NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2953 8.1227 123.5846 51.6521 19.9342 175.9124 3 V 3.8803 8.4209 123.6012 62.6661 32.4685 171.7339 4 E 4.4250 10.2007 127.2705 56.9555 33.3766 175.1173 5 Y 5.3156 7.9874 115.2744 55.9207 42.2545 174.5697 6 L 5.1516 8.7547 124.6059 53.5380 44.3074 175.0518 7 V 4.7104 9.1788 127.9342 61.6558 32.9060 175.4530 8 D 4.3050 8.3025 127.7908 52.0070 41.7738 177.1314 9 A 3.9018 8.1333 119.3230 55.3945 18.1795 179.8524 10 S 3.9993 7.8838 112.1396 61.3794 63.0687 176.4930 11 A 3.8820 8.8936 124.6900 54.7840 18.0457 179.1503 12 L 3.6878 7.9763 119.2089 58.5005 41.5240 178.5459 13 Y 3.9476 8.2344 119.1170 60.6915 38.7927 178.0664 14 A 4.0743 7.9688 121.3803 55.1728 18.5817 179.5452 15 L 4.2238 8.4537 117.2061 57.1882 41.3956 179.0684 16 A 4.4172 7.6175 119.8328 54.0167 18.3151 178.3219 17 A 4.4239 7.8917 117.8937 52.5676 20.3727 177.2060 18 H 5.0411 8.1261 115.7408 54.9369 29.7017 175.8673 19 Y 3.7052 8.4419 122.5353 61.0036 39.0009 177.5057 20 D 4.0863 8.3048 117.3386 57.3870 40.9179 178.4865 21 K 4.0129 7.3976 115.4067 58.3336 32.3060 177.6246 22 W 4.8615 7.2816 113.3708 55.4023 29.8360 177.3076 23 I 3.2477 6.5407 113.8035 63.8677 36.3023 177.6966 24 K 3.7994 7.7105 120.1162 58.9664 32.2350 177.2797 25 H 4.9244 7.8126 114.4538 55.5500 29.0147 176.6850 26 R 4.1806 7.7585 121.2775 59.2651 28.6408 178.0596 27 E 4.1703 8.1537 115.4843 57.9063 30.2258 177.3642 28 K 4.5946 8.5271 118.4416 56.0383 33.0247 175.5940 29 L 5.3832 7.6187 119.4839 53.0505 43.8805 175.5192 30 A 5.3985 9.1955 124.0212 50.4784 23.4392 174.8161 31 I 4.8878 8.7102 112.0234 59.6024 41.7790 173.6668 32 L 4.9933 8.3321 120.7688 53.0677 44.7006 178.0774 33 H 4.2259 8.8077 116.6119 58.8636 29.2722 178.0258 34 L 4.2016 8.2314 120.7617 58.6580 41.8868 178.7183 35 T 4.0278 7.7672 115.6341 66.9006 68.2361 176.4840 36 I 3.5511 7.4884 121.5927 64.6899 37.1621 178.1415 37 Y 4.0252 7.6035 116.9669 61.0029 37.8344 178.1933 38 E 3.9894 8.4349 119.4836 59.2042 29.5247 179.2927 39 A 4.1345 8.1677 121.0722 55.0569 18.5064 179.8244 40 G 3.6550 8.3089 104.5001 48.1633 0.0000 175.4390 41 N 4.5276 8.9002 119.7172 56.2335 39.0752 176.8890 42 A 3.9293 7.9262 122.0012 54.9787 18.4073 179.3983 43 L 4.3125 8.1590 120.3266 57.3609 42.1012 178.8825 44 W 4.1412 8.4907 128.5681 60.4093 30.4623 178.1449 45 K 3.2650 8.1008 118.4137 59.0625 31.2883 179.2184 46 E 3.9280 7.6931 117.8833 59.0216 29.5464 178.9903 47 A 3.9307 7.8708 120.8867 55.3097 18.1769 179.9657 48 R 3.6903 7.5124 115.3827 58.4077 29.9661 178.2423 49 L 4.5014 6.8062 116.7301 54.3487 41.9898 177.1589 50 G 4.0288 7.6928 106.0971 45.0344 0.0000 174.4527 51 R 4.0126 8.1206 121.4547 56.1984 30.3364 176.5092 52 V 3.8880 8.6196 126.1882 65.8040 32.0388 176.4692 53 D 4.7071 7.8787 119.3317 53.5679 40.7494 178.6267 54 W 4.3865 8.0961 120.4462 60.5599 28.1061 176.8101 55 A 3.7303 6.6117 120.8507 54.7780 17.8394 179.3338 56 A 3.8598 7.6384 118.3911 55.3501 18.6390 179.5950 57 A 4.0615 8.5510 119.7030 55.0632 18.2365 180.0116 58 S 4.2199 8.3751 113.5311 61.6793 63.1607 176.9686 59 R 3.9141 7.7243 121.6996 59.0861 29.7848 178.4640 60 H 4.0982 8.1850 118.0277 59.1664 29.8694 177.0207 61 L 3.8822 7.8768 122.1443 57.8867 41.9055 178.7203 62 K 3.8645 8.3083 119.7921 59.4225 31.9320 178.5029 63 K 3.9139 7.9389 118.3692 59.5217 32.4611 178.3064 64 V 4.1366 8.1574 118.7661 66.4872 31.5663 177.8763 65 L 4.0808 8.5115 119.1177 57.9082 41.2574 179.6892 66 S 4.3688 8.1969 112.9209 61.1022 62.9506 176.1913 67 S 4.3914 8.3334 117.6727 59.5751 63.0144 173.9176 68 F 4.8131 7.7575 119.9918 55.9646 40.7625 175.7439 69 K 4.3980 8.5623 121.2720 56.0779 33.4344 175.9982 70 V 4.7022 8.3478 124.3699 61.5163 32.8036 175.3011 71 L 4.6209 8.4149 127.7541 53.3380 43.1835 176.6420 