NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5340 8.3044 120.2864 55.2913 33.8684 173.9199 3 V 4.2379 8.0607 121.4136 59.8799 33.8352 172.8651 4 W 4.6214 9.1357 135.0000 57.4757 31.6719 174.8172 5 T 4.2056 8.0914 123.8687 61.3932 66.9625 172.6830 6 P 4.5180 0.0000 0.0000 63.4616 32.2854 175.7799 7 V 4.0311 7.3468 119.7980 62.8692 32.7863 175.3566 8 N 4.1919 8.6540 124.8337 54.8143 36.0743 173.3763 9 N 5.0620 7.5400 108.6553 52.9908 40.0982 174.1889 10 K 4.1439 8.3058 116.0890 56.4887 32.8107 176.5207 11 M 5.0266 8.3148 120.3960 53.8908 35.3231 175.1984 12 F 4.6157 8.2830 116.7262 57.3156 41.1309 176.7537 13 E 3.5168 8.3697 121.5856 57.0748 27.5580 175.5508 14 T 3.8051 8.3760 122.6263 66.5578 68.9265 174.1898 15 F 4.5187 9.0165 124.1832 57.6159 36.6096 176.3606 16 S 4.5130 8.2123 114.8288 60.2904 63.1213 174.5474 17 Y 4.3507 8.3116 117.3618 58.4529 38.1698 175.0606 18 L 4.6951 7.5569 119.8347 52.1213 43.6388 174.5101 19 P 4.4233 0.0000 0.0000 61.9318 31.7743 175.0188 20 P 4.3194 0.0000 0.0000 62.7890 31.7900 176.4341 21 L 3.9959 8.3198 122.5756 54.8170 42.2043 177.9779 22 T 4.2967 8.1693 114.0010 61.0580 71.3771 175.4673 23 D 4.3360 8.4799 120.5110 57.3944 40.7374 178.6900 24 E 3.9765 8.0727 119.5595 59.2472 29.7383 178.7206 25 Q 3.9209 7.9810 117.8775 58.7559 28.6564 178.6675 26 I 3.6860 7.9894 120.7783 64.4202 37.1362 178.1667 27 A 4.0110 8.1016 121.3148 55.2530 18.1421 179.4230 28 A 3.9610 8.1551 119.0893 55.5554 18.4339 179.9423 29 Q 4.0950 8.1178 116.4890 59.0860 28.8015 179.0998 30 V 3.7417 8.2729 119.5283 66.1802 31.5629 177.7110 31 D 4.4313 8.5430 118.9738 57.5999 40.5068 178.2565 32 Y 4.1806 8.2168 119.9589 60.6600 38.8343 177.9915 33 I 3.9626 7.9812 120.7723 64.6242 37.4406 178.6432 34 V 3.5288 7.9607 118.6184 65.9751 31.1902 177.9057 35 A 3.9323 8.1474 119.6924 54.7121 18.2535 178.4658 36 N 4.0181 7.1843 112.7232 52.5950 38.6947 175.9285 37 G 3.7175 7.2240 107.9128 45.8427 0.0000 173.7942 38 W 5.0105 7.5345 118.6717 55.8993 30.7895 176.2161 39 I 4.4198 8.9160 123.2650 59.5100 37.9775 174.0396 40 P 4.9222 0.0000 0.0000 62.9049 32.8045 175.0938 41 C 5.0177 8.8921 121.1344 58.4444 35.6022 172.4497 42 L 5.3092 8.7483 123.5880 53.1786 44.5516 175.2049 43 E 5.6041 9.1962 121.1330 54.8833 33.9951 174.6530 44 F 5.6133 9.0008 116.3600 56.1046 42.3144 172.9916 45 A 4.4496 8.3306 119.4888 50.3770 22.6056 176.3402 46 E 4.2672 8.6927 119.3970 55.7884 30.6961 177.6496 47 A 4.2832 8.9361 123.4014 55.9581 18.3238 179.9193 48 D 4.5104 8.1538 112.8309 56.3929 41.0634 177.2923 49 K 4.6159 8.0134 117.3276 56.0439 32.5259 176.7528 50 A 3.9969 7.6375 124.5722 53.5236 19.1604 178.2361 51 Y 4.6970 7.4667 111.5397 55.5342 40.2927 175.7354 52 V 3.8263 8.4479 122.4922 63.9082 32.0318 175.3405 53 S 4.7892 8.9175 119.9241 57.3943 66.0929 173.7656 54 N 5.2770 8.5821 115.0051 52.8080 39.8129 176.0034 55 E 3.9856 8.3615 118.4712 59.5887 29.7353 179.3753 56 S 4.1025 8.7200 115.1353 60.5164 62.8383 175.9828 57 A 2.5800 7.4844 123.3879 53.5737 17.7184 179.0295 58 I 3.5562 6.8581 115.6122 63.7444 38.0194 177.1899 59 R 4.2269 7.5874 116.6273 55.9289 30.6424 176.3792 60 F 5.0073 7.2003 118.1457 56.0727 41.0814 178.0495 61 G 4.0814 8.3066 116.6343 46.0159 0.0000 176.5012 62 S 4.6524 8.4450 115.6859 57.9074 61.6458 174.2664 63 V 4.4628 7.1950 107.4582 61.1686 33.3587 177.4611 64 S 4.5396 8.2115 114.1733 59.1508 63.6054 173.5014 65 C 4.0793 8.0337 119.5693 61.5829 28.0098 173.0867 66 L 3.6553 8.4763 122.7781 55.5871 39.0362 173.1124 67 Y 4.4102 7.5829 119.2659 56.0470 39.9703 174.6405 68 Y 4.8783 7.0719 123.1002 56.4067 42.3877 174.6528 69 D 4.4957 8.8753 123.5050 55.3680 41.7433 176.7596 70 N 4.5071 8.8961 116.9549 54.3605 35.8371 176.1457 71 R 3.9496 8.0192 118.7874 59.3515 30.3723 177.2307 72 Y 4.3700 7.6530 114.5057 57.9819 38.3112 175.1969 73 W 5.0453 8.6946 123.6914 55.2830 32.8368 174.5044 74 T 4.2812 8.1207 117.2544 62.4374 69.4648 174.6756 75 M 4.5663 8.5202 