NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.2886 8.3049 120.3465 55.4067 32.0880 175.6249 1 M 4.2587 7.9769 127.1110 53.5310 34.2755 175.4122 2 R 4.1641 8.3053 118.9257 59.6508 30.7101 177.5517 3 Y 4.2177 7.9937 117.4132 60.1263 38.0535 178.0682 4 L 3.3235 5.8636 122.5449 57.5517 41.9719 178.4352 5 H 4.1612 7.7260 117.7297 58.7368 29.5944 177.2592 6 K 3.9095 7.7777 121.2704 59.5020 32.0169 178.7678 7 I 4.0028 7.5236 119.8102 63.4884 38.0664 177.0677 8 E 4.0646 8.2024 120.2407 59.3333 29.4137 178.6661 9 L 3.9406 7.9009 120.2889 58.1255 42.1347 178.6325 10 E 4.0205 8.1217 119.2914 59.2895 29.5741 178.7428 11 L 4.2902 8.4821 119.4613 57.9531 41.5566 179.2739 12 N 4.5096 8.4414 116.5641 56.1968 38.5774 177.7614 13 R 3.9870 8.1233 119.7291 59.1114 30.0608 179.1060 14 L 4.2474 8.4979 119.3225 58.1690 41.4288 179.4863 15 T 4.1395 8.4562 115.3386 66.5716 68.5153 176.0289 16 S 4.4302 7.8558 113.5573 59.5385 63.6167 175.3041 17 R 4.3944 7.3223 119.9514 56.0802 31.0948 174.9240 18 Y 4.7675 8.0406 116.0134 55.0592 39.0165 173.9391 19 P 4.3078 0.0000 0.0000 65.2857 31.3645 177.7130 20 F 4.3395 8.5350 114.6777 57.5230 39.3890 174.5649 21 F 4.9752 8.5551 125.0123 57.0784 39.8370 174.7024 22 K 4.0715 8.1067 127.8170 54.1666 33.9461 176.1983 23 K 3.9415 7.6624 124.5173 53.8134 32.0839 175.5343 24 I 3.7638 7.5561 118.1650 59.6714 38.4715 176.2341 25 A 3.8395 7.9808 123.9184 51.7504 18.7939 177.7558 26 F 4.6451 7.7743 119.3042 57.2014 39.9390 175.2868 27 D 4.6279 8.7522 121.5354 53.7013 41.9808 176.7270 28 A 4.0641 8.7716 129.4059 55.3507 18.4759 178.8319 29 E 3.9366 8.2839 117.2347 59.6502 29.8207 179.0078 30 I 3.9260 8.0844 119.4631 64.0216 37.1100 178.4604 31 I 3.7766 8.0247 121.1517 64.4414 36.7261 178.5880 32 K 4.2474 7.9231 118.1600 59.3533 32.1488 179.2132 33 L 4.1760 8.0824 119.5119 57.7421 41.6388 179.6465 34 V 3.5131 8.2613 118.5044 65.6165 31.1161 177.7815 35 D 4.4558 7.8578 118.3592 57.6128 40.7801 178.2142 36 D 4.4647 7.6702 117.4569 55.7410 41.2431 177.3260 37 L 3.9334 6.7398 118.6280 55.2642 42.4996 177.7026 38 N 4.6712 8.4124 123.5250 51.8784 37.4357 173.8973 39 V 4.5240 6.8519 118.2733 58.5266 35.4942 176.2528 40 D 4.4450 8.3527 120.2765 54.1735 42.6130 177.0747 41 E 3.7753 8.7540 122.8380 60.0190 29.5522 179.1956 42 N 4.1738 8.0771 115.4798 56.3033 38.5399 177.4152 43 V 3.3124 7.1136 118.9482 65.8127 31.6992 178.0397 44 K 3.5299 7.5622 118.1573 59.5443 31.7017 179.1497 45 C 3.9997 7.8121 116.7454 62.3770 27.7834 176.0831 46 A 4.2121 7.7945 122.4598 55.2610 18.0200 179.6593 47 I 3.5889 7.8151 118.4695 64.5313 37.1795 178.7725 48 V 3.4580 7.6059 118.6003 65.8807 31.2495 177.9099 49 A 4.1161 7.9677 120.4025 55.3775 18.3323 179.5233 50 I 3.4044 7.9068 117.2859 63.7350 37.8492 177.5562 51 D 4.2718 7.7808 119.0689 57.7551 41.0785 178.4926 52 T 4.0235 8.1038 116.2421 66.4136 68.1879 176.4723 53 S 4.1474 8.0388 114.4943 62.0865 62.6043 176.1480 54 M 4.2983 8.1576 120.9699 58.1930 31.6974 179.0881 55 R 3.9535 8.1635 118.6300 59.4214 30.2886 178.6732 56 M 4.4905 8.4762 117.9504 58.4618 32.0019 177.8261 57 Q 4.0825 7.8755 119.9700 59.4810 28.9616 178.0134 58 D 4.3401 7.8901 118.0020 56.0543 40.8979 176.9550 59 F 4.7651 7.7280 116.5082 57.2753 39.7653 176.2566 60 I 3.8607 7.4163 123.5478 61.3487 37.2758 174.9506 61 N 5.0142 9.7388 122.2212 50.9500 40.4957 174.5443 62 E 3.9214 8.7838 117.8388 59.2938 29.6525 177.5506 63 D 4.5637 8.1513 117.8493 55.5725 41.4426 176.7829 64 N 4.9696 7.9436 115.0482 52.2715 38.0021 176.1869 65 K 3.8890 8.3191 119.6465 60.4944 31.8097 177.9977 66 D 4.5085 8.2786 116.9807 57.7677 41.1156 178.9284 67 S 4.7497 8.1295 113.8332 61.0139 62.7415 176.0341 68 F 4.0077 9.1463 120.8732 60.3040 38.6864 178.0250 69 V 3.6925 7.9412 117.6000 66.1102 31.4112 178.0558 70 L 4.0354 8.0160 118.1795 57.8832 41.5182 179.3645 71 S 4.4575 8.2327 115.3452 62.1219 62.8571 177.0140 72 T 3.9769 8.1070 