NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3061 8.1233 123.5793 51.8121 19.6799 177.5574 3 R 3.9416 8.8183 122.1762 55.3647 30.2130 175.8140 4 R 5.1658 7.0590 125.7027 56.4053 31.4639 174.0492 5 R 4.5701 6.8792 118.9259 54.3667 32.0919 176.9237 6 R 3.5119 8.4793 125.0042 57.9438 31.3587 175.5762 7 A 3.6685 6.9168 119.1915 56.3538 15.6180 175.4228 8 E 3.6295 6.6742 120.7078 52.2081 33.4174 177.9532 9 V 3.9516 7.9774 121.0728 60.9020 30.3025 175.0106 10 R 3.9644 8.2400 121.0477 55.6281 29.5155 176.3329 11 Q 4.3799 8.5566 123.0102 54.7395 30.2473 174.4008 12 L 4.6423 8.1426 124.5744 53.9180 42.3965 176.0505 13 Q 4.0933 8.6748 120.9104 55.3350 28.9990 174.0713 14 P 4.2747 0.0000 0.0000 60.6980 33.0943 174.9676 15 D 4.4737 8.7306 118.4731 55.0816 41.5942 176.4239 16 L 5.0078 7.9144 124.4604 54.1870 41.9533 176.5606 17 V 4.4485 7.1858 119.7801 63.3576 35.0999 171.6944 18 Y 4.2521 8.6309 112.9090 59.0606 41.5341 174.6734 19 G 4.0218 7.9056 108.4622 46.6019 0.0000 173.6947 20 D 4.9101 7.5464 117.2598 51.5171 45.1556 176.1856 21 V 3.6908 8.6490 119.6009 64.5458 31.5871 178.6166 22 L 4.1729 8.3720 118.2418 58.7870 41.5174 178.6483 23 V 3.8125 9.6486 117.6306 66.2630 31.0456 178.0417 24 T 3.6809 7.7620 113.5420 66.7173 68.8781 175.4967 25 A 4.0090 8.3270 122.4900 55.3881 18.3690 179.0895 26 F 4.5260 8.6615 118.8625 62.0339 39.4416 177.3789 27 I 3.0745 7.7148 119.2721 64.1981 36.5148 178.0387 28 N 4.2208 7.9554 116.3882 56.3583 38.4862 177.0646 29 K 4.1202 7.9060 118.4128 59.6206 32.2317 178.9917 30 I 3.8342 7.7902 118.9569 64.7548 37.3379 175.7900 31 M 3.5114 7.0997 117.0106 52.2691 34.4777 175.5496 32 R 4.5629 8.7010 119.0658 57.2940 30.5163 174.2837 33 D 4.3784 9.8359 118.6793 55.1258 38.9963 173.9300 34 G 4.2433 8.5283 113.9677 47.3044 0.0000 176.8730 35 K 4.9128 6.8599 120.3490 55.7647 28.7180 175.9565 36 K 3.7774 8.3077 122.4353 57.9688 32.5970 177.5857 37 N 4.3742 8.7515 112.7443 55.0892 36.6444 176.6563 38 L 3.8304 8.1777 122.9890 58.0154 42.4018 177.2095 39 A 3.8369 8.1879 120.3006 55.3378 18.0979 179.1523 40 A 3.3006 8.4029 117.7743 55.3613 18.4471 179.1812 41 R 3.8219 8.1168 115.9547 60.2117 30.0053 178.8031 42 I 3.8406 8.3951 120.2554 63.9613 37.1877 178.0306 43 F 3.9643 7.8625 120.0512 62.5158 39.2951 176.5540 44 Y 4.5089 8.3837 116.5910 60.6619 37.5978 178.1777 45 D 4.4640 8.9521 119.2886 57.8080 41.1922 179.3878 46 A 4.1736 8.4659 121.1912 55.6705 18.4294 179.1950 47 C 3.7633 8.2912 115.1973 63.1088 28.1160 176.8816 48 K 3.9480 8.0055 119.6677 59.5203 31.6591 179.0823 49 I 3.7052 7.9994 120.3733 65.4337 37.0832 177.5274 50 I 3.5613 8.0051 118.4812 65.3046 36.5114 177.7159 51 Q 4.0189 8.4293 121.3487 60.1413 29.1059 178.1935 52 E 4.1205 8.5584 119.9459 57.5462 29.5905 177.3099 53 K 3.8456 8.1126 123.5060 59.1548 32.8802 177.0482 54 T 4.3559 7.8241 111.7675 60.3076 68.2551 173.6753 55 G 3.8950 8.6292 116.7825 48.6259 0.0000 171.7041 56 Q 3.7398 7.4282 118.7313 53.4546 30.3175 177.9962 57 E 4.2419 8.6711 120.3855 55.4202 31.5879 176.4001 58 P 4.1955 0.0000 0.0000 66.0244 31.1965 178.2391 59 L 3.8148 7.9539 119.5219 57.9971 41.9036 178.7302 60 K 3.9335 8.0153 118.7091 59.5030 32.1315 178.8017 61 V 3.5609 8.0022 118.5486 65.8825 31.4014 177.4714 62 F 4.0630 8.4762 120.6477 61.3704 39.1196 176.9166 63 K 3.8863 8.4109 117.8744 59.6688 31.9178 178.9497 64 Q 3.8827 8.3783 119.4383 59.1853 28.9235 177.9039 65 A 3.8428 8.0983 122.0408 55.4216 18.2355 179.3058 66 V 3.3319 7.6831 116.4155 66.4812 31.2845 177.6169 67 E 3.8742 8.2174 118.1529 59.5337 29.4111 178.6522 68 N 4.4090 7.9871 115.7487 56.4664 38.8183 177.4316 69 V 3.7627 7.8164 118.6486 64.2748 31.6938 176.3616 70 K 4.0866 7.8206 118.9463 55.7785 32.7118 175.7811 71 P 4.8600 0.0000 0.0000 63.0357 