NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.6119 8.4093 119.1992 52.9326 40.0885 173.8667 4 Q 3.9178 8.5384 123.7703 56.9014 29.0595 174.5805 5 Y 5.2441 9.0038 119.0908 57.1666 41.1058 175.1565 6 Y 6.1496 8.1033 121.0794 55.4146 42.8235 175.0651 7 G 3.6852 6.8804 108.8049 45.3460 0.0000 172.3197 8 T 4.1868 8.1109 123.6339 63.0915 69.1697 174.2940 9 G 4.1080 8.7572 114.3112 44.5627 0.0000 172.0679 10 R 5.7320 8.4144 125.8014 53.3762 32.9089 174.5916 11 R 4.2564 8.4684 126.4567 55.0538 33.1988 174.5956 12 K 3.7531 9.1805 129.5804 58.1655 30.7305 175.4295 13 S 3.7116 7.8528 111.4409 58.7356 60.7881 170.5066 14 S 4.7429 7.8989 118.3808 57.0275 68.1863 174.3701 15 A 4.8506 8.5927 125.8757 51.4065 21.2471 176.5351 16 A 5.7207 8.1230 120.0610 51.5334 21.5592 173.8425 17 R 4.3815 8.4057 118.4122 56.5850 31.7205 175.7272 18 V 4.5309 8.3429 125.5462 61.2282 33.3590 174.0989 19 F 5.9571 9.1960 127.8026 56.0953 41.3477 174.9641 20 I 4.8434 9.1528 123.4653 59.3861 41.5408 174.1107 21 K 4.7167 9.3623 126.9669 54.0006 36.9561 174.6553 22 P 4.7462 0.0000 0.0000 62.8599 28.6980 175.0855 23 G 4.0589 7.5512 114.1090 44.2790 0.0000 167.8851 24 N 4.3225 8.9214 116.5239 53.3480 37.0103 174.6896 25 G 4.8534 8.7643 112.0425 45.3851 0.0000 170.3985 26 K 4.8475 7.8216 122.2405 55.3967 36.2015 176.5176 27 I 3.9238 8.4832 124.7665 61.1766 38.3830 175.7030 28 V 4.6790 8.7460 127.3696 61.0537 31.1617 173.2302 29 I 4.0763 8.4391 123.1694 59.8277 39.3794 175.5717 30 N 3.8736 9.3427 129.4487 55.8054 36.1709 174.2608 31 Q 3.1624 7.5672 107.7590 56.8485 28.6181 174.4893 32 R 4.5870 7.8505 115.4817 55.1995 33.6137 175.4247 33 S 5.0439 8.0638 113.8544 55.5874 64.3250 173.7931 34 L 3.7973 8.0164 120.2331 59.4644 41.8165 178.1101 35 E 4.3801 8.0220 118.7871 57.5539 30.2906 178.1084 36 Q 4.2521 7.5906 118.7990 58.9578 28.7107 178.5835 37 Y 4.9794 8.1073 108.1553 57.6261 40.9760 174.6103 38 F 4.3922 8.1452 117.4714 56.9215 40.8234 175.2343 39 G 3.4699 7.8212 109.5088 46.0188 0.0000 171.2741 40 R 3.8209 8.5739 130.7423 55.4872 28.3490 176.0302 41 E 4.3892 8.8548 121.1626 56.8617 30.0803 177.5635 42 T 4.1218 8.8947 124.5691 65.4668 70.0962 174.0356 43 A 4.3021 7.3486 121.2132 52.4837 21.6306 175.4424 44 R 4.5523 7.8663 114.9614 57.1892 35.1431 176.3118 45 M 4.2436 8.3765 117.4440 58.9358 32.2405 178.9416 46 V 3.3746 7.6429 111.0831 64.3062 31.8405 177.4995 47 V 3.9638 7.9445 111.5260 63.3019 32.4232 178.6536 48 R 4.0364 8.0481 118.6892 59.6347 30.0728 178.5870 49 Q 3.9652 8.5295 118.2204 58.9619 28.4841 178.2167 50 P 4.2471 0.0000 0.0000 65.1337 31.7049 177.4877 51 L 4.7169 7.5170 114.8644 54.3088 41.9226 177.7572 52 E 4.3007 8.4414 116.5144 57.3349 28.8347 177.3427 53 L 4.4151 7.7049 120.7875 56.1362 42.6415 177.8492 54 V 4.2816 8.3144 108.2645 61.0909 34.7587 170.2112 55 D 4.3889 8.3757 127.2676 53.8955 42.4796 172.1124 56 M 4.7276 7.5720 126.1158 53.9924 32.5198 176.5328 57 V 3.3656 8.7653 117.2325 61.9338 30.4104 173.3777 58 E 4.9215 7.5100 119.8838 56.3501 33.8754 177.3190 59 K 4.0782 8.3822 120.5785 59.0118 32.7278 176.0604 60 L 5.0512 7.5740 116.1911 54.9573 43.5663 174.4836 61 D 5.4683 9.0761 120.9644 53.3289 40.8161 176.2044 62 L 4.6383 8.4435 117.2374 53.1029 44.3149 174.4506 63 Y 4.7924 8.7144 125.2262 55.9787 40.3438 174.0558 64 I 4.9587 7.9286 127.1712 59.6779 41.1454 175.0387 65 T 5.6357 9.3597 121.4888 60.7569 72.3204 173.5101 66 V 5.3110 8.2752 123.8897 59.8712 34.6300 174.7282 67 K 4.3251 9.0264 124.0334 58.5352 35.5203 174.4682 68 G 4.2360 10.1877 111.5054 44.7204 0.0000 173.5921 69 G 4.2833 9.2382 109.2699 45.4322 0.0000 176.7128 70 G 3.7340 9.0935 111.9459 46.0752 0.0000 175.7256 71 I 2.6205 8.8279 117.2040 60.9143 