NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3028 8.2993 121.7896 56.2717 33.4896 174.7560 2 E 4.5908 8.2446 122.9444 51.9226 32.9822 173.3948 3 S 4.6576 9.0587 116.4089 57.4978 66.7803 176.5425 4 R 3.9570 8.4622 120.8086 59.4726 29.8878 179.2167 5 A 4.1907 7.9345 120.0670 54.9960 18.3809 179.4689 6 K 3.9655 8.2696 118.2696 59.4492 32.2108 178.9383 7 K 4.1245 8.4874 121.7811 58.8572 32.0251 178.3951 8 F 4.0913 8.5038 120.9617 61.4656 39.3348 177.1343 9 Q 4.0272 8.2230 117.2565 59.0003 28.3367 178.7374 10 R 3.8824 8.0471 118.6874 59.6601 30.2203 178.2295 11 Q 3.9351 8.0605 116.6692 57.9622 29.1119 176.3008 12 H 4.6574 7.9561 114.0247 53.8720 31.6033 173.2500 13 M 4.6789 7.9236 118.5793 53.8002 33.4516 176.5195 14 D 4.7300 9.0531 122.9302 52.8363 40.8221 175.8487 15 S 4.4008 8.3560 117.0539 60.0833 63.6018 175.1545 16 D 4.8514 8.0485 117.2353 53.9636 40.9370 175.9183 17 S 4.8264 7.6216 114.9406 56.2511 65.2062 173.9540 18 S 4.1373 8.3646 116.9463 57.9151 62.7979 172.5837 19 P 3.9394 0.0000 0.0000 65.6143 31.1788 177.6240 20 S 4.3140 7.4597 114.0062 56.2905 60.7016 172.2084 21 S 3.9044 7.7610 119.7832 57.8460 63.4606 174.8531 22 S 4.4243 8.4856 119.4352 57.7108 63.5673 175.2697 23 S 4.2250 8.5483 115.1231 60.8887 62.8968 175.1110 24 L 4.3941 7.8280 119.3795 55.2696 42.4578 177.5067 25 Y 3.9924 8.1326 120.8541 61.1794 38.5476 177.5592 26 C 4.1962 8.4808 117.0794 59.9307 38.5527 175.6120 27 N 4.4130 8.3229 117.6233 56.6162 38.1028 177.2687 28 L 4.0258 7.7389 119.8853 58.0356 41.8201 179.4996 29 M 3.6588 7.9439 118.9431 58.4584 31.7016 178.7659 30 M 4.0468 8.0923 119.2438 58.0534 32.0162 178.6993 31 L 4.0335 7.3655 120.4629 57.7558 42.1649 179.1282 32 L 4.0686 7.8556 117.4491 57.0285 41.4833 178.6454 33 R 4.4257 7.6763 115.9434 55.2136 30.2482 175.9594 34 N 4.2790 7.7140 114.3299 54.9205 36.5383 174.6402 35 M 4.4596 8.1806 116.1677 55.5766 31.8112 177.2548 36 T 5.3663 7.6110 107.1900 60.2697 69.6324 172.7370 37 Q 4.7017 8.2184 121.3844 56.6454 29.6608 174.2612 38 G 4.0939 10.9719 114.0728 45.2465 0.0000 173.2380 39 R 3.6717 6.6180 113.0842 54.3848 31.8719 174.6665 40 C 4.7813 8.6738 117.1374 55.9878 40.0932 173.8829 41 K 4.0389 8.8005 127.4447 56.3079 32.4279 174.7682 42 P 4.5740 0.0000 0.0000 65.3046 32.3239 176.5172 43 V 5.0471 7.5624 116.4125 61.5733 34.9258 173.7962 44 N 4.7700 9.1019 123.5058 52.8059 42.9095 172.8936 45 T 4.8874 7.9734 121.0151 61.7086 71.4404 172.9824 46 F 4.8092 9.0094 124.9431 55.6798 42.1066 174.7646 47 V 4.5640 8.9377 122.6974 61.2954 33.3577 175.5746 48 H 5.3892 8.8745 129.3502 53.7040 25.9852 174.0979 49 E 4.8105 7.7161 119.3087 52.7548 34.6484 173.5762 50 P 4.4231 0.0000 0.0000 62.5563 33.1852 177.1379 51 L 4.0383 7.9892 124.0034 58.6603 42.0084 180.0562 52 V 3.8860 7.8813 118.2253 65.1129 30.9510 177.8964 53 D 4.3899 8.0220 118.1446 57.0351 41.0621 178.4696 54 V 3.8067 7.8026 118.3252 66.2023 31.6534 178.0107 55 Q 3.9712 8.5594 118.2271 59.1897 28.5138 178.6823 56 N 4.8001 8.4868 116.8139 55.6242 38.5014 177.4105 57 V 3.7618 7.7743 120.2194 65.9978 31.3255 176.9096 58 C 3.4992 7.6326 114.9811 58.2212 39.7943 174.2424 59 F 4.8454 7.4701 117.6902 57.1186 40.2032 175.9855 60 Q 4.6518 7.5969 121.5483 55.8618 28.0678 176.1514 61 E 4.2886 8.6645 126.8003 56.6050 30.6659 176.0598 62 K 4.2211 8.7783 129.2556 56.4837 32.8070 176.1732 63 V 4.5621 8.0864 119.9427 59.4508 36.0286 175.5382 64 T 3.9501 8.3074 119.1216 63.4289 69.0524 175.7933 65 C 4.5796 8.4992 123.2494 56.6043 41.0378 174.6842 66 K 3.6916 9.3359 123.3141 59.4820 31.7033 177.7847 67 N 4.5852 8.1412 112.5617 52.3693 37.6649 175.8055 68 G 3.9548 8.4316 107.5843 45.6879 0.0000 173.5399 69 Q 4.4543 8.2019 117.5000 54.8553 