72 E 4.2010 8.6350 120.1297 56.2924 30.0893 177.1253 73 D 4.5125 8.4898 121.8588 53.8929 41.4794 174.9095 74 P 4.6203 0.0000 0.0000 61.3425 32.6277 174.7315 75 P 4.4424 0.0000 0.0000 62.0106 32.2651 177.1773 76 L 4.2096 8.7988 124.8893 59.0407 41.9254 177.5357 77 D 4.2439 8.3108 116.6099 58.0375 40.8629 178.0344 78 E 3.8249 7.7192 117.3859 59.3325 29.6230 179.4203 79 V 3.1686 6.9823 117.5913 65.9170 31.3654 177.6199 80 L 4.0055 7.8322 119.8444 58.2036 41.7661 178.9330 81 R 3.8262 7.5143 117.1588 59.4995 29.9999 178.5789 82 V 3.5623 7.6793 117.7575 66.0564 31.5325 177.8629 83 A 3.9568 8.1086 120.6636 55.0297 17.9728 179.8666 84 V 3.5526 7.8274 116.1537 66.0956 31.7038 177.9551 85 E 4.1468 8.2823 117.5257 59.1761 29.4777 178.1037 86 R 4.3193 8.0365 114.8474 55.2838 30.3564 176.4216 87 G 3.9012 7.9252 105.3741 46.8833 0.0000 173.4648 88 L 4.6993 7.6263 118.1691 52.6683 44.7152 176.9907 89 T 4.4454 7.9630 109.8702 60.8275 71.4763 175.2789 90 F 3.9021 8.6218 123.6699 61.7044 38.9726 177.0471 91 Y 4.4401 7.7245 115.6616 61.4299 37.8693 178.0799 92 D 4.6513 8.7085 119.7814 57.5292 40.9715 178.8228 93 A 4.0811 8.6382 121.4245 55.0465 18.2528 179.8788 94 S 3.8931 7.7154 113.6456 61.9016 62.8592 176.4669 95 Y 4.0223 7.5356 119.1414 60.9282 37.6258 178.3981 96 A 4.0419 8.0009 121.2844 55.3227 18.4593 179.0308 97 Y 3.8828 8.4190 118.4845 60.7364 38.8386 178.5238 98 V 3.3714 7.9559 118.8290 65.8249 31.4656 177.5089 99 A 3.9797 7.9608 120.5125 55.4618 18.1226 179.4517 100 E 4.2320 8.0297 116.8524 59.6193 29.4534 179.8052 101 S 4.0049 7.6574 112.9280 60.6049 62.7770 175.5827 102 S 4.6163 7.7791 116.4821 56.7589 63.7704 173.8551 103 G 3.8776 8.1707 109.8743 47.1162 0.0000 172.9546 104 L 4.7847 8.7227 117.4991 52.5649 45.8742 177.4675 105 V 4.1992 8.0297 120.2897 61.1145 33.0221 174.7142 106 L 4.6181 8.5956 131.3230 55.2626 43.3949 175.3779 107 V 4.7754 9.0815 127.4011 61.6850 33.3145 174.3506 108 T 4.9332 8.7500 121.5267 61.1028 71.0291 173.6579 109 Q 4.3071 8.5318 126.2394 55.9849 29.6433 175.4192 110 D 4.5770 8.2557 118.2714 54.0911 41.9726 176.5286 111 R 3.8933 8.6409 127.0592 59.5499 29.9268 178.5488 112 E 3.9641 8.3577 118.1640 59.2307 29.7969 178.5478 113 L 4.1935 8.0783 118.6049 57.3327 41.6012 179.0664 114 L 3.9655 7.9768 118.3762 57.9452 41.7415 179.2881 115 A 4.2090 7.9340 118.6087 53.8076 18.3673 178.7267 116 K 4.6541 7.3892 114.9679 55.2633 32.8889 176.0256 117 T 4.4914 7.2732 116.6027 61.1454 71.0244 173.4504 118 K 4.0225 8.1786 126.2710 58.2785 32.2511 177.7635 119 G 3.9098 9.0004 111.8785 44.9414 0.0000 173.1130 120 A 4.5341 7.8243 122.1598 52.0497 19.0968 177.1103 121 I 4.8005 8.8596 114.5986 59.1450 41.9702 174.4845 122 D 5.5247 8.2879 122.5354 51.5871 41.8638 177.4089 123 V 3.4744 8.7861 117.3968 66.2283 31.3175 177.0109 124 E 3.8795 8.2536 118.3300 59.9263 29.4037 178.7655 125 T 3.8229 8.2543 115.2186 66.6795 68.5798 176.0702 126 L 3.7736 7.8915 122.0486 58.2016 41.9683 179.1307 127 L 3.9521 8.1379 118.9177 57.9813 41.3901 179.7466 128 V 3.6519 7.5281 110.9766 64.6047 31.7120 178.6852 129 R 4.0360 7.8504 117.1762 59.3414 30.2030 178.9729 130 L 3.8495 7.7804 117.9512 57.7133 41.3191 179.7734 131 A 4.0739 7.8225 119.9872 55.0744 18.4244 179.1180 132 A 4.0649 7.6900 118.1527 54.9676 18.4921 177.5732 133 Q 4.1566 7.4393 118.8259 56.1999 28.9494 175.5881 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 A 8.12 4.30 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.42 3.88 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 0.91 0.00 0.00 0.97 0.00 0.00 4 E 10.20 4.43 0.00 1.67 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 2.08 2.36 0.00 5 Y 7.99 5.32 0.00 2.92 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 6 L 8.75 5.15 0.00 1.84 1.61 1.08 