126.7380 55.3980 33.0071 175.2267 76 W 4.7613 9.5629 135.0000 56.6563 31.3385 176.7204 77 K 3.4399 8.6295 128.5378 57.5798 30.6202 178.1157 78 L 4.9247 8.2614 124.9065 52.6665 45.1017 174.0308 79 P 4.3674 0.0000 0.0000 63.3082 31.9767 177.5888 80 M 4.2868 8.5280 123.3395 53.7753 30.4219 175.4533 81 F 4.3959 7.4854 119.2181 58.5796 40.0477 176.1912 82 G 3.9253 9.0788 111.9669 45.9199 0.0000 172.8696 83 C 4.2888 7.9074 120.6831 59.3146 31.5614 173.3283 84 R 4.4620 8.6627 124.6323 55.6945 30.3933 175.0041 85 D 4.8433 7.7026 118.6631 51.5138 42.7396 174.4227 86 P 4.3135 0.0000 0.0000 66.1258 31.2855 178.5193 87 M 4.1247 8.2262 116.9597 58.2725 31.9792 178.3620 88 Q 3.9795 7.8733 119.6783 59.0901 29.2262 178.5431 89 V 3.6310 7.7474 118.7653 66.1222 31.8404 177.9101 90 L 4.0552 7.9878 118.7195 57.8072 41.3126 179.7507 91 R 3.9896 8.2752 118.2725 59.2490 29.8937 178.9446 92 E 4.1024 8.2659 118.2628 59.2075 29.4667 179.2873 93 I 3.5315 7.8590 120.0426 64.2519 37.1107 178.4192 94 V 3.4582 7.6015 118.2967 66.0520 31.4373 177.7808 95 A 3.9177 8.0987 120.5438 55.2728 18.2274 179.2399 96 C 2.0000 7.7074 117.5104 62.0933 31.2866 175.9632 97 T 3.7366 7.5063 111.3275 64.4270 67.9935 176.3598 98 K 3.7992 7.8283 121.7603 59.3099 32.3046 178.4276 99 A 3.9695 7.4780 119.8017 53.4202 19.7170 177.6158 100 F 4.7114 7.6612 115.6942 55.0454 39.1025 173.9390 101 P 4.4336 0.0000 0.0000 64.1892 31.8994 177.9038 102 D 4.6854 8.0658 116.9556 53.8424 41.1454 175.3380 103 A 4.7625 7.2570 121.0896 50.1704 21.6586 176.8949 104 Y 4.1890 8.3884 117.9061 57.8160 39.2039 175.1702 105 V 5.1851 8.8905 123.9954 61.0393 35.0224 174.3314 106 R 4.9607 9.5301 123.8193 54.2680 32.9730 173.7870 107 L 4.8003 8.0936 123.8102 54.0443 43.7144 175.7245 108 V 4.8925 8.5798 118.2455 59.5120 36.3294 174.1428 109 A 4.9012 8.0487 121.4373 50.4835 22.9159 175.1677 110 F 5.2340 8.9727 119.1062 55.7064 42.7620 174.0059 111 D 5.3895 8.7852 122.7231 52.9014 42.2889 176.6119 112 N 4.7924 9.1610 122.6794 53.8839 38.4325 176.1667 113 Q 4.2203 8.6950 118.7429 58.7051 29.1169 177.4610 114 K 4.0381 8.2919 114.9527 56.8658 33.0680 176.4279 115 Q 3.4852 7.9593 118.7525 55.9016 27.0717 172.6154 116 V 4.5032 7.7134 117.0373 60.1652 35.0124 173.9781 117 Q 4.3932 8.7422 123.3174 56.4956 29.2819 175.5025 118 I 4.1535 8.2911 125.3623 61.5545 39.7142 174.4307 119 M 4.5839 6.6978 117.5881 54.1534 34.4471 173.6681 120 G 4.7872 8.2012 106.7718 47.2225 0.0000 172.3222 121 F 4.9166 7.0518 114.7614 55.5119 40.8490 172.6606 122 L 4.5859 8.9285 122.9291 55.5212 41.9905 176.7529 123 V 4.4749 8.6977 118.4803 61.7662 33.9781 175.8127 124 Q 4.6467 7.8038 120.8778 54.4226 32.4433 173.3687 125 R 4.4584 8.1387 121.3155 52.9365 32.9290 173.4088 126 P 4.1772 0.0000 0.0000 62.8025 31.6937 177.6469 127 K 4.0970 8.4698 120.0420 59.1281 32.1574 178.0515 128 T 4.1798 7.7430 106.8045 61.9651 69.4674 174.8880 129 A 4.2385 7.7382 126.3837 53.0106 18.6432 177.3508 130 R 4.6420 8.7477 119.6457 55.8572 32.0446 175.1937 131 D 4.9396 8.3805 117.4159 52.8246 39.7574 175.5904 132 F 5.3024 7.7986 112.7748 55.6759 41.0253 173.6081 133 Q 4.4236 8.3724 120.4228 53.0589 31.1025 174.1668 134 P 4.4788 0.0000 0.0000 62.3203 32.3732 176.9384 135 A 3.9664 8.9370 123.7452 55.6778 18.1436 179.4264 136 N 4.5761 8.0731 109.4958 54.2094 37.8499 175.5891 137 K 4.3879 7.9125 118.0851 56.3145 32.5975 177.5042 138 R 3.5621 7.6188 121.2259 57.7672 30.1407 176.7226 139 S 5.0474 7.4835 110.1795 56.2675 65.9997 174.2275 140 V 3.9769 8.5285 114.8182 61.6884 31.8721 175.6484 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 M 8.30 4.53 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.06 4.24 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 0.96 0.00 0.00 4 W 9.14 4.62 0.00 3.48 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 5 T 8.09 4.21 4.07 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 0.00 0.00 1.04 0.00 0.00 6 P 0.00 4.52 0.00 2.23 2.19 0.00 3.78 