NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4744 8.1776 115.2901 57.8749 63.4171 174.3228 3 V 3.3774 8.3542 129.0572 64.6976 31.2132 176.6822 4 Y 3.8976 8.6760 118.2485 60.9039 37.9823 179.0768 5 D 4.4173 7.9217 118.7013 57.1043 41.1861 178.3418 6 A 4.0728 8.1614 121.2746 55.0882 18.3824 179.5812 7 A 3.8739 8.2262 119.1986 55.0310 18.1821 179.5553 8 A 4.0817 7.5992 117.7676 54.6658 18.5155 179.0605 9 Q 4.2462 7.6937 115.1269 56.5768 30.0693 177.1242 10 L 4.2172 7.3721 121.7424 53.7090 40.1469 176.9495 11 T 4.2110 7.6186 114.5526 60.3546 71.5919 175.0702 12 A 3.9549 8.4739 122.0491 55.7144 18.2930 179.5184 13 D 4.2909 7.9952 116.6382 57.3964 40.9594 179.0877 14 V 3.5029 7.3395 118.0970 65.9317 31.5420 178.2268 15 K 3.8650 8.2468 118.5691 59.2310 31.7518 179.2440 16 K 3.9761 8.0771 119.9080 59.7283 32.1568 178.6925 17 D 4.6382 8.0834 118.9230 57.2380 40.6719 178.8412 18 L 3.9046 7.9920 119.6015 57.8300 41.5921 179.7467 19 R 4.1350 8.2003 117.9948 59.4389 28.4710 178.8551 20 D 4.5010 8.6468 119.2858 57.5517 40.9051 179.1168 21 S 3.8130 8.4123 114.7985 60.8734 63.0964 176.2989 22 W 4.2184 8.6945 132.0801 60.0176 30.2027 177.7202 23 K 3.8228 7.9633 119.1397 59.3087 31.8197 178.6645 24 V 3.6383 7.0339 117.5530 65.9651 31.5333 178.2226 25 I 3.5491 7.3852 119.5843 63.9639 36.6997 178.3259 26 G 2.1294 7.0042 105.0876 45.6570 0.0000 175.2992 27 S 4.2253 7.1651 115.3923 59.6181 64.5245 174.0012 28 D 4.6287 7.3048 122.0957 51.1351 41.1264 175.4697 29 K 3.8034 7.9787 123.1337 58.6124 32.4536 178.3684 30 K 3.9902 7.9448 119.4991 59.4076 32.3241 178.9850 31 G 3.7651 8.0120 106.7119 47.5959 0.0000 175.3036 32 N 4.4743 8.2843 119.5378 55.2495 38.5969 178.0307 33 G 3.4832 8.1542 107.6567 47.8008 0.0000 176.0802 34 V 3.5889 7.7700 120.8671 65.3873 31.4845 177.9409 35 A 3.9968 7.8371 121.9696 54.3513 18.2160 179.3476 36 L 3.7337 7.8663 118.7568 58.5082 42.1519 179.1905 37 M 3.4884 7.7010 118.5633 58.4299 31.8272 178.9335 38 T 3.9699 8.0667 110.2219 65.0574 68.7299 176.7313 39 T 3.9318 7.7699 118.7042 66.1099 68.3837 176.4227 40 L 3.8011 7.6005 122.2432 58.2993 41.8558 179.1840 41 F 4.4772 7.4870 116.0817 60.4345 38.8559 177.3439 42 A 4.1766 8.0917 119.8148 55.1985 18.3520 178.9408 43 D 4.6248 8.2216 115.5963 55.1834 42.7656 176.7740 44 N 5.1946 8.2441 116.3436 50.9860 39.2418 174.8636 45 Q 4.1725 8.1770 120.0848 58.9201 29.4752 179.1145 46 E 4.2524 8.2527 113.6953 57.8259 30.0997 177.7815 47 T 4.6213 8.2223 110.6426 62.9368 69.5036 176.5219 48 I 3.9093 7.8801 123.3573 64.6421 36.8656 178.0136 49 G 3.6503 8.1381 105.0384 48.2763 0.0000 174.8110 50 Y 4.3516 7.7126 117.3857 59.9713 38.0733 176.4714 51 F 4.8209 8.2884 118.5903 56.9040 39.9426 177.8075 52 K 3.8377 8.3679 124.8106 59.6932 32.0285 178.5412 53 R 3.9848 7.9893 117.5522 59.1080 30.1074 177.1367 54 L 4.2099 7.9848 116.3119 55.3298 42.7212 179.0274 55 G 3.8258 7.6450 105.9483 46.4374 0.0000 176.5337 56 D 4.4986 8.3657 121.1106 53.3845 40.6903 176.8710 57 V 3.7515 7.9011 120.3055 63.0219 31.5287 177.5914 58 S 4.3254 7.8012 112.8439 60.4296 63.1695 175.7144 59 Q 4.1429 8.1554 121.4601 56.0652 28.8968 177.1579 60 G 3.7758 8.5212 109.3307 46.3112 0.0000 176.8407 61 M 3.9276 8.9699 122.5698 58.1846 31.9603 176.9890 62 A 4.0151 7.6672 119.9976 53.8035 18.8811 177.2255 63 N 4.6328 8.1540 115.4460 52.5722 39.4477 175.0420 64 D 4.3792 8.6654 129.1594 57.5534 41.0568 178.9754 65 K 4.0337 8.1082 118.4629 59.2930 32.1008 179.0662 66 L 4.0656 8.6286 121.0727 58.0362 41.9997 178.9965 67 R 4.0265 8.3685 119.0676 59.3864 30.1637 178.7819 68 G 3.6313 8.3540 105.7034 47.9459 0.0000 175.2418 69 H 4.2453 8.4491 120.5957 59.2159 29.7308 177.6007 70 S 4.0676 8.3353 116.1455 61.5978 62.8119 176.4793 71 I 3.9026 7.9577 122.4882 64.8089 37.0225 178.6298 72 T 4.0602 7.9091 116.2850 66.5789 68.2935 176.3674 73 L 3.8757 8.0506 122.3006 58.4711 42.0707 179.0392 74 M 4.1589 7.8896 118.4479 58.3023 31.8334 178.0238 75 Y 4.0574 7.9082 115.9247 59.9988 38.0714 177.7599 76 A 3.6432 7.6149 122.3580 54.7788 18.3470 179.6459 77 L 3.5467 7.2979 117.0347 57.5273 41.6508 179.2491 78 Q 3.5137 7.6292 119.6596 58.8072 28.7495 177.7178 79 