NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2726 8.4449 121.4697 56.1824 31.1119 175.0262 2 T 4.2818 7.7895 113.3267 58.7213 70.1271 172.4424 3 P 4.3545 0.0000 0.0000 62.5845 32.1066 175.8214 4 R 4.2495 8.2905 123.0602 55.1428 31.0249 176.7157 5 E 3.9881 8.8078 123.1129 59.0912 29.8485 177.0776 6 K 4.0705 7.7516 116.5421 56.6153 32.1589 173.8105 7 L 3.6971 7.8870 119.2860 55.9861 40.4207 179.5635 8 K 3.9700 7.5921 125.2214 57.4823 33.2136 176.6084 9 Q 3.5527 8.4780 120.8642 56.0408 27.8011 171.9832 10 H 4.7986 8.0610 115.8966 54.8766 31.4838 175.2702 11 S 4.0645 8.7946 113.8102 59.9409 60.0497 173.6471 12 D 4.2796 7.7165 121.9868 56.2921 38.6870 177.3226 13 A 4.4176 7.7271 121.0344 52.4839 19.4610 178.1613 14 C 4.5334 7.8573 114.2394 58.9352 40.5425 176.0337 15 K 3.9291 8.0239 117.6016 58.9956 32.3343 177.6931 16 A 3.9869 7.1417 121.6716 55.3519 18.7601 178.3927 17 E 4.0768 8.0461 115.5131 59.2045 30.6812 178.5474 18 S 4.5374 7.6087 114.5486 57.9000 60.9906 174.7168 19 G 4.1078 7.4711 109.9891 44.8615 0.0000 174.5936 20 V 3.5279 7.8518 121.2754 62.5593 31.5967 176.8056 21 S 3.7631 7.9820 112.8728 58.8634 62.0226 171.5182 22 E 3.6922 8.1696 116.7548 58.3566 28.0176 175.6192 23 E 4.2140 8.2481 117.6281 58.6268 29.6145 177.8065 24 S 4.2573 7.8554 114.5675 61.3431 63.0918 176.4756 25 L 4.0156 7.8561 121.4759 57.6179 41.3504 178.8256 26 N 4.2844 7.7837 115.6091 56.7542 38.9637 177.1431 27 K 4.0094 7.7396 118.3773 59.2271 31.7990 179.3814 28 V 3.6402 7.3469 117.6364 65.9290 31.4104 177.2589 29 R 4.0551 7.8618 117.4387 58.5222 30.1836 176.6961 30 N 4.7521 7.7112 115.0471 51.7627 38.4432 176.3990 31 R 4.4979 8.1872 121.1483 54.8721 27.7866 174.9243 32 E 4.5102 7.2918 117.2066 54.6119 33.2119 175.3400 33 E 5.0126 7.5415 119.0302 56.5025 33.2762 176.6363 34 V 4.4855 8.2438 121.5391 61.9084 35.0892 174.8670 35 D 4.7599 8.3295 125.1433 51.2738 39.8577 174.3594 36 D 4.9223 7.6277 121.2825 52.4324 44.9040 174.0313 37 P 4.2452 0.0000 0.0000 66.2261 31.7394 178.9206 38 K 3.9981 8.1460 118.4105 58.7698 31.8311 178.7442 39 L 3.8944 7.8163 120.1664 58.2310 42.3236 179.0027 40 K 4.0259 7.6964 117.4807 59.4337 31.7366 179.1489 41 E 3.9951 8.4107 118.5688 59.6574 29.7495 178.2110 42 H 4.2241 8.7292 118.1684 59.4595 29.8069 176.8500 43 A 3.9487 8.0946 122.2546 55.4557 18.2859 179.2993 44 F 4.3511 8.2290 118.5817 61.8126 39.3622 176.5127 45 C 4.1278 8.2248 118.0235 59.2128 41.5857 175.3434 46 I 3.7741 7.4436 120.8226 63.4727 37.1100 177.8393 47 L 4.2533 8.1896 120.3721 57.7789 41.5277 179.7314 48 K 4.0968 7.4948 119.0127 59.1736 31.8226 179.7159 49 R 3.7958 7.1952 115.9082 59.1365 30.0021 178.7182 50 A 4.0069 8.2886 120.3006 53.0084 18.3857 177.9569 51 G 3.5372 7.7976 104.4263 46.3991 0.0000 174.6236 52 F 4.6587 7.5212 117.1463 57.8357 40.2479 175.9178 53 I 4.7922 7.8351 119.7486 58.4879 40.1646 174.5558 54 D 4.8007 8.3334 124.6905 51.7300 40.9310 177.2409 55 A 4.1097 8.6289 123.6670 55.1433 18.3870 178.3932 56 S 4.5023 7.6486 109.6695 57.6669 63.0854 173.5484 57 G 3.7931 8.1731 112.7505 46.4181 0.0000 172.6445 58 E 4.0701 7.9412 124.6404 54.7020 31.3043 174.6792 59 F 4.6017 7.5668 122.1489 57.1477 38.7198 175.7284 60 Q 4.5894 8.3238 120.8503 53.5867 29.9013 175.4981 61 L 4.0245 8.2830 123.0247 57.0748 40.4045 177.9743 62 D 4.5290 8.2576 117.9246 57.1373 41.0767 177.0832 63 H 4.7307 8.2055 117.6818 57.9442 30.3639 177.0604 64 I 3.6066 7.6067 122.2733 64.0808 36.9729 178.1775 65 K 4.0011 8.5099 120.1098 60.6005 32.2999 179.0685 66 T 3.8668 7.4315 115.4536 66.1318 68.1688 176.7790 67 K 3.9892 7.8773 118.9303 59.6631 32.2514 179.3820 68 F 4.4091 8.2988 116.6762 60.3884 38.7641 176.9642 69 K 4.1327 7.9872 120.0480 57.6583 32.4248 176.4072 70 E 3.8696 7.8478 117.6677 57.8975 29.9570 175.8474 71 N 4.1521 8.7902 121.0096 53.3431 35.1143 171.8208 72 S 4.5979 8.2254 114.9142 58.1293 69.8117 176.0051 73 E 