NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2163 8.3293 121.6988 55.6908 30.4563 175.5028 4 S 4.2120 8.2582 120.5086 57.8076 65.2526 174.5716 5 F 4.1056 10.1522 123.3462 60.6124 39.0481 179.6010 6 T 3.9163 8.3627 116.0098 66.6524 68.3461 176.5744 7 S 4.1061 7.9528 114.7825 61.3614 62.3360 176.2654 8 I 3.6874 7.7196 122.1583 64.1524 36.8064 178.3065 9 A 4.0078 8.3502 121.9790 55.1464 18.2992 179.2273 10 R 3.8161 8.1231 117.1746 59.8964 30.1627 178.6184 11 I 3.7712 7.8186 118.8477 64.4035 37.2136 178.7569 12 G 3.6502 8.4002 106.7613 48.0582 0.0000 175.4969 13 D 4.4016 8.7182 121.8947 57.1054 40.5996 178.2073 14 Y 3.9965 8.0750 120.0248 60.6990 38.5397 178.3079 15 I 3.8194 7.6112 119.4466 64.3873 37.3642 178.1904 16 L 4.1154 7.9170 118.6846 57.3019 41.4040 179.4977 17 K 4.2299 7.7284 118.0078 57.9882 32.5017 177.5032 18 S 4.0693 7.1900 115.7879 57.3871 62.4463 172.9899 19 P 4.4252 0.0000 0.0000 65.0814 30.7283 178.7075 20 V 3.6119 7.6004 117.3709 65.9471 31.6614 177.8483 21 L 3.8950 7.6390 117.8917 57.8575 41.3547 179.1990 22 S 4.1337 8.3946 113.5175 61.6106 61.9597 176.2644 23 K 3.9586 7.4821 118.6539 58.0630 32.0272 178.7041 24 L 4.1673 7.0940 119.9421 57.9092 42.4766 178.1976 25 C 4.2317 8.4796 116.8525 62.6412 28.3660 175.8394 26 V 3.5599 7.1591 119.5078 66.0176 31.1373 176.2824 27 P 4.3282 0.0000 0.0000 65.3957 31.1095 178.7981 28 V 3.5676 7.6665 116.3686 66.0265 31.5746 177.6465 29 A 4.0025 8.3716 120.9066 55.4406 18.0383 179.3453 30 N 4.3326 8.8424 115.1950 56.5368 38.6026 177.4762 31 Q 4.0145 8.1231 120.6582 58.8644 29.1543 177.8906 32 F 4.1692 8.4480 121.9441 61.4486 39.2609 177.1691 33 I 3.7840 7.9481 118.2451 64.5546 36.8178 177.9225 34 N 4.3544 7.9991 117.2416 56.1490 38.1275 177.5450 35 L 3.7194 7.6816 119.4452 57.1835 41.7045 178.7258 36 A 3.9424 7.3380 120.5329 54.3172 18.6656 179.0279 37 G 3.7105 7.5214 104.3306 45.6115 0.0000 174.8384 38 Y 4.1566 7.6048 118.3818 60.1016 37.7417 178.5140 39 K 4.1593 7.0648 119.5840 58.8466 32.2083 178.7852 40 K 2.7083 7.6041 118.0569 57.4050 31.6548 178.0638 41 L 4.3283 7.3882 117.4603 54.3939 42.1645 177.2406 42 G 3.9186 8.1640 106.5779 45.6300 0.0000 173.2078 43 L 4.8666 7.6912 117.8655 52.7785 44.1256 175.8767 44 K 4.9439 8.9489 119.9435 54.4722 34.8198 177.3482 45 F 3.3817 9.3961 124.2276 61.7573 38.9114 177.6328 46 D 4.0163 8.2061 117.3151 57.1170 40.2464 178.2415 47 D 4.4303 7.8364 118.4324 56.5243 40.8898 177.7724 48 L 4.0982 7.3039 118.1114 54.6197 42.0577 177.2199 49 I 3.6229 6.4728 120.6194 60.5935 37.4485 175.7886 50 A 4.0008 8.6368 128.8112 52.6721 18.4199 176.8697 51 E 4.3743 8.6346 120.2800 56.7035 31.1686 176.5788 52 E 4.3812 7.8906 121.4574 54.6526 28.5870 175.6753 53 N 4.9519 7.3423 117.1186 49.9845 41.8293 173.4423 54 P 4.2702 0.0000 0.0000 66.1756 31.1243 178.7026 55 I 3.6831 7.7143 118.8751 64.6633 37.2071 178.2499 56 M 4.0396 8.0404 118.6696 58.2658 31.7843 178.7761 57 Q 4.0152 7.9005 118.0878 58.9480 29.0446 178.4871 58 T 3.8213 8.1879 116.7952 66.4986 68.4308 176.4560 59 A 4.0002 8.2105 122.7814 55.3747 18.2699 179.8189 60 L 3.9813 7.7536 115.8223 57.6415 41.6466 179.4730 61 R 3.9869 7.6591 118.2830 59.1527 30.1522 178.0808 62 R 4.1166 7.5332 114.9883 55.9750 30.5985 176.6463 63 L 3.3577 6.5677 120.9275 53.5030 42.7804 175.4224 64 P 4.2879 0.0000 0.0000 62.6986 33.0422 176.8812 65 E 3.3681 8.5628 120.5479 59.9809 29.3251 179.7197 66 D 4.3724 7.9457 117.8862 57.5417 40.8267 178.7216 67 E 3.8847 7.9387 118.5667 59.0252 29.5436 179.0569 68 S 3.9807 7.7460 113.2974 61.6920 62.4627 175.9459 69 Y 4.3959 7.8698 