NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4207 8.3049 120.3162 55.0421 33.7010 174.9037 2 K 4.2204 7.9430 119.0008 55.1031 34.1734 176.7244 3 T 3.8733 8.3070 118.3674 67.1471 68.8939 176.7339 4 F 4.2927 8.2961 115.5689 59.7980 38.0014 177.1923 5 E 3.5603 7.0054 118.8747 59.0026 29.2644 179.0174 6 I 3.7171 7.5225 119.8202 64.1599 37.0358 178.4216 7 L 3.9797 8.0174 119.9237 57.8510 41.4968 179.7949 8 K 3.9982 8.1133 118.3657 59.6752 31.9353 179.2544 9 H 4.1826 8.1071 116.1867 58.8161 28.6599 177.8535 10 L 4.0122 8.1013 120.9100 57.7687 41.2601 179.3547 11 Q 4.1414 8.4436 119.6885 59.0371 29.0945 178.1630 12 A 4.0924 8.0974 121.8736 55.4240 18.4868 179.4025 13 D 4.3529 8.4217 117.2075 57.2244 40.7778 178.8643 14 A 4.0323 8.2476 121.4304 55.3801 18.6194 179.6132 15 I 3.2370 7.5284 117.2212 63.8349 37.8848 178.3110 16 V 3.5456 7.6197 118.9297 65.8723 31.2725 178.1045 17 L 3.7305 8.2043 119.2261 57.2607 41.2305 179.1161 18 F 4.1461 8.1778 120.9498 61.5633 39.4503 176.9388 19 M 3.8499 7.9438 117.4388 58.3107 31.9373 178.0389 20 K 3.4691 7.7911 119.8147 59.4452 32.3099 178.9700 21 V 3.5332 7.7203 111.8021 63.4598 31.4262 178.2729 22 H 3.3198 6.9652 115.4506 58.0990 28.2171 176.9029 23 N 4.0967 7.0131 118.3479 56.8196 38.7947 176.8732 24 F 4.1721 6.9604 118.6747 60.6933 38.6717 177.0470 25 H 4.2604 7.7796 118.4732 58.5380 29.6944 176.9476 26 W 4.7634 8.0491 119.5241 58.8278 29.4024 176.8396 27 N 5.1659 8.5343 114.8718 53.0531 39.3580 175.4225 28 V 4.3197 7.7149 118.1628 63.1680 32.1598 175.5630 29 K 4.7845 9.1514 125.5682 55.5163 35.8947 175.4843 30 G 4.1801 9.1561 108.7897 44.3044 0.0000 174.9528 31 T 4.1183 8.4800 108.5411 63.0573 68.9605 174.4651 32 D 4.6206 8.1984 121.6122 55.5649 41.7174 177.6598 33 F 3.5915 8.0769 120.3940 61.4711 40.4767 176.8929 34 F 4.0590 8.8751 121.5705 61.5887 39.1228 177.2628 35 N 4.2066 8.2749 115.4606 56.3997 38.4633 177.7565 36 V 3.6091 7.5760 119.9545 64.7153 31.4171 177.8787 37 H 3.7817 8.0782 119.5452 58.7699 29.2684 177.2327 38 K 3.7264 7.5675 121.2292 59.1882 31.9882 178.7621 39 A 3.8903 8.0879 121.6936 55.3660 18.2281 179.7381 40 T 3.7664 8.0416 108.6426 64.7329 68.7319 176.3252 41 E 2.5400 7.3778 120.7306 58.5845 29.6890 178.6359 42 E 3.7816 7.4685 118.2946 59.2091 29.4267 179.4924 43 I 3.6196 7.5349 120.1031 64.5158 37.2769 178.0876 44 Y 4.6134 7.8427 118.1910 59.7056 37.7815 177.8409 45 E 4.2650 7.9059 121.0517 59.3067 29.4260 178.7315 46 E 3.9151 7.9572 119.0027 59.3599 29.6794 178.9380 47 F 4.4239 8.2882 117.6473 60.4601 39.0372 177.5443 48 A 4.0809 8.5548 120.7591 55.2572 18.0998 179.4831 49 D 4.3975 8.1063 117.1190 57.6596 40.8500 178.6161 50 M 4.2100 8.5583 119.1025 58.6089 32.2842 177.8575 51 F 4.3328 8.8799 121.3024 61.6271 39.5582 176.6974 52 D 4.0927 8.1391 117.0069 57.2504 41.0047 177.9321 53 D 4.2436 8.4182 119.7254 57.1746 40.8389 178.6138 54 L 3.8430 8.2354 119.5839 57.8086 41.8089 179.4380 55 A 3.8864 7.5339 120.0300 55.3403 18.3047 179.6022 56 E 3.9229 8.1274 116.8795 59.1552 29.4872 179.5446 57 R 3.8359 8.0219 119.2167 59.2466 30.0457 178.5743 58 I 3.7611 7.7665 119.7182 64.5595 37.0369 178.8881 59 V 3.9145 7.6071 114.2525 63.8791 31.1219 178.6849 60 Q 3.9641 7.9792 117.1189 58.5926 28.6133 177.9501 61 L 4.3214 7.6905 117.5689 54.8776 41.8399 177.6352 62 G 3.6788 8.0803 107.4823 45.8182 0.0000 172.5042 63 H 4.6300 8.0686 116.6626 53.7034 32.0228 171.9743 64 H 4.8625 8.4067 117.3542 53.9231 29.6579 173.9111 65 P 4.6576 0.0000 0.0000 61.3718 32.5490 175.7392 66 L 4.3191 8.7423 119.7914 55.2605 41.7970 177.8867 67 V 4.4929 8.5263 114.0515 60.7723 33.3196 176.1376 68 T 4.7789 7.4450 110.1469 59.0607 73.0961 174.6431 69 L 4.0334 8.4904 122.3313 57.8532 41.1659 179.7801 70 S 4.0877 8.0142 112.8285 61.5280 62.4743 175.9623 71 E 4.0220 8.2505 121.0460 59.0894 29.1521 179.1464 72 A 4.0056 7.8491 120.7847 55.2184 18.3932 179.5410 73 I 3.9815 7.6107 110.1694 62.2894 37.8156 177.5052 74 K 4.1219 7.5041 120.3001 58.5476 32.2145 177.6015 75 L 4.4787 7.5584 117.4821 54.5288 42.5114 177.1174 76 T 4.2998 7.3544 109.5506 62.0620 69.1021 174.7267 77 R 4.4685 8.7148 119.7038 