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 7 V 9.18 4.71 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 0.68 0.00 0.00 1.02 0.00 0.00 8 D 8.30 4.31 0.00 1.58 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 0.00 0.00 0.00 9 A 8.13 3.90 1.28 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 0.00 0.00 10 S 7.88 4.00 0.00 4.01 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 11 A 8.89 3.88 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 12 L 7.98 3.69 0.00 1.57 1.82 0.87 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 8.23 3.95 0.00 3.28 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 14 A 7.97 4.07 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 15 L 8.45 4.22 0.00 1.68 1.45 0.62 0.74 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 16 A 7.62 4.42 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 17 A 7.89 4.42 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 18 H 8.13 5.04 0.00 3.49 3.41 0.00 5.65 0.00 0.00 0.00 0.00 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 8.44 3.71 0.00 2.97 2.89 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 20 D 8.30 4.09 0.00 2.65 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 21 K 7.40 4.01 0.00 2.05 1.96 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.45 7.81 22 W 7.28 4.86 0.00 3.51 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 23 I 6.54 3.25 1.40 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 -0.36 0.06 0.00 0.00 24 K 7.71 3.80 0.00 1.56 1.57 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.15 1.39 7.81 25 H 7.81 4.92 0.00 3.28 3.32 0.00 5.70 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 7.76 4.18 0.00 2.14 2.39 0.00 2.77 0.00 0.00 3.34 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 27 E 8.15 4.17 0.00 2.12 2.13 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 0.00 2.30 2.29 0.00 28 K 8.53 4.59 0.00 2.10 2.09 0.00 1.82 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.65 1.43 7.81 29 L 7.62 5.38 0.00 1.40 1.70 0.95 0.78 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 30 A 9.20 5.40 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 31 I 8.71 4.89 1.82 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.92 0.57 0.00 0.00 32 L 8.33 4.99 0.00 1.55 1.54 0.17 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 33 H 8.81 4.23 0.00 3.30 3.52 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.23 4.20 0.00 1.75 1.73 1.21 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 35 T 7.77 4.03 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 1.12 0.00 0.00 36 I 7.49 3.55 1.38 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 1.41 0.52 0.54 0.00 0.00 37 Y 7.60 4.03 0.00 3.06 2.98 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 38 E 8.43 3.99 0.00 2.05 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 0.00 2.18 2.24 0.00 39 A 8.17 4.13 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 40 G 8.31 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 41 N 8.90 4.53 0.00 2.86 2.87 0.00 0.00 7.14 8.38 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 42 A 7.93 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.16 4.31 0.00 2.14 1.85 1.09 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 44 W 8.49 4.14 0.00 3.45 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 45 K 8.10 3.27 0.00 1.95 1.65 0.00 1.68 0.00 0.00 1.59 0.00 0.00 3.03 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.23 1.79 7.81 46 E 7.69 3.93 0.00 2.32 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 0.00 2.35 2.51 0.00 47 A 7.87 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.51 3.69 0.00 1.27 1.56 0.00 3.09 0.00 0.00 3.04 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.85 0.00 49 L 6.81 4.50 0.00 1.46 