NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2341 8.2644 123.5856 51.4146 20.6348 176.4206 3 F 4.5731 7.3704 116.6068 55.8786 41.5008 174.8597 4 S 4.3081 7.9678 119.7438 58.5059 62.2751 174.6302 5 S 4.4540 8.6643 124.0024 61.3353 62.7385 175.7593 6 E 3.9726 8.3273 121.8424 59.2422 29.2252 178.7721 7 Q 3.7834 8.2819 118.0835 58.9810 28.8004 178.2843 8 F 4.7557 8.8172 121.1367 61.8436 39.3644 177.2115 9 T 3.5337 8.3487 115.3978 67.0093 68.1741 176.9625 10 T 3.8323 8.0254 116.4399 66.5413 68.8063 176.6095 11 K 4.1568 8.1978 122.0185 58.8065 32.0763 179.4049 12 L 3.9173 7.8032 119.3387 57.8700 41.1668 179.3859 13 N 4.5980 8.3760 116.0682 55.2490 38.3408 176.5458 14 T 4.6013 7.4014 109.8786 60.3066 69.4174 173.6707 15 L 4.2982 7.1755 122.3917 55.2220 42.0812 176.4821 16 E 4.6694 8.4741 122.2963 54.4275 32.2597 176.0983 17 D 4.6110 8.2697 120.5279 53.3327 39.9927 175.3510 18 S 4.6272 7.7726 117.0889 55.2792 66.8505 173.8398 19 Q 3.9558 8.6292 126.5186 59.1932 28.5396 179.0425 20 E 4.0964 8.0576 119.1549 58.9721 29.6140 178.9975 21 S 4.0575 7.8941 112.8470 61.4748 62.5560 175.9526 22 I 3.7165 7.6194 122.4008 64.6577 36.8249 178.4255 23 S 4.1062 7.6970 112.4124 61.1460 61.8991 175.8303 24 S 4.0959 8.5606 116.1916 61.6405 62.0991 176.2091 25 A 4.2595 8.1327 123.1487 55.0194 18.1932 179.5368 26 S 4.1444 8.6130 114.1994 61.9693 62.7579 177.0341 27 K 3.9462 8.2724 119.9358 59.4018 31.9695 178.8464 28 W 4.3907 7.8473 128.3548 60.5577 30.6575 178.1509 29 L 3.6662 8.3022 119.0435 57.3588 40.7900 179.0529 30 L 4.0654 8.0690 120.0701 57.5373 41.8947 177.9450 31 L 4.6066 7.1726 117.1500 54.3794 41.9031 176.6772 32 Q 4.4525 8.3174 118.1896 54.5825 29.1959 177.4679 33 Y 3.7510 8.4067 118.8119 59.8563 37.9699 177.7451 34 R 3.4557 6.7559 118.3760 58.1004 30.3308 176.2484 35 D 4.5606 7.4097 118.2534 53.7139 41.5383 178.5591 36 A 3.2343 7.4911 122.2431 54.9060 18.3497 177.7721 37 P 4.1013 0.0000 0.0000 65.5155 31.4718 178.7378 38 K 3.8791 7.7259 117.7915 59.3951 32.1412 179.2187 39 V 3.4851 8.0582 118.4974 65.9007 31.3197 177.9135 40 A 3.8729 7.5057 120.0991 54.9074 18.1245 179.2641 41 E 3.9137 8.4451 118.0768 59.6301 29.7183 178.7168 42 M 4.1489 8.3806 118.3225 58.4633 32.3530 177.7060 43 W 4.4718 9.1214 128.9570 60.7311 30.8841 177.5121 44 K 3.9198 8.7913 119.4251 59.8068 31.5297 178.4897 45 E 3.9617 8.3781 118.2180 59.5701 29.4425 178.5964 46 Y 4.1722 8.0646 119.2194 60.6590 38.9969 177.0847 47 M 3.9006 8.0166 118.8991 56.9270 32.0243 177.1912 48 L 4.5374 7.6292 118.4264 54.0023 42.1571 176.3587 49 R 4.6553 6.8707 116.9410 53.5055 32.9388 175.7011 50 P 4.3729 0.0000 0.0000 65.8993 31.7914 177.7478 51 S 4.1428 8.2138 112.6836 60.7978 62.6186 175.2212 52 V 3.4208 6.7275 120.2454 62.4787 31.7349 176.0293 53 N 4.8137 8.3917 125.1753 51.9907 41.8585 175.7934 54 T 3.9015 8.1548 110.6752 65.3692 68.7107 175.9384 55 R 3.8148 7.9264 121.6519 59.2270 29.9672 178.1583 56 R 4.0280 8.1011 116.9664 59.3554 30.0373 179.0855 57 K 4.0171 8.1210 117.6217 59.4753 31.6509 178.8823 58 L 4.2695 8.8561 120.9707 58.5696 41.9318 179.1860 59 L 4.3321 8.4281 118.7593 57.8498 41.5469 179.4718 60 G 4.1075 8.5432 105.8866 48.0513 0.0000 175.2736 61 L 4.2270 8.4663 122.6800 58.3873 42.1308 178.7964 62 Y 4.0608 7.9035 115.8014 60.7076 37.7505 178.2248 63 L 4.0149 8.2608 121.7108 58.4758 42.3432 178.9862 64 M 3.4235 8.1650 117.1734 57.8520 30.7426 178.0698 65 N 4.0506 8.0096 118.1806 56.8251 39.3016 176.4166 66 H 4.0545 8.2757 119.7019 59.0168 29.6770 177.4091 67 V 3.3373 7.4587 119.1607 65.8475 31.6917 177.7633 68 V 3.4442 7.3689 117.8724 66.1951 31.4910 177.7759 69 Q 3.8699 7.9163 117.5880 59.3225 28.4440 179.2775 70 Q 3.9774 7.7652 118.0658 58.4547 28.6056 178.1089 71 A 3.9787 7.6886 122.1067 55.3876 17.7782 179.6521 72 K 3.9019 7.7081 115.8549 59.6309 31.8556 179.4523 73 G 3.7562 8.2389 105.0490 46.3990 0.0000 174.2909 74 Q 4.4175 7.8642 118.9759 54.8689 29.4552 175.9742 75 K 3.7951 7.3953 114.1347 58.0243 29.8943 175.6211 