NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2571 8.3144 119.9990 55.9397 33.9531 174.9012 2 E 3.7037 8.5362 119.9555 55.4152 29.8843 175.4127 3 T 4.2969 8.6982 118.2714 61.0422 72.3951 175.1986 4 A 4.0015 8.4590 122.7379 55.1641 18.4943 179.8718 5 A 3.9987 7.9776 118.8249 55.2195 18.6177 179.5893 6 A 4.0273 8.1284 119.4611 55.0311 18.3945 179.7924 7 K 4.1362 8.4175 119.9516 59.0587 32.2229 178.8027 8 F 4.0591 8.4440 120.9472 61.3607 39.3161 176.8416 9 E 4.0158 8.3435 117.9518 59.5781 29.0543 179.4532 10 R 3.9173 7.9284 117.5945 59.4034 30.2467 178.1324 11 Q 4.0248 8.2028 117.1369 57.8152 29.1175 176.1431 12 H 4.5935 7.9927 113.6698 53.7761 31.3347 173.0975 13 M 4.9440 7.9748 118.4232 53.7185 34.2311 176.1897 14 D 4.7693 9.2518 122.3969 52.9601 41.6643 175.7106 15 S 4.5129 8.5657 117.3888 59.6594 63.5443 175.3684 16 S 4.4838 7.9025 114.5322 59.1595 63.4323 174.1311 17 T 4.7113 7.4555 110.0075 60.0418 71.5503 173.6220 18 S 4.2626 8.4616 116.3077 59.9154 62.9970 173.4474 19 A 3.8027 6.9357 119.4524 50.8521 21.3340 175.3704 20 A 3.3728 8.0370 123.1703 52.1193 18.7656 178.0834 21 S 4.5322 8.4073 115.8431 58.8022 64.5052 173.8134 22 S 4.6099 7.5076 114.5079 57.0398 65.1516 175.4739 23 S 4.2161 8.6685 115.5223 61.3464 62.7779 175.1187 24 N 4.6055 8.0411 117.4030 54.3063 38.9917 176.2189 25 Y 3.9450 8.2130 120.4463 61.0352 38.7088 177.4715 26 C 4.2148 8.4279 117.1252 60.0360 37.4602 175.6550 27 N 4.4077 8.2815 117.5265 56.7345 38.0892 177.3378 28 Q 3.9131 7.9360 119.0525 59.2197 28.8275 178.6890 29 M 3.7648 7.5865 121.0788 57.6845 31.8733 178.6918 30 M 4.0581 8.1004 119.2852 58.1013 32.0130 178.8278 31 K 3.9362 7.7067 119.7289 59.6182 31.9927 179.2188 32 S 4.1254 8.2294 114.6445 60.9804 62.5919 175.5036 33 R 4.3693 7.7635 119.1869 55.3303 29.0447 176.0236 34 N 4.3099 8.1043 115.7374 54.4824 35.0557 175.6235 35 L 4.0446 8.0242 117.7501 55.7553 42.0707 178.1152 36 T 5.6289 7.0516 108.3495 60.5343 69.0539 175.7210 37 K 4.1387 8.3751 123.6026 60.2597 32.3247 177.4953 38 D 4.6494 7.8306 116.1472 55.2983 41.9339 176.2999 39 R 3.8907 7.2206 113.0859 55.4465 31.3124 174.3701 40 C 4.7906 8.7989 116.7021 55.8461 39.8359 174.1719 41 K 4.2100 8.0306 125.2081 56.1101 32.2473 175.9124 42 P 4.7222 0.0000 0.0000 65.2163 32.3688 176.4697 43 V 5.0726 7.5052 116.2564 61.6774 35.0432 173.9319 44 N 4.6301 8.5568 121.3296 52.9699 42.5886 173.1507 45 T 4.8236 7.7317 120.2688 61.6508 72.2985 172.7025 46 F 4.8029 8.9514 124.2635 55.7437 41.9652 174.7700 47 V 4.4541 8.9912 122.6559 61.1125 33.6853 175.5658 48 H 5.4222 8.7313 128.4619 53.8168 26.2248 173.3032 49 E 4.8053 7.6872 118.2782 53.3910 34.7012 176.3395 50 S 4.4034 8.3514 114.8895 58.0358 65.2188 174.8735 51 L 3.9819 8.5471 125.1043 58.4548 41.9347 179.0132 52 A 4.0304 8.1266 120.1239 55.6758 18.0026 179.2597 53 D 4.3696 7.8463 115.5590 57.2106 41.1402 178.8009 54 V 3.8363 7.7084 118.6337 65.8654 31.7258 178.1071 55 Q 3.9123 8.7389 117.9515 58.7690 28.4892 178.4960 56 A 4.0801 8.0909 121.3037 54.3187 18.2834 179.5225 57 V 3.4880 7.6279 116.9121 65.5546 31.3260 176.7429 58 C 3.8378 7.6700 114.6625 57.9367 39.8409 173.8969 59 S 4.6428 7.5629 114.7462 57.8811 63.9804 174.7348 60 Q 4.3451 7.4529 121.3848 56.2436 30.5831 177.2862 61 K 4.1863 7.9402 130.7101 57.0313 32.9881 175.9614 62 N 4.4659 8.7721 127.4499 53.6086 39.6498 174.3340 63 V 4.5743 8.4780 117.9961 59.4392 36.8453 174.5070 64 A 4.3268 8.3662 124.9876 52.0011 19.1275 178.5915 65 C 4.6825 9.1094 119.5908 56.1573 40.9798 175.3818 66 K 3.7019 9.3835 121.6031 59.6932 32.1136 177.6759 67 N 4.5877 8.0494 114.7485 52.7050 37.5906 175.3901 68 G 4.0166 8.2521 108.6706 45.7383 0.0000 174.6649 69 Q 4.1186 8.3589 119.0023 56.6613 29.1607 176.8337 70 T 4.5982 8.3621 109.6555 61.5870 69.2559 174.1245 71 N 5.0296 7.8751 118.5627 53.6869 38.4224 174.7369 72 C 5.3446 7.4563 115.6592 57.0645 43.0160 172.8330 73 Y 5.1169 8.9697 118.6594 56.3574 42.0214 173.9032 74 Q 5.0566 9.5783 126.1045 54.1011 31.3499 174.9363 75 S 4.4154 8.6978 121.7495 58.5482 63.3226 174.3426 76 Y 4.4970 9.1132 120.8715 60.4931 37.9461 176.5511 77 S 4.8987 7.8577 114.1457 56.7312 65.2308 173.6927 78 T 4.2422 8.0534 112.5009 61.9001 69.9275 173.5130 79 M 5.0673 9.0163 121.5992 53.5014 36.8605 174.5287 80 S 5.1310 9.6424 116.8015 57.2299 63.6759 173.1311 81 I 5.2323 9.0088 120.1173 59.5446 