NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 4.3108 8.2548 109.1394 45.4670 0.0000 175.3862 4 L 4.3740 7.8298 118.6868 55.1425 41.4707 176.5135 5 D 4.3737 8.3775 118.8784 57.5461 41.1845 177.8249 6 K 3.7400 7.7831 118.2454 59.1565 32.1863 177.4818 7 Y 4.5853 7.4442 115.2194 58.3588 40.1164 175.7086 8 L 4.7762 7.8627 118.9056 51.5522 41.9655 173.2443 9 P 4.4482 0.0000 0.0000 63.1597 31.9719 176.7345 10 G 3.9420 8.3117 110.5870 46.2892 0.0000 172.7005 11 I 4.3499 7.6691 120.5875 59.6859 38.3091 175.4065 12 E 4.7316 8.7790 121.7172 56.0320 32.1081 175.6140 13 K 5.2485 8.0995 118.3592 54.5654 35.9626 175.5110 14 L 5.0053 8.9498 122.8115 52.7570 45.9772 176.3080 15 R 4.7500 9.0310 121.1641 56.5928 31.9282 176.2097 16 R 4.9520 9.3766 123.4554 54.9001 33.3933 175.6881 17 G 3.7576 8.9389 117.4420 47.2395 0.0000 174.1633 18 D 4.8614 9.0658 123.9913 53.7975 42.0945 176.3709 19 G 4.4889 7.9054 110.2672 44.4780 0.0000 171.6391 20 E 5.3529 8.6086 118.6770 54.9579 33.1810 175.4974 21 V 4.6867 8.9058 113.3081 59.4333 36.1253 175.0879 22 E 4.6216 8.6717 122.0264 56.1088 30.4145 178.3756 23 V 3.6943 8.9600 123.1189 66.1177 31.3946 178.6617 24 K 4.0580 8.2453 117.9976 59.1593 31.6457 178.4869 25 S 4.4096 7.8791 112.9161 59.9549 63.2968 175.1986 26 L 4.4342 7.8537 122.3355 53.5114 41.6301 175.9341 27 A 4.2697 7.1171 122.7360 54.1507 18.5403 178.7200 28 G 4.0124 9.4179 111.1463 45.2576 0.0000 173.7884 29 K 4.7622 7.7992 119.3599 55.2729 34.3351 175.7205 30 L 4.5594 8.4713 124.5979 54.8097 43.5618 175.5878 31 V 4.6373 8.6650 126.3181 61.1255 34.1781 173.9500 32 F 5.0594 9.1620 127.5892 55.9871 40.9276 175.0238 33 F 4.8294 8.8674 124.1951 57.1135 40.3569 174.1432 34 Y 5.2012 9.0100 126.5200 56.0896 40.4045 174.2710 35 F 5.0611 8.9600 127.3247 55.9089 40.4254 175.3623 36 S 4.5624 8.2318 116.8286 57.7258 66.3209 172.1895 37 A 4.9420 7.9048 121.7184 50.4032 21.5139 177.6531 38 S 3.1903 8.8577 116.0463 60.6547 62.9393 176.0026 39 W 4.3416 7.2000 116.0696 57.6801 28.2236 175.6178 40 C 4.4279 7.3565 121.3446 57.9958 31.5559 171.8648 41 P 4.3790 0.0000 0.0000 65.3298 30.6058 176.9381 42 P 4.4083 0.0000 0.0000 65.6775 31.1985 178.0278 43 C 4.3472 7.7807 115.7616 62.6866 27.6934 176.0258 44 R 4.0967 7.8046 118.9558 59.4435 30.3629 179.0776 45 G 3.7643 8.1275 104.6672 47.1900 0.0000 175.4122 46 F 4.1338 7.9313 122.2674 61.1273 39.4725 177.3302 47 T 3.8536 8.2424 115.8974 66.4100 68.3856 174.5499 48 P 4.1439 0.0000 0.0000 65.9557 31.1834 178.3910 49 Q 3.9051 7.2921 116.7522 58.6270 28.5167 178.4466 50 L 3.7747 7.2779 121.3085 57.9661 41.9450 179.0753 51 I 3.9541 8.0656 120.1455 64.2607 37.0135 177.9111 52 E 3.8958 8.2632 120.1228 59.3054 29.5336 178.5900 53 F 4.1052 8.2906 120.6118 61.4901 39.4141 176.3622 54 Y 4.3959 8.8641 119.5130 61.1122 38.4889 177.8262 55 D 4.3290 8.4955 118.8723 57.2891 40.9439 178.7167 56 K 3.7131 7.5530 118.1478 58.3793 32.1784 177.8823 57 F 4.9197 7.8708 113.9700 55.7066 41.0507 176.6430 58 H 2.5800 7.8850 117.5504 57.9024 28.4949 177.8204 59 E 3.6719 7.4570 119.4042 59.0193 29.9051 179.1747 60 S 4.0967 7.8547 112.8916 60.4128 63.3053 175.3443 61 K 4.3186 8.1081 118.1015 55.0236 33.1105 175.4748 62 N 4.1260 7.7291 117.5534 54.5926 37.3062 171.7323 63 F 5.7623 8.0055 112.6371 55.3661 42.3972 175.1950 64 E 5.1630 9.7327 119.2178 54.5730 33.7218 174.0187 65 V 4.8719 8.8001 123.0832 61.0205 34.6727 174.3009 66 V 4.8017 8.8699 127.6550 60.7898 34.0001 174.2685 67 F 4.9963 9.7828 132.4853 58.7593 40.7900 173.6661 68 C 4.6993 9.1136 124.6515 57.8580 29.8038 173.1089 69 T 4.1948 7.8479 118.6982 61.5514 67.7513 173.8967 70 W 5.0685 8.9461 126.7719 56.6883 30.0936 176.0210 71 D 5.0560 8.6924 120.9994 54.6855 40.7613 176.2169 72 E 4.7324 9.1183 120.8800 56.1955 30.7626 175.5713 73 E 4.5251 8.1997 120.3078 54.9053 30.4805 176.3096 74 E 2.5400 8.7336 125.0898 58.9273 29.5685 178.2548 75 D 4.5181 7.9556 116.0084 56.1425 41.2711 177.8616 76 G 3.9058 7.7898 104.8679 46.1046 0.0000 175.5228 77 F 4.3148 8.3631 123.4921 61.5480 39.2997 176.5518 78 A 4.2558 8.5199 119.8683 55.5894 17.8695 179.6914 79 