.98 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 62 L 8.24 5.71 0.00 1.91 1.77 0.92 0.74 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 63 Y 8.94 5.13 0.00 3.07 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 64 I 8.16 4.86 1.79 0.00 0.00 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 1.29 0.63 0.82 0.00 0.00 65 T 8.21 5.21 4.18 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 1.24 0.00 0.00 66 V 8.55 5.09 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 0.96 0.00 0.00 67 K 8.27 4.65 0.00 1.78 1.95 0.00 1.62 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.38 7.81 68 G 8.50 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 0.00 0.00 0.00 0.00 69 G 7.52 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 0.00 0.00 0.00 0.00 70 G 7.86 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 0.00 0.00 0.00 71 I 7.91 3.31 1.78 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.33 0.77 0.00 0.00 72 S 7.77 4.17 0.00 3.95 4.15 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 0.00 0.00 0.00 0.00 73 G 7.73 3.44 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 0.00 74 Q 8.22 3.97 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 75 A 7.38 3.86 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 76 G 8.08 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.23 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 78 I 7.74 3.54 1.97 0.00 0.00 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 1.48 0.64 0.86 0.00 0.00 79 R 7.94 3.68 0.00 1.93 2.07 0.00 3.07 0.00 0.00 2.31 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 80 H 8.62 4.40 0.00 3.30 3.42 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 81 G 8.29 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 82 I 8.24 3.60 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.64 0.88 0.00 0.00 83 T 7.29 3.92 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 1.31 0.00 0.00 84 R 7.59 4.00 0.00 1.86 1.90 0.00 2.95 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.00 85 A 7.82 4.87 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 86 L 7.85 4.43 0.00 1.72 1.81 0.96 0.97 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 87 M 8.02 4.21 0.00 2.37 2.47 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 88 E 7.44 3.54 0.00 1.16 1.80 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 2.14 2.12 0.00 89 Y 8.08 4.15 0.00 2.97 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 90 D 7.16 4.48 0.00 2.83 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 E 7.98 4.25 0.00 2.02 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 2.39 2.23 0.00 92 S 7.77 4.15 0.00 3.95 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 0.00 93 L 9.18 4.11 0.00 1.87 1.88 1.07 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.07 4.50 0.00 1.89 2.04 0.00 3.24 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 95 S 7.54 4.65 0.00 3.85 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 96 E 8.09 4.26 0.00 1.95 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 2.35 2.28 0.00 97 L 7.60 3.78 0.00 2.04 1.68 1.12 0.76 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 98 R 7.40 3.90 0.00 1.97 1.87 0.00 3.14 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 1.60 1.62 0.00 99 K 7.31 3.87 0.00 1.55 1.90 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.40 7.81 100 A 7.08 3.81 0.48 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 0.00 101 G 8.08 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 0.00 102 F 7.13 4.81 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 0.00 103 V 7.62 3.98 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 0.78 0.00 0.00 0.92 0.00 0.00 104 T 7.47 4.11 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 1.20 0.00 0.00 105 R 8.44 3.72 0.00 1.66 1.79 0.00 3.36 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 106 D 8.51 4.44 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 0.00 107 A 8.28 4.13 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 0.00 108 R 7.38 3.97 0.00 1.81 1.89 0.00 3.10 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 109 Q 8.28 4.66 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.02 0.00 0.00 0.00 0.00 0.00 2.59 2.27 0.00 110 V 8.36 3.52 2.07 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 0.65 0.00 0.00 0.92 0.00 0.00 111 E 8.70 4.16 0.00 1.90 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 0.00 2.28 2.35 0.00 112 R 8.56 4.00 0.00 2.02 2.07 0.00 3.01 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 113 K 8.28 4.31 0.00 1.74 1.74 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.46 7.81 114 K 8.23 4.51 0.00 1.78 1.63 0.00 1.75 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.48 7.81 115 V 8.40 3.60 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 0.69 0.00 0.00 0.93 0.00 0.00 116 G 9.32 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 0.00 117 L 7.30 4.86 0.00 1.78 1.70 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.63 4.02 0.00 1.78 1.96 0.00 3.39 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 119 K 8.25 4.87 0.00 1.94 1.85 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.16 1.18 7.81 120 A 8.05 4.02 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 0.00 121 R 8.15 4.35 0.00 1.78 1.96 0.00 3.41 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 122 R 7.56 3.70 0.00 1.88 1.84 0.00 3.19 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 123 R 8.33 4.78 0.00 1.75 1.77 0.00 3.32 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 124 P 0.00 4.14 0.00 2.25 2.11 0.00 3.83 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 125 Q 8.86 4.02 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 126 F 8.77 4.90 0.00 3.20 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 0.00 127 S 8.15 4.08 0.00 3.86 3.86 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 0.00 128 K 7.83 3.28 0.00 1.76 1.72 0.00 1.28 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.45 7.81 129 R 7.85 4.21 0.00 1.74 1.82 0.00 3.44 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00