N 4.2839 7.6815 117.0895 56.8220 39.4343 176.3401 80 F 4.6626 7.6130 118.9676 60.9134 39.0697 177.7379 81 I 3.6445 7.7163 119.1636 64.5732 36.6862 178.2404 82 D 4.5389 8.1712 118.0150 56.4142 41.0293 177.6667 83 Q 4.4737 7.7475 117.1879 55.8134 28.8724 177.2041 84 L 4.0056 7.5913 120.9522 57.9374 41.6547 178.2709 85 D 4.3495 8.1051 117.6152 56.0665 41.2348 175.8377 86 N 4.8404 7.9755 117.0462 50.5839 40.6026 172.5755 87 P 4.2277 0.0000 0.0000 66.2342 31.0446 177.9809 88 D 4.4509 8.2990 118.3428 57.2809 40.7072 178.3520 89 D 4.4257 8.2452 118.9530 56.7892 41.0040 178.3908 90 L 3.9563 8.0721 121.1078 58.1141 42.0239 179.1861 91 V 3.3746 7.8681 118.5319 66.0869 31.3033 177.8147 92 C 4.1214 7.9052 114.0076 61.1227 29.5350 176.0964 93 V 3.7431 7.7189 114.5789 63.7469 31.2250 178.6417 94 V 3.7831 8.0030 118.2932 66.1351 31.4394 178.0225 95 E 3.9119 8.4567 118.6118 59.0017 28.9799 179.2823 96 K 3.8453 7.5324 119.2902 59.6262 32.4250 178.7325 97 F 4.6624 8.1590 117.4018 60.1914 38.7633 177.6471 98 A 3.9740 8.3042 121.1315 55.1155 18.1625 179.7301 99 V 3.5635 7.7798 116.5932 66.3004 31.8849 177.9846 100 N 4.3849 7.9946 116.1700 56.3701 38.3544 176.6739 101 H 4.2117 8.0760 116.5762 57.8557 29.3453 177.5388 102 I 3.7604 8.1044 122.6298 64.4643 36.7171 178.4002 103 T 4.0354 7.8900 109.2970 63.8648 68.6717 175.7726 104 R 4.3348 6.9400 118.1148 55.0064 30.4591 176.0534 105 K 3.8514 7.8077 117.0437 57.5273 29.8984 175.5754 106 I 4.0175 7.6220 120.1668 60.0598 38.0532 177.0806 107 S 4.5629 8.3634 120.5982 57.1635 65.7778 174.9421 108 A 3.9872 8.4219 123.0401 55.2079 17.8308 179.6923 109 A 3.9839 7.9047 117.8799 55.5143 18.8708 179.3173 110 E 4.1483 8.2527 116.7990 59.2982 29.5811 179.2877 111 F 4.1663 8.6298 121.2030 61.0370 39.4688 177.1576 112 G 3.8612 8.2679 104.7667 46.7287 0.0000 175.2185 113 K 4.2056 7.9496 120.6136 58.4113 32.0535 178.4657 114 I 3.7999 7.5789 119.0852 63.1822 37.8154 177.2649 115 N 4.4888 8.1990 117.9715 56.2320 38.2859 177.2961 116 G 3.5623 7.6739 106.0787 47.4951 0.0000 173.8951 117 P 4.2296 0.0000 0.0000 65.0146 31.3545 178.7618 118 I 3.5688 7.7441 118.5303 64.2477 36.9910 178.4181 119 K 4.0105 8.0588 120.4309 59.3186 32.1387 179.0306 120 K 3.9443 8.0529 118.7817 59.5774 32.1941 179.5864 121 V 3.5817 7.9280 118.5884 65.8309 31.3432 177.9482 122 L 4.0158 8.0532 118.5978 57.8623 41.5034 179.3694 123 A 4.2783 8.5402 122.2720 54.5207 18.1126 179.3946 124 S 4.3355 7.8293 110.4710 60.0121 63.2560 175.5797 125 K 4.4557 7.2490 119.8136 55.6174 32.3781 175.4900 126 N 4.2620 8.0856 116.5411 54.2836 37.8864 173.5794 127 F 4.4745 8.4883 116.1731 55.0622 40.3798 176.1396 128 G 4.1058 8.6092 114.2172 43.9107 0.0000 172.0268 129 D 4.5012 8.8956 118.6367 57.6004 40.5166 178.8450 130 K 3.7507 8.1558 119.3281 60.0652 32.0968 178.2453 131 Y 4.2239 8.0868 116.4199 60.8704 37.8513 177.9550 132 A 4.2542 8.2740 121.4089 55.4191 18.4962 179.3098 133 N 4.3746 8.8330 115.2413 56.1730 38.0787 177.5597 134 A 3.8942 7.7853 122.3286 55.0901 18.4437 179.8394 135 W 3.7465 8.4127 117.0883 59.5089 29.0808 178.6861 136 A 4.0868 8.1635 121.0713 54.9976 17.5267 179.8386 137 K 3.9425 7.5727 116.2757 59.3362 32.3682 179.0560 138 L 3.9329 7.4403 120.1582 57.9817 41.9799 179.0775 139 V 3.7631 8.2080 118.2690 66.0147 31.5003 177.8510 140 A 4.4412 8.0660 121.7440 54.3485 17.8767 179.8232 141 V 3.4208 7.3585 116.5854 65.9986 31.8404 178.1396 142 V 3.4770 7.4612 117.5746 65.9443 31.2898 177.7706 143 Q 3.8343 8.1463 117.6483 58.9280 28.3200 178.7681 144 A 4.0203 7.7938 120.1881 54.0588 18.4655 178.4118 145 A 4.3423 7.5714 117.2265 52.2092 19.5644 177.0799 146 L 4.1080 7.3894 122.2674 54.7040 41.8331 176.5571 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 S 8.18 4.47 0.00 3.90 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 3 V 8.35 3.38 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 0.38 0.00 0.00 0.70 0.00 0.00 4 Y 8.68 3.90 0.00 3.03 3.04 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 5 D 7.92 4.42 0.00 2.76 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 6 A 8.16 4.07 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 7 A 8.23 3.87 