55.7492 31.2843 175.8422 78 V 3.9520 7.2926 118.4281 60.7553 32.7628 175.0407 79 K 4.1537 8.2725 128.4764 55.6525 32.9336 175.8020 80 E 4.0785 8.5038 126.5849 55.8008 30.3655 175.5321 81 E 4.5104 8.4833 125.1867 55.4281 30.1133 176.2911 82 T 4.2865 8.4395 114.1431 62.4969 69.8302 175.5450 83 K 4.2159 8.7255 122.5136 56.7884 32.4789 176.4646 84 T 4.6955 7.7881 109.8486 60.7948 69.2892 173.4979 85 S 4.6050 6.6055 114.1796 58.2325 65.2570 173.4805 86 F 5.0249 9.0408 124.4356 56.5879 44.3105 172.8072 87 H 5.2288 8.3682 116.4142 54.5876 31.7854 175.7744 88 S 3.5496 8.5491 116.1072 60.9566 62.9820 176.2565 89 K 3.9244 8.2554 121.9771 60.1035 31.8877 178.2917 90 D 4.3557 7.9804 118.2691 57.1784 40.6684 178.8822 91 I 2.4007 7.1916 119.8495 64.0687 37.0850 178.4066 92 F 4.3307 7.5763 118.2943 60.0755 38.5858 178.1336 93 K 4.0022 7.9493 118.4112 59.3800 31.7932 179.2103 94 E 3.9510 7.9129 118.7561 59.5416 29.3367 179.4281 95 I 3.6676 7.6250 119.7959 64.2283 37.1044 178.2393 96 L 3.8594 7.9009 121.0570 58.0908 41.9811 178.8073 97 E 4.0444 8.2758 118.5449 59.8074 29.4781 179.2514 98 D 4.6401 8.5102 118.9445 57.5431 40.7980 178.5244 99 Y 4.3931 8.6838 117.7827 61.1737 37.7967 178.5856 100 K 4.0944 8.5198 119.5162 59.5289 32.2145 178.8610 101 Y 4.1141 8.1303 119.4754 60.7258 38.7035 177.9334 102 L 3.6958 8.2414 119.9857 57.5570 41.7423 179.0849 103 E 3.9959 8.4576 119.4702 59.2500 29.5710 179.0764 104 K 3.9735 7.8237 118.2962 59.5249 32.0410 179.2273 105 E 3.8024 7.7545 118.5735 59.3667 29.2539 179.4178 106 F 4.0971 8.4208 117.7834 59.9701 38.8692 178.0343 107 K 4.0479 7.9880 118.6160 59.2335 31.8550 179.2209 108 E 3.9083 8.1374 118.9501 59.1881 29.3317 178.7929 109 L 3.8745 7.9698 120.5354 58.4316 42.2199 178.9457 110 S 4.1227 8.2771 112.7732 61.5101 62.2519 175.9372 111 N 4.3462 8.3634 119.3495 56.6863 38.3610 177.6434 112 T 3.9912 8.5097 111.2145 64.4976 68.8606 176.6201 113 A 4.1258 8.2955 125.4308 54.3356 18.3789 179.2092 114 E 3.8798 8.1500 117.6549 59.4605 29.5313 179.2374 115 K 4.0375 7.7054 117.0750 59.2748 32.1902 178.4787 116 E 4.2992 7.9584 116.3525 56.6043 29.6330 177.6799 117 G 3.8957 7.8514 107.1721 46.2736 0.0000 175.0722 118 D 4.6297 8.1391 121.4791 52.2853 38.9246 176.3641 119 K 3.8937 8.1908 123.9187 59.4292 32.6474 178.7284 120 V 3.7875 7.7581 111.6262 64.4459 31.4723 178.6375 121 T 4.1120 8.1636 115.3175 66.1935 68.1592 177.1181 122 V 3.6457 7.7253 120.4421 66.2675 31.6127 178.2820 123 T 3.8899 7.8665 109.1399 64.6859 68.6493 176.0211 124 Y 4.0015 8.0893 122.0786 60.4798 38.9082 177.7366 125 A 4.0243 8.4023 121.9309 55.4906 18.6279 179.4270 126 D 4.2838 8.3465 117.4579 57.4224 40.7872 178.8283 127 D 4.2352 7.9177 119.6696 57.3261 40.7116 178.7856 128 Q 3.5386 7.3430 118.4043 58.4394 28.3374 178.6163 129 L 3.7562 7.5457 119.8767 57.5835 41.6116 179.3484 130 A 3.9185 7.6810 120.3707 55.1790 18.3443 179.9035 131 K 3.8715 7.6421 116.4759 59.4811 31.9957 179.6704 132 L 3.7816 7.9213 119.4930 57.9405 41.4787 179.6873 133 Q 4.0407 8.3957 118.2818 58.5880 28.5775 178.7454 134 K 4.2588 7.9807 120.6019 59.6986 32.3103 179.1944 135 S 4.1653 8.1692 115.5134 61.5405 62.6636 176.6754 136 I 3.8610 8.3017 123.0073 63.9748 36.7580 178.1618 137 W 4.2791 8.1257 128.8182 60.9857 30.6193 177.8997 138 M 3.1765 7.5618 118.3766 57.9672 31.2913 178.8232 139 L 3.6680 8.1802 119.4005 57.8850 41.5904 179.6439 140 Q 3.9865 8.0772 116.6388 58.8290 29.0360 178.3424 141 A 4.1338 8.2674 122.2819 55.3861 18.1675 179.1462 142 H 3.9329 7.8945 115.7989 58.9954 29.9586 176.5763 143 L 4.3635 7.4979 117.4414 54.8009 41.6742 176.6988 144 A 4.3041 7.5722 127.7962 52.2218 19.1211 177.1649 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.42 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 2 K 7.94 4.22 0.00 1.53 1.80 0.00 1.52 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.62 7.81 3 T 8.31 3.87 4.37 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 1.32 0.00 0.00 4 F 8.30 4.29 0.00 3.17 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 5 E 7.01 3.56 0.00 1.78 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.47 0.00 6 I 7.52 3.72 