NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4814 8.1927 117.0974 58.3026 64.9592 175.6975 5 D 4.1691 7.9622 120.3784 56.4521 40.9867 176.5532 6 L 3.9446 7.9990 119.3031 57.7084 42.0542 178.8968 7 V 3.5922 7.8377 117.6278 66.3615 31.3863 177.9150 8 T 3.4983 7.8404 115.3807 66.5895 68.0269 176.6966 9 K 3.8197 7.9889 119.2529 59.2056 32.3199 178.9178 10 F 4.2720 8.3941 121.0129 61.5124 39.3349 176.9561 11 E 3.6840 8.4471 118.5979 59.3904 29.0145 179.6080 12 S 4.2560 8.0634 113.7006 60.1849 63.2553 175.3764 13 L 4.3577 7.3759 121.6940 55.0722 40.5555 177.9085 14 I 3.3692 6.5939 120.0654 64.5478 37.3343 176.7547 15 I 4.0031 7.2700 117.9550 62.9460 37.9546 177.4828 16 S 3.8235 7.0644 112.7940 59.0089 63.0882 174.7515 17 K 3.8298 8.1389 118.7170 56.9195 29.8203 174.5409 18 Y 4.7383 7.7269 119.0849 54.8521 40.5338 173.2134 19 P 4.1302 0.0000 0.0000 62.3872 32.0850 175.9988 20 V 4.1289 8.4545 121.7414 60.6179 33.8884 175.3501 21 S 4.2396 8.6038 123.4700 58.2929 63.3668 174.3420 22 F 4.6760 8.5266 122.9165 57.9585 39.4722 176.0206 23 T 4.3973 8.4717 117.2404 61.6131 71.0421 176.6196 24 K 4.1077 8.6127 127.9125 60.5474 31.6162 178.7361 25 E 4.1690 8.1044 119.1904 60.9898 29.6206 180.9296 26 Q 4.0276 7.7875 118.8715 58.8064 28.6104 179.0494 27 S 4.3219 8.0515 115.7571 61.7895 62.8561 176.6761 28 A 3.9894 8.1149 123.1797 55.3194 18.0842 179.7359 29 Q 3.8835 8.4335 116.5766 59.0643 28.8509 178.7731 30 A 4.2011 8.4138 121.9469 55.1873 18.4264 179.5137 31 A 3.9662 8.4001 119.4642 55.2769 18.5508 179.2214 32 Q 3.6986 8.1857 118.4315 59.5899 28.9846 179.4179 33 W 4.2704 8.0728 119.4296 59.4884 29.0089 178.2625 34 E 4.0515 8.4986 119.6098 59.2786 29.0415 178.8504 35 S 4.0631 8.1201 113.2984 61.2757 62.4724 176.2548 36 V 3.5042 7.6541 120.8047 65.9275 31.2584 178.0445 37 L 4.0602 8.0783 118.6212 57.9365 41.3244 179.6697 38 K 4.0479 8.2392 117.6212 59.0350 32.0627 178.5963 39 S 4.5616 7.9847 111.8548 57.7049 63.3965 174.6259 40 G 3.9595 7.7271 110.0943 46.9909 0.0000 174.1027 41 Q 4.7100 7.9317 116.3792 55.3345 29.5006 177.3553 42 I 3.9807 8.1130 121.3526 64.8627 37.6616 178.0320 43 Q 4.0063 8.4457 120.5653 58.8809 28.6101 176.7292 44 P 4.4494 0.0000 0.0000 65.1457 31.5692 176.7230 45 H 4.7882 8.1713 115.4563 55.8781 28.9217 176.6558 46 L 4.1649 8.0225 123.6968 58.0019 41.4262 179.0673 47 D 4.5289 8.2370 118.4910 57.2341 40.7195 178.3752 48 Q 4.0064 8.1759 119.6998 59.2088 29.2049 177.9102 49 L 3.9930 8.6616 121.7941 58.2762 42.0740 178.4268 50 N 4.3631 8.4579 117.0197 56.5853 38.3890 176.6490 51 L 3.9867 7.9643 121.9078 57.8535 42.2296 178.8747 52 V 3.6980 8.1478 118.6681 66.1704 31.2805 177.8650 53 L 4.3059 7.6674 117.6927 55.9935 41.5689 178.7276 54 R 3.6968 7.6682 118.7264 58.6484 30.0519 176.5783 55 D 4.8268 7.3315 115.0769 53.8920 42.3404 175.8471 56 N 4.9802 7.8233 116.6162 51.3695 42.3073 175.5784 57 T 3.4993 8.5690 119.4330 65.8309 68.9476 174.4072 58 F 5.1614 7.3238 117.7440 55.1157 42.5057 176.2381 59 I 3.4255 9.0022 123.5171 64.3088 36.7964 177.7929 60 V 4.1116 7.7650 116.8697 62.2672 31.4166 175.2732 61 S 3.7266 7.6723 111.2992 59.5581 60.3893 171.8779 62 T 4.6518 7.7924 108.1989 59.9833 70.9894 174.4734 63 L 4.1879 8.3149 120.5045 56.1622 42.0466 176.6646 64 Y 4.6948 7.3504 114.9589 55.0591 41.9653 172.9469 65 P 3.7295 0.0000 0.0000 62.9332 32.0411 176.0828 66 T 4.6418 8.7011 111.3452 59.5880 72.8276 175.3730 67 S 4.1722 8.5958 115.0856 61.5883 62.7710 176.6163 68 T 4.0360 8.1015 119.2859 66.8131 68.1959 175.8412 69 D 4.7419 7.8225 120.0333 57.5616 40.8371 179.1843 70 V 3.6558 7.6587 118.1661 66.2916 31.0805 177.9155 71 H 4.3232 8.7621 116.4093 58.8730 28.6349 177.8936 72 V 3.7234 8.0874 120.0753 66.0693 31.3047 177.6295 73 F 4.2993 8.8071 120.5145 61.5544 38.9300 176.6328 74 E 3.6891 8.3302 117.7145 59.0768 29.1740 178.6293 75 V 3.7845 7.6081 117.2566 65.6208 31.7251 177.9320 76 A 4.0258 8.5718 120.9364 55.0198 18.2183 179.0491 77 L 3.7511 7.8229 119.2189 57.8321 42.0878 177.4337 78 P 4.1939 0.0000 0.0000 65.6263 31.0989 177.9091 79 L 3.8919 7.5504 119.3323 58.2132 42.0265 179.1328 80 I 3.6524 8.0664 119.9980 64.1685 36.9081 178.5252 81 K 3.9737 8.1551 119.3560 59.6965 31.8992 179.1151 82 D 4.3458 8.2471 119.0197 57.2681 40.5066 178.7337 83 L 3.9793 8.0502 118.8874 57.7966 