32.1203 175.9851 70 G 3.8553 8.8289 106.4324 45.2597 0.0000 172.0986 71 N 4.8200 8.4095 115.0844 51.7808 40.5711 175.0691 72 C 5.4674 8.2914 120.8136 55.3884 45.1794 172.6863 73 Y 5.1516 8.6458 117.5408 56.3561 41.9832 173.9201 74 K 5.0650 9.1604 125.2223 54.3114 34.4881 175.6520 75 S 4.5017 8.8611 123.0040 58.6024 63.0396 174.4090 76 N 4.5021 9.8604 121.3795 55.6893 38.5440 175.3263 77 S 4.8794 7.6377 110.2525 56.0615 66.1758 173.8363 78 S 4.2264 8.4013 115.7717 58.4504 62.7194 173.1067 79 M 4.8491 8.8930 126.8536 53.6201 35.3735 174.9861 80 H 5.0297 9.8410 119.4163 55.5456 29.8235 174.8219 81 I 5.2625 9.0786 116.6730 59.4791 41.9419 174.3005 82 T 5.0108 8.9547 118.2810 62.0710 72.3627 173.1026 83 D 5.1564 9.1825 126.7809 53.5207 43.0303 174.7825 84 C 5.6168 9.4119 120.3440 55.2847 44.4626 173.1872 85 R 5.1999 8.9158 122.1755 53.8749 33.4119 174.7064 86 L 3.8224 9.2921 127.3904 55.2861 42.2384 177.0232 87 T 3.9913 8.5928 117.0335 61.5678 69.5699 174.9295 88 N 4.2384 9.0164 122.5012 56.8996 39.0627 176.5330 89 G 3.7088 7.9336 105.3220 47.4836 0.0000 173.8478 90 S 4.5132 7.3432 114.0662 57.5994 64.3829 173.7368 91 R 4.6628 7.9200 117.2318 54.1504 32.4097 173.8304 92 Y 4.2524 8.7444 120.2808 58.0658 38.9314 174.6357 93 P 3.3211 0.0000 0.0000 62.6361 31.7379 175.7623 94 N 4.3364 7.9184 119.4083 53.4987 37.6937 173.0598 95 C 4.7829 8.5749 123.8304 55.1512 40.1541 173.1752 96 A 5.1555 7.9802 126.5845 50.3169 21.4185 174.9390 97 Y 5.1289 9.3470 117.5286 56.2989 42.2283 175.2767 98 R 4.5252 9.0099 122.0645 55.7308 32.0480 175.4343 99 T 4.9715 8.5446 120.0908 62.2419 70.4585 174.4491 100 S 4.6247 9.2554 121.3663 55.5514 64.4586 170.7578 101 P 4.9877 0.0000 0.0000 62.6208 32.2645 175.5097 102 K 4.5335 9.0373 120.5958 56.4346 36.8432 173.8589 103 E 5.0753 8.6478 119.6208 54.9514 31.3584 175.6681 104 R 4.8104 8.9125 122.9111 54.6110 35.5005 174.4519 105 H 4.6853 9.2280 119.5342 55.9570 29.9421 174.7113 106 I 4.6777 8.5953 116.1472 59.5520 40.3811 174.5268 107 I 4.8922 8.2430 124.7500 59.7231 40.0862 174.9927 108 V 4.7075 8.6481 119.7624 59.2628 35.8240 174.6229 109 A 4.9262 8.7747 125.7873 51.3806 20.2256 175.8231 110 C 5.0741 8.6799 119.2426 55.3002 41.3211 173.1214 111 E 4.5590 8.4494 120.1803 56.5057 33.3605 175.0092 112 G 3.9600 9.5354 110.1387 44.6774 0.0000 172.1838 113 S 4.7288 8.0749 112.1374 55.4112 63.6235 171.7986 114 P 4.4446 0.0000 0.0000 62.5955 31.8212 175.8512 115 Y 4.8029 8.4231 121.1222 56.6358 38.7740 174.5874 116 V 4.4396 8.1184 119.4877 58.3858 36.7363 173.4914 117 P 4.4101 0.0000 0.0000 62.9240 31.1465 176.8769 118 V 4.4437 8.5904 115.6595 61.1102 33.7946 175.2719 119 H 4.9377 7.7133 120.1211 55.0105 33.4175 171.8289 120 F 4.5103 8.9398 128.7198 57.8159 39.1872 174.2595 121 D 4.5075 8.2978 126.9757 56.1826 41.9490 175.7542 122 A 4.6237 6.6711 117.2798 51.4345 22.5033 174.7757 123 S 5.1859 8.6757 112.6847 57.0795 66.3812 173.9384 124 V 4.5230 8.6424 113.3950 60.0826 35.7215 176.0838 125 E 3.9823 8.9892 124.5347 58.8216 29.9625 177.3823 126 D 4.4217 7.9050 118.0000 53.2405 39.9554 175.8082 127 S 4.1057 8.5413 117.6788 58.0573 63.5342 173.8066 128 T 3.5498 8.5091 120.5372 63.2847 68.3664 172.0746 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 8.30 4.30 0.00 1.74 1.81 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.24 4.59 0.00 2.22 1.98 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 2.26 2.38 0.00 3 S 9.06 4.66 0.00 4.08 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 4 R 8.46 3.96 0.00 1.88 2.05 0.00 3.13 0.00 0.00 3.56 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 5 A 7.93 4.19 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 6 K 8.27 3.97 0.00 1.93 1.99 