1.27 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 0.00 0.00 8 A 7.60 4.08 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 9 Q 7.69 4.25 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.26 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 10 L 7.37 4.22 0.00 1.67 1.53 0.77 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.62 4.21 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 1.18 0.00 0.00 12 A 8.47 3.95 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 13 D 8.00 4.29 0.00 2.66 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 14 V 7.34 3.50 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 0.86 0.00 0.00 15 K 8.25 3.87 0.00 1.93 1.81 0.00 1.69 0.00 0.00 1.52 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.55 7.81 16 K 8.08 3.98 0.00 2.03 1.96 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.80 7.81 17 D 8.08 4.64 0.00 2.88 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 18 L 7.99 3.90 0.00 1.68 1.29 0.48 -0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.20 4.14 0.00 2.09 2.09 0.00 3.18 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.93 0.00 20 D 8.65 4.50 0.00 2.96 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 21 S 8.41 3.81 0.00 3.58 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 22 W 8.69 4.22 0.00 3.85 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 23 K 7.96 3.82 0.00 1.85 2.00 0.00 1.87 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.44 7.81 24 V 7.03 3.64 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 0.98 0.00 0.00 1.05 0.00 0.00 25 I 7.39 3.55 1.48 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.20 0.59 0.00 0.00 26 G 7.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.17 4.23 0.00 3.90 3.98 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 28 D 7.30 4.63 0.00 2.55 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 29 K 7.98 3.80 0.00 1.73 1.69 0.00 1.24 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.21 1.35 7.81 30 K 7.94 3.99 0.00 1.82 1.77 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 8.01 3.77 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 0.00 0.00 0.00 32 N 8.28 4.47 0.00 2.69 2.71 0.00 0.00 6.98 7.17 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 33 G 8.15 3.48 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 0.00 34 V 7.77 3.59 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 1.08 0.00 0.00 0.95 0.00 0.00 35 A 7.84 4.00 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 36 L 7.87 3.73 0.00 1.75 1.71 0.78 0.67 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 37 M 7.70 3.49 0.00 1.72 1.94 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.68 0.00 38 T 8.07 3.97 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 1.31 0.00 0.00 39 T 7.77 3.93 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 1.19 0.00 0.00 40 L 7.60 3.80 0.00 1.48 1.24 0.86 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.49 4.48 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 42 A 8.09 4.18 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 43 D 8.22 4.62 0.00 2.64 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.24 5.19 0.00 2.99 2.89 0.00 0.00 6.81 7.91 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 45 Q 8.18 4.17 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.97 0.00 0.00 0.00 0.00 0.00 2.59 2.41 0.00 46 E 8.25 4.25 0.00 2.09 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 2.30 0.00 47 T 8.22 4.62 4.70 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 1.45 0.00 0.00 48 I 7.88 3.91 1.95 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 1.23 0.74 0.74 0.00 0.00 49 G 8.14 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 50 Y 7.71 4.35 0.00 2.92 2.55 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 51 F 8.29 4.82 0.00 3.13 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 52 K 8.37 3.84 0.00 1.93 1.84 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.45 7.81 53 R 7.99 3.98 0.00 1.84 2.00 0.00 3.32 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 7.98 4.21 0.00 1.83 1.74 1.04 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.64 