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 1.96 1.96 0.00 7 V 7.35 4.03 2.03 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.65 4.19 0.00 2.89 2.90 0.00 0.00 6.77 8.00 0.00 0.00 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 N 7.54 5.06 0.00 2.67 2.72 0.00 0.00 7.31 6.68 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 10 K 8.31 4.14 0.00 1.93 1.46 0.00 0.61 0.00 0.00 1.11 0.00 0.00 2.50 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.31 1.34 7.81 11 M 8.31 5.03 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.67 0.00 12 F 8.28 4.62 0.00 3.11 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 13 E 8.37 3.52 0.00 2.14 1.73 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 2.19 2.14 0.00 14 T 8.38 3.81 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 0.17 0.00 0.00 15 F 9.02 4.52 0.00 3.29 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 16 S 8.21 4.51 0.00 4.16 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 17 Y 8.31 4.35 0.00 3.02 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 18 L 7.56 4.70 0.00 1.88 1.61 0.88 0.85 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 19 P 0.00 4.42 0.00 2.03 2.00 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 20 P 0.00 4.32 0.00 2.05 2.02 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 21 L 8.32 4.00 0.00 1.61 1.51 0.33 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.17 4.30 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 1.19 0.00 0.00 23 D 8.48 4.34 0.00 2.71 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 24 E 8.07 3.98 0.00 2.02 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 2.36 2.39 0.00 25 Q 7.98 3.92 0.00 2.31 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 26 I 7.99 3.69 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.73 1.09 0.00 0.00 27 A 8.10 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 28 A 8.16 3.96 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 29 Q 8.12 4.10 0.00 2.46 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.38 1.93 0.00 30 V 8.27 3.74 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 1.10 0.00 0.00 1.11 0.00 0.00 31 D 8.54 4.43 0.00 2.98 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 32 Y 8.22 4.18 0.00 3.12 3.33 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 33 I 7.98 3.96 2.17 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.04 1.07 0.00 0.00 34 V 7.96 3.53 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 1.01 0.00 0.00 1.02 0.00 0.00 35 A 8.15 3.93 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 36 N 7.18 4.02 0.00 1.44 1.42 0.00 0.00 7.07 7.79 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 37 G 7.22 3.72 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 0.00 0.00 0.00 38 W 7.53 5.01 0.00 3.37 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 39 I 8.92 4.42 2.13 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.02 0.80 0.00 0.00 40 P 0.00 4.92 0.00 2.10 1.99 0.00 3.79 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.89 5.02 0.00 3.09 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 42 L 8.75 5.31 0.00 1.87 1.64 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.20 5.60 0.00 2.04 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 2.35 2.33 0.00 44 F 9.00 5.61 0.00 3.02 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 A 8.33 4.45 -0.12 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 0.00 0.00 46 E 8.69 4.27 0.00 2.17 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 2.31 2.28 0.00 47 A 8.94 4.28 1.47 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 0.00 0.00 48 D 8.15 4.51 0.00 2.71 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 49 K 8.01 4.62 0.00 1.62 1.69 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.43 7.81 50 A 7.64 4.