0.00 1.69 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.51 7.81 7 K 8.49 4.12 0.00 1.94 2.00 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.41 7.81 8 F 8.50 4.09 0.00 3.27 3.29 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 9 Q 8.22 4.03 0.00 2.39 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.55 2.75 0.00 10 R 8.05 3.88 0.00 1.78 2.08 0.00 3.36 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 1.61 1.67 0.00 11 Q 8.06 3.94 0.00 1.64 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.49 0.00 0.00 0.00 0.00 0.00 2.21 2.40 0.00 12 H 7.96 4.66 0.00 1.88 2.60 0.00 5.61 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 13 M 7.92 4.68 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.70 0.00 14 D 9.05 4.73 0.00 2.71 2.39 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 15 S 8.36 4.40 0.00 3.93 3.95 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 0.00 0.00 0.00 16 D 8.05 4.85 0.00 2.65 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 17 S 7.62 4.83 0.00 4.07 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 18 S 8.36 4.14 0.00 3.78 3.70 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 19 P 0.00 3.94 0.00 1.86 1.70 0.00 3.58 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 20 S 7.46 4.31 0.00 3.76 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 21 S 7.76 3.90 0.00 3.61 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 22 S 8.49 4.42 0.00 4.02 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 23 S 8.55 4.23 0.00 4.03 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 0.00 24 L 7.83 4.39 0.00 1.76 1.75 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.13 3.99 0.00 3.08 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 26 C 8.48 4.20 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 8.32 4.41 0.00 2.94 2.93 0.00 0.00 7.14 6.74 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 28 L 7.74 4.03 0.00 1.72 1.54 0.92 0.95 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 29 M 7.94 3.66 0.00 0.74 1.12 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.73 0.00 30 M 8.09 4.05 0.00 1.68 1.83 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.33 0.00 31 L 7.37 4.03 0.00 1.87 1.90 0.94 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 32 L 7.86 4.07 0.00 1.52 1.64 0.79 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.68 4.43 0.00 1.92 2.07 0.00 3.60 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.96 0.00 34 N 7.71 4.28 0.00 2.91 2.93 0.00 0.00 6.85 7.65 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 35 M 8.18 4.46 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.38 0.00 36 T 7.61 5.37 4.44 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 1.45 0.00 0.00 37 Q 8.22 4.70 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.70 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 38 G 10.97 4.09 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 0.00 39 R 6.62 3.67 0.00 1.79 1.65 0.00 2.87 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 40 C 8.67 4.78 0.00 3.04 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 41 K 8.80 4.04 0.00 1.81 1.78 0.00 1.73 0.00 0.00 1.59 0.00 0.00 3.13 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.42 7.81 42 P 0.00 4.57 0.00 2.15 2.11 0.00 3.64 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 43 V 7.56 5.05 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 0.78 0.00 0.00 0.98 0.00 0.00 44 N 9.10 4.77 0.00 2.64 2.27 0.00 0.00 6.96 6.84 0.00 0.00 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 7.97 4.89 3.05 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 0.86 0.00 0.00 46 F 9.01 4.81 0.00 2.96 