1.94 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.74 0.79 0.00 0.00 7 L 8.02 3.98 0.00 1.93 1.74 0.99 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.11 4.00 0.00 1.73 1.83 0.00 1.75 0.00 0.00 1.95 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.74 7.81 9 H 8.11 4.18 0.00 3.34 3.36 0.00 5.62 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 10 L 8.10 4.01 0.00 1.94 1.69 0.59 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.44 4.14 0.00 2.26 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.25 0.00 12 A 8.10 4.09 1.48 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 13 D 8.42 4.35 0.00 2.99 2.87 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 14 A 8.25 4.03 1.70 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 0.00 0.00 15 I 7.53 3.24 0.89 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.95 0.90 0.00 0.00 16 V 7.62 3.55 2.14 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 0.89 0.00 0.00 0.90 0.00 0.00 17 L 8.20 3.73 0.00 1.32 0.28 0.84 0.89 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 18 F 8.18 4.15 0.00 3.12 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 19 M 7.94 3.85 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 20 K 7.79 3.47 0.00 1.76 1.62 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.22 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.66 1.09 7.81 21 V 7.72 3.53 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.13 0.00 0.00 22 H 6.97 3.32 0.00 2.51 1.31 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 N 7.01 4.10 0.00 2.63 2.45 0.00 0.00 7.24 6.99 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 24 F 6.96 4.17 0.00 2.95 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 25 H 7.78 4.26 0.00 3.05 3.04 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 W 8.05 4.76 0.00 3.56 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 27 N 8.53 5.17 0.00 3.22 3.12 0.00 0.00 6.62 8.45 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 28 V 7.71 4.32 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 0.68 0.00 0.00 0.87 0.00 0.00 29 K 9.15 4.78 0.00 1.62 1.64 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.43 7.81 30 G 9.16 4.18 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 0.00 31 T 8.48 4.12 4.30 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 0.00 0.00 0.00 1.25 0.00 0.00 32 D 8.20 4.62 0.00 2.82 2.76 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 33 F 8.08 3.59 0.00 3.40 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 34 F 8.88 4.06 0.00 3.31 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 35 N 8.27 4.21 0.00 3.00 2.90 0.00 0.00 6.86 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 36 V 7.58 3.61 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 0.91 0.00 0.00 0.65 0.00 0.00 37 H 8.08 3.78 0.00 2.16 2.92 0.00 5.78 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.57 3.73 0.00 1.26 1.55 0.00 1.38 0.00 0.00 1.42 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.19 1.30 7.81 39 A 8.09 3.89 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 40 T 8.04 3.77 4.33 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 1.19 0.00 0.00 41 E 7.38 2.54 0.00 1.68 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.83 0.00 42 E 7.47 3.78 0.00 2.05 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 0.00 2.21 2.30 0.00 43 I 7.53 3.62 2.04 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.76 1.17 0.00 0.00 44 Y 7.84 4.61 0.00 2.81 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 45 E 7.91 4.26 0.00 2.17 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 0.00 2.29 2.28 0.00 46 E 7.96 3.92 0.00 2.15 1.67 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 2.08 2.23 0.00 47 F 8.29 4.42 0.00 3.45 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 48 A 8.55 4.08 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.11 4.40 0.00 2.93 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 M 8.56 4.21 0.00 2.50 2.22 0.00 0.00 0.00 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.90 0.00 51 F 8.88 4.33 0.00 3.22 3.34 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 