29.6414 174.2294 72 R 4.3146 7.4528 116.3529 56.0788 32.5027 173.5442 73 M 5.1397 7.3338 117.1251 53.0663 35.9053 173.5720 74 E 4.9531 8.7986 125.9495 55.7376 33.2740 173.3636 75 V 4.8073 7.9091 116.8579 61.9960 35.3015 175.7176 76 R 4.9203 8.7098 121.9452 55.4747 35.4932 174.0895 77 S 6.3000 8.9395 115.5305 56.5959 66.7110 172.9860 78 R 4.4831 8.7931 120.4955 54.7337 32.7060 175.0129 79 R 5.1949 8.2984 125.9892 54.0832 28.2504 175.0076 80 V 3.9669 7.7447 120.1916 63.4208 33.3828 176.3133 81 G 3.7710 7.2397 110.7714 44.3765 0.0000 172.2040 82 G 3.8971 8.2344 111.1006 45.7345 0.0000 170.0838 83 A 4.3904 6.6113 117.8715 51.0593 23.4940 175.9806 84 N 6.1367 8.7745 116.4787 50.9205 39.1011 173.5176 85 Y 4.7033 8.0958 121.2525 56.0840 40.9785 175.3220 86 Q 5.1044 8.4209 121.3895 55.0313 29.3597 175.4094 87 V 4.3917 8.3404 125.1981 60.1488 34.3027 173.0400 88 P 5.5543 0.0000 0.0000 61.7242 33.4555 174.0866 89 M 4.7011 7.8882 116.3540 54.0257 34.9391 173.7358 90 E 4.4104 8.7507 118.9538 56.1852 29.2451 176.2180 91 V 3.8709 9.3387 128.1969 63.5221 29.9706 174.3741 92 S 3.7770 7.4996 117.6786 53.4115 64.3210 171.7681 93 P 4.3610 0.0000 0.0000 66.1626 30.6028 180.2536 94 R 3.2744 7.0969 114.2496 56.8738 32.0740 178.0255 95 R 3.8265 8.2362 117.2968 60.0527 30.3424 179.4248 96 Q 3.6942 8.3291 119.1110 59.3425 29.6328 178.4943 97 Q 4.1178 9.0988 122.1337 57.1015 28.6554 178.7929 98 S 4.0042 7.8154 115.3027 61.3599 63.4645 176.3504 99 L 4.0594 8.3272 122.7701 57.1645 41.9449 178.3751 100 A 4.5321 8.2868 121.2096 55.7115 18.1918 178.2598 101 L 3.8237 8.5720 119.0363 58.3168 41.8338 178.7838 102 R 3.8330 9.2618 117.0108 60.7743 30.1878 179.3774 103 W 4.2700 9.1841 123.7556 58.7188 31.6513 177.8561 104 L 3.7758 8.9504 118.7782 58.1723 41.4740 179.6471 105 V 3.7078 8.1924 117.7517 66.6456 31.4022 178.0858 106 Q 4.0088 8.4993 117.3270 59.0679 28.6535 178.4303 107 A 3.9394 8.4425 121.6516 55.3302 18.0702 179.3506 108 A 4.2101 8.0317 119.8491 54.9305 18.5661 178.9337 109 N 4.3576 8.0182 113.5516 56.7800 38.7492 176.9346 110 Q 4.1688 8.2450 117.7721 59.2624 29.1800 177.2537 111 R 3.9244 7.1896 117.2511 52.5742 33.5480 176.3962 112 P 4.5210 0.0000 0.0000 62.6289 30.4912 180.1719 113 E 3.5126 9.4582 119.1291 57.5961 30.3411 175.5733 114 R 4.7229 8.3538 112.4755 55.3739 33.9338 175.2749 115 R 4.6282 7.7324 117.5535 53.3719 33.8766 175.4561 116 A 3.9713 8.7391 125.4445 55.5986 18.3478 179.6289 117 A 3.9374 8.0465 118.4324 55.1834 18.2921 179.6764 118 V 3.4336 7.6482 116.1979 66.5255 31.5255 177.7392 119 R 4.3569 7.8972 118.7290 58.5620 29.8733 178.7101 120 I 3.7339 8.1608 118.8940 65.5315 37.2732 177.2701 121 A 3.9282 8.8377 120.1601 55.6067 17.8781 180.0766 122 H 3.7775 8.8120 111.0344 58.1358 29.1577 176.8420 123 E 3.8970 9.1262 121.6388 58.9006 29.6095 178.9278 124 L 3.7665 8.2887 120.4647 58.9202 42.2836 178.7181 125 M 4.0949 8.5409 117.4608 57.7082 31.0182 177.8804 126 D 4.3168 8.6240 120.0133 56.9647 41.0163 179.1576 127 A 3.8959 8.3574 120.5462 54.6163 18.4748 179.0776 128 A 4.1394 8.1124 118.9882 56.0697 18.6885 178.7657 129 E 4.0999 8.3529 117.4171 55.2515 30.7747 175.1969 130 G 3.0891 7.5593 114.9934 43.0872 0.0000 171.0188 131 K 4.2499 6.9267 116.5320 58.1860 33.5769 175.4538 132 G 4.1218 7.8294 116.1865 44.6190 0.0000 171.4157 133 G 3.5522 8.0690 107.9735 48.5606 0.0000 175.5990 134 A 3.4633 9.5128 121.4207 53.9301 17.9202 179.3077 135 V 3.0849 8.3762 119.1964 64.7335 32.1930 176.6173 136 K 3.7311 7.8029 118.9212 59.5984 32.0036 178.5879 137 K 4.6626 7.8300 120.1889 59.4548 31.8217 178.1017 138 K 3.8544 7.3096 118.8775 59.3126 31.8439 178.2509 139 E 3.8933 8.6092 117.9917 60.0751 29.7412 179.1973 140 D 4.3497 8.3411 118.6230 57.4594 40.8367 178.7319 141 V 3.7086 8.4571 118.4083 