1.61 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 50 G 7.69 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 0.00 0.00 0.00 51 R 8.12 4.01 0.00 1.83 2.04 0.00 3.43 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.71 0.00 52 V 8.62 3.89 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 0.87 0.00 0.00 1.03 0.00 0.00 53 D 7.88 4.71 0.00 2.89 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 54 W 8.10 4.39 0.00 3.68 3.43 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 55 A 6.61 3.73 0.62 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 0.00 0.00 56 A 7.64 3.86 1.24 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 0.00 0.00 57 A 8.55 4.06 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 58 S 8.38 4.22 0.00 4.20 4.51 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 59 R 7.72 3.91 0.00 1.96 2.01 0.00 3.10 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 60 H 8.19 4.10 0.00 3.21 3.43 0.00 5.79 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 61 L 7.88 3.88 0.00 2.01 1.75 1.07 0.63 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 62 K 8.31 3.86 0.00 1.97 2.02 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.47 7.81 63 K 7.94 3.91 0.00 1.84 1.96 0.00 1.79 0.00 0.00 1.48 0.00 0.00 2.34 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.44 7.81 64 V 8.16 4.14 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 1.39 0.00 0.00 0.91 0.00 0.00 65 L 8.51 4.08 0.00 1.89 1.73 0.90 0.51 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 66 S 8.20 4.37 0.00 4.12 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 67 S 8.33 4.39 0.00 4.30 4.11 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 68 F 7.76 4.81 0.00 2.92 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 69 K 8.56 4.40 0.00 1.75 1.78 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.43 7.81 70 V 8.35 4.70 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 0.49 0.00 0.00 0.94 0.00 0.00 71 L 8.41 4.62 0.00 1.59 1.59 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.63 4.20 0.00 2.00 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 2.36 2.38 0.00 73 D 8.49 4.51 0.00 2.71 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 74 P 0.00 4.62 0.00 2.00 2.16 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.16 0.00 75 P 0.00 4.44 0.00 2.05 1.95 0.00 3.51 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.16 0.00 76 L 8.80 4.21 0.00 1.76 1.71 0.73 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.31 4.24 0.00 2.74 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.72 3.82 0.00 1.16 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 2.22 2.15 0.00 79 V 6.98 3.17 1.60 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 -0.18 0.00 0.00 0.64 0.00 0.00 80 L 7.83 4.01 0.00 2.10 1.69 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.51 3.83 0.00 1.95 1.99 0.00 3.16 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.63 0.00 82 V 7.68 3.56 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 1.07 0.00 0.00 1.08 0.00 0.00 83 A 8.11 3.96 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 84 V 7.83 3.55 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 0.87 0.00 0.00 0.99 0.00 0.00 85 E 8.28 4.15 0.00 2.04 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 2.35 2.41 0.00 86 R 8.04 4.32 0.00 1.85 1.96 0.00 3.33 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 87 G 7.93 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 88 L 7.63 4.70 0.00 1.67 1.63 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.96 4.45 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 1.28 0.00 0.00 90 F 8.62 3.90 0.00 3.02 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 91 Y 7.72 4.44 0.00 3.19 3.22 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 