NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4571 8.2893 120.3254 55.0956 32.9891 175.0085 2 N 4.4107 8.5365 121.9136 50.3550 38.4242 173.4335 3 I 4.0935 8.1117 114.1924 60.3544 40.0437 177.1044 4 R 4.3386 7.9033 120.8421 54.3142 30.5119 172.4001 5 P 4.3922 0.0000 0.0000 62.5156 32.1339 177.0410 6 L 4.2076 8.0799 123.2774 54.6695 40.7314 173.9562 7 H 3.7890 9.2584 112.7603 57.2199 28.7610 176.2695 8 D 4.6990 8.8029 121.2138 54.1919 41.2437 173.1124 9 R 4.8685 7.3714 118.0336 55.4518 32.2063 175.5440 10 V 4.7535 8.9933 122.5433 61.1478 34.9991 174.0765 11 I 4.8349 8.4827 128.3071 59.9208 38.9234 175.1674 12 V 5.1363 8.6127 120.0683 59.1862 36.2593 174.6188 13 K 4.8486 8.4937 121.7575 54.7508 34.8312 175.9191 14 R 4.5836 8.8383 124.5692 56.5231 30.6544 176.7717 15 K 4.6478 8.3047 124.8933 56.5804 34.0589 176.8095 16 E 4.2137 8.6981 127.3161 55.9968 30.3522 176.0368 17 V 3.5092 8.4045 123.4727 63.5863 31.4396 175.4651 18 E 3.6753 8.7555 128.3034 56.7349 25.7327 175.2134 19 T 3.7769 7.6128 114.0137 63.9138 69.1566 174.6932 20 K 4.5264 8.5351 127.0393 55.9851 29.9120 176.1432 21 S 4.6437 8.3379 114.8305 58.3198 66.5592 176.6497 22 A 4.0311 7.3202 125.4756 54.3844 18.3084 177.9463 23 G 3.9774 8.3817 109.9586 45.0665 0.0000 172.2571 24 G 4.1509 7.4802 107.4773 45.1465 0.0000 176.8393 25 I 4.0341 8.8629 126.7464 62.3268 38.1192 176.1066 26 V 3.6001 7.5778 121.6682 62.9625 32.4439 175.0967 27 L 4.4827 8.4898 130.7508 53.8660 41.1268 174.0412 28 T 3.9086 8.2903 117.2389 61.5109 67.4495 173.6793 29 G 3.6217 8.5598 117.9877 44.8597 0.0000 171.2026 30 S 3.9628 8.6450 115.8042 58.9096 61.9074 173.8082 31 A 4.5296 8.2839 130.8184 51.7966 19.2248 175.8018 32 A 3.5409 8.1513 124.5221 53.3618 14.9670 176.9405 33 A 4.4142 7.4281 122.2612 51.4210 22.3072 174.5168 34 K 4.6324 8.1800 119.0224 55.1556 35.4280 174.3912 35 S 4.7364 8.4951 112.9774 56.9282 64.2771 173.8397 36 T 3.8982 8.1191 114.9415 61.4884 70.2914 173.9032 37 R 4.7908 7.4348 122.0428 55.4850 32.6066 175.4661 38 G 4.5758 8.7778 107.5936 45.7375 0.0000 171.2423 39 E 5.3098 8.7861 121.0058 53.9783 32.0665 175.2045 40 V 4.2226 8.4279 126.7960 63.1763 32.1977 176.1331 41 L 4.4484 8.9332 126.8555 55.7963 44.3937 176.7612 42 A 4.7209 7.6174 117.9106 50.5721 22.7361 175.4154 43 V 4.6218 8.2254 119.8053 60.9732 34.6514 175.7259 44 G 3.8552 8.4798 114.8867 45.6434 0.0000 173.4577 45 N 4.4759 9.2113 116.4283 54.6161 38.6506 176.6479 46 G 4.7917 7.3035 102.2043 44.8178 0.0000 171.3063 47 R 4.0630 7.7409 119.3627 56.3722 30.4386 177.4307 48 I 4.0017 8.2769 124.6706 62.9985 37.9865 176.0307 49 L 3.9124 7.5895 118.5413 56.1185 42.0097 176.8683 50 E 3.7390 8.8836 120.7855 55.8063 27.4189 172.9604 51 N 4.2594 6.5821 116.2837 53.6704 39.2414 173.7070 52 G 3.9458 7.8447 116.3321 45.4828 0.0000 174.1564 53 E 3.4476 8.6171 129.9503 56.4295 29.1526 177.5140 54 V 4.6020 8.2325 128.7937 62.3239 34.1316 174.1719 55 K 4.3831 8.7233 128.8804 55.7710 33.8118 175.0540 56 P 5.4771 0.0000 0.0000 62.2647 32.1862 176.0040 57 L 4.4759 8.3323 120.4906 54.7649 42.5269 176.4969 58 D 4.7798 8.6484 119.4649 54.1589 40.7809 176.8138 59 V 4.4905 7.5623 113.2281 59.2704 34.1639 175.5050 60 K 4.2700 8.5890 124.4017 55.2121 33.8710 176.2581 61 V 3.5305 8.1620 120.2982 67.4406 30.9488 174.8682 62 G 4.0869 7.8201 116.8672 45.4538 0.0000 172.4666 63 D 4.6835 7.9161 118.9066 53.5604 42.8349 175.9784 64 I 4.3897 8.2848 122.6395 60.7815 38.3383 175.1008 65 V 4.9052 8.9924 121.2252 59.5167 35.2801 