41.8262 179.3789 84 V 3.6871 8.2740 118.2595 66.1075 31.2607 177.9251 85 A 4.0755 8.2289 119.6830 54.3390 18.2513 178.7072 86 S 4.5601 7.6114 109.7124 57.2538 63.9475 174.4948 87 S 4.1998 7.1159 117.4429 58.7344 62.5581 174.5028 88 K 4.0630 8.5270 125.5397 58.5123 32.4591 177.4551 89 D 4.2937 8.1387 118.1438 52.2560 43.1089 175.3639 90 V 3.3060 8.2051 127.8998 65.6286 31.4991 177.3216 91 K 3.8794 7.8923 118.8197 59.7936 32.0332 178.7285 92 S 4.1081 8.0412 114.7642 61.7202 62.5284 176.7710 93 T 3.8278 7.8212 118.3607 66.9999 68.0507 176.0302 94 Y 4.5586 7.6436 117.3163 61.9218 38.0306 179.0238 95 T 4.0716 8.2336 115.6086 66.6380 68.5883 176.5836 96 T 3.9884 7.5345 116.6233 64.9387 69.0082 174.3496 97 Y 5.0039 7.5324 119.3150 56.7436 39.4021 177.9358 98 R 3.9586 8.3243 120.8008 59.9851 30.3859 177.9644 99 H 4.4228 7.8651 115.1175 58.6703 28.9928 177.5864 100 I 3.9045 7.9070 121.2029 64.5658 36.8694 178.3014 101 L 4.2719 8.2334 119.8583 57.4634 41.4881 179.2246 102 R 3.9293 8.1489 118.9142 59.4880 29.9648 178.4344 103 W 4.2803 8.3399 127.5781 60.2884 30.6905 178.0172 104 I 3.6333 8.7096 120.3528 64.3324 36.4525 177.5301 105 D 4.3184 8.3534 119.0004 57.7053 40.9104 177.5876 106 Y 3.9303 7.8777 119.4576 61.2621 38.8055 178.2043 107 M 3.6556 8.1309 119.9794 58.0725 31.8258 178.8586 108 Q 4.0600 8.2317 118.1518 58.9519 28.9414 178.3992 109 N 4.2111 7.6757 118.7444 55.8454 38.4519 176.8091 110 L 3.6641 7.4057 121.1816 58.0125 42.0081 177.7783 111 L 4.2560 7.7140 114.4558 53.7673 42.2734 176.3132 112 E 3.7125 7.6105 117.4078 57.2934 27.3278 175.4251 113 V 3.7920 7.8065 117.3847 62.2912 33.0777 176.3060 114 S 4.2724 8.5741 120.9304 58.4788 64.4708 175.4169 115 S 4.0962 8.6607 120.3941 62.5403 62.7287 176.9580 116 T 3.9811 7.8141 113.4478 64.9903 67.2984 175.0903 117 D 4.5818 7.7002 118.5482 54.3610 41.4894 177.1824 118 K 4.2742 7.0960 118.5329 56.1477 32.6930 175.9510 119 L 4.3515 8.8054 126.4136 54.1925 42.8360 177.1070 120 E 4.0110 8.9134 124.9842 56.9382 29.9307 175.3006 121 I 3.7937 8.7575 126.0213 59.3038 34.2679 172.7794 122 N 4.5217 7.2439 122.6128 51.5320 37.2977 174.2148 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 4 S 8.19 4.48 0.00 3.67 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 0.00 5 D 7.96 4.17 0.00 2.87 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 6 L 8.00 3.94 0.00 1.70 1.67 0.90 0.84 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 7 V 7.84 3.59 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 1.18 0.00 0.00 0.94 0.00 0.00 8 T 7.84 3.50 4.20 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 0.15 0.00 0.00 9 K 7.99 3.82 0.00 1.82 1.81 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.56 7.81 10 F 8.39 4.27 0.00 3.05 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 11 E 8.45 3.68 0.00 2.14 1.88 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 2.32 2.43 0.00 12 S 8.06 4.26 0.00 3.97 4.05 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 13 L 7.38 4.36 0.00 1.78 1.76 0.89 0.44 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 14 I 6.59 3.37 1.63 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.20 0.74 0.00 0.00 15 I 7.27 4.00 1.29 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.78 0.84 0.00 0.00 16 S 7.06 3.82 0.00 3.97 3.42 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 17 K 8.14 3.83 0.00 1.84 1.94 0.00 1.47 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.37 7.81 18 Y 7.73 4.74 0.00 2.82 2.86 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 19 P 0.00 4.13 0.00 2.03 1.91 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 20 V 8.45 4.13 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 0.88 0.00 0.00 0.86 0.00 0.00 21 S 8.60 4.24 0.00 3.92 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 22 F 8.53 4.68 0.00 2.96 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.47 4.40 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 1.25 0.00 0.00 24 K 8.61 4.11 0.00 1.78 1.86 0.00 1.80 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.07 7.81 25 E 8.10 4.17 0.00 1.97 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 2.31 1.97 0.00 26 Q 7.79 4.03 0.00 1.