G 3.5632 8.0736 101.7971 48.0486 0.0000 174.8147 80 Y 4.3343 8.1706 121.9822 60.4560 38.8793 177.4650 81 F 3.8737 8.2406 121.3390 60.9030 39.1613 176.8416 82 A 3.5792 7.8477 120.0425 54.4839 18.1632 178.7675 83 K 3.9438 7.1068 114.2472 56.2792 32.6809 176.5950 84 M 3.7487 6.6107 119.5978 52.5506 34.0036 174.1644 85 P 4.2882 0.0000 0.0000 62.5707 32.7880 176.0019 86 W 5.0450 6.2852 117.5020 56.1922 31.0067 174.9392 87 L 5.3533 8.9692 119.0817 54.2316 44.1584 175.4580 88 A 5.2303 8.7024 120.5079 50.2822 22.8609 175.9978 89 V 3.9685 8.3182 121.7129 62.1303 32.2736 174.5506 90 P 4.3235 0.0000 0.0000 62.3298 32.0123 176.9216 91 F 3.3013 8.2838 123.6646 61.1828 39.1175 176.8622 92 A 4.1722 7.9142 120.8967 53.8491 18.6898 177.4583 93 Q 4.5932 7.9932 115.6052 55.6931 29.4434 178.0685 94 S 3.9172 7.4777 117.9789 61.7524 62.6582 176.0010 95 E 3.8549 8.1803 120.4429 59.6083 29.1731 179.2251 96 A 3.9765 7.7918 120.3316 55.0681 18.4011 179.8704 97 V 3.5967 7.5744 116.2594 66.2151 31.6934 178.0320 98 Q 3.9593 8.3595 118.1413 59.1021 28.4882 179.1856 99 K 4.0199 8.1884 119.3947 59.1791 32.0312 179.3016 100 L 4.0194 8.2022 120.8473 58.2631 41.9762 179.0298 101 S 3.9970 8.7527 115.6432 61.5634 62.7397 176.7581 102 K 3.9351 8.0753 122.2920 59.6183 31.7404 178.2734 103 H 4.0028 8.2924 117.8900 58.9870 29.7731 176.2464 104 F 4.6211 7.9931 116.3419 55.9592 39.5439 175.0916 105 N 4.0142 8.0841 116.2606 54.3688 37.6696 175.2524 106 V 3.7680 8.0649 117.3743 62.8008 31.5243 174.7815 107 E 4.7073 8.7950 127.1087 56.7382 31.0131 176.2012 108 S 4.9098 7.7857 111.1293 56.3224 66.2748 172.8666 109 I 4.2315 7.7625 113.8848 57.9264 39.9026 173.4643 110 P 4.6076 0.0000 0.0000 63.2609 32.3625 175.5593 111 T 4.6431 8.5066 116.9544 61.9266 73.3026 172.7813 112 L 5.2957 8.4522 125.7276 53.6493 45.5203 174.7916 113 I 4.7419 9.0961 127.4268 59.4431 40.3611 174.6860 114 G 3.8551 9.1797 114.9548 44.4092 0.0000 172.8792 115 V 4.9748 8.2874 117.5718 59.1827 36.3246 174.2346 116 D 4.7532 8.9982 123.3474 53.8456 41.8885 176.9736 117 A 4.0311 8.9081 128.6124 55.4954 18.7472 179.5557 118 D 4.3321 8.3581 115.2846 57.1642 41.2279 178.4797 119 S 4.3303 8.4985 112.0433 58.3084 63.6869 175.5278 120 G 4.1571 8.5548 108.3975 45.3192 0.0000 173.3753 121 D 4.6448 8.1101 120.7857 54.1011 42.0627 176.0165 122 V 3.9629 8.5969 123.2123 63.5740 31.8932 175.2313 123 V 4.0900 8.9996 128.3955 64.7378 33.0275 175.3539 124 T 5.2256 7.5587 113.8849 60.8220 70.7145 173.6262 125 T 4.4598 9.3607 116.7165 61.6008 69.7251 174.5968 126 R 4.5254 7.7604 120.8939 55.8328 31.1884 177.5115 127 A 4.1536 7.7520 124.3750 54.2082 17.7830 180.4605 128 R 3.3780 7.6886 117.1263 59.3236 29.8745 178.4044 129 A 4.0334 7.4955 119.4101 55.0861 18.3643 179.1735 130 T 3.6886 7.5107 108.2624 64.2532 68.9420 176.8564 131 L 3.0277 7.0520 123.3425 57.7890 41.7663 179.4668 132 V 3.6922 6.9459 111.4517 63.6628 31.5541 177.7850 133 K 4.3449 7.3567 115.3690 56.4224 33.8147 176.2940 134 D 4.9464 7.7452 118.8124 52.0555 41.0529 174.1960 135 P 4.5462 0.0000 0.0000 65.3982 32.0320 177.7561 136 E 4.6862 8.5322 116.4379 55.5654 29.9355 175.7984 137 G 4.2106 8.7045 107.8060 46.6813 0.0000 176.2688 138 E 4.0152 8.9155 120.4650 58.3381 29.9627 178.2230 139 Q 4.5413 9.1624 116.4055 55.1367 29.3830 175.0712 140 F 2.5270 7.2470 120.7210 57.6953 39.5490 172.7788 141 P 2.9700 0.0000 0.0000 61.8490 31.7042 175.5020 142 W 3.5911 7.3059 115.1752 57.8814 26.8482 175.3162 143 K 4.1145 8.0531 115.6696 57.2285 32.1366 178.0545 144 D 4.6015 8.7718 124.3307 54.0351 41.7939 176.4599 145 A 4.2404 8.4647 121.4933 52.4067 18.0650 177.5562 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 G 8.25 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 0.00 0.00 0.00 0.00 4 L 7.83 4.37 0.00 1.91 1.93 1.03 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 5 D 8.38 4.37 0.00 2.70 2.64 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 6 K 7.78 3.74 0.00 1.48 1.06 0.00 1.61 0.00 0.00 1.47 0.00 0.00 2.79 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.68 1.20 7.81 7 Y 7.44 4.59 0.00 3.21 2.81 