119.4351 60.8240 37.5050 178.4259 70 A 4.0400 7.8801 121.8204 55.1872 18.4706 179.5295 71 R 3.7999 8.3031 117.4612 59.5020 30.1255 178.4545 72 A 4.0127 8.0390 120.4907 55.4418 18.3376 179.0197 73 Y 4.1309 8.1070 117.9705 60.9266 38.8961 178.3602 74 R 3.6849 8.1831 119.0271 59.1856 30.1585 179.1723 75 I 3.6621 7.9634 119.7299 64.4062 37.1248 178.5927 76 I 3.7274 7.7679 120.6213 64.4134 36.9670 178.4904 77 R 3.7412 7.9938 119.6466 59.1945 29.7140 178.4579 78 A 3.9374 7.9973 120.6621 55.3726 18.2848 179.3394 79 H 4.0959 8.1400 114.7591 59.0139 28.5589 177.8369 80 Q 3.9311 7.8545 120.2040 59.4820 29.2427 178.1924 81 T 3.9980 7.9527 116.7538 66.4512 68.5194 176.2005 82 E 3.8965 8.4945 121.9507 59.3251 29.4636 178.9580 83 L 3.9995 8.0139 118.3158 58.0910 40.6580 178.1814 84 T 4.1640 7.6322 109.3705 60.8823 69.0469 174.4011 85 H 4.3072 7.8803 117.5375 57.6615 26.8257 173.5499 86 H 5.1060 7.5623 111.9894 54.0812 32.3034 172.3639 87 L 4.9499 8.1251 118.9289 52.8406 44.9062 176.7393 88 L 4.5000 8.3805 120.3989 53.8102 42.8538 175.6087 89 P 4.3508 0.0000 0.0000 62.7105 32.0873 177.7911 90 R 2.0000 8.6519 123.0854 58.8219 29.9447 178.3209 91 N 4.3621 7.7770 112.6259 54.6354 37.3577 175.1190 92 E 4.4869 8.2329 117.6338 56.3313 30.4853 176.2861 93 W 4.7745 7.7323 118.9566 56.8926 29.9862 175.8646 94 I 4.2007 8.2468 123.3260 61.2535 37.4233 176.2627 95 K 4.5107 9.5093 126.2616 55.3548 33.6169 177.8638 96 A 4.0786 8.8314 124.1310 55.7676 17.9669 180.3309 97 Q 4.1250 8.0604 115.2364 58.9034 28.9134 177.9754 98 E 4.2855 8.0762 118.7121 57.9948 30.9791 177.1912 99 D 4.8220 7.4824 118.3201 53.6171 39.6106 175.8359 100 V 4.2379 7.3620 119.9307 61.3921 33.5725 174.5365 101 P 4.7672 0.0000 0.0000 61.9844 29.5719 176.3528 102 Y 4.1037 7.9242 122.1965 59.9905 38.9375 177.7185 103 L 4.3868 7.4527 121.7778 55.8954 43.1116 177.7852 104 L 3.6205 7.5000 120.5992 57.8798 41.8210 177.1764 105 P 4.0873 0.0000 0.0000 66.1606 31.0613 177.8989 106 Y 4.0626 7.5932 115.8958 60.6623 37.7473 178.3182 107 I 3.6588 7.7094 120.7444 64.3938 37.2331 178.3908 108 L 3.9847 8.0361 120.0555 57.7592 41.4435 179.2474 109 E 3.8808 8.2434 118.8912 59.3221 29.5545 178.7896 110 A 4.0357 8.0715 120.7702 55.2141 18.4018 179.4659 111 E 3.9215 8.6103 117.2542 59.3193 29.4220 179.4993 112 A 3.9414 8.1276 120.6341 55.1058 18.6131 179.3790 113 A 3.9113 8.1075 119.1001 55.3339 18.4259 179.7239 114 A 3.9257 8.2042 119.2340 55.2633 18.5056 179.7760 115 K 3.8983 8.4919 118.6239 59.5643 32.2215 178.6185 116 E 3.9268 8.4663 119.8722 59.0714 29.4768 178.6773 117 K 3.9194 7.9925 119.5324 59.5852 32.0376 178.2724 118 D 4.3120 7.9257 117.2935 57.2220 41.4197 177.8978 119 E 4.1081 8.2401 119.1172 59.5447 29.1373 179.3543 120 L 4.0498 8.5192 119.2780 57.8592 41.4427 179.2484 121 D 4.5296 8.4151 117.9712 56.0928 40.7213 176.8563 122 N 4.9597 7.3711 114.8151 52.4400 39.3017 174.4838 123 I 3.7366 7.3631 112.8043 61.1402 37.8362 175.9526 124 E 4.4651 8.5119 124.1949 55.4095 30.7808 175.8793 125 V 4.4683 7.9861 112.5570 59.5751 35.0235 175.3006 126 S 4.6686 8.6315 117.7149 56.3906 64.5829 173.8635 127 K 4.1980 8.6583 125.7092 56.5809 32.0702 176.1366 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 3 Q 8.33 4.22 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.98 0.00 0.00 0.00 0.00 0.00 2.11 2.28 0.00 4 S 8.26 4.21 0.00 4.43 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 5 F 10.15 4.11 0.00 3.38 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.36 3.92 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 7 S 7.95 4.11 0.00 3.84 