39.9094 176.1906 72 S 4.1622 9.0277 120.1433 61.5438 63.2092 175.8775 73 G 3.6450 8.6563 108.2954 47.3382 0.0000 176.1081 74 Q 4.0419 8.5792 120.5605 59.0739 28.9442 178.0986 75 A 3.8872 8.3463 121.4096 55.4035 18.1644 179.8658 76 G 3.4340 7.8618 103.1059 47.9599 0.0000 175.8730 77 A 4.0426 7.6372 123.7675 55.0953 18.2751 179.0963 78 I 3.5475 8.7068 119.2428 64.7154 37.1563 178.0362 79 R 4.0103 8.6833 119.1011 60.1556 29.9978 177.8821 80 H 4.0984 8.7455 118.0249 59.6863 29.5737 177.3775 81 G 3.5652 8.2866 106.1659 47.4711 0.0000 175.6270 82 I 3.8583 8.5065 123.3207 64.6195 36.9904 178.4602 83 T 3.9789 7.7295 112.1315 64.7540 67.2213 176.2105 84 R 4.0440 7.9169 119.0059 57.7379 30.1007 177.3393 85 A 5.6927 7.5390 121.5698 50.1891 21.3049 176.9773 86 L 4.6864 7.7751 119.9078 54.7337 42.1923 175.8735 87 M 4.9999 7.9606 110.2999 56.7744 35.2024 175.7146 88 E 4.0398 8.2419 120.8512 59.5434 30.1952 178.2564 89 Y 3.7206 8.0502 118.5970 59.8164 39.0886 175.6427 90 D 4.7714 7.9315 118.6635 52.4960 43.8066 174.9909 91 E 4.2843 8.9791 126.7711 57.5207 30.0343 176.6076 92 S 4.6771 8.6602 112.3530 59.0013 63.0550 175.4302 93 L 4.3028 7.7299 121.9698 56.6336 41.6681 178.3277 94 R 3.9261 8.0808 118.2072 59.9689 29.5675 178.3703 95 S 4.1151 7.9898 111.7017 61.3834 62.3592 175.6091 96 E 4.1631 7.7977 118.9386 57.9615 29.3706 177.3397 97 L 4.4673 7.6892 118.8049 56.2658 43.6771 178.7910 98 R 3.9074 8.1436 116.3795 59.2586 29.9816 178.6442 99 K 4.0005 7.4652 115.9299 59.9639 32.5133 178.7897 100 A 3.7846 7.4735 120.7823 52.5258 18.3817 177.6861 101 G 3.6699 8.1279 104.6516 46.6833 0.0000 174.3559 102 F 5.0350 7.7315 119.2949 58.5105 40.6791 178.2807 103 V 3.7156 7.9055 109.9934 62.3181 31.0587 175.5827 104 T 4.4053 7.5751 118.0702 61.4166 68.9768 174.4626 105 R 3.8207 8.6010 128.2117 55.9881 30.2181 176.4170 106 D 4.5397 8.5355 126.0675 52.5393 38.0513 176.5070 107 A 4.2451 8.2645 124.9771 53.3742 17.9896 177.9291 108 R 3.9414 8.0292 117.8549 57.6371 29.0127 175.4696 109 Q 4.7075 8.1792 124.1229 53.8622 32.0786 174.4216 110 V 4.1447 7.9993 111.7113 59.7289 32.6212 176.2740 111 E 4.0194 8.7316 124.4565 56.1848 30.0931 177.2968 112 R 4.0304 8.5115 119.8421 55.9124 30.0707 176.0925 113 K 4.3199 8.4004 120.7031 56.3303 33.0532 176.1709 114 K 4.5199 8.3228 123.5303 53.9044 34.4281 175.9232 115 V 3.6759 8.4850 123.6950 63.8874 31.1377 176.0355 116 G 4.0732 8.9575 112.1513 45.0249 0.0000 172.9471 117 L 4.8818 7.7086 118.9239 52.6264 44.7490 177.0355 118 R 4.0158 8.3450 120.0920 58.8663 30.3706 177.5655 119 K 3.9019 8.1944 111.8084 56.7761 33.4022 172.8233 120 A 4.2061 8.3132 127.3064 50.8456 17.5784 177.1718 121 R 4.4716 7.5644 115.3139 55.0790 33.2132 176.3376 122 R 3.9596 8.4344 120.1037 56.0846 30.0735 174.8732 123 R 4.7326 8.2849 125.8535 53.8206 31.7099 174.0520 124 P 4.4523 0.0000 0.0000 62.3284 32.0277 176.5468 125 Q 4.5732 8.3664 120.6626 56.0864 30.3239 176.3409 126 F 5.0164 8.1448 110.8471 56.1175 37.7107 173.6148 127 S 4.0402 7.6242 116.7495 59.7282 64.3421 175.1962 128 K 3.7937 9.1671 121.1671 56.7970 30.5179 175.8022 129 R 4.1002 7.3337 120.9037 56.6068 30.6480 175.9585 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 8.41 4.61 0.00 2.70 2.85 0.00 0.00 7.00 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 8.54 3.92 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.70 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 5 Y 9.00 5.24 0.00 3.04 2.92 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 6 Y 8.10 6.15 0.00 3.38 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 7 G 6.88 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 8 T 8.11 4.19 4.19 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 