65.9876 31.4247 177.8286 142 E 4.3627 9.0332 117.5241 57.8599 29.0590 178.6156 143 R 4.3088 6.1313 123.9900 59.6722 30.3674 177.3288 144 M 3.9050 8.2691 118.5160 58.4896 32.6109 175.8104 145 A 4.2935 7.9793 122.7408 53.5005 19.3411 175.4514 146 E 4.2508 9.2790 119.0636 56.3599 28.9292 176.9365 147 A 3.9344 7.6887 120.5672 55.5257 18.5109 178.7283 148 N 4.5873 7.8591 113.4448 53.1735 37.3877 176.3955 149 R 3.6890 7.8729 121.9040 58.8028 31.1936 178.3170 150 A 3.5758 7.5450 120.8631 55.4337 19.0453 178.9389 151 Y 4.3456 7.5810 113.2695 61.1559 37.7334 178.4250 152 A 3.8228 8.5767 122.7417 55.4210 18.3847 179.2832 153 H 4.0190 8.1334 111.5737 58.5723 28.4927 176.1908 154 Y 4.6033 8.2589 119.2412 58.2043 37.9753 172.4124 155 R 4.2262 8.2001 127.2296 55.4478 31.2075 176.2748 156 W 4.5495 9.0731 120.8066 56.9376 29.3781 175.8706 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 4.31 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 R 8.82 3.94 0.00 1.88 1.99 0.00 3.48 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 4 R 7.06 5.17 0.00 1.97 2.04 0.00 3.01 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.30 0.00 5 R 6.88 4.57 0.00 1.80 1.79 0.00 3.48 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.51 0.00 6 R 8.48 3.51 0.00 1.80 1.92 0.00 3.49 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 7 A 6.92 3.67 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 8 E 6.67 3.63 0.00 2.23 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 2.36 2.42 0.00 9 V 7.98 3.95 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 0.86 0.00 0.00 0.94 0.00 0.00 10 R 8.24 3.96 0.00 1.96 1.97 0.00 2.69 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 11 Q 8.56 4.38 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 12 L 8.14 4.64 0.00 1.77 1.64 0.99 0.68 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 13 Q 8.67 4.09 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 14 P 0.00 4.27 0.00 2.07 2.16 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 15 D 8.73 4.47 0.00 2.95 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 16 L 7.91 5.01 0.00 1.71 1.69 0.93 0.89 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 17 V 7.19 4.45 2.51 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 0.87 0.00 0.00 0.67 0.00 0.00 18 Y 8.63 4.25 0.00 3.41 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 19 G 7.91 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 20 D 7.55 4.91 0.00 2.85 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.65 3.69 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 0.87 0.00 0.00 1.00 0.00 0.00 22 L 8.37 4.17 0.00 2.40 2.38 1.02 0.96 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 23 V 9.65 3.81 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 0.94 0.00 0.00 1.12 0.00 0.00 24 T 7.76 3.68 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 1.22 0.00 0.00 25 A 8.33 4.01 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 26 F 8.66 4.53 0.00 3.41 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 27 I 7.71 3.07 1.43 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 -0.36 0.55 0.00 0.00 28 N 7.96 4.22 0.00 2.91 2.87 0.00 0.00 7.08 7.33 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 29 K 7.91 4.12 0.00 2.23 2.05 0.00 1.92 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.57 1.88 7.81 30 I 7.79 3.83 1.80 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 -0.02 0.86 0.00 0.00 31 M 7.10 3.51 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.50 0.00 32 R 8.70 4.56 0.00 2.05 2.02 0.00 3.16 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.40 0.00 33 D 9.84 4.38 0.00 2.82 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 34 G 8.53 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 0.00 0.00 0.00 35 K 6.86 4.91 0.00 2.00 1.85 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.46 7.81 36 K 8.31 3.78 0.00 1.84 1.78 0.00 1.49 0.00 0.00 1.65 0.00 0.00 3.38 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.44 7.81 37 N 8.75 4.37 0.00 3.02 2.76 0.00 0.00 6.23 6.67 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 38 L 8.18 3.83 0.00 1.73 1.77 0.92 0.93 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 39 A 8.19 3.84 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 40 A 8.40 3.