NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9302 8.3393 109.7365 45.4538 0.0000 173.5458 2 S 4.4919 8.0094 113.3976 55.4245 65.0142 171.4735 3 S 4.5852 8.5127 117.4892 57.4333 64.1485 173.4871 4 G 4.2444 8.4781 116.9821 46.3068 0.0000 173.9625 5 S 4.6619 7.7565 117.3324 56.6213 62.0621 173.9600 6 S 4.2153 8.2150 118.4136 60.4137 63.6581 175.4020 7 G 4.0967 7.3604 107.1828 42.8979 0.0000 170.1390 8 P 4.3296 0.0000 0.0000 63.2105 32.0680 175.6508 9 V 3.1605 8.0474 118.7696 63.8219 28.9476 171.5390 10 L 4.4245 7.3569 124.0949 53.2409 43.3320 177.9989 11 T 3.8458 8.3215 113.9219 65.0264 67.4049 174.4515 12 Q 4.5936 7.4378 115.9013 55.4490 31.5433 175.2763 13 T 4.6101 8.1325 111.7955 60.4932 69.5595 171.3370 14 S 4.3611 7.8549 122.9502 58.2247 66.2400 173.6448 15 E 4.3802 8.7447 126.0844 55.6063 30.0000 175.7612 16 Q 4.8789 8.1360 122.2173 53.4232 32.3953 175.0158 17 A 4.5981 8.7593 121.1978 50.9225 19.6092 175.7695 18 P 4.5982 0.0000 0.0000 62.4302 32.5285 177.2427 19 S 5.1646 8.1190 122.0247 56.8748 62.8217 173.8896 20 S 4.4920 7.7797 112.1711 56.4947 65.2712 173.2879 21 A 4.4047 8.4774 130.7334 51.0751 18.9436 175.2012 22 P 4.4502 0.0000 0.0000 62.8083 32.2563 175.9185 23 R 4.5582 7.9392 118.6598 54.8226 33.1990 175.3800 24 D 4.4300 8.5908 113.6700 55.3587 39.5243 172.7239 25 V 4.4008 7.8465 117.1386 62.2548 31.2879 175.0299 26 Q 4.7510 8.9870 126.2492 54.2155 33.6784 173.8316 27 A 5.6702 8.9813 124.2684 49.3745 21.4661 175.7553 28 R 4.6168 8.3970 119.2159 54.4196 32.1407 175.5042 29 M 4.3356 8.7732 123.7112 55.2143 32.7364 175.9848 30 L 4.5975 8.3892 121.7571 55.1237 44.3253 175.8853 31 S 4.6139 7.4593 110.0024 56.9518 65.3076 172.8768 32 S 4.4048 8.6633 114.9554 61.3936 63.0220 174.8699 33 T 4.7877 7.5622 110.3763 61.2978 69.8507 173.6061 34 T 4.9655 8.0341 118.5229 63.0968 72.9222 173.4470 35 I 4.6949 8.8814 120.2753 59.0035 41.7170 174.1513 36 L 4.6391 8.1540 122.0069 53.7069 45.4775 174.5937 37 V 4.9577 9.1464 127.4416 61.1910 33.7180 174.2124 38 Q 4.8822 8.7366 125.6843 54.2484 31.8862 174.3662 39 W 5.9887 7.7177 117.3918 55.6390 31.6014 173.2098 40 K 4.6876 9.3137 119.0454 54.1659 35.0996 176.0949 41 E 4.7493 8.6797 120.8947 55.6309 30.2895 175.2977 42 P 4.6110 0.0000 0.0000 62.6323 32.2462 176.0441 43 E 4.3206 8.7505 116.4114 57.5761 30.3922 176.6848 44 E 4.6977 7.7062 118.8289 53.4954 29.3740 174.1523 45 P 4.1834 0.0000 0.0000 65.8280 32.2595 179.4997 46 N 4.1186 8.3816 115.1893 51.1452 35.7928 174.1682 47 G 4.5006 6.5080 103.6659 44.2842 0.0000 173.1468 48 Q 4.0532 7.9922 119.5276 55.2480 28.6919 176.7447 49 I 3.6040 8.1898 124.9872 61.4969 37.5678 176.2265 50 Q 4.1539 7.5874 123.9374 56.0236 29.5322 176.4274 51 G 3.6865 5.7311 103.1511 46.2758 0.0000 169.9179 52 Y 5.2497 8.3636 117.2191 57.0608 42.8238 174.2622 53 R 4.6964 8.8535 118.4105 54.8203 33.5699 173.9787 54 V 4.7360 8.2536 124.7048 61.3192 35.3106 173.6829 55 Y 5.3617 8.9583 123.2160 56.5193 40.2588 174.1427 56 Y 5.7740 8.5358 121.9369 55.4502 41.5045 173.8502 57 T 4.6095 7.9064 115.8016 60.9745 70.2367 174.1678 58 M 3.1590 8.7834 125.0096 57.1931 31.6946 176.4493 59 D 4.6831 7.2098 120.3528 51.6947 40.2884 174.6096 60 P 3.8240 0.0000 0.0000 64.0816 32.0179 178.5253 61 T 3.9228 7.7968 113.3799 64.5200 67.3732 173.6452 62 Q 4.5451 7.5028 119.8684 54.4736 30.5499 174.6688 63 H 4.2001 8.5038 118.3647 55.9810 30.0783 176.4389 64 V 2.2546 7.6676 118.5538 63.8863 30.8962 178.1776 65 N 4.4527 8.1291 115.2331 55.6070 38.9531 175.2203 66 N 4.7644 8.3828 116.9957 53.2852 39.8138 174.6107 67 W 4.5721 7.3434 118.8071 57.0264 29.8725 176.1036 