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 8.94 4.56 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 1.18 0.00 0.00 1.05 0.00 0.00 48 H 8.87 5.39 0.00 3.01 3.25 0.00 5.83 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.72 4.81 0.00 2.01 1.84 0.00 0.00 0.00 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 2.34 0.00 50 P 0.00 4.42 0.00 2.30 2.01 0.00 3.82 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.18 0.00 51 L 7.99 4.04 0.00 1.95 1.74 1.03 0.91 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 52 V 7.88 3.89 2.12 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 0.87 0.00 0.00 0.97 0.00 0.00 53 D 8.02 4.39 0.00 2.87 2.82 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 54 V 7.80 3.81 2.33 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 1.27 0.00 0.00 1.07 0.00 0.00 55 Q 8.56 3.97 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 56 N 8.49 4.80 0.00 3.02 2.98 0.00 0.00 6.61 7.28 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 57 V 7.77 3.76 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 1.09 0.00 0.00 1.11 0.00 0.00 58 C 7.63 3.50 0.00 2.06 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 0.00 0.00 0.00 59 F 7.47 4.85 0.00 3.11 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 60 Q 7.60 4.65 0.00 2.26 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 61 E 8.66 4.29 0.00 2.13 1.98 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 2.31 2.27 0.00 62 K 8.78 4.22 0.00 1.85 1.63 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.13 0.75 7.81 63 V 8.09 4.56 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 0.75 0.00 0.00 0.82 0.00 0.00 64 T 8.31 3.95 4.19 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 1.17 0.00 0.00 65 C 8.50 4.58 0.00 3.00 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 66 K 9.34 3.69 0.00 1.70 1.90 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.59 1.55 7.81 67 N 8.14 4.59 0.00 2.79 2.90 0.00 0.00 6.12 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 8.43 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.20 4.45 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 70 G 8.83 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 71 N 8.41 4.82 0.00 2.82 2.92 0.00 0.00 6.64 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 72 C 8.29 5.47 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 73 Y 8.65 5.15 0.00 2.78 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 74 K 9.16 5.07 0.00 1.74 1.65 0.00 1.60 0.00 0.00 1.85 0.00 0.00 2.70 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.36 7.81 75 S 8.86 4.50 0.00 3.94 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 76 N 9.86 4.50 0.00 2.73 2.97 0.00 0.00 6.82 7.55 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 77 S 7.64 4.88 0.00 3.83 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.40 4.23 0.00 3.79 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 0.00 79 M 8.89 4.85 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 80 H 9.84 5.03 0.00 3.40 3.23 0.00 5.76 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.08 5.26 1.97 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.83 1.08 0.00 0.00 82 T 8.95 5.01 4.39 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 1.24 0.00 0.00 83 D 9.18 5.16 0.00 2.62 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 84 C 9.41 5.62 0.00 2.87 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 85 R 8.92 5.20 0.00 1.81 1.84 0.00 3.18 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 86 L 9.29 3.82 0.00 1.59 1.51 0.39 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.59 3.99 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 1.17 0.00 0.00 88 N 9.02 4.24 0.00 2.67 