174.9131 66 I 4.8383 8.2458 124.4429 59.8471 38.8022 174.9348 67 F 5.4528 7.9615 121.0504 54.9664 41.4272 173.6342 68 N 4.7185 8.9886 118.7947 51.6029 39.4268 175.7194 69 D 4.9185 8.4903 129.4453 53.6596 40.4686 175.6120 70 G 4.0608 7.4727 112.7065 45.7218 0.0000 171.5089 71 Y 4.2178 8.8866 119.3405 60.5121 39.1125 178.7101 72 G 3.6272 8.1303 106.3558 47.2009 0.0000 172.9636 73 V 3.9694 7.1941 120.8659 62.3291 31.8842 175.4527 74 K 4.6464 8.7613 127.1353 54.5949 35.5776 174.9623 75 S 5.1457 8.4497 116.2003 56.8208 64.9929 172.7244 76 E 4.7960 9.0370 124.3372 54.6883 34.7150 174.0522 77 K 4.8203 8.6011 121.5385 54.9369 34.4269 175.3263 78 I 4.3688 8.1049 128.2492 60.4975 39.3663 175.4293 79 D 4.5516 9.7481 123.7512 55.1012 38.3492 173.0295 80 N 4.3116 8.3572 113.8090 54.9247 37.0777 173.3540 81 E 4.6275 8.0235 115.2021 53.7899 32.0364 175.3725 82 E 4.4182 8.7300 122.8791 56.4803 29.9248 176.3666 83 V 4.7434 8.4820 117.1276 59.3683 36.3712 174.8241 84 L 5.2540 8.9003 121.1038 53.1069 46.0434 175.9593 85 I 5.0661 8.6482 122.9218 59.8044 40.6751 174.5656 86 M 5.0720 8.5171 123.3557 53.8885 35.5354 174.1453 87 S 5.3339 8.3229 113.1141 56.2542 65.1833 174.8315 88 E 3.9458 8.8842 120.9729 59.5067 29.5115 179.0502 89 S 4.1431 8.1866 113.6377 61.7299 63.0579 175.1154 90 D 4.5843 8.2226 118.6404 55.5261 41.0220 175.9841 91 I 4.5344 7.6233 121.0603 60.5505 38.1053 175.2807 92 L 4.6757 8.6244 124.2087 56.1571 44.0424 175.8589 93 A 4.5969 7.5251 118.0360 51.3781 22.7961 174.8524 94 I 4.8678 8.2008 118.2363 59.7722 40.8728 176.4590 95 V 4.1314 8.9104 126.3664 61.7710 31.5369 174.6858 96 E 4.5214 8.6774 126.9672 55.3816 31.7054 176.4020 97 A 4.1034 8.6602 124.2965 52.8217 18.7985 176.7636 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 M 8.29 4.46 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 2 N 8.54 4.41 0.00 2.90 2.81 0.00 0.00 6.30 6.93 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 3 I 8.11 4.09 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.48 0.89 0.00 0.00 4 R 7.90 4.34 0.00 1.70 1.82 0.00 3.28 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 5 P 0.00 4.39 0.00 2.32 2.00 0.00 3.78 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 6 L 8.08 4.21 0.00 1.53 1.46 0.77 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 7 H 9.26 3.79 0.00 3.82 3.44 0.00 5.77 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 8 D 8.80 4.70 0.00 3.00 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 9 R 7.37 4.87 0.00 1.69 1.77 0.00 3.23 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.65 0.00 10 V 8.99 4.75 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 0.95 0.00 0.00 0.92 0.00 0.00 11 I 8.48 4.83 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.60 0.87 0.00 0.00 12 V 8.61 5.14 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 0.75 0.00 0.00 0.62 0.00 0.00 13 K 8.49 4.85 0.00 1.82 1.89 0.00 1.32 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.36 7.81 14 R 8.84 4.58 0.00 1.94 1.94 0.00 3.28 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 15 K 8.30 4.65 0.00 1.71 1.57 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.43 7.81 16 E 8.70 4.21 0.00 1.95 1.88 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 2.28 2.23 0.00 17 V 8.40 3.51 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 0.82 0.00 0.00 0.94 0.00 0.00 18 E 8.76 3.68 0.00 2.08 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 0.00 2.22 2.30 0.00 19 T 7.61 3.78 4.23 