41.8113 174.1455 82 T 5.0345 8.7822 118.7059 62.0161 71.8019 172.8292 83 D 5.0638 9.4924 126.9682 53.0919 43.3675 174.8867 84 C 5.4894 9.0780 120.4084 55.2688 39.0270 172.9308 85 R 5.2579 8.8239 124.4120 53.9440 32.9818 174.2762 86 E 4.0500 9.2194 127.9909 56.9038 30.3983 176.4631 87 T 4.3987 8.5692 117.2917 59.8905 71.1124 175.9443 88 G 3.6459 8.7431 110.4787 48.4687 0.0000 174.5666 89 S 4.4629 7.3703 112.4243 58.2329 63.2362 174.2371 90 S 4.0539 7.7063 117.0759 57.9250 62.5127 173.5535 91 K 4.3722 8.7307 128.7953 54.9360 34.5020 174.3706 92 Y 4.1965 8.8399 127.5422 58.0736 38.8263 174.1166 93 P 3.4105 0.0000 0.0000 62.5597 32.3749 176.4952 94 N 4.6057 7.8356 119.7433 52.0554 36.9563 172.9088 95 C 4.5811 8.0348 117.4144 56.6439 40.8929 173.1687 96 A 4.9226 8.2862 125.1900 50.3698 21.6867 174.5782 97 Y 5.0859 8.5922 118.0911 56.0650 42.5892 174.4650 98 K 4.5583 9.3604 123.2878 55.5078 34.2220 175.2085 99 T 5.0149 8.5627 124.0463 62.7917 70.0086 174.2114 100 T 4.6292 9.0259 123.0555 61.7723 72.0490 172.6462 101 Q 4.9744 8.7398 127.2718 54.8296 30.8701 174.0642 102 A 4.6508 9.0098 126.3437 51.1681 24.0567 174.7454 103 N 5.3443 8.7414 115.6385 51.7972 41.3321 174.1185 104 K 4.7943 8.7840 122.4685 54.8046 37.7174 175.5998 105 H 4.8787 9.3370 119.0251 55.7566 30.0501 174.9817 106 I 4.8842 8.5256 114.6363 59.2686 40.8888 174.3144 107 I 4.8319 8.5997 124.5227 59.7080 40.0847 175.1729 108 V 4.7451 8.7625 119.3809 59.3660 36.2151 174.1989 109 A 5.1550 8.7147 124.1288 50.8011 20.9389 175.6243 110 C 5.1822 8.7266 118.6504 55.4106 44.9568 173.1544 111 E 4.7466 8.6099 119.1219 56.7641 34.4092 176.5553 112 G 4.0756 9.9811 108.5214 45.0951 0.0000 172.0581 113 N 4.9891 8.3529 119.5042 51.5008 40.3800 173.4320 114 P 4.3230 0.0000 0.0000 62.7835 31.9460 175.6455 115 Y 4.8609 8.3056 121.5229 57.1127 38.9977 174.5823 116 V 4.4289 8.3902 119.4743 58.4744 36.7585 173.3723 117 P 4.5403 0.0000 0.0000 62.8834 31.1784 177.1001 118 V 4.5019 8.6824 114.7669 60.9712 34.0275 175.1720 119 H 5.1168 7.9312 119.9204 54.6006 33.6556 171.5853 120 F 4.5150 8.7762 127.5415 57.3195 39.4830 174.6376 121 D 4.4642 8.4770 127.0981 55.9622 41.4737 175.7956 122 A 4.6911 6.6725 117.2018 51.4206 22.6229 174.2645 123 S 5.2078 8.8035 113.1806 56.8613 66.0976 174.7309 124 V 4.1580 9.1210 115.0274 61.8284 32.7767 174.8924 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 K 8.31 4.26 0.00 1.89 1.90 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.39 7.81 2 E 8.54 3.70 0.00 2.11 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 2.41 2.38 0.00 3 T 8.70 4.30 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 4 A 8.46 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 7.98 4.00 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 6 A 8.13 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.42 4.14 0.00 1.90 2.03 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.31 7.81 8 F 8.44 4.06 0.00 3.19 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 9 E 8.34 4.02 0.00 2.31 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 0.00 2.50 2.69 0.00 10 R 7.93 3.92 0.00 1.82 2.08 0.00 3.38 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 11 Q 8.20 4.02 0.00 1.70 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.23 2.45 0.00 12 H 7.99 4.59 0.00 1.98 2.69 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.97 4.94 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.64 0.00 14 D 9.25 4.77 0.00 2.69 2.45 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 15 S 8.57 4.51 0.00 3.93 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 16 S 7.90 4.48 0.00 3.93 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 17 T 7.46 4.71 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 1.32 0.00 0.00 18 S 8.46 4.26 0.00 3.82 3.87 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 19 A 6.94 3.80 1.09 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 0.00 0.00 20 A 8.04 3.37 0.76 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 21 S 8.41 4.53 0.00 3.99 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.51 4.61 0.00 4.