92 D 8.71 4.65 0.00 2.79 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 93 A 8.64 4.08 1.28 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 0.00 0.00 94 S 7.72 3.89 0.00 3.71 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 95 Y 7.54 4.02 0.00 3.25 3.02 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 96 A 8.00 4.04 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 97 Y 8.42 3.88 0.00 3.06 3.10 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 98 V 7.96 3.37 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 0.95 0.00 0.00 1.01 0.00 0.00 99 A 7.96 3.98 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 0.00 100 E 8.03 4.23 0.00 2.02 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 2.29 2.36 0.00 101 S 7.66 4.00 0.00 3.59 3.07 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 0.00 102 S 7.78 4.62 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 0.00 103 G 8.17 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 0.00 0.00 0.00 104 L 8.72 4.78 0.00 1.33 1.65 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.03 4.20 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 1.20 0.00 0.00 0.84 0.00 0.00 106 L 8.60 4.62 0.00 1.82 1.57 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 107 V 9.08 4.78 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 0.79 0.00 0.00 0.95 0.00 0.00 108 T 8.75 4.93 4.17 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 1.19 0.00 0.00 109 Q 8.53 4.31 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.63 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 110 D 8.26 4.58 0.00 2.68 2.50 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 0.00 111 R 8.64 3.89 0.00 1.93 1.98 0.00 3.33 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 112 E 8.36 3.96 0.00 1.94 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 2.34 2.41 0.00 113 L 8.08 4.19 0.00 1.87 1.69 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.98 3.97 0.00 1.81 1.74 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.93 4.21 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 0.00 116 K 7.39 4.65 0.00 1.80 1.83 0.00 1.66 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.52 7.81 117 T 7.27 4.49 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 1.23 0.00 0.00 118 K 8.18 4.02 0.00 1.86 1.78 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.63 7.81 119 G 9.00 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 0.00 120 A 7.82 4.53 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 0.00 121 I 8.86 4.80 1.89 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 1.36 0.92 1.00 0.00 0.00 122 D 8.29 5.52 0.00 3.03 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 0.00 123 V 8.79 3.47 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 1.09 0.00 0.00 0.94 0.00 0.00 124 E 8.25 3.88 0.00 2.07 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 0.00 2.38 2.43 0.00 125 T 8.25 3.82 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 1.22 0.00 0.00 126 L 7.89 3.77 0.00 1.56 1.75 0.08 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 127 L 8.14 3.95 0.00 1.84 1.68 0.84 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.53 3.65 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 0.76 0.00 0.00 0.95 0.00 0.00 129 R 7.85 4.04 0.00 2.00 2.00 0.00 3.25 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 130 L 7.78 3.85 0.00 1.64 1.56 0.94 0.98 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 0.00 131 A 7.82 4.07 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 0.00 132 A 7.69 4.06 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 0.00 133 Q 7.44 4.16 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.49 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00