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 1.21 0.00 0.00 20 K 8.54 4.53 0.00 1.72 1.79 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.28 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.64 7.81 21 S 8.34 4.64 0.00 3.93 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.32 4.03 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 23 G 8.38 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 0.00 0.00 0.00 24 G 7.48 4.15 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 0.00 25 I 8.86 4.03 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 1.30 0.61 0.91 0.00 0.00 26 V 7.58 3.60 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 0.93 0.00 0.00 0.93 0.00 0.00 27 L 8.49 4.48 0.00 1.69 1.58 0.92 0.97 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 28 T 8.29 3.91 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 1.21 0.00 0.00 29 G 8.56 3.62 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 0.00 30 S 8.65 3.96 0.00 3.84 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 31 A 8.28 4.53 1.27 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 0.00 0.00 0.00 32 A 8.15 3.54 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 33 A 7.43 4.41 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 34 K 8.18 4.63 0.00 1.66 1.69 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.47 7.81 35 S 8.50 4.74 0.00 4.00 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 36 T 8.12 3.90 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 1.06 0.00 0.00 37 R 7.43 4.79 0.00 1.77 1.85 0.00 3.09 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 38 G 8.78 4.58 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 0.00 0.00 0.00 39 E 8.79 5.31 0.00 2.07 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 2.21 2.23 0.00 40 V 8.43 4.22 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 0.91 0.00 0.00 1.01 0.00 0.00 41 L 8.93 4.45 0.00 1.50 1.64 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.62 4.72 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.23 4.62 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 0.83 0.00 0.00 0.95 0.00 0.00 44 G 8.48 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 45 N 9.21 4.48 0.00 2.79 2.89 0.00 0.00 6.61 7.61 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 46 G 7.30 4.79 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 0.00 0.00 0.00 47 R 7.74 4.06 0.00 1.86 1.80 0.00 3.17 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 1.69 1.66 0.00 48 I 8.28 4.00 1.81 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.48 0.86 0.00 0.00 49 L 7.59 3.91 0.00 1.62 1.65 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.88 3.74 0.00 2.08 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 2.15 2.33 0.00 51 N 6.58 4.26 0.00 2.71 2.82 0.00 0.00 7.03 7.86 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 52 G 7.84 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 53 E 8.62 3.45 0.00 2.01 1.68 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 2.24 2.33 0.00 54 V 8.23 4.60 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 0.82 0.00 0.00 0.90 0.00 0.00 55 K 8.72 4.38 0.00 1.87 1.92 0.00 1.56 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.44 7.81 56 P 0.00 5.48 0.00 2.10 2.10 0.00 3.36 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.84 0.00 57 L 8.33 4.48 0.00 1.66 1.73 0.92 1.10 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 58 D 8.65 4.78 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.56 