76 I 4.5969 7.4880 116.8928 59.5463 40.3296 176.7226 77 I 4.4367 8.1973 124.4052 61.9892 39.0264 177.8923 78 Q 4.0259 8.1059 118.5572 58.8511 28.4382 178.8028 79 F 4.1959 8.0967 118.5128 60.6293 39.1168 177.5788 80 Q 4.3006 8.2198 117.3144 59.1601 28.6252 178.1395 81 D 4.4807 8.3870 119.0743 57.0645 40.9182 178.6191 82 S 3.9997 8.3191 115.9757 61.7114 62.7940 176.5585 83 F 4.4653 8.6933 118.7539 59.6878 39.0748 177.8316 84 G 3.1474 8.4534 106.3353 47.0568 0.0000 176.0785 85 K 4.1105 7.9946 119.9773 58.6970 32.8370 178.5505 86 V 4.3542 7.2394 111.3845 60.8737 32.3116 177.4017 87 A 4.0664 7.7336 121.9713 55.3148 18.1639 179.7827 88 A 3.9313 7.8687 118.7244 55.0759 18.2505 179.2431 89 E 3.9462 8.0396 117.5338 59.2885 30.0241 178.5877 90 V 3.4968 8.0077 118.0867 66.0948 31.6108 177.7890 91 L 4.0107 8.4247 119.0551 58.0664 41.4789 180.0691 92 G 3.9568 7.7430 106.3846 47.0203 0.0000 175.9858 93 R 3.9654 8.1091 120.9022 58.7660 30.1309 178.7163 94 I 3.7622 8.1393 113.0235 63.2562 37.5573 177.7333 95 N 4.1548 8.1132 119.0052 56.2465 38.7818 176.3985 96 Q 4.1931 7.4244 118.0269 58.9550 29.1155 177.7119 97 E 4.1944 7.7560 118.2223 57.6107 30.0105 177.5075 98 F 4.4929 7.9516 117.8812 56.3355 39.7396 174.0161 99 P 4.5773 0.0000 0.0000 62.3343 33.1615 177.6643 100 R 3.9310 8.4706 115.3439 59.1576 29.3760 178.2572 101 D 4.4357 7.9612 118.6622 57.4650 41.4084 178.0539 102 L 4.2225 7.8724 118.7716 57.3150 41.6633 179.1384 103 K 3.9731 8.3700 119.1091 59.6933 32.0006 179.3107 104 K 4.0436 7.7987 117.0026 59.4272 31.5486 179.5614 105 K 4.0434 8.1188 118.3286 59.3426 31.9385 178.9841 106 L 3.8332 8.4311 120.8985 57.9600 41.6144 178.5301 107 S 4.0997 8.5862 113.7932 61.6423 62.0497 176.5338 108 R 4.0185 7.9766 117.2364 59.0493 29.3071 178.6599 109 V 3.7133 7.2649 119.0387 65.6782 31.3077 178.1267 110 V 3.6426 8.0271 118.2363 66.0639 31.2245 177.8166 111 N 4.3773 7.9627 115.5193 56.1591 38.3425 177.1479 112 I 3.6736 7.4988 121.2718 64.6240 37.1719 178.2039 113 L 3.9665 7.7283 119.5085 57.7653 41.1728 179.7389 114 K 4.0644 8.1151 118.0990 58.9646 31.9675 178.9100 115 E 4.0585 7.8324 118.6301 59.4544 29.9580 178.6741 116 R 3.9539 7.8609 115.7833 56.5333 30.7483 176.0927 117 N 4.1600 8.0675 115.0206 54.4155 35.8542 175.4287 118 I 3.5472 7.0972 119.4774 63.2919 37.9959 177.4212 119 F 4.7612 6.9918 119.5095 56.9359 40.5862 176.1688 120 S 4.6933 8.2609 118.5743 57.1739 65.7783 175.1805 121 K 3.9760 8.4813 121.9313 59.8679 31.4970 178.5722 122 Q 3.9782 8.0003 117.4848 58.7935 28.9947 178.4371 123 V 3.7071 7.6843 118.6686 65.8433 31.9172 177.9192 124 V 3.6109 7.9461 118.0845 66.3461 31.1780 177.7021 125 N 4.3756 8.4895 116.1254 56.1174 38.2730 176.9911 126 D 4.3025 8.0829 119.6962 57.1949 41.3377 178.0805 127 I 3.6594 7.6879 119.7980 64.5086 37.1730 177.7808 128 E 3.9387 7.9686 118.7719 59.8061 29.2829 179.6650 129 R 3.9255 7.6670 117.7128 59.3738 30.1043 178.9128 130 S 4.0798 8.0561 112.7423 61.5798 62.3245 176.4053 131 L 4.0017 7.8400 120.9465 57.6093 41.1313 179.0600 132 A 3.9757 7.8970 119.7625 55.2528 17.9746 179.3070 133 A 4.0574 7.8954 118.7052 55.3140 18.3001 179.7195 134 A 4.0590 7.4491 117.1965 54.6218 18.5096 179.1726 135 L 3.9888 7.8648 118.6692 56.4629 42.4271 176.5679 136 E 4.5809 7.2630 118.4093 54.7285 31.1579 174.7638 137 H 4.4910 8.8620 126.2465 59.0230 30.5736 174.3001 138 H 4.2937 8.2207 121.5584 56.5227 29.5845 174.5453 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 4.23 1.40 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 0.00 0.00 0.00 3 F 7.37 4.57 0.00 3.11 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 4 S 7.97 4.31 0.00 3.93 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 5 S 8.66 4.45 0.00 3.97 4.09 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 6 E 8.33 3.97 0.00 2.06 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 2.39 2.43 0.00 7 Q 8.28 3.78 0.00 2.64 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.49 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 