3.9522 9.2482 117.1283 56.7674 28.1923 174.0542 74 H 4.8627 7.4198 113.5065 54.2336 29.9726 173.4237 75 P 4.4638 0.0000 0.0000 63.4298 31.1935 174.6560 76 E 5.0285 8.2424 129.3251 55.5477 31.3457 178.3712 77 K 4.2504 7.3461 117.4899 56.8139 32.4944 178.8074 78 V 3.4099 7.6299 119.3146 65.8451 31.3684 176.9357 79 D 4.5261 8.1616 118.3786 57.1037 38.8045 178.5565 80 D 4.3057 7.9862 120.5679 56.6180 40.7381 178.7811 81 L 3.9144 8.2174 120.0239 57.8317 41.5440 179.3381 82 V 3.4956 8.5567 119.1872 65.9333 31.2483 177.8532 83 A 3.9320 7.6425 120.6653 55.0165 18.3829 179.2666 84 K 3.9931 8.1657 117.7122 59.5175 32.4259 177.8939 85 C 4.5447 8.6210 114.9581 57.7817 41.1377 174.0936 86 A 4.6664 8.2055 123.7433 50.7578 17.8958 178.5811 87 V 3.4945 7.4753 116.7732 61.6456 32.0528 176.9835 88 K 4.1541 8.5707 125.2677 57.1614 32.3183 176.8471 89 K 4.5013 8.4263 124.4705 54.4047 34.1836 176.9510 90 D 4.3947 8.5144 118.4421 55.9529 39.5905 176.8249 91 T 4.7063 7.3845 110.3022 58.3467 73.1709 173.0000 92 P 4.2633 0.0000 0.0000 66.2212 31.4591 178.7473 93 Q 3.2129 6.9315 115.8065 58.8289 28.4991 177.4286 94 H 4.2920 7.9310 120.7504 58.5467 29.9448 176.7338 95 S 4.5060 8.3006 118.0467 60.5302 62.6538 176.7367 96 S 3.7015 7.8780 117.6615 61.4756 62.4890 176.4770 97 A 4.0429 7.6787 124.5665 54.6308 18.1053 179.2612 98 D 4.3077 7.4018 117.3961 57.5626 40.5786 179.0659 99 F 4.6031 7.1808 117.5382 59.5285 39.0031 175.7359 100 F 4.9058 7.8556 119.4964 57.9014 39.4092 176.1577 101 K 4.6856 8.1497 116.8492 57.8136 36.6079 178.9750 102 C 4.1110 8.4513 117.4711 59.8149 43.9663 175.1549 103 V 3.9079 7.3950 112.1807 60.1625 30.4877 174.5812 104 H 4.9078 7.7992 117.7979 57.1838 37.4955 176.0849 105 D 4.8072 7.7005 118.1725 53.8717 41.3751 176.4822 106 N 4.8808 7.7540 117.4328 52.4274 37.9337 172.9330 107 R 4.3754 7.6631 119.6433 57.5414 32.9947 174.9206 108 S 4.3368 8.0215 114.9827 58.4561 63.3225 173.6374 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 E 8.44 4.27 0.00 1.92 2.01 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 2.19 2.40 0.00 2 T 7.79 4.28 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 3 P 0.00 4.35 0.00 2.17 2.09 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 4 R 8.29 4.25 0.00 1.82 1.89 0.00 3.21 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 5 E 8.81 3.99 0.00 1.92 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 2.29 2.33 0.00 6 K 7.75 4.07 0.00 1.78 1.76 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.46 7.81 7 L 7.89 3.70 0.00 1.79 1.63 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.59 3.97 0.00 1.70 1.75 0.00 1.89 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.41 7.81 9 Q 8.48 3.55 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.52 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 10 H 8.06 4.80 0.00 3.20 3.18 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.79 4.06 0.00 4.08 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 12 D 7.72 4.28 0.00 2.89 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 13 A 7.73 4.42 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 C 7.86 4.53 0.00 3.12 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 15 K 8.02 3.93 0.00 1.86 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.43 7.81 16 A 7.14 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 17 E 8.05 4.08 0.00 1.94 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 2.30 2.40 0.00 18 S 7.61 4.54 0.00 4.05 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.47 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 20 V 7.85 3.53 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 0.82 0.00 0.00 0.92 0.00 0.00 21 S 7.98 3.76 0.00 4.06 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 22 E 8.17 3.69 0.00 2.06 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 2.17 2.23 0.00 23 E 8.25 4.21 0.00 2.12 