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.67 4.22 0.00 4.03 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 24 N 8.04 4.61 0.00 2.75 3.06 0.00 0.00 6.46 7.45 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 25 Y 8.21 3.94 0.00 3.08 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 26 C 8.43 4.21 0.00 3.17 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 8.28 4.41 0.00 3.05 2.92 0.00 0.00 7.11 7.48 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 28 Q 7.94 3.91 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 29 M 7.59 3.76 0.00 0.80 1.17 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.51 0.00 30 M 8.10 4.06 0.00 1.76 1.95 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 2.49 0.00 31 K 7.71 3.94 0.00 1.81 1.86 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.42 7.81 32 S 8.23 4.13 0.00 4.00 4.02 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 0.00 0.00 0.00 33 R 7.76 4.37 0.00 1.95 2.15 0.00 3.60 0.00 0.00 3.20 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 34 N 8.10 4.31 0.00 2.92 2.92 0.00 0.00 6.98 6.26 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 35 L 8.02 4.04 0.00 1.79 1.64 0.85 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.05 5.63 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 1.42 0.00 0.00 37 K 8.38 4.14 0.00 1.95 1.92 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.81 7.81 38 D 7.83 4.65 0.00 2.68 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 39 R 7.22 3.89 0.00 1.84 1.78 0.00 3.12 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.60 0.00 40 C 8.80 4.79 0.00 3.09 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 41 K 8.03 4.21 0.00 1.87 1.80 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.43 7.81 42 P 0.00 4.72 0.00 2.12 2.13 0.00 3.59 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 43 V 7.51 5.07 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 0.80 0.00 0.00 0.98 0.00 0.00 44 N 8.56 4.63 0.00 2.64 2.25 0.00 0.00 7.15 7.23 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 45 T 7.73 4.82 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 0.82 0.00 0.00 46 F 8.95 4.80 0.00 2.99 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 47 V 8.99 4.45 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 1.08 0.00 0.00 1.06 0.00 0.00 48 H 8.73 5.42 0.00 3.15 3.40 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.69 4.81 0.00 1.95 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 0.00 2.26 2.28 0.00 50 S 8.35 4.40 0.00 4.07 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 51 L 8.55 3.98 0.00 1.83 1.75 1.04 1.03 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 52 A 8.13 4.03 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 7.85 4.37 0.00 2.86 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 54 V 7.71 3.84 2.31 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 1.21 0.00 0.00 1.09 0.00 0.00 55 Q 8.74 3.91 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 56 A 8.09 4.08 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 57 V 7.63 3.49 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 1.04 0.00 0.00 0.96 0.00 0.00 58 C 7.67 3.84 0.00 2.85 2.62 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 59 S 7.56 4.64 0.00 3.89 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 60 Q 7.45 4.35 0.00 1.75 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.98 0.00 0.00 0.00 0.00 0.00 1.83 2.12 0.00 61 K 7.94 4.19 0.00 1.84 1.77 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.45 7.81 62 N 8.77 4.47 0.00 2.79 2.64 0.00 0.00 7.01 7.71 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 63 V 8.48 4.57 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 0.65 0.00 0.00 0.83 0.00 0.00 64 A 8.37 4.33 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 65 C 9.11 4.68 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.38 3.70 0.00 1.81 2.09 0.00 1.63 0.00 0.00 1.78 0.00 0.00 3.24 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.39 7.81 67 N 8.05 4.59 0.00 2.84 2.95 0.00 0.00 6.32 7.00 0.00 0.00 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 G 8.25 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.36 4.12 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 70 T 8.36 4.60 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 1.17 0.00 0.00 71 N 7.88 5.03 0.00 3.08 3.14 0.00 0.00 6.07 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 72 C 7.46 5.34 0.00 3.11 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 Y 8.97 5.12 0.00 2.78 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 