8 F 8.82 4.76 0.00 3.64 3.36 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 9 T 8.35 3.53 4.26 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 1.24 0.00 0.00 10 T 8.03 3.83 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 1.17 0.00 0.00 11 K 8.20 4.16 0.00 1.82 1.82 0.00 1.27 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.21 7.81 12 L 7.80 3.92 0.00 1.19 1.10 -0.71 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.38 4.60 0.00 2.79 2.92 0.00 0.00 7.01 7.99 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 14 T 7.40 4.60 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 1.23 0.00 0.00 15 L 7.18 4.30 0.00 1.88 1.72 1.01 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.47 4.67 0.00 1.91 1.84 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 2.21 2.32 0.00 17 D 8.27 4.61 0.00 2.63 2.59 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 0.00 0.00 0.00 0.00 18 S 7.77 4.63 0.00 3.85 3.60 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 19 Q 8.63 3.96 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 20 E 8.06 4.10 0.00 2.00 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 2.39 2.35 0.00 21 S 7.89 4.06 0.00 3.88 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 22 I 7.62 3.72 1.82 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 1.61 0.60 0.91 0.00 0.00 23 S 7.70 4.11 0.00 3.89 3.85 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 24 S 8.56 4.10 0.00 3.95 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 25 A 8.13 4.26 1.49 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 0.00 0.00 0.00 26 S 8.61 4.14 0.00 4.08 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 27 K 8.27 3.95 0.00 1.89 1.98 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.54 7.81 28 W 7.85 4.39 0.00 3.34 3.55 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 0.00 0.00 0.00 0.00 29 L 8.30 3.67 0.00 1.91 1.61 1.21 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.07 4.07 0.00 1.84 1.74 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.17 4.61 0.00 1.56 1.49 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 8.32 4.45 0.00 1.98 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 5.11 0.00 0.00 0.00 0.00 0.00 1.67 1.48 0.00 33 Y 8.41 3.75 0.00 3.04 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 34 R 6.76 3.46 0.00 1.32 1.60 0.00 2.89 0.00 0.00 3.00 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 35 D 7.41 4.56 0.00 2.40 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 36 A 7.49 3.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.10 0.00 2.19 2.21 0.00 3.36 0.00 0.00 3.55 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 38 K 7.73 3.88 0.00 1.77 1.84 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.44 7.81 39 V 8.06 3.49 1.84 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 0.61 0.00 0.00 0.63 0.00 0.00 40 A 7.51 3.87 1.13 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 0.00 0.00 41 E 8.45 3.91 0.00 2.25 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 2.36 2.35 0.00 42 M 8.38 4.15 0.00 2.50 2.34 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 2.76 2.74 0.00 43 W 9.12 4.47 0.00 4.12 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 44 K 8.79 3.92 0.00 2.19 2.19 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.56 7.81 45 E 8.38 3.96 0.00 2.23 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 0.00 2.40 2.53 0.00 46 Y 8.06 4.17 0.00 2.97 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 47 M 8.02 3.90 0.00 1.51 1.60 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.91 0.00 48 L 7.63 4.54 0.00 1.55 1.61 0.91 0.66 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 49 R 6.87 4.66 0.00 1.78 1.64 0.00 3.21 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 50 P 0.00 4.37 0.00 2.14 2.14 0.00 3.72 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 1.94 1.92 0.00 51 S 8.21 4.14 0.00 3.95 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 