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.47 4.70 0.00 2.92 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 52 V 8.45 3.83 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.81 0.00 0.00 53 S 8.92 4.79 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 54 N 8.58 5.28 0.00 2.76 2.83 0.00 0.00 6.59 7.66 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 55 E 8.36 3.99 0.00 2.11 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 0.00 2.40 2.32 0.00 56 S 8.72 4.10 0.00 3.85 3.80 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 57 A 7.48 2.58 1.11 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 58 I 6.86 3.56 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.89 0.00 0.00 59 R 7.59 4.23 0.00 1.89 2.01 0.00 3.20 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 1.60 1.56 0.00 60 F 7.20 5.01 0.00 3.01 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 61 G 8.31 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.45 4.65 0.00 3.86 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 63 V 7.19 4.46 1.85 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 0.66 0.00 0.00 0.48 0.00 0.00 64 S 8.21 4.54 0.00 4.10 4.27 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 65 C 8.03 4.08 0.00 2.97 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 66 L 8.48 3.66 0.00 1.78 1.76 0.94 0.97 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 67 Y 7.58 4.41 0.00 2.92 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 68 Y 7.07 4.88 0.00 2.82 2.70 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 69 D 8.88 4.50 0.00 2.79 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 70 N 8.90 4.51 0.00 3.07 3.24 0.00 0.00 7.00 7.66 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 71 R 8.02 3.95 0.00 1.49 1.67 0.00 3.07 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 72 Y 7.65 4.37 0.00 3.06 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 73 W 8.69 5.05 0.00 3.05 3.14 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 0.00 0.00 0.00 74 T 8.12 4.28 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 0.93 0.00 0.00 75 M 8.52 4.57 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.78 0.00 76 W 9.56 4.76 0.00 3.73 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 77 K 8.63 3.44 0.00 1.65 0.75 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.87 0.21 7.81 78 L 8.26 4.92 0.00 1.59 1.57 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.37 0.00 0.70 1.83 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.12 0.00 80 M 8.53 4.29 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 81 F 7.49 4.40 0.00 3.11 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 82 G 9.08 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 0.00 0.00 0.00 83 C 7.91 4.29 0.00 2.99 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 84 R 8.66 4.46 0.00 1.82 1.90 0.00 3.21 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.74 0.00 85 D 7.70 4.84 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 4.31 0.00 2.22 2.21 0.00 3.67 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 87 M 8.23 4.12 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.56 0.00 88 Q 7.87 3.98 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.75 3.63 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 1.02 0.00 0.00 90 L 7.99 4.06 0.00 1.91 1.72 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.28 3.99 0.00 2.05 2.01 0.00 3.15 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 92 E 8.27 4.10 0.00 2.25 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 2.60 2.65 0.00 93 I 7.86 3.53 1.99 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 1.35 1.07 0.85 0.00 0.00 94 V 7.60 3.46 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 1.05 0.00 0.00 0.92 0.00 0.00 95 A 8.10 3.92 1.50 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 0.00 0.00 96 C 7.71 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.51 3.74 4.34 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 1.13 0.00 0.00 98 K 7.83 3.80 0.00 1.76 1.97 