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 0.00 2.25 2.32 0.00 24 S 7.86 4.26 0.00 3.88 3.88 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 25 L 7.86 4.02 0.00 1.63 1.66 0.84 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 26 N 7.78 4.28 0.00 2.94 2.90 0.00 0.00 7.18 6.42 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 27 K 7.74 4.01 0.00 2.04 1.85 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 28 V 7.35 3.64 2.21 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 0.79 0.00 0.00 0.99 0.00 0.00 29 R 7.86 4.06 0.00 1.97 2.01 0.00 3.40 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 30 N 7.71 4.75 0.00 2.83 2.82 0.00 0.00 7.05 7.67 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 31 R 8.19 4.50 0.00 1.83 1.95 0.00 3.22 0.00 0.00 2.25 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.62 0.00 32 E 7.29 4.51 0.00 2.09 1.77 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 2.20 2.24 0.00 33 E 7.54 5.01 0.00 1.92 1.81 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 2.06 2.04 0.00 34 V 8.24 4.49 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 0.87 0.00 0.00 0.93 0.00 0.00 35 D 8.33 4.76 0.00 2.76 2.61 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 36 D 7.63 4.92 0.00 2.78 2.52 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 37 P 0.00 4.25 0.00 2.43 2.26 0.00 3.76 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 2.06 2.04 0.00 38 K 8.15 4.00 0.00 1.80 1.99 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.85 1.51 7.81 39 L 7.82 3.89 0.00 1.77 1.69 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 40 K 7.70 4.03 0.00 1.93 1.81 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.64 7.81 41 E 8.41 4.00 0.00 2.04 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 0.00 2.37 2.39 0.00 42 H 8.73 4.22 0.00 3.22 3.31 0.00 5.60 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 43 A 8.09 3.95 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 44 F 8.23 4.35 0.00 3.13 3.31 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 45 C 8.22 4.13 0.00 3.02 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 46 I 7.44 3.77 2.03 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.85 0.98 0.00 0.00 47 L 8.19 4.25 0.00 1.95 1.93 1.34 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.49 4.10 0.00 1.51 1.65 0.00 0.61 0.00 0.00 0.95 0.00 0.00 2.73 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.20 0.74 7.81 49 R 7.20 3.80 0.00 1.83 1.90 0.00 3.13 0.00 0.00 2.62 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 50 A 8.29 4.01 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 7.80 3.54 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 52 F 7.52 4.66 0.00 3.35 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 53 I 7.84 4.79 2.20 0.00 0.00 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 1.38 2.22 1.24 0.00 0.00 54 D 8.33 4.80 0.00 2.95 2.78 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 55 A 8.63 4.11 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 56 S 7.65 4.50 0.00 3.92 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 57 G 8.17 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.94 4.07 0.00 2.07 1.79 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 2.14 1.94 0.00 59 F 7.57 4.60 0.00 3.06 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 8.32 4.59 0.00 2.40 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.97 0.00 0.00 0.00 0.00 0.00 2.55 2.36 0.00 61 L 8.28 4.02 0.00 1.68 1.66 0.75 0.69 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 62 D 8.26 4.53 0.00 2.75 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 63 H 8.21 4.73 0.00 3.33 3.47 0.00 5.73 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.61 3.61 1.92 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.58 0.85 0.00 0.00 65 K 8.51 4.00 0.00 1.96 2.11 0.00 1.41 