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 0.00 0.00 0.00 8 L 7.86 4.78 0.00 1.78 1.62 1.20 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.45 0.00 2.02 2.00 0.00 3.86 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 10 G 8.31 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 0.00 0.00 0.00 11 I 7.67 4.35 2.03 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 1.37 0.65 0.98 0.00 0.00 12 E 8.78 4.73 0.00 2.04 2.18 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 2.27 2.33 0.00 13 K 8.10 5.25 0.00 1.65 1.75 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.36 1.41 7.81 14 L 8.95 5.01 0.00 1.63 1.73 1.04 0.90 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 15 R 9.03 4.75 0.00 1.66 2.12 0.00 3.37 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.90 0.00 16 R 9.38 4.95 0.00 2.00 1.86 0.00 3.33 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 17 G 8.94 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 9.07 4.86 0.00 2.70 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.91 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.61 5.35 0.00 2.07 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 2.22 2.38 0.00 21 V 8.91 4.69 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 0.84 0.00 0.00 1.08 0.00 0.00 22 E 8.67 4.62 0.00 1.94 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 2.44 2.29 0.00 23 V 8.96 3.69 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 1.12 0.00 0.00 1.08 0.00 0.00 24 K 8.25 4.06 0.00 1.84 1.89 0.00 1.77 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.48 7.81 25 S 7.88 4.41 0.00 4.09 4.04 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 26 L 7.85 4.43 0.00 1.88 1.77 0.99 0.76 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 27 A 7.12 4.27 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 28 G 9.42 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 0.00 0.00 0.00 29 K 7.80 4.76 0.00 1.92 1.81 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.53 7.81 30 L 8.47 4.56 0.00 1.78 1.64 0.58 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.66 4.64 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 0.49 0.00 0.00 0.90 0.00 0.00 32 F 9.16 5.06 0.00 3.08 2.81 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 0.00 0.00 0.00 33 F 8.87 4.83 0.00 2.99 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 34 Y 9.01 5.20 0.00 2.73 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 35 F 8.96 5.06 0.00 2.70 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 0.00 0.00 0.00 0.00 36 S 8.23 4.56 0.00 2.72 3.44 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 37 A 7.90 4.94 0.26 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 0.00 0.00 38 S 8.86 3.19 0.00 3.64 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 39 W 7.20 4.34 0.00 3.31 3.24 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 40 C 7.36 4.43 0.00 1.94 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 41 P 0.00 4.38 0.00 2.26 2.15 0.00 3.80 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 42 P 0.00 4.41 0.00 2.25 2.32 0.00 3.66 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 2.18 2.07 0.00 43 C 7.78 4.35 0.00 3.18 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.80 4.10 0.00 2.01 2.05 0.00 3.20 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 45 G 8.13 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.93 4.13 0.00 3.21 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 47 T 8.24 3.85 4.32 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 1.25 0.00 0.00 48 P 0.00 4.14 0.00 2.20 2.25 0.00 3.65 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 2.18 2.04 0.00 49 Q 7.29 3.91 0.00 1.89 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 50 L 7.28 3.77 0.00 0.76 1.38 0.59 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.07 3.95 1.93 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.55 0.78 0.00 0.00 52 E 8.26 3.90 0.00 2.04 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 2.29 0.00 53 F 8.29 4.11 0.00 3.45 3.35 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 