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.38 7.81 99 A 7.48 3.97 1.17 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 0.00 0.00 0.00 0.00 0.00 100 F 7.66 4.71 0.00 2.80 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 0.00 101 P 0.00 4.43 0.00 2.12 2.10 0.00 3.25 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.07 4.69 0.00 2.68 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 0.00 103 A 7.26 4.76 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 0.00 104 Y 8.39 4.19 0.00 2.55 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 0.00 105 V 8.89 5.19 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 1.10 0.00 0.00 0.89 0.00 0.00 106 R 9.53 4.96 0.00 1.81 1.93 0.00 2.30 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.34 0.00 107 L 8.09 4.80 0.00 1.48 0.68 0.86 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.58 4.89 1.71 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 0.42 0.00 0.00 0.45 0.00 0.00 109 A 8.05 4.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 F 8.97 5.23 0.00 3.02 2.90 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 0.00 111 D 8.79 5.39 0.00 2.47 2.49 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 0.00 112 N 9.16 4.79 0.00 2.93 3.05 0.00 0.00 6.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 8.69 4.22 0.00 2.30 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.03 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 114 K 8.29 4.04 0.00 1.76 1.87 0.00 2.14 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.47 7.81 115 Q 7.96 3.49 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 116 V 7.71 4.50 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 0.57 0.00 0.00 0.92 0.00 0.00 117 Q 8.74 4.39 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.18 1.88 0.00 118 I 8.29 4.15 1.21 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.24 -0.37 0.00 0.00 119 M 6.70 4.58 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.72 0.00 120 G 8.20 4.79 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 0.00 0.00 0.00 121 F 7.05 4.92 0.00 3.19 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 0.00 122 L 8.93 4.59 0.00 1.65 1.64 0.83 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.70 4.47 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 0.68 0.00 0.00 0.92 0.00 0.00 124 Q 7.80 4.65 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 125 R 8.14 4.46 0.00 1.28 1.54 0.00 2.21 0.00 0.00 2.92 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.28 0.00 126 P 0.00 4.18 0.00 2.09 2.15 0.00 2.20 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.55 0.00 127 K 8.47 4.10 0.00 1.74 1.91 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.39 7.81 128 T 7.74 4.18 4.27 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 1.21 0.00 0.00 129 A 7.74 4.24 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.75 4.64 0.00 1.79 1.89 0.00 3.36 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.54 0.00 131 D 8.38 4.94 0.00 2.91 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 0.00 132 F 7.80 5.30 0.00 3.21 3.16 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 0.00 133 Q 8.37 4.42 0.00 1.88 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.04 0.00 0.00 0.00 0.00 0.00 2.31 2.04 0.00 134 P 0.00 4.48 0.00 2.20 2.18 0.00 3.54 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.87 0.00 135 A 8.94 3.97 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 0.00 136 N 8.07 4.58 0.00 2.83 2.95 0.00 0.00 5.91 7.13 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 0.00 137 K 7.91 4.39 0.00 1.72 1.72 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.30 7.81 138 R 7.62 3.56 0.00 1.66 0.66 0.00 3.10 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.20 0.00 139 S 7.48 5.05 0.00 4.06 3.92 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 0.00 140 V 8.53 3.98 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 0.61 0.00 0.00 0.96 0.00 0.00