52 V 6.73 3.42 1.87 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 0.54 0.00 0.00 -0.15 0.00 0.00 53 N 8.39 4.81 0.00 2.75 2.72 0.00 0.00 6.87 7.03 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 54 T 8.15 3.90 3.57 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 0.81 0.00 0.00 55 R 7.93 3.81 0.00 1.86 1.99 0.00 3.18 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 56 R 8.10 4.03 0.00 2.03 2.09 0.00 3.59 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 57 K 8.12 4.02 0.00 2.48 1.99 0.00 2.06 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.48 7.81 58 L 8.86 4.27 0.00 1.96 2.03 1.21 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.43 4.33 0.00 2.02 1.82 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.54 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 61 L 8.47 4.23 0.00 2.02 1.64 0.86 0.79 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 62 Y 7.90 4.06 0.00 3.32 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 63 L 8.26 4.01 0.00 1.91 2.02 1.06 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 64 M 8.16 3.42 0.00 1.05 0.57 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 1.62 0.00 65 N 8.01 4.05 0.00 2.89 2.95 0.00 0.00 6.64 7.37 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 66 H 8.28 4.05 0.00 3.42 3.40 0.00 5.84 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 67 V 7.46 3.34 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 0.28 0.00 0.00 0.92 0.00 0.00 68 V 7.37 3.44 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 0.93 0.00 0.00 0.80 0.00 0.00 69 Q 7.92 3.87 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 70 Q 7.77 3.98 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.68 0.00 0.00 0.00 0.00 0.00 2.18 2.31 0.00 71 A 7.69 3.98 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 72 K 7.71 3.90 0.00 2.00 1.84 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.53 7.81 73 G 8.24 3.76 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 0.00 0.00 0.00 74 Q 7.86 4.42 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 75 K 7.40 3.80 0.00 1.85 1.81 0.00 1.50 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.41 7.81 76 I 7.49 4.60 2.03 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 1.10 0.00 0.00 77 I 8.20 4.44 1.89 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 1.65 0.97 0.94 0.00 0.00 78 Q 8.11 4.03 0.00 1.87 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 79 F 8.10 4.20 0.00 3.13 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 80 Q 8.22 4.30 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 81 D 8.39 4.48 0.00 2.85 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 82 S 8.32 4.00 0.00 3.92 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 83 F 8.69 4.47 0.00 3.35 3.05 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 84 G 8.45 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 0.00 0.00 0.00 85 K 7.99 4.11 0.00 1.92 2.08 0.00 1.47 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.72 7.81 86 V 7.24 4.35 2.30 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 0.99 0.00 0.00 1.35 0.00 0.00 87 A 7.73 4.07 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 88 A 7.87 3.93 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.04 3.95 0.00 2.11 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 2.38 2.41 0.00 90 V 8.01 3.50 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 0.51 0.00 0.00 1.05 0.00 0.00 91 L 8.42 4.01 0.00 1.76 1.69 0.93 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 92 G 7.74 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.11 3.97 0.00 2.01 1.91 0.00 3.25 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 94 I 8.14 3.76 0.96 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.29 0.74 0.00 0.00 95 N 8.11 4.15 0.00 2.69 2.84 0.00 0.00 7.22 6.91 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 96 Q 7.42 4.19 0.00 2.39 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 