54 Y 8.86 4.40 0.00 3.58 3.45 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 55 D 8.50 4.33 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.55 3.71 0.00 0.79 0.74 0.00 1.32 0.00 0.00 1.18 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.03 1.28 7.81 57 F 7.87 4.92 0.00 2.73 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 58 H 7.88 2.58 0.00 2.34 2.15 0.00 5.26 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 59 E 7.46 3.67 0.00 1.80 1.83 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 2.11 1.59 0.00 60 S 7.85 4.10 0.00 3.97 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 61 K 8.11 4.32 0.00 1.81 1.32 0.00 0.74 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 1.07 7.81 62 N 7.73 4.13 0.00 2.87 2.83 0.00 0.00 6.66 9.00 0.00 0.00 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 F 8.01 5.76 0.00 3.43 3.32 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 64 E 9.73 5.16 0.00 2.20 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 0.00 2.34 2.45 0.00 65 V 8.80 4.87 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 -0.34 0.00 0.00 0.89 0.00 0.00 66 V 8.87 4.80 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 1.14 0.00 0.00 0.99 0.00 0.00 67 F 9.78 5.00 0.00 3.48 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 68 C 9.11 4.70 0.00 2.12 2.64 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 69 T 7.85 4.19 3.93 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 1.27 0.00 0.00 70 W 8.95 5.07 0.00 3.17 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 D 8.69 5.06 0.00 3.14 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 72 E 9.12 4.73 0.00 2.04 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 0.00 2.26 2.43 0.00 73 E 8.20 4.53 0.00 2.16 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 2.40 2.36 0.00 74 E 8.73 2.54 0.00 1.56 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.47 0.00 75 D 7.96 4.52 0.00 2.68 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 76 G 7.79 3.91 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 0.00 0.00 0.00 77 F 8.36 4.31 0.00 3.19 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 78 A 8.52 4.26 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 79 G 8.07 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 80 Y 8.17 4.33 0.00 3.08 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 81 F 8.24 3.87 0.00 2.70 2.81 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 0.00 0.00 0.00 82 A 7.85 3.58 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 83 K 7.11 3.94 0.00 1.55 1.63 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.39 7.81 84 M 6.61 3.75 0.00 0.51 1.38 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.83 0.00 85 P 0.00 4.29 0.00 2.07 1.86 0.00 2.20 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.51 0.00 86 W 6.29 5.05 0.00 3.49 2.46 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 87 L 8.97 5.35 0.00 1.93 1.89 1.06 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.70 5.23 0.57 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 89 V 8.32 3.97 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 0.72 0.00 0.00 0.96 0.00 0.00 90 P 0.00 4.32 0.00 2.35 1.97 0.00 3.66 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 91 F 8.28 3.30 0.00 1.74 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 92 A 7.91 4.17 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 93 Q 7.99 4.59 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 94 S 7.48 3.92 0.00 3.43 3.62 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 95 E 8.18 3.85 0.00 1.95 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 2.34 2.32 0.00 96 A 7.79 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 97 V 7.57 3.60 2.20 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 1.37 0.00 0.00 0.87 0.00 0.00 98 Q 8.36 3.96 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.21 2.46 0.00 99 K 8.19 4.02 0.00 1.79 1.84 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.49 7.81 100 L 8.20 4.02 0.00 1.93 2.02 0.99 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.75 