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 8 I 7.72 3.69 1.82 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 1.39 0.52 0.88 0.00 0.00 9 A 8.35 4.01 1.44 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 0.00 0.00 0.00 10 R 8.12 3.82 0.00 2.06 2.09 0.00 3.10 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 11 I 7.82 3.77 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.80 0.88 0.00 0.00 12 G 8.40 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 13 D 8.72 4.40 0.00 2.78 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 14 Y 8.08 4.00 0.00 3.21 3.13 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 0.00 0.00 0.00 15 I 7.61 3.82 2.06 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 1.65 0.98 0.92 0.00 0.00 16 L 7.92 4.12 0.00 1.86 1.72 0.92 0.81 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 17 K 7.73 4.23 0.00 1.59 1.75 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.56 7.81 18 S 7.19 4.07 0.00 3.52 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 4.43 0.00 2.17 2.06 0.00 3.59 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 20 V 7.60 3.61 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.91 0.00 0.00 21 L 7.64 3.89 0.00 1.70 1.71 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.39 4.13 0.00 4.11 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 23 K 7.48 3.96 0.00 1.90 1.84 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.49 7.81 24 L 7.09 4.17 0.00 1.78 1.88 0.92 0.95 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 C 8.48 4.23 0.00 2.95 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.16 3.56 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.98 0.00 0.00 27 P 0.00 4.33 0.00 2.20 2.09 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.15 0.00 28 V 7.67 3.57 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.97 0.00 0.00 29 A 8.37 4.00 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 30 N 8.84 4.33 0.00 3.00 2.91 0.00 0.00 6.67 7.20 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 31 Q 8.12 4.01 0.00 2.24 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 32 F 8.45 4.17 0.00 3.07 3.23 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 33 I 7.95 3.78 2.08 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.06 0.94 0.00 0.00 34 N 8.00 4.35 0.00 2.78 2.81 0.00 0.00 7.03 7.73 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 35 L 7.68 3.72 0.00 1.64 1.62 0.93 0.79 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 36 A 7.34 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 37 G 7.52 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 38 Y 7.60 4.16 0.00 3.22 3.23 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 39 K 7.06 4.16 0.00 1.44 1.89 0.00 1.88 0.00 0.00 1.80 0.00 0.00 2.65 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 0.84 7.81 40 K 7.60 2.71 0.00 1.41 1.08 0.00 1.16 0.00 0.00 1.14 0.00 0.00 2.52 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.21 7.81 41 L 7.39 4.33 0.00 1.78 1.66 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.16 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.69 4.87 0.00 1.96 1.64 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.95 4.94 0.00 2.13 1.93 0.00 1.81 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.46 7.81 45 F 9.40 3.38 0.00 3.02 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 46 D 8.21 4.02 0.00 2.27 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 0.00 0.00 0.00 47 D 7.84 4.43 0.00 2.72 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 48 L 7.30 4.10 0.00 1.14 1.28 0.76 