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.37 4.50 0.00 2.77 2.57 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 57 V 7.90 3.75 1.60 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 0.47 0.00 0.00 0.29 0.00 0.00 58 S 7.80 4.33 0.00 4.03 3.95 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 59 Q 8.16 4.14 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.86 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 60 G 8.52 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 0.00 0.00 0.00 61 M 8.97 3.93 0.00 1.96 2.12 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 2.59 2.61 0.00 62 A 7.67 4.02 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 63 N 8.15 4.63 0.00 2.77 2.88 0.00 0.00 7.02 8.01 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 64 D 8.67 4.38 0.00 2.74 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 65 K 8.11 4.03 0.00 1.99 1.90 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.63 4.07 0.00 1.78 1.86 1.08 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.37 4.03 0.00 2.03 2.05 0.00 3.16 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 1.65 1.66 0.00 68 G 8.35 3.63 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 0.00 0.00 0.00 69 H 8.45 4.25 0.00 3.42 3.64 0.00 5.79 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 70 S 8.34 4.07 0.00 3.99 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 71 I 7.96 3.90 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 1.13 0.00 0.00 72 T 7.91 4.06 4.42 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 0.00 0.00 0.00 1.29 0.00 0.00 73 L 8.05 3.88 0.00 1.66 1.78 0.87 0.76 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 74 M 7.89 4.16 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.86 0.00 75 Y 7.91 4.06 0.00 3.25 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 76 A 7.61 3.64 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.30 3.55 0.00 1.30 1.00 0.75 0.99 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 78 Q 7.63 3.51 0.00 2.34 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.79 0.00 0.00 0.00 0.00 0.00 2.54 2.65 0.00 79 N 7.68 4.28 0.00 2.95 2.86 0.00 0.00 7.28 7.16 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 80 F 7.61 4.66 0.00 3.15 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 81 I 7.72 3.64 1.73 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.47 0.93 0.00 0.00 82 D 8.17 4.54 0.00 2.83 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 83 Q 7.75 4.47 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.79 2.62 0.00 84 L 7.59 4.01 0.00 1.60 1.70 0.83 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.11 4.35 0.00 2.68 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.98 4.84 0.00 2.75 2.68 0.00 0.00 6.83 7.31 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 87 P 0.00 4.23 0.00 2.36 2.32 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 88 D 8.30 4.45 0.00 2.99 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 89 D 8.25 4.43 0.00 2.83 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 90 L 8.07 3.96 0.00 1.92 1.75 0.86 0.59 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 91 V 7.87 3.37 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 0.60 0.00 0.00 0.41 0.00 0.00 92 C 7.91 4.12 0.00 3.14 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 93 V 7.72 3.74 2.36 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 1.09 0.00 0.00 1.27 0.00 0.00 94 V 8.00 3.78 2.05 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 0.91 0.00 0.00 0.45 0.00 0.00 95 E 8.46 3.91 0.00 2.00 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 2.24 2.43 0.00 96 K 7.53 3.85 0.00 1.68 1.76 0.00 0.73 0.00 0.00 1.16 0.00 0.00 2.71 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.26 1.38 7.81 97 F 8.16 4.66 0.00 3.39 3.21 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 98 A 8.30 3.97 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 99 V 7.78 3.56 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 1.02 0.00 0.00 0.97 0.00 0.00 100 N 7.99 4.38 0.00 3.15 2.90 0.00 0.00 6.98 8.03 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 