4.00 0.00 4.11 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 0.00 102 K 8.08 3.94 0.00 1.81 1.94 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.42 7.81 103 H 8.29 4.00 0.00 3.05 3.36 0.00 5.99 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 0.00 104 F 7.99 4.62 0.00 3.15 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.08 4.01 0.00 2.77 2.84 0.00 0.00 7.04 7.22 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 0.00 106 V 8.06 3.77 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 0.51 0.00 0.00 0.23 0.00 0.00 107 E 8.80 4.71 0.00 2.03 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 2.28 2.46 0.00 108 S 7.79 4.91 0.00 3.92 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 0.00 109 I 7.76 4.23 1.45 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.40 -0.53 0.00 0.00 110 P 0.00 4.61 0.00 2.03 2.20 0.00 3.59 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 1.64 1.95 0.00 111 T 8.51 4.64 4.12 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 1.14 0.00 0.00 112 L 8.45 5.30 0.00 1.76 1.50 0.88 0.60 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 0.00 113 I 9.10 4.74 1.82 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.10 -0.04 0.00 0.00 114 G 9.18 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 0.00 115 V 8.29 4.97 2.21 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 0.60 0.00 0.00 0.86 0.00 0.00 116 D 9.00 4.75 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 0.00 117 A 8.91 4.03 1.42 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 0.00 0.00 0.00 118 D 8.36 4.33 0.00 2.88 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 0.00 119 S 8.50 4.33 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 0.00 120 G 8.55 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 0.00 0.00 0.00 0.00 121 D 8.11 4.64 0.00 2.67 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 0.00 122 V 8.60 3.96 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.35 0.00 0.00 123 V 9.00 4.09 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 0.66 0.00 0.00 0.86 0.00 0.00 124 T 7.56 5.23 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 125 T 9.36 4.46 4.22 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 1.24 0.00 0.00 126 R 7.76 4.53 0.00 1.75 1.81 0.00 3.12 0.00 0.00 3.42 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 127 A 7.75 4.15 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 0.00 128 R 7.69 3.38 0.00 1.41 1.58 0.00 2.95 0.00 0.00 2.73 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 129 A 7.50 4.03 1.19 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 0.00 0.00 130 T 7.51 3.69 3.35 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 1.09 0.00 0.00 131 L 7.05 3.03 0.00 0.82 1.42 0.26 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 132 V 6.95 3.69 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 1.03 0.00 0.00 0.94 0.00 0.00 133 K 7.36 4.34 0.00 1.66 1.82 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.51 7.81 134 D 7.75 4.95 0.00 2.85 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 0.00 135 P 0.00 4.55 0.00 2.38 2.29 0.00 3.90 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 136 E 8.53 4.69 0.00 2.11 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 0.00 2.40 2.35 0.00 137 G 8.70 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 0.00 0.00 0.00 0.00 138 E 8.92 4.02 0.00 2.19 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 2.34 2.37 0.00 139 Q 9.16 4.54 0.00 2.46 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 140 F 7.25 2.53 0.00 2.25 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 0.00 141 P 0.00 2.97 0.00 1.52 0.58 0.00 3.66 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 142 W 7.31 3.59 0.00 3.58 3.11 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 0.00 143 K 8.05 4.11 0.00 1.61 1.75 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.38 7.81 144 D 8.77 4.60 0.00 2.58 2.63 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 0.00 145 A 8.46 4.24 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