68 M 4.0046 7.9511 119.3092 57.2160 31.3354 176.8709 69 K 4.0979 7.9701 119.4314 55.9164 31.7207 173.5925 70 H 5.2923 8.7745 119.3770 54.9646 33.3312 171.6905 71 N 5.2813 8.4721 114.5402 51.7178 41.8240 174.5092 72 V 4.6288 8.3964 119.7305 61.2497 34.8472 174.4850 73 A 4.6352 8.0020 127.3063 51.6633 19.1740 175.7513 74 D 4.6234 8.0826 122.2970 55.2266 39.9148 172.9562 75 S 4.4481 7.6625 113.3378 57.3736 65.4132 174.5490 76 Q 2.5200 8.0236 116.5892 55.4640 25.9995 172.0133 77 I 4.1702 6.3042 114.2216 60.3270 41.6157 173.5979 78 T 4.7787 8.9665 123.7928 60.7942 71.2974 172.1295 79 T 4.9321 8.5875 118.5000 60.1537 70.6530 173.3861 80 I 4.3274 7.9012 126.6243 59.6817 39.8716 175.8077 81 G 4.1562 7.7999 112.4919 45.8868 0.0000 171.1024 82 N 4.1251 8.6995 114.3170 54.9522 37.0988 174.2474 83 L 4.8062 7.7155 117.7223 52.5343 44.5940 175.5748 84 V 4.4670 8.0902 118.2403 59.4625 33.3330 173.8543 85 P 4.5000 0.0000 0.0000 63.3369 32.3435 175.4461 86 Q 3.4716 8.8354 116.2876 56.3487 26.2242 175.0218 87 K 4.5872 8.1007 116.0310 55.2779 37.4118 177.5609 88 T 4.2480 8.6229 122.4940 64.0352 69.3104 173.3717 89 Y 4.5650 8.6567 122.4826 56.2975 42.0474 175.1445 90 S 5.5161 8.1318 119.6355 57.5463 64.8210 173.4987 91 V 5.2166 8.5057 121.5649 61.7580 35.1381 173.9113 92 K 4.8254 9.3288 125.7542 55.0433 36.8471 175.3355 93 V 4.9428 8.3264 120.3392 61.2338 34.9119 173.2686 94 L 4.7501 8.3065 124.5414 54.7109 44.5040 173.7081 95 A 5.2653 8.7114 120.3363 50.2192 22.0894 175.2367 96 F 5.3393 7.9862 115.0615 55.5624 41.6171 173.8598 97 T 4.6353 8.7244 110.4228 59.3769 71.5975 174.5348 98 S 3.8818 8.6203 114.8404 61.4915 62.4601 175.6176 99 I 3.9389 7.9038 120.3999 63.1785 37.7573 175.8212 100 G 3.9849 7.4988 109.2611 45.5889 0.0000 171.7031 101 D 5.2912 8.7729 120.9509 51.6916 41.8654 174.9828 102 G 4.6543 8.1911 106.8926 43.1002 0.0000 171.0736 103 P 4.5758 0.0000 0.0000 62.4894 32.1231 176.5648 104 L 4.5304 8.4060 122.5700 54.9755 43.0797 175.2758 105 S 4.7559 7.7675 115.1729 56.4577 65.8311 173.9470 106 S 4.1039 8.0646 115.5476 58.4728 62.2971 174.3253 107 D 4.5842 8.7944 125.9727 54.2140 39.2277 176.1206 108 I 4.6947 8.3766 115.7802 59.1051 41.6471 174.4598 109 Q 4.9976 8.4663 120.5777 54.2597 32.8607 174.4570 110 V 4.7657 8.6411 123.6050 59.8698 34.3712 174.9155 111 I 4.4584 8.4240 125.3769 60.7740 38.6611 176.4534 112 T 4.4132 8.4079 116.3645 61.1441 68.4537 173.0778 113 Q 4.7923 8.1126 125.2707 54.8128 31.8035 175.2649 114 T 4.0591 8.2858 111.4375 61.3165 69.7811 172.3188 115 G 3.5827 7.7318 109.9361 44.0574 0.0000 172.5160 116 S 4.6068 8.2472 119.0633 56.2882 66.3036 173.6382 117 G 3.9911 8.0064 105.2946 44.1672 0.0000 171.5004 118 P 4.3814 0.0000 0.0000 62.1356 31.8847 176.7490 119 S 4.1953 8.5965 118.7158 58.6953 63.3459 173.3458 120 S 4.6463 8.2785 117.7212 56.5306 65.2460 174.0278 121 G 4.2863 8.5823 110.7058 46.0917 0.0000 173.6296 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 G 8.34 3.93 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 0.00 2 S 8.01 4.49 0.00 4.06 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 3 S 8.51 4.59 0.00 3.85 3.80 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 4 G 8.48 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 5 S 7.76 4.66 0.00 3.85 3.81 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 6 S 8.21 4.22 0.00 3.98 3.99 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 7 G 7.36 4.10 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 0.00 0.00 0.00 8 P 0.00 4.33 0.00 2.19 2.06 0.00 3.92 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 9 