97 E 7.76 4.19 0.00 2.11 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 0.00 2.41 2.53 0.00 98 F 7.95 4.49 0.00 2.98 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 99 P 0.00 4.58 0.00 2.24 2.15 0.00 3.45 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.89 0.00 100 R 8.47 3.93 0.00 2.00 2.14 0.00 3.04 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 101 D 7.96 4.44 0.00 2.73 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 0.00 102 L 7.87 4.22 0.00 1.77 1.90 0.04 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.37 3.97 0.00 2.05 1.93 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.57 1.64 7.81 104 K 7.80 4.04 0.00 2.03 1.89 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.51 7.81 105 K 8.12 4.04 0.00 2.05 2.01 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.68 7.81 106 L 8.43 3.83 0.00 1.79 1.71 0.71 0.80 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 0.00 107 S 8.59 4.10 0.00 3.94 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 0.00 108 R 7.98 4.02 0.00 2.05 2.09 0.00 3.21 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.70 0.00 109 V 7.26 3.71 2.13 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 0.67 0.00 0.00 0.75 0.00 0.00 110 V 8.03 3.64 2.23 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 1.00 0.00 0.00 1.00 0.00 0.00 111 N 7.96 4.38 0.00 2.97 2.86 0.00 0.00 7.23 7.11 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 0.00 112 I 7.50 3.67 2.01 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 1.13 0.90 0.00 0.00 113 L 7.73 3.97 0.00 1.89 1.79 0.74 0.85 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 0.00 114 K 8.12 4.06 0.00 1.78 1.88 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.62 7.81 115 E 7.83 4.06 0.00 1.95 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 0.00 2.27 2.38 0.00 116 R 7.86 3.95 0.00 1.73 1.88 0.00 3.48 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.87 0.00 117 N 8.07 4.16 0.00 2.84 2.86 0.00 0.00 6.98 6.71 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 0.00 118 I 7.10 3.55 0.91 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 1.17 0.39 0.10 0.00 0.00 119 F 6.99 4.76 0.00 3.09 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 0.00 120 S 8.26 4.69 0.00 3.92 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 0.00 121 K 8.48 3.98 0.00 1.88 1.83 0.00 1.63 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.61 7.81 122 Q 8.00 3.98 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 123 V 7.68 3.71 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 0.69 0.00 0.00 0.96 0.00 0.00 124 V 7.95 3.61 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 1.00 0.00 0.00 1.06 0.00 0.00 125 N 8.49 4.38 0.00 2.95 2.86 0.00 0.00 6.78 8.93 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 0.00 126 D 8.08 4.30 0.00 2.69 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 0.00 127 I 7.69 3.66 1.98 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 1.58 1.09 0.90 0.00 0.00 128 E 7.97 3.94 0.00 2.02 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 2.46 2.52 0.00 129 R 7.67 3.93 0.00 1.95 1.99 0.00 3.30 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 130 S 8.06 4.08 0.00 4.04 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 0.00 131 L 7.84 4.00 0.00 1.79 1.70 0.92 1.07 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 0.00 132 A 7.90 3.98 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 0.00 133 A 7.90 4.06 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 0.00 134 A 7.45 4.06 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 0.00 135 L 7.86 3.99 0.00 1.81 1.86 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 136 E 7.26 4.58 0.00 1.99 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 0.00 2.25 2.25 0.00 137 H 8.86 4.49 0.00 3.14 3.32 0.00 5.81 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 0.00 138 H 8.22 4.29 0.00 3.11 3.16 0.00 5.83 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00