112.2251 64.8747 68.3547 176.2519 73 D 4.3701 8.1344 121.7383 57.1473 40.8489 178.8881 74 V 3.5220 8.2703 119.0965 66.0102 31.4431 177.9370 75 L 4.0677 8.1615 118.7123 58.0656 41.4407 179.7795 76 S 4.1965 8.3397 114.8315 61.5383 62.7187 176.5677 77 A 4.1996 8.3028 123.6725 55.1399 18.0941 179.6985 78 L 3.6793 8.7006 117.8849 57.7095 41.4752 179.0999 79 F 4.3300 8.3046 119.6903 61.8263 39.5229 176.3055 80 Y 4.1937 8.2126 118.6144 60.6586 38.6441 177.9329 81 K 3.6830 7.9217 121.8269 59.1236 32.1679 178.1884 82 Y 4.6038 8.5697 116.4696 59.8286 37.6533 177.3064 83 L 4.9711 7.7301 119.2130 54.4265 42.5100 177.7540 84 S 4.4446 8.0529 115.4390 59.1299 64.0428 173.5586 85 Q 4.4659 7.6733 121.3791 53.9488 29.4254 171.8556 86 P 4.3216 0.0000 0.0000 61.8462 32.1623 176.4500 87 F 4.7362 8.4671 122.2504 58.6580 39.4846 176.3336 88 Y 4.1763 8.3061 130.3910 55.8907 34.6049 175.3407 89 Q 3.1051 6.8864 124.9396 59.3924 29.4638 177.0856 90 H 4.0627 8.1661 118.0509 59.7389 29.8114 176.7790 91 D 4.4696 8.2100 119.8668 57.4141 40.7227 178.4378 92 F 4.4395 8.7790 121.6214 61.1292 39.2293 177.3453 93 L 3.8788 8.1799 119.0247 57.8119 41.4035 179.8927 94 V 3.5823 7.6836 112.3484 64.4158 31.4987 178.7599 95 L 4.2370 8.3504 119.2423 57.9605 41.3852 179.6499 96 T 3.8962 8.0158 109.9991 64.7444 68.6264 176.1585 97 D 4.2662 7.9098 120.7280 57.1840 41.2258 177.9207 98 C 3.9746 8.2233 117.4567 62.7458 28.2761 176.2431 99 V 3.6984 7.8703 119.9044 66.1380 31.1498 178.2258 100 S 4.1408 7.7869 114.0857 61.5025 62.7445 176.6761 101 R 4.2864 7.9325 123.0274 58.5063 29.7597 178.7959 102 I 3.6040 8.1378 118.7722 64.1803 37.7795 177.7207 103 N 4.3400 8.0753 116.9505 56.1218 38.2028 177.3500 104 E 3.9699 8.1577 120.0924 59.4863 29.5773 179.3925 105 L 4.0020 8.2793 119.4068 57.7356 41.4328 179.7338 106 K 4.0123 8.1228 117.5348 58.7837 31.9976 179.0011 107 S 4.2963 7.6506 113.9977 61.0795 62.3918 176.1217 108 I 3.7710 8.0348 122.9164 64.3414 36.7900 178.1482 109 R 3.8203 8.1952 119.4257 59.5917 29.5788 178.1820 110 A 4.0374 7.5132 118.2668 54.3977 18.2957 178.0718 111 T 4.4052 7.6856 105.1894 61.3468 69.3146 174.0891 112 I 4.4595 7.6389 123.6344 60.2318 38.6431 175.5554 113 T 4.4481 8.2212 112.6536 61.2060 70.8002 174.3315 114 D 4.3319 8.0745 122.1712 54.3888 41.9369 176.0880 115 E 3.9417 8.8709 126.9627 59.6928 29.5532 179.2411 116 I 3.6771 7.7028 117.7429 63.9629 38.1222 177.4864 117 A 3.9932 8.0165 121.4831 55.1121 18.1900 179.3688 118 L 3.8696 8.1799 118.9863 58.5623 42.0572 178.7169 119 H 4.1497 8.4386 118.4311 59.3637 29.7933 177.0288 120 N 4.4013 8.6391 118.7540 56.1331 38.3923 177.3685 121 I 3.7693 8.1008 120.2936 63.8383 38.0307 177.7661 122 N 4.2930 8.1770 117.7294 56.2494 38.3928 177.5349 123 K 4.0534 7.8208 120.0586 59.2833 31.8724 179.3280 124 Q 4.0268 7.8279 119.3715 59.2009 28.8792 177.9300 125 I 3.7608 7.9622 121.1033 64.6165 36.9025 177.9653 126 H 4.1017 8.1414 118.1052 58.6142 29.8526 175.9445 127 Y 4.6259 7.8085 116.2808 57.6916 37.7678 176.7968 128 M 3.7076 7.2598 120.2796 59.0886 32.3060 178.0192 129 F 4.6273 7.8384 114.3841 58.9114 39.6568 176.6648 130 I 4.3568 7.7473 117.3888 62.2833 38.4835 176.9358 131 Q 4.0026 8.4634 121.1453 58.7067 28.6645 176.3378 132 P 4.3157 0.0000 0.0000 64.6701 31.3041 176.4164 133 Y 4.6019 7.4362 114.2343 57.7654 38.0204 175.5744 134 M 4.3898 7.9943 126.0831 55.6918 33.1825 175.0050 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 0 M 8.30 4.29 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 1 M 7.98 4.26 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.71 0.00 2 R 8.31 4.16 0.00 1.89 1.95 0.00 3.44 0.00 0.00 3.41 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 3 Y 7.99 4.22 0.00 3.15 3.13 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 4 L 5.86 3.32 0.00 0.63 1.36 0.77 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 5 H 7.73 4.16 0.00 3.25 3.43 0.00 5.84 