1.26 0.00 0.00 9 G 8.76 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 10 R 8.41 5.73 0.00 1.76 1.72 0.00 3.06 0.00 0.00 3.82 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 11 R 8.47 4.26 0.00 1.89 1.76 0.00 3.37 0.00 0.00 3.59 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.84 0.00 12 K 9.18 3.75 0.00 1.87 1.78 0.00 1.98 0.00 0.00 1.63 0.00 0.00 2.72 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.40 7.81 13 S 7.85 3.71 0.00 4.01 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 14 S 7.90 4.74 0.00 4.00 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 15 A 8.59 4.85 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 16 A 8.12 5.72 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 17 R 8.41 4.38 0.00 1.73 1.54 0.00 3.13 0.00 0.00 3.20 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 18 V 8.34 4.53 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 0.99 0.00 0.00 0.97 0.00 0.00 19 F 9.20 5.96 0.00 3.19 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 20 I 9.15 4.84 2.03 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.70 1.12 0.00 0.00 21 K 9.36 4.72 0.00 1.76 1.53 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.21 1.34 7.81 22 P 0.00 4.75 0.00 2.17 2.10 0.00 3.57 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 23 G 7.55 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 24 N 8.92 4.32 0.00 2.89 3.04 0.00 0.00 5.86 6.92 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 25 G 8.76 4.85 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 0.00 0.00 0.00 26 K 7.82 4.85 0.00 1.72 1.75 0.00 1.59 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.46 7.81 27 I 8.48 3.92 1.88 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 1.23 1.02 0.93 0.00 0.00 28 V 8.75 4.68 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 0.88 0.00 0.00 1.01 0.00 0.00 29 I 8.44 4.08 1.74 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.32 0.93 0.00 0.00 30 N 9.34 3.87 0.00 2.68 2.65 0.00 0.00 6.51 7.51 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 31 Q 7.57 3.16 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.59 6.79 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 32 R 7.85 4.59 0.00 1.89 1.73 0.00 3.09 0.00 0.00 2.91 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.01 0.00 33 S 8.06 5.04 0.00 4.01 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 34 L 8.02 3.80 0.00 1.75 1.67 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.02 4.38 0.00 2.04 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 2.33 2.35 0.00 36 Q 7.59 4.25 0.00 2.41 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.69 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 37 Y 8.11 4.98 0.00 3.18 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 38 F 8.15 4.39 0.00 2.61 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 39 G 7.82 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 3.82 0.00 1.97 2.01 0.00 3.15 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 41 E 8.85 4.39 0.00 1.70 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 1.95 2.23 0.00 42 T 8.89 4.12 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 1.17 0.00 0.00 43 A 7.35 4.30 1.14 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 0.00 0.00 44 R 7.87 4.55 0.00 1.76 1.82 0.00 3.24 0.00 0.00 3.48 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 45 M 8.38 4.24 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 46 V 7.64 3.37 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 0.63 0.00 0.00 0.89 0.00 0.00 47 V 7.94 3.96 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 0.68 0.00 0.00 1.04 0.00 0.00 48 R 8.05 4.04 0.00 1.81 1.96 0.00 3.32 