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.12 3.82 0.00 2.06 1.95 0.00 3.17 0.00 0.00 3.17 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 42 I 8.40 3.84 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.39 0.93 0.00 0.00 43 F 7.86 3.96 0.00 2.62 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 44 Y 8.38 4.51 0.00 3.33 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 45 D 8.95 4.46 0.00 2.72 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 46 A 8.47 4.17 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 47 C 8.29 3.76 0.00 3.16 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 0.00 48 K 8.01 3.95 0.00 2.12 1.82 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.52 7.81 49 I 8.00 3.71 2.04 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 1.54 0.44 0.94 0.00 0.00 50 I 8.01 3.56 2.01 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.72 0.96 0.00 0.00 51 Q 8.43 4.02 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.03 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 52 E 8.56 4.12 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 2.33 2.35 0.00 53 K 8.11 3.85 0.00 2.04 1.90 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.57 7.81 54 T 7.82 4.36 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 1.35 0.00 0.00 55 G 8.63 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 56 Q 7.43 3.74 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 57 E 8.67 4.24 0.00 2.07 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 2.43 2.39 0.00 58 P 0.00 4.20 0.00 2.04 2.40 0.00 3.77 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 59 L 7.95 3.81 0.00 1.89 1.78 1.01 0.70 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 60 K 8.02 3.93 0.00 1.89 1.81 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.52 7.81 61 V 8.00 3.56 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 1.02 0.00 0.00 1.00 0.00 0.00 62 F 8.48 4.06 0.00 3.09 3.11 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 63 K 8.41 3.89 0.00 2.05 1.90 0.00 1.86 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.80 1.69 7.81 64 Q 8.38 3.88 0.00 2.28 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.63 0.00 65 A 8.10 3.84 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 66 V 7.68 3.33 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 1.00 0.00 0.00 0.65 0.00 0.00 67 E 8.22 3.87 0.00 1.95 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 0.00 2.32 2.41 0.00 68 N 7.99 4.41 0.00 2.86 2.78 0.00 0.00 6.99 7.67 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 69 V 7.82 3.76 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 0.68 0.00 0.00 0.86 0.00 0.00 70 K 7.82 4.09 0.00 1.80 1.80 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.57 7.81 71 P 0.00 4.86 0.00 2.21 2.11 0.00 4.04 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 72 R 7.45 4.31 0.00 1.87 2.07 0.00 2.91 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.48 0.00 73 M 7.33 5.14 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 74 E 8.80 4.95 0.00 2.02 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 2.19 2.38 0.00 75 V 7.91 4.81 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 0.86 0.00 0.00 