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 K 7.78 3.91 0.00 1.92 1.93 0.00 1.72 0.00 0.00 1.54 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.50 7.81 7 I 7.52 4.00 1.75 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.61 0.91 0.00 0.00 8 E 8.20 4.06 0.00 2.34 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 2.33 2.38 0.00 9 L 7.90 3.94 0.00 1.92 1.80 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.12 4.02 0.00 2.15 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 2.32 2.37 0.00 11 L 8.48 4.29 0.00 1.86 1.93 1.25 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.44 4.51 0.00 2.99 2.88 0.00 0.00 6.98 7.01 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 13 R 8.12 3.99 0.00 2.07 1.99 0.00 3.13 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 14 L 8.50 4.25 0.00 1.87 1.50 0.51 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.46 4.14 4.52 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 1.22 0.00 0.00 16 S 7.86 4.43 0.00 3.98 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 17 R 7.32 4.39 0.00 1.64 1.76 0.00 2.88 0.00 0.00 2.97 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.50 0.00 18 Y 8.04 4.77 0.00 3.24 2.94 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 19 P 0.00 4.31 0.00 2.24 2.18 0.00 3.88 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 2.16 2.19 0.00 20 F 8.54 4.34 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 21 F 8.56 4.98 0.00 2.95 3.28 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 22 K 8.11 4.07 0.00 1.03 1.24 0.00 1.59 0.00 0.00 1.44 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.19 1.36 7.81 23 K 7.66 3.94 0.00 1.27 1.45 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.06 1.34 7.81 24 I 7.56 3.76 1.79 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.69 0.80 0.00 0.00 25 A 7.98 3.84 1.18 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 0.00 0.00 26 F 7.77 4.65 0.00 3.12 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 27 D 8.75 4.63 0.00 2.88 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.77 4.06 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 29 E 8.28 3.94 0.00 2.12 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 0.00 2.52 2.51 0.00 30 I 8.08 3.93 1.91 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.55 0.94 0.00 0.00 31 I 8.02 3.78 2.12 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.07 0.96 0.00 0.00 32 K 7.92 4.25 0.00 1.97 1.91 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.68 7.81 33 L 8.08 4.18 0.00 1.77 1.75 1.12 0.86 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 34 V 8.26 3.51 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 0.49 0.00 0.00 0.86 0.00 0.00 35 D 7.86 4.46 0.00 2.92 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 36 D 7.67 4.46 0.00 2.80 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 37 L 6.74 3.93 0.00 1.65 1.43 0.54 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.41 4.67 0.00 2.65 2.75 0.00 0.00 6.84 7.71 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 39 V 6.85 4.52 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 0.48 0.00 0.00 0.85 0.00 0.00 40 D 8.35 4.44 0.00 2.54 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 41 E 8.75 3.78 0.00 2.02 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 2.38 2.50 0.00 42 N 8.08 4.17 0.00 2.81 3.14 0.00 0.00 6.65 7.68 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 43 V 7.11 3.31 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 0.90 0.00 0.00 0.19 0.00 0.00 44 K 7.56 3.53 0.00 1.41 0.74 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.90 1.24 7.81 45 C 7.81 4.00 0.00 2.50 1.55 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 46 A 7.79 4.21 1.52 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 47 I 7.82 3.59 1.72 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.66 0.92 0.00 0.00 48 V 