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.65 0.00 49 Q 8.53 3.97 0.00 1.79 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.61 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 50 P 0.00 4.25 0.00 1.98 2.07 0.00 3.68 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.95 0.00 51 L 7.52 4.72 0.00 1.67 1.66 0.93 0.92 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 52 E 8.44 4.30 0.00 1.96 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 2.62 2.42 0.00 53 L 7.70 4.42 0.00 1.65 1.71 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.31 4.28 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 0.66 0.00 0.00 0.93 0.00 0.00 55 D 8.38 4.39 0.00 2.77 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 56 M 7.57 4.73 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.64 0.00 57 V 8.77 3.37 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 1.09 0.00 0.00 0.94 0.00 0.00 58 E 7.51 4.92 0.00 2.05 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 2.41 2.11 0.00 59 K 8.38 4.08 0.00 1.80 1.89 0.00 1.74 0.00 0.00 1.95 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.39 7.81 60 L 7.57 5.05 0.00 1.99 1.68 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.08 5.47 0.00 2.70 2.77 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 0.00 0.00 0.00 62 L 8.44 4.64 0.00 1.75 1.61 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.71 4.79 0.00 3.13 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 64 I 7.93 4.96 1.77 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 1.19 0.35 0.81 0.00 0.00 65 T 9.36 5.64 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 1.28 0.00 0.00 66 V 8.28 5.31 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 0.74 0.00 0.00 1.09 0.00 0.00 67 K 9.03 4.33 0.00 1.73 1.74 0.00 1.54 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.52 7.81 68 G 10.19 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 0.00 0.00 0.00 0.00 69 G 9.24 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 0.00 0.00 0.00 0.00 70 G 9.09 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 71 I 8.83 2.62 1.52 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.61 0.47 0.00 0.00 72 S 9.03 4.16 0.00 3.81 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 73 G 8.66 3.65 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 0.00 0.00 0.00 74 Q 8.58 4.04 0.00 2.40 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.65 0.00 0.00 0.00 0.00 0.00 2.66 2.58 0.00 75 A 8.35 3.89 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 76 G 7.86 3.43 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 0.00 77 A 7.64 4.04 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 78 I 8.71 3.55 2.07 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 1.39 1.15 0.88 0.00 0.00 79 R 8.68 4.01 0.00 1.88 1.98 0.00 2.21 0.00 0.00 2.75 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.39 0.00 80 H 8.75 4.10 0.00 3.30 3.49 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 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 0.00 0.00 0.00 0.00 82 I 8.51 3.86 1.94 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 0.90 0.91 0.00 0.00 83 T 7.73 3.98 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 1.37 0.00 0.00 84 R 7.92 4.04 0.00 1.86 1.83 0.00 3.28 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 1.53 1.85 0.00 85 A 7.54 5.69 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 86 L 7.78 4.69 0.00 1.82 1.60 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.96 5.00 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 88 E 8.24 4.04 0.00 1.65 1.78 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 2.34 2.30 0.00 89 Y 8.05 3.72 0.00 3.21 