76 R 8.71 4.92 0.00 2.91 2.13 0.00 3.52 0.00 0.00 3.60 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 77 S 8.94 6.30 0.00 3.87 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 78 R 8.79 4.48 0.00 1.47 1.68 0.00 2.75 0.00 0.00 2.55 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.47 0.00 79 R 8.30 5.19 0.00 1.60 1.75 0.00 3.38 0.00 0.00 3.74 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.32 0.00 80 V 7.74 3.97 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 0.60 0.00 0.00 0.75 0.00 0.00 81 G 7.24 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 0.00 0.00 0.00 82 G 8.23 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 83 A 6.61 4.39 1.20 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 0.00 0.00 84 N 8.77 6.14 0.00 2.69 2.76 0.00 0.00 6.31 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 85 Y 8.10 4.70 0.00 2.38 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 86 Q 8.42 5.10 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 87 V 8.34 4.39 0.67 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 0.66 0.00 0.00 1.18 0.00 0.00 88 P 0.00 5.55 0.00 2.01 1.89 0.00 3.39 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.77 0.00 89 M 7.89 4.70 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.59 0.00 90 E 8.75 4.41 0.00 1.88 2.01 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 2.33 2.38 0.00 91 V 9.34 3.87 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 0.67 0.00 0.00 1.04 0.00 0.00 92 S 7.50 3.78 0.00 3.94 3.66 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 93 P 0.00 4.36 0.00 2.31 2.20 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 94 R 7.10 3.27 0.00 1.98 1.85 0.00 3.25 0.00 0.00 3.27 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 95 R 8.24 3.83 0.00 1.90 2.03 0.00 3.23 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 96 Q 8.33 3.69 0.00 2.55 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 97 Q 9.10 4.12 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.29 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 98 S 7.82 4.00 0.00 4.02 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 99 L 8.33 4.06 0.00 1.56 1.38 0.63 0.85 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 0.00 100 A 8.29 4.53 1.53 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 0.00 0.00 101 L 8.57 3.82 0.00 1.86 1.95 1.04 0.85 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 0.00 102 R 9.26 3.83 0.00 1.94 2.05 0.00 3.16 0.00 0.00 3.11 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 103 W 9.18 4.27 0.00 3.71 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 0.00 104 L 8.95 3.78 0.00 1.87 1.59 0.80 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.19 3.71 2.36 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 1.31 0.00 0.00 1.28 0.00 0.00 106 Q 8.50 4.01 0.00 2.40 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 107 A 8.44 3.94 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.03 4.21 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 0.00 109 N 8.02 4.36 0.00 2.95 2.96 0.00 0.00 7.14 8.45 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 0.00 110 Q 8.25 4.17 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.64 2.58 0.00 111 R 7.19 3.92 0.00 2.02 1.92 0.00 3.48 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 112 P 0.00 4.52 0.00 2.20 1.51 0.00 3.97 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 2.07 1.97 0.00 113 E 9.46 3.51 0.00 2.19 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 0.00 2.26 2.48 0.00 114 R 8.35 4.72 0.00 1.76 1.93 0.00 3.15 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 115 R 7.73 4.63 0.00 1.79 1.78 0.00 3.15 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 116 A 8.74 3.97 