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 49 I 6.47 3.62 1.75 0.00 0.00 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 1.31 0.06 1.06 0.00 0.00 50 A 8.64 4.00 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 51 E 8.63 4.37 0.00 2.07 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 2.20 2.31 0.00 52 E 7.89 4.38 0.00 1.96 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 0.00 2.31 2.35 0.00 53 N 7.34 4.95 0.00 2.88 2.87 0.00 0.00 5.84 7.76 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 54 P 0.00 4.27 0.00 2.29 2.36 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 55 I 7.71 3.68 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.98 0.95 0.00 0.00 56 M 8.04 4.04 0.00 2.01 2.13 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 2.93 2.62 0.00 57 Q 7.90 4.02 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 58 T 8.19 3.82 4.42 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 1.23 0.00 0.00 59 A 8.21 4.00 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 60 L 7.75 3.98 0.00 1.64 1.70 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.66 3.99 0.00 2.00 2.11 0.00 3.24 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 62 R 7.53 4.12 0.00 1.93 1.92 0.00 3.28 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 63 L 6.57 3.36 0.00 1.31 1.49 0.87 0.96 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 64 P 0.00 4.29 0.00 2.25 2.15 0.00 3.55 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 2.05 2.12 0.00 65 E 8.56 3.37 0.00 1.88 1.70 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 2.20 2.33 0.00 66 D 7.95 4.37 0.00 2.65 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 67 E 7.94 3.88 0.00 2.01 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 2.33 2.29 0.00 68 S 7.75 3.98 0.00 3.70 3.60 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 69 Y 7.87 4.40 0.00 3.04 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 70 A 7.88 4.04 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 71 R 8.30 3.80 0.00 1.93 2.08 0.00 3.19 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.01 0.00 72 A 8.04 4.01 1.52 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 0.00 0.00 73 Y 8.11 4.13 0.00 3.13 3.18 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 74 R 8.18 3.68 0.00 2.04 1.94 0.00 3.44 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 1.93 0.00 75 I 7.96 3.66 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.83 0.95 0.00 0.00 76 I 7.77 3.73 1.85 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.76 0.92 0.00 0.00 77 R 7.99 3.74 0.00 1.16 1.69 0.00 2.92 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.47 0.00 78 A 8.00 3.94 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 79 H 8.14 4.10 0.00 3.39 3.33 0.00 5.82 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 7.85 3.93 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 81 T 7.95 4.00 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 1.26 0.00 0.00 82 E 8.49 3.90 0.00 2.10 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 2.36 0.00 83 L 8.01 4.00 0.00 1.76 1.76 0.88 1.27 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 84 T 7.63 4.16 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 1.24 0.00 0.00 85 H 7.88 4.31 0.00 3.39 3.46 0.00 5.59 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 H 7.56 5.11 0.00 3.13 3.23 0.00 5.79 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 87 L 8.13 4.95 0.00 1.61 1.62 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.38 4.50 0.00 1.95 1.79 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.35 