2.89 0.00 0.00 7.01 7.98 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 89 G 7.93 3.71 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 0.00 0.00 0.00 90 S 7.34 4.51 0.00 4.13 3.78 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 91 R 7.92 4.66 0.00 1.86 2.01 0.00 2.81 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 92 Y 8.74 4.25 0.00 3.00 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 93 P 0.00 3.32 0.00 1.76 0.98 0.00 3.59 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 94 N 7.92 4.34 0.00 2.79 2.84 0.00 0.00 6.98 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 95 C 8.57 4.78 0.00 3.15 3.17 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 96 A 7.98 5.16 1.16 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 97 Y 9.35 5.13 0.00 2.82 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 98 R 9.01 4.53 0.00 1.83 1.89 0.00 3.12 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 99 T 8.54 4.97 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 1.29 0.00 0.00 100 S 9.26 4.62 0.00 3.86 3.73 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 0.00 101 P 0.00 4.99 0.00 2.06 2.03 0.00 3.84 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 1.95 2.04 0.00 102 K 9.04 4.53 0.00 1.82 1.93 0.00 1.30 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.45 7.81 103 E 8.65 5.08 0.00 1.88 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 2.28 2.22 0.00 104 R 8.91 4.81 0.00 1.74 1.82 0.00 3.38 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 105 H 9.23 4.69 0.00 3.23 3.24 0.00 5.60 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.60 4.68 1.88 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.99 1.18 0.00 0.00 107 I 8.24 4.89 1.78 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 1.16 0.75 0.79 0.00 0.00 108 V 8.65 4.71 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 0.69 0.00 0.00 0.82 0.00 0.00 109 A 8.77 4.93 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 0.00 110 C 8.68 5.07 0.00 1.91 1.79 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 0.00 111 E 8.45 4.56 0.00 1.94 1.59 0.00 0.00 0.00 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 2.25 0.00 112 G 9.54 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 0.00 113 S 8.07 4.73 0.00 3.83 3.78 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 0.00 114 P 0.00 4.44 0.00 2.30 2.10 0.00 3.84 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 115 Y 8.42 4.80 0.00 2.94 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 0.00 116 V 8.12 4.44 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 0.78 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.41 0.00 0.49 1.00 0.00 3.35 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 118 V 8.59 4.44 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 0.56 0.00 0.00 0.92 0.00 0.00 119 H 7.71 4.94 0.00 3.25 3.09 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.94 4.51 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 0.00 121 D 8.30 4.51 0.00 2.60 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 6.67 4.62 1.15 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 0.00 0.00 123 S 8.68 5.19 0.00 4.02 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 0.00 124 V 8.64 4.52 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 0.64 0.00 0.00 0.97 0.00 0.00 125 E 8.99 3.98 0.00 1.95 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 2.32 0.00 126 D 7.90 4.42 0.00 2.80 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 0.00 127 S 8.54 4.11 0.00 3.88 3.79 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 0.00 128 T 8.51 3.55 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 1.19 0.00 0.00