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 27 S 8.05 4.32 0.00 4.11 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 28 A 8.11 3.99 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 29 Q 8.43 3.88 0.00 2.26 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 30 A 8.41 4.20 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 0.00 0.00 0.00 0.00 0.00 31 A 8.40 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 8.19 3.70 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.76 0.00 0.00 0.00 0.00 0.00 1.92 2.14 0.00 33 W 8.07 4.27 0.00 3.56 3.27 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 34 E 8.50 4.05 0.00 2.24 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 2.34 2.35 0.00 35 S 8.12 4.06 0.00 4.02 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 36 V 7.65 3.50 2.29 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 1.01 0.00 0.00 0.41 0.00 0.00 37 L 8.08 4.06 0.00 2.01 1.76 1.11 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.24 4.05 0.00 1.88 1.89 0.00 1.98 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.69 7.81 39 S 7.98 4.56 0.00 4.05 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 40 G 7.73 3.96 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 0.00 0.00 0.00 41 Q 7.93 4.71 0.00 2.11 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.10 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 42 I 8.11 3.98 1.94 0.00 0.00 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 1.42 0.97 0.99 0.00 0.00 43 Q 8.45 4.01 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 44 P 0.00 4.45 0.00 2.19 2.17 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.08 0.00 45 H 8.17 4.79 0.00 3.55 3.55 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 8.02 4.16 0.00 1.80 1.76 0.71 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.24 4.53 0.00 2.75 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 48 Q 8.18 4.01 0.00 2.19 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.90 0.00 0.00 0.00 0.00 0.00 2.62 2.48 0.00 49 L 8.66 3.99 0.00 1.85 1.83 -0.12 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.46 4.36 0.00 3.15 3.09 0.00 0.00 6.88 6.28 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 51 L 7.96 3.99 0.00 1.86 1.88 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.15 3.70 2.22 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 0.92 0.00 0.00 1.17 0.00 0.00 53 L 7.67 4.31 0.00 1.55 1.58 0.06 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 54 R 7.67 3.70 0.00 1.64 2.02 0.00 3.16 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.32 0.00 55 D 7.33 4.83 0.00 2.79 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 56 N 7.82 4.98 0.00 2.72 2.69 0.00 0.00 6.91 7.54 0.00 0.00 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 T 8.57 3.50 3.74 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 -0.01 0.00 0.00 58 F 7.32 5.16 0.00 3.17 3.25 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 59 I 9.00 3.43 1.74 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.26 0.31 0.00 0.00 60 V 7.77 4.11 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 0.34 0.00 0.00 1.01 0.00 0.00 61 S 7.67 3.73 0.00 4.03 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 62 T 7.79 4.65 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 1.47 0.00 0.00 63 L 8.31 4.19 0.00 1.27 1.09 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.35 4.69 0.00 2.80 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 65 P 0.00 3.73 0.00 1.96 1.60 0.00 3.61 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.91 0.00 66 T 8.70 4.64 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 67 S 8.60 4.17 0.00 4.09 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.10 4.04 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 69 D 7.82 4.74 0.00 3.10 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 70 V 7.66 3.66 2.15 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 1.13 0.00 0.00 0.96 0.00 0.00 71 H 8.76 4.32 0.00 3.31 3.40 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 8.09 3.72 2.25 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 0.68 0.00 0.00 0.89 0.00 0.00 73 F 8.81 4.30 0.00 2.82 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 74 E 8.33 3.69 0.00 2.23 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 2.33 2.31 0.00 75 V 7.61 3.78 2.26 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 