52 D 8.14 4.09 0.00 2.98 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 53 D 8.42 4.24 0.00 2.76 2.43 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 54 L 8.24 3.84 0.00 1.71 1.73 1.11 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.53 3.89 1.08 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 0.00 0.00 56 E 8.13 3.92 0.00 1.95 1.94 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 2.25 2.48 0.00 57 R 8.02 3.84 0.00 1.78 1.95 0.00 3.08 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 58 I 7.77 3.76 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.58 1.01 0.00 0.00 59 V 7.61 3.91 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 1.10 0.00 0.00 0.92 0.00 0.00 60 Q 7.98 3.96 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 61 L 7.69 4.32 0.00 1.93 1.76 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.08 3.68 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 0.00 0.00 0.00 63 H 8.07 4.63 0.00 3.03 2.98 0.00 5.60 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 H 8.41 4.86 0.00 3.18 3.21 0.00 5.69 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 65 P 0.00 4.66 0.00 2.09 2.16 0.00 3.80 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 66 L 8.74 4.32 0.00 1.72 1.70 1.00 1.15 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 67 V 8.53 4.49 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 0.77 0.00 0.00 1.01 0.00 0.00 68 T 7.45 4.78 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 1.27 0.00 0.00 69 L 8.49 4.03 0.00 1.76 1.76 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.01 4.09 0.00 3.89 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 71 E 8.25 4.02 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 72 A 7.85 4.01 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 73 I 7.61 3.98 1.86 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 1.65 1.42 0.89 0.00 0.00 74 K 7.50 4.12 0.00 1.89 2.06 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.48 7.81 75 L 7.56 4.48 0.00 1.75 1.65 0.96 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.35 4.30 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 1.34 0.00 0.00 77 R 8.71 4.47 0.00 1.43 1.77 0.00 3.35 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 78 V 7.29 3.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.84 0.00 0.00 79 K 8.27 4.15 0.00 1.70 1.66 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.35 7.81 80 E 8.50 4.08 0.00 1.94 1.80 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 2.26 2.26 0.00 81 E 8.48 4.51 0.00 1.88 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 0.00 2.49 2.47 0.00 82 T 8.44 4.29 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 1.23 0.00 0.00 83 K 8.73 4.22 0.00 1.93 1.46 0.00 1.69 0.00 0.00 2.16 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.40 7.81 84 T 7.79 4.70 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 85 S 6.61 4.60 0.00 3.72 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.04 5.02 0.00 2.98 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 87 H 8.37 5.23 0.00 3.09 3.17 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.55 3.55 0.00 3.96 3.89 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 89 K 8.26 3.92 0.00 1.91 1.85 0.00 1.81 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.59 7.81 90 D 7.98 4.36 0.00 2.91 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 91 I 7.19 2.40 1.18 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.43 -0.14 0.00 0.00 92 F 7.58 4.33 0.00 3.03 2.83 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 93 K 7.95 4.00 0.00 1.96 1.85 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.68 7.81 94 E 7.91 3.95 0.00 2.05 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 0.00 2.37 2.36 0.00 95 I 7.63 3.67 1.71 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.67 0.29 0.00 0.00 96 L 7.90 3.86 0.00 1.96 1.81 0.94 0.83 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 97 E 8.28 4.04 0.00 2.13 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 0.00 2.59 2.53 0.00 98 D 8.51 4.64 0.00 3.01 