7.61 3.46 1.93 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 0.31 0.00 0.00 0.89 0.00 0.00 49 A 7.97 4.12 1.64 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 50 I 7.91 3.40 1.17 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 0.35 0.38 -0.26 0.00 0.00 51 D 7.78 4.27 0.00 2.89 2.80 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 52 T 8.10 4.02 4.43 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 1.35 0.00 0.00 53 S 8.04 4.15 0.00 4.01 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 54 M 8.16 4.30 0.00 2.20 2.32 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.96 0.00 55 R 8.16 3.95 0.00 1.99 2.10 0.00 3.24 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 56 M 8.48 4.49 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.65 0.00 57 Q 7.88 4.08 0.00 2.20 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 58 D 7.89 4.34 0.00 2.27 2.33 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 59 F 7.73 4.77 0.00 3.44 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 60 I 7.42 3.86 1.92 0.00 0.00 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 1.64 0.93 0.97 0.00 0.00 61 N 9.74 5.01 0.00 2.79 2.84 0.00 0.00 6.25 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 62 E 8.78 3.92 0.00 1.92 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 2.30 2.41 0.00 63 D 8.15 4.56 0.00 2.82 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 64 N 7.94 4.97 0.00 2.81 2.79 0.00 0.00 6.79 7.10 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 65 K 8.32 3.89 0.00 1.87 1.99 0.00 1.71 0.00 0.00 2.02 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.58 1.83 7.81 66 D 8.28 4.51 0.00 2.99 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 67 S 8.13 4.75 0.00 4.06 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 0.00 68 F 9.15 4.01 0.00 3.22 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 69 V 7.94 3.69 2.24 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 1.14 0.00 0.00 1.08 0.00 0.00 70 L 8.02 4.04 0.00 1.98 1.76 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.23 4.46 0.00 3.97 3.90 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 72 T 8.11 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 1.42 0.00 0.00 73 D 8.13 4.37 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 74 V 8.27 3.52 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 0.76 0.00 0.00 0.91 0.00 0.00 75 L 8.16 4.07 0.00 2.00 1.99 1.05 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.34 4.20 0.00 4.15 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 77 A 8.30 4.20 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 78 L 8.70 3.68 0.00 1.89 1.66 0.92 0.84 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 79 F 8.30 4.33 0.00 3.04 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 80 Y 8.21 4.19 0.00 3.17 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 81 K 7.92 3.68 0.00 1.62 1.58 0.00 1.49 0.00 0.00 1.34 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.14 7.81 82 Y 8.57 4.60 0.00 3.22 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 83 L 7.73 4.97 0.00 1.62 1.73 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.05 4.44 0.00 3.74 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 85 Q 7.67 4.47 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.06 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 86 P 0.00 4.32 0.00 1.86 1.92 0.00 3.94 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 87 F 8.47 4.74 0.00 2.80 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 88 Y 8.31 4.18 0.00 3.03 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 89 Q 6.89 3.11 0.00 1.42 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.59 0.00 90 H 8.17 4.06 0.00 3.28 3.34 0.00 5.92 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.21 4.47 0.00 3.03 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 92 F 8.78 4.44 