0.00 101 H 8.08 4.21 0.00 3.36 3.40 0.00 5.82 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 0.00 102 I 8.10 3.76 1.98 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 1.56 1.12 0.91 0.00 0.00 103 T 7.89 4.04 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 1.24 0.00 0.00 104 R 6.94 4.33 0.00 1.87 1.84 0.00 3.31 0.00 0.00 3.45 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 105 K 7.81 3.85 0.00 2.02 2.01 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.60 7.81 106 I 7.62 4.02 1.97 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.68 0.96 0.00 0.00 107 S 8.36 4.56 0.00 4.07 4.03 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 0.00 108 A 8.42 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 0.00 109 A 7.90 3.98 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 0.00 110 E 8.25 4.15 0.00 2.12 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 2.43 2.41 0.00 111 F 8.63 4.17 0.00 3.25 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.27 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 0.00 0.00 0.00 113 K 7.95 4.21 0.00 1.98 1.88 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.70 7.81 114 I 7.58 3.80 1.58 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 1.30 1.08 0.70 0.00 0.00 115 N 8.20 4.49 0.00 2.98 2.88 0.00 0.00 6.70 7.73 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 0.00 116 G 7.67 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.23 0.00 2.15 2.00 0.00 3.67 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 118 I 7.74 3.57 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.84 0.86 0.00 0.00 119 K 8.06 4.01 0.00 1.97 1.95 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.55 7.81 120 K 8.05 3.94 0.00 1.98 1.82 0.00 1.80 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.58 7.81 121 V 7.93 3.58 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 0.94 0.00 0.00 0.90 0.00 0.00 122 L 8.05 4.02 0.00 2.02 2.00 1.01 0.31 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 0.00 123 A 8.54 4.28 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 0.00 124 S 7.83 4.34 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.25 4.46 0.00 2.17 2.00 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.64 1.48 7.81 126 N 8.09 4.26 0.00 2.82 2.73 0.00 0.00 6.95 6.84 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 0.00 127 F 8.49 4.47 0.00 3.25 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 0.00 128 G 8.61 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 0.00 129 D 8.90 4.50 0.00 2.81 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 0.00 130 K 8.16 3.75 0.00 1.70 1.58 0.00 1.53 0.00 0.00 1.32 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.96 1.33 7.81 131 Y 8.09 4.22 0.00 3.49 3.29 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 0.00 132 A 8.27 4.25 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 0.00 133 N 8.83 4.37 0.00 2.94 2.88 0.00 0.00 6.91 7.30 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 0.00 134 A 7.79 3.89 1.23 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 0.00 0.00 0.00 135 W 8.41 3.75 0.00 3.66 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.16 4.09 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 0.00 137 K 7.57 3.94 0.00 1.80 1.80 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.56 7.81 138 L 7.44 3.93 0.00 1.43 1.67 0.62 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.21 3.76 2.34 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 1.19 0.00 0.00 1.15 0.00 0.00 140 A 8.07 4.44 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 0.00 141 V 7.36 3.42 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 0.60 0.00 0.00 0.82 0.00 0.00 142 V 7.46 3.48 1.92 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 0.19 0.00 0.00 0.75 0.00 0.00 143 Q 8.15 3.83 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 144 A 7.79 4.02 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 0.00 145 A 7.57 4.34 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 0.00 146 L 7.39 4.11 0.00 1.72 1.51 0.54 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00