0.00 2.07 1.95 0.00 3.87 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.16 0.00 90 R 8.65 2.00 0.00 1.31 0.88 0.00 2.40 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.29 0.00 91 N 7.78 4.36 0.00 2.74 2.84 0.00 0.00 5.95 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 92 E 8.23 4.49 0.00 2.22 2.15 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 2.33 2.29 0.00 93 W 7.73 4.77 0.00 3.24 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 94 I 8.25 4.20 1.96 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 1.26 0.91 1.03 0.00 0.00 95 K 9.51 4.51 0.00 1.87 1.90 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.46 7.81 96 A 8.83 4.08 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 97 Q 8.06 4.12 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.03 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 98 E 8.08 4.29 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 99 D 7.48 4.82 0.00 2.82 2.75 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 0.00 0.00 0.00 100 V 7.36 4.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.04 0.00 0.00 101 P 0.00 4.77 0.00 2.26 2.25 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 102 Y 7.92 4.10 0.00 3.32 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.45 4.39 0.00 0.89 1.34 0.88 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.50 3.62 0.00 1.77 1.74 0.83 0.85 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 0.00 105 P 0.00 4.09 0.00 1.87 2.11 0.00 3.65 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 1.72 1.91 0.00 106 Y 7.59 4.06 0.00 3.21 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 0.00 107 I 7.71 3.66 1.69 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.70 0.71 0.00 0.00 108 L 8.04 3.98 0.00 1.76 1.71 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.24 3.88 0.00 2.07 2.15 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 2.32 2.32 0.00 110 A 8.07 4.04 1.41 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 0.00 0.00 0.00 111 E 8.61 3.92 0.00 2.19 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 2.39 2.55 0.00 112 A 8.13 3.94 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 0.00 113 A 8.11 3.91 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 0.00 114 A 8.20 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 0.00 115 K 8.49 3.90 0.00 1.91 1.96 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.50 7.81 116 E 8.47 3.93 0.00 2.07 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 0.00 2.31 2.32 0.00 117 K 7.99 3.92 0.00 1.90 1.94 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.45 7.81 118 D 7.93 4.31 0.00 2.71 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 0.00 119 E 8.24 4.11 0.00 2.32 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 2.33 2.35 0.00 120 L 8.52 4.05 0.00 1.64 1.72 0.92 1.10 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 0.00 121 D 8.42 4.53 0.00 2.63 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 7.37 4.96 0.00 2.68 2.78 0.00 0.00 6.99 8.02 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 0.00 123 I 7.36 3.74 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.52 0.99 0.00 0.00 124 E 8.51 4.47 0.00 1.98 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 0.00 2.28 2.32 0.00 125 V 7.99 4.47 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 0.71 0.00 0.00 0.93 0.00 0.00 126 S 8.63 4.67 0.00 3.78 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 0.00 127 K 8.66 4.20 0.00 1.75 1.68 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.46 7.81