74 Q 9.58 5.06 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 75 S 8.70 4.42 0.00 3.94 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 76 Y 9.11 4.50 0.00 3.02 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 77 S 7.86 4.90 0.00 3.91 3.81 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 78 T 8.05 4.24 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 0.95 0.00 0.00 79 M 9.02 5.07 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 80 S 9.64 5.13 0.00 3.99 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.01 5.23 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.17 1.00 0.00 0.00 82 T 8.78 5.03 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 1.30 0.00 0.00 83 D 9.49 5.06 0.00 2.64 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 C 9.08 5.49 0.00 2.90 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 85 R 8.82 5.26 0.00 1.93 1.79 0.00 3.14 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 86 E 9.22 4.05 0.00 2.09 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 2.06 1.70 0.00 87 T 8.57 4.40 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 88 G 8.74 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.37 4.46 0.00 3.93 3.88 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 90 S 7.71 4.05 0.00 3.80 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 91 K 8.73 4.37 0.00 1.86 1.58 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.34 1.42 7.81 92 Y 8.84 4.20 0.00 2.98 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 93 P 0.00 3.41 0.00 1.74 0.93 0.00 3.63 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 94 N 7.84 4.61 0.00 2.79 2.76 0.00 0.00 6.99 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 95 C 8.03 4.58 0.00 3.16 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 96 A 8.29 4.92 1.12 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 97 Y 8.59 5.09 0.00 2.85 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 98 K 9.36 4.56 0.00 1.82 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.44 7.81 99 T 8.56 5.01 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 1.28 0.00 0.00 100 T 9.03 4.63 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 1.23 0.00 0.00 101 Q 8.74 4.97 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.18 2.36 0.00 102 A 9.01 4.65 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.74 5.34 0.00 2.61 2.73 0.00 0.00 6.54 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 0.00 104 K 8.78 4.79 0.00 1.73 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.44 7.81 105 H 9.34 4.88 0.00 3.14 3.24 0.00 5.57 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.53 4.88 1.82 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.66 1.12 0.00 0.00 107 I 8.60 4.83 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.75 0.83 0.00 0.00 108 V 8.76 4.75 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 0.61 0.00 0.00 0.85 0.00 0.00 109 A 8.71 5.16 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 0.00 110 C 8.73 5.18 0.00 1.77 1.78 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 0.00 111 E 8.61 4.75 0.00 1.87 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 2.28 2.25 0.00 112 G 9.98 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 0.00 113 N 8.35 4.99 0.00 2.65 2.70 0.00 0.00 6.85 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.32 0.00 2.23 2.05 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.31 4.86 0.00 2.83 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 0.00 116 V 8.39 4.43 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 0.79 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.54 0.00 0.49 1.13 0.00 3.35 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 118 V 8.68 4.50 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 0.64 0.00 0.00 0.91 0.00 0.00 119 H 7.93 5.12 0.00 3.27 3.09 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.78 4.51 0.00 2.65 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 0.00 121 D 8.48 4.46 0.00 2.58 2.56 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 0.00 122 A 6.67 4.69 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 0.00 123 S 8.80 5.21 0.00 3.96 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 9.12 4.16 2.10 0.00 0.00 0.00 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 0.94 0.00 0.00