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 99 Y 8.68 4.39 0.00 3.25 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 0.00 100 K 8.52 4.09 0.00 2.10 1.96 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.69 7.81 101 Y 8.13 4.11 0.00 3.19 3.26 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 0.00 102 L 8.24 3.70 0.00 2.04 1.92 1.27 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.46 4.00 0.00 2.07 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 0.00 2.33 2.37 0.00 104 K 7.82 3.97 0.00 1.87 1.80 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.67 7.81 105 E 7.75 3.80 0.00 1.72 1.63 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 1.67 1.81 0.00 106 F 8.42 4.10 0.00 3.12 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 0.00 107 K 7.99 4.05 0.00 2.02 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.71 7.81 108 E 8.14 3.91 0.00 2.08 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 2.57 2.40 0.00 109 L 7.97 3.87 0.00 1.85 1.91 1.17 0.93 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 0.00 110 S 8.28 4.12 0.00 4.06 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 0.00 111 N 8.36 4.35 0.00 3.00 2.85 0.00 0.00 6.83 6.70 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 0.00 112 T 8.51 3.99 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 1.26 0.00 0.00 113 A 8.30 4.13 1.41 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 0.00 0.00 114 E 8.15 3.88 0.00 2.22 2.14 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 2.31 2.36 0.00 115 K 7.71 4.04 0.00 1.90 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.63 7.81 116 E 7.96 4.30 0.00 2.09 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 2.36 2.53 0.00 117 G 7.85 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 0.00 0.00 0.00 118 D 8.14 4.63 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 0.00 119 K 8.19 3.89 0.00 1.82 1.88 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.76 1.50 7.81 120 V 7.76 3.79 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 1.00 0.00 0.00 0.95 0.00 0.00 121 T 8.16 4.11 4.35 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 1.33 0.00 0.00 122 V 7.73 3.65 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 1.16 0.00 0.00 1.04 0.00 0.00 123 T 7.87 3.89 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 1.28 0.00 0.00 124 Y 8.09 4.00 0.00 3.17 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 0.00 125 A 8.40 4.02 1.56 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 0.00 126 D 8.35 4.28 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 0.00 127 D 7.92 4.24 0.00 2.61 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 0.00 128 Q 7.34 3.54 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 1.30 1.40 0.00 129 L 7.55 3.76 0.00 1.88 1.62 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.68 3.92 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 131 K 7.64 3.87 0.00 1.72 1.71 0.00 1.47 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.51 7.81 132 L 7.92 3.78 0.00 1.75 1.63 0.84 1.00 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 0.00 133 Q 8.40 4.04 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 134 K 7.98 4.26 0.00 1.91 1.99 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.57 1.87 7.81 135 S 8.17 4.17 0.00 4.25 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 0.00 136 I 8.30 3.86 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.02 1.01 0.00 0.00 137 W 8.13 4.28 0.00 3.34 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 0.00 138 M 7.56 3.18 0.00 1.63 1.85 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.04 0.00 139 L 8.18 3.67 0.00 1.80 1.61 0.62 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.08 3.99 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 141 A 8.27 4.13 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 0.00 142 H 7.89 3.93 0.00 2.89 3.24 0.00 5.94 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 0.00 143 L 7.50 4.36 0.00 1.68 1.69 0.93 0.88 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 0.00 144 A 7.57 4.30 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