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.53 7.81 66 T 7.43 3.87 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 67 K 7.88 3.99 0.00 1.91 1.87 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.77 1.89 7.81 68 F 8.30 4.41 0.00 3.12 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 69 K 7.99 4.13 0.00 2.04 1.83 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.47 7.81 70 E 7.85 3.87 0.00 2.16 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 2.63 2.35 0.00 71 N 8.79 4.15 0.00 2.91 2.92 0.00 0.00 6.79 7.58 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 72 S 8.23 4.60 0.00 4.12 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 9.25 3.95 0.00 2.08 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 2.07 2.27 0.00 74 H 7.42 4.86 0.00 3.02 3.17 0.00 5.71 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.46 0.00 2.19 2.12 0.00 3.84 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 76 E 8.24 5.03 0.00 2.05 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 0.00 2.23 2.13 0.00 77 K 7.35 4.25 0.00 1.73 1.82 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.38 7.81 78 V 7.63 3.41 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 1.11 0.00 0.00 0.97 0.00 0.00 79 D 8.16 4.53 0.00 2.88 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 80 D 7.99 4.31 0.00 2.70 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 81 L 8.22 3.91 0.00 1.74 1.50 0.87 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.56 3.50 2.16 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 0.73 0.00 0.00 0.92 0.00 0.00 83 A 7.64 3.93 1.21 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 0.00 0.00 84 K 8.17 3.99 0.00 1.77 1.80 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 85 C 8.62 4.54 0.00 3.01 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.21 4.67 0.98 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 0.00 0.00 87 V 7.48 3.49 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 0.88 0.00 0.00 0.95 0.00 0.00 88 K 8.57 4.15 0.00 2.18 1.98 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.56 7.81 89 K 8.43 4.50 0.00 1.82 1.76 0.00 1.56 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.35 1.37 7.81 90 D 8.51 4.39 0.00 2.79 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 T 7.38 4.71 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 1.16 0.00 0.00 92 P 0.00 4.26 0.00 2.17 2.40 0.00 3.53 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.98 0.00 93 Q 6.93 3.21 0.00 1.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 7.04 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 94 H 7.93 4.29 0.00 3.14 3.22 0.00 5.71 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.30 4.51 0.00 4.23 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 0.00 96 S 7.88 3.70 0.00 4.32 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.68 4.04 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 98 D 7.40 4.31 0.00 2.64 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 99 F 7.18 4.60 0.00 3.20 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 0.00 100 F 7.86 4.91 0.00 3.14 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 0.00 101 K 8.15 4.69 0.00 1.87 1.78 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.38 7.81 102 C 8.45 4.11 0.00 3.02 3.15 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 0.00 103 V 7.39 3.91 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.70 0.00 0.00 104 H 7.80 4.91 0.00 3.38 3.35 0.00 5.88 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 D 7.70 4.81 0.00 2.74 2.61 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 0.00 106 N 7.75 4.88 0.00 2.65 2.69 0.00 0.00 6.91 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 0.00 107 R 7.66 4.38 0.00 1.75 1.85 0.00 3.28 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 108 S 8.02 4.34 0.00 4.01 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