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 0.00 117 A 8.05 3.94 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 0.00 118 V 7.65 3.43 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 1.04 0.00 0.00 0.92 0.00 0.00 119 R 7.90 4.36 0.00 2.08 1.97 0.00 3.24 0.00 0.00 3.29 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.84 0.00 120 I 8.16 3.73 2.04 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 1.59 0.87 1.16 0.00 0.00 121 A 8.84 3.93 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 H 8.81 3.78 0.00 3.43 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 9.13 3.90 0.00 2.02 1.87 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 2.23 2.24 0.00 124 L 8.29 3.77 0.00 1.93 1.64 0.91 0.84 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 0.00 125 M 8.54 4.09 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.82 0.00 126 D 8.62 4.32 0.00 3.04 3.09 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 0.00 127 A 8.36 3.90 1.20 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 0.00 0.00 128 A 8.11 4.14 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 0.00 129 E 8.35 4.10 0.00 1.94 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 0.00 2.30 2.30 0.00 130 G 7.56 3.09 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 0.00 131 K 6.93 4.25 0.00 1.78 1.83 0.00 1.89 0.00 0.00 1.95 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.23 1.27 7.81 132 G 7.83 4.12 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 0.00 133 G 8.07 3.55 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 0.00 134 A 9.51 3.46 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 0.00 135 V 8.38 3.08 1.92 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 1.06 0.00 0.00 0.80 0.00 0.00 136 K 7.80 3.73 0.00 1.80 1.90 0.00 1.99 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.37 1.57 7.81 137 K 7.83 4.66 0.00 1.40 1.78 0.00 1.58 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.35 7.81 138 K 7.31 3.85 0.00 0.93 1.78 0.00 1.79 0.00 0.00 1.62 0.00 0.00 3.42 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.58 1.98 7.81 139 E 8.61 3.89 0.00 2.22 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 2.30 2.42 0.00 140 D 8.34 4.35 0.00 2.92 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 0.00 141 V 8.46 3.71 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 1.13 0.00 0.00 1.35 0.00 0.00 142 E 9.03 4.36 0.00 2.17 1.80 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 2.41 2.42 0.00 143 R 6.13 4.31 0.00 1.95 2.09 0.00 3.39 0.00 0.00 3.01 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 144 M 8.27 3.91 0.00 2.28 2.13 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 2.62 2.53 0.00 145 A 7.98 4.29 1.31 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 0.00 0.00 0.00 146 E 9.28 4.25 0.00 2.00 2.38 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 2.17 2.15 0.00 147 A 7.69 3.93 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 0.00 148 N 7.86 4.59 0.00 2.84 3.28 0.00 0.00 6.75 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 0.00 149 R 7.87 3.69 0.00 1.99 1.75 0.00 3.18 0.00 0.00 3.12 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 150 A 7.54 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.58 4.35 0.00 3.10 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 0.00 152 A 8.58 3.82 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 0.00 153 H 8.13 4.02 0.00 3.25 3.41 0.00 5.55 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.26 4.60 0.00 3.30 3.28 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 0.00 155 R 8.20 4.23 0.00 2.13 2.15 0.00 3.37 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 156 W 9.07 4.55 0.00 3.28 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