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 90 D 7.93 4.77 0.00 2.83 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.98 4.28 0.00 1.94 1.95 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 2.28 2.35 0.00 92 S 8.66 4.68 0.00 3.97 3.94 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 93 L 7.73 4.30 0.00 1.88 1.77 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 94 R 8.08 3.93 0.00 1.81 1.99 0.00 3.29 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.72 0.00 95 S 7.99 4.12 0.00 3.87 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 96 E 7.80 4.16 0.00 2.05 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 2.55 2.50 0.00 97 L 7.69 4.47 0.00 1.85 1.68 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.14 3.91 0.00 1.74 1.97 0.00 3.20 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 99 K 7.47 4.00 0.00 1.88 1.89 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.37 7.81 100 A 7.47 3.78 0.60 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 0.00 0.00 101 G 8.13 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 0.00 0.00 0.00 102 F 7.73 5.04 0.00 3.06 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 0.00 103 V 7.91 3.72 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 0.71 0.00 0.00 0.93 0.00 0.00 104 T 7.58 4.41 4.29 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 1.24 0.00 0.00 105 R 8.60 3.82 0.00 1.72 1.84 0.00 3.36 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.47 0.00 106 D 8.54 4.54 0.00 2.95 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 0.00 107 A 8.26 4.25 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 0.00 108 R 8.03 3.94 0.00 1.80 1.94 0.00 3.11 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 109 Q 8.18 4.71 0.00 1.97 1.98 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 2.22 2.33 0.00 110 V 8.00 4.14 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 0.00 111 E 8.73 4.02 0.00 1.93 1.90 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 2.32 2.37 0.00 112 R 8.51 4.03 0.00 1.98 2.07 0.00 2.96 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 113 K 8.40 4.32 0.00 1.74 1.75 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.24 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.46 7.81 114 K 8.32 4.52 0.00 1.81 1.66 0.00 2.08 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.49 7.81 115 V 8.48 3.68 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 8.96 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 0.00 0.00 0.00 117 L 7.71 4.88 0.00 1.67 1.83 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.34 4.02 0.00 1.80 1.99 0.00 3.21 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 119 K 8.19 3.90 0.00 1.87 1.88 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.33 7.81 120 A 8.31 4.21 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 0.00 121 R 7.56 4.47 0.00 1.76 1.94 0.00 3.37 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 122 R 8.43 3.96 0.00 1.86 1.95 0.00 3.13 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 123 R 8.28 4.73 0.00 1.77 1.80 0.00 3.27 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 124 P 0.00 4.45 0.00 2.11 1.99 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 125 Q 8.37 4.57 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.41 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 126 F 8.14 5.02 0.00 3.13 2.92 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 0.00 127 S 7.62 4.04 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 0.00 128 K 9.17 3.79 0.00 1.86 1.89 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.50 7.81 129 R 7.33 4.10 0.00 2.07 1.89 0.00 3.38 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00