4.49 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 0.78 0.00 0.00 0.93 0.00 0.00 60 K 8.59 4.27 0.00 1.96 1.93 0.00 1.32 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.46 7.81 61 V 8.16 3.53 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 0.84 0.00 0.00 0.93 0.00 0.00 62 G 7.82 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 63 D 7.92 4.68 0.00 2.71 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.28 4.39 1.88 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 1.36 0.59 0.92 0.00 0.00 65 V 8.99 4.91 2.24 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 0.84 0.00 0.00 1.14 0.00 0.00 66 I 8.25 4.84 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.64 0.81 0.00 0.00 67 F 7.96 5.45 0.00 3.13 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 68 N 8.99 4.72 0.00 2.81 2.85 0.00 0.00 7.13 8.44 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 69 D 8.49 4.92 0.00 2.83 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.47 4.06 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 0.00 0.00 0.00 71 Y 8.89 4.22 0.00 3.05 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 72 G 8.13 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 0.00 0.00 0.00 73 V 7.19 3.97 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 0.64 0.00 0.00 0.94 0.00 0.00 74 K 8.76 4.65 0.00 1.61 1.57 0.00 1.51 0.00 0.00 1.36 0.00 0.00 2.57 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 1.38 7.81 75 S 8.45 5.15 0.00 3.81 3.67 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 76 E 9.04 4.80 0.00 1.84 1.74 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 2.17 2.35 0.00 77 K 8.60 4.82 0.00 1.69 1.66 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.48 7.81 78 I 8.10 4.37 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.42 0.90 0.00 0.00 79 D 9.75 4.55 0.00 2.95 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 80 N 8.36 4.31 0.00 2.86 2.94 0.00 0.00 6.98 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 81 E 8.02 4.63 0.00 2.31 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 2.21 2.27 0.00 82 E 8.73 4.42 0.00 1.86 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 2.31 2.29 0.00 83 V 8.48 4.74 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 0.78 0.00 0.00 0.94 0.00 0.00 84 L 8.90 5.25 0.00 1.48 1.27 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 85 I 8.65 5.07 1.80 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 1.23 0.89 0.85 0.00 0.00 86 M 8.52 5.07 0.00 1.82 2.03 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 87 S 8.32 5.33 0.00 4.20 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 88 E 8.88 3.95 0.00 2.02 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 2.39 2.36 0.00 89 S 8.19 4.14 0.00 3.91 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 90 D 8.22 4.58 0.00 2.88 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 91 I 7.62 4.53 2.02 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 1.35 0.51 0.97 0.00 0.00 92 L 8.62 4.68 0.00 1.64 1.71 0.94 0.78 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 93 A 7.53 4.60 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 8.20 4.87 1.88 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 1.25 0.74 0.95 0.00 0.00 95 V 8.91 4.13 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 0.75 0.00 0.00 0.93 0.00 0.00 96 E 8.68 4.52 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 97 A 8.66 4.10 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