0.00 3.19 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 93 L 8.18 3.88 0.00 1.90 1.66 0.97 1.03 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 94 V 7.68 3.58 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 0.62 0.00 0.00 0.94 0.00 0.00 95 L 8.35 4.24 0.00 2.20 2.15 1.28 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.02 3.90 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 0.63 0.00 0.00 97 D 7.91 4.27 0.00 2.78 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 98 C 8.22 3.97 0.00 3.34 2.69 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 99 V 7.87 3.70 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 1.05 0.00 0.00 0.84 0.00 0.00 100 S 7.79 4.14 0.00 4.01 4.08 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 0.00 101 R 7.93 4.29 0.00 2.01 1.94 0.00 3.09 0.00 0.00 3.15 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 102 I 8.14 3.60 1.65 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.42 1.00 0.00 0.00 103 N 8.08 4.34 0.00 2.94 2.84 0.00 0.00 7.02 6.97 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 0.00 104 E 8.16 3.97 0.00 2.19 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 2.31 2.50 0.00 105 L 8.28 4.00 0.00 1.75 1.68 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.12 4.01 0.00 1.89 1.85 0.00 1.82 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.56 7.81 107 S 7.65 4.30 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 0.00 108 I 8.03 3.77 1.85 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 1.39 0.57 0.90 0.00 0.00 109 R 8.20 3.82 0.00 1.94 2.07 0.00 3.16 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 110 A 7.51 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 0.00 111 T 7.69 4.41 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 1.20 0.00 0.00 112 I 7.64 4.46 1.97 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 1.35 0.80 0.91 0.00 0.00 113 T 8.22 4.45 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 0.00 114 D 8.07 4.33 0.00 2.81 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 0.00 115 E 8.87 3.94 0.00 2.04 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 2.40 2.38 0.00 116 I 7.70 3.68 1.87 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 1.57 1.48 0.97 0.00 0.00 117 A 8.02 3.99 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 0.00 118 L 8.18 3.87 0.00 1.99 1.85 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.44 4.15 0.00 3.37 3.50 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 N 8.64 4.40 0.00 2.77 2.86 0.00 0.00 6.67 7.05 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 0.00 121 I 8.10 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 1.50 1.55 0.97 0.00 0.00 122 N 8.18 4.29 0.00 2.96 2.79 0.00 0.00 6.92 7.39 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 0.00 123 K 7.82 4.05 0.00 1.94 2.04 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.51 7.81 124 Q 7.83 4.03 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 125 I 7.96 3.76 2.00 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 1.35 0.83 0.86 0.00 0.00 126 H 8.14 4.10 0.00 3.07 3.18 0.00 5.74 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Y 7.81 4.63 0.00 3.17 2.89 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 0.00 0.00 0.00 128 M 7.26 3.71 0.00 1.27 1.95 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 129 F 7.84 4.63 0.00 3.12 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 0.00 130 I 7.75 4.36 2.01 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 1.63 1.39 1.25 0.00 0.00 131 Q 8.46 4.00 0.00 2.41 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 132 P 0.00 4.32 0.00 1.56 1.89 0.00 3.92 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 133 Y 7.44 4.60 0.00 2.90 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 0.00 134 M 7.99 4.39 0.00 1.94 1.88 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 2.58 2.47 0.00