0.99 0.00 0.00 0.98 0.00 0.00 76 A 8.57 4.03 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.82 3.75 0.00 0.96 1.16 0.92 0.46 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 78 P 0.00 4.19 0.00 2.26 2.24 0.00 3.70 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.99 0.00 79 L 7.55 3.89 0.00 1.90 1.86 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 80 I 8.07 3.65 1.87 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.67 0.95 0.00 0.00 81 K 8.16 3.97 0.00 1.96 1.87 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.68 7.81 82 D 8.25 4.35 0.00 2.84 2.71 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 0.00 0.00 0.00 0.00 83 L 8.05 3.98 0.00 1.74 1.78 0.80 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.27 3.69 2.27 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 1.05 0.00 0.00 1.08 0.00 0.00 85 A 8.23 4.08 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 86 S 7.61 4.56 0.00 4.04 3.96 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 87 S 7.12 4.20 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 88 K 8.53 4.06 0.00 1.77 1.84 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.36 7.81 89 D 8.14 4.29 0.00 2.64 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.21 3.31 1.89 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 0.36 0.00 0.00 0.82 0.00 0.00 91 K 7.89 3.88 0.00 1.87 1.94 0.00 1.81 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.61 7.81 92 S 8.04 4.11 0.00 4.02 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 7.82 3.83 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 1.39 0.00 0.00 94 Y 7.64 4.56 0.00 3.10 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 95 T 8.23 4.07 4.41 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 1.19 0.00 0.00 96 T 7.53 3.99 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 0.51 0.00 0.00 97 Y 7.53 5.00 0.00 3.12 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.32 3.96 0.00 1.50 1.91 0.00 3.10 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.78 0.00 99 H 7.87 4.42 0.00 3.33 3.43 0.00 5.63 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 0.00 100 I 7.91 3.90 2.16 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 1.60 0.64 1.14 0.00 0.00 101 L 8.23 4.27 0.00 1.93 1.75 1.02 0.75 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 0.00 102 R 8.15 3.93 0.00 1.95 2.21 0.00 3.06 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 103 W 8.34 4.28 0.00 3.38 3.39 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 0.00 104 I 8.71 3.63 2.03 0.00 0.00 1.00 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 0.88 1.05 0.00 0.00 105 D 8.35 4.32 0.00 2.97 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 7.88 3.93 0.00 3.18 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 0.00 107 M 8.13 3.66 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.86 0.00 108 Q 8.23 4.06 0.00 2.35 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.67 2.39 0.00 109 N 7.68 4.21 0.00 2.64 2.74 0.00 0.00 6.49 6.63 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 0.00 110 L 7.41 3.66 0.00 1.17 1.60 0.81 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.71 4.26 0.00 1.68 1.65 0.79 0.81 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 0.00 112 E 7.61 3.71 0.00 2.07 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 2.21 2.16 0.00 113 V 7.81 3.79 2.15 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 0.82 0.00 0.00 1.11 0.00 0.00 114 S 8.57 4.27 0.00 4.08 3.99 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 0.00 115 S 8.66 4.10 0.00 3.85 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 0.00 116 T 7.81 3.98 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 0.00 117 D 7.70 4.58 0.00 2.63 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.10 4.27 0.00 1.94 1.76 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.60 7.81 119 L 8.81 4.35 0.00 1.60 1.60 1.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.91 4.01 0.00 2.03 1.75 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 2.23 1.88 0.00 121 I 8.76 3.79 1.87 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 1.27 1.12 0.91 0.00 0.00 122 N 7.24 4.52 0.00 2.80 2.89 0.00 0.00 6.82 7.56 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