V 8.05 3.16 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 0.78 0.00 0.00 0.93 0.00 0.00 10 L 7.36 4.42 0.00 1.75 1.59 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.32 3.85 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 12 Q 7.44 4.59 0.00 2.23 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 13 T 8.13 4.61 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 14 S 7.85 4.36 0.00 3.83 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 15 E 8.74 4.38 0.00 1.93 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 0.00 2.28 2.38 0.00 16 Q 8.14 4.88 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 17 A 8.76 4.60 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 18 P 0.00 4.60 0.00 2.17 2.23 0.00 3.70 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 2.29 2.03 0.00 19 S 8.12 5.16 0.00 3.82 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 20 S 7.78 4.49 0.00 3.84 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 21 A 8.48 4.40 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 22 P 0.00 4.45 0.00 2.02 1.93 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.84 0.00 23 R 7.94 4.56 0.00 1.82 1.91 0.00 3.30 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 24 D 8.59 4.43 0.00 2.93 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 25 V 7.85 4.40 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 0.81 0.00 0.00 0.97 0.00 0.00 26 Q 8.99 4.75 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.55 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 27 A 8.98 5.67 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 28 R 8.40 4.62 0.00 1.85 2.03 0.00 2.96 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 29 M 8.77 4.34 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.49 0.00 30 L 8.39 4.60 0.00 1.59 1.65 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 31 S 7.46 4.61 0.00 3.73 3.69 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 32 S 8.66 4.40 0.00 3.89 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 33 T 7.56 4.79 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 1.24 0.00 0.00 34 T 8.03 4.97 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 35 I 8.88 4.69 1.80 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.79 0.81 0.00 0.00 36 L 8.15 4.64 0.00 1.74 1.57 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.15 4.96 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 1.43 0.00 0.00 0.95 0.00 0.00 38 Q 8.74 4.88 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.26 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 39 W 7.72 5.99 0.00 3.40 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 40 K 9.31 4.69 0.00 1.70 1.78 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.37 7.81 41 E 8.68 4.75 0.00 1.93 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 2.52 2.53 0.00 42 P 0.00 4.61 0.00 2.23 2.30 0.00 3.93 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 43 E 8.75 4.32 0.00 2.11 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 2.29 2.29 0.00 44 E 7.71 4.70 0.00 2.02 1.89 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 2.29 2.26 0.00 45 P 0.00 4.18 0.00 2.37 2.32 0.00 3.92 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 2.08 2.01 0.00 46 N 8.38 4.12 0.00 3.15 2.95 0.00 0.00 7.09 7.64 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 47 G 6.51 4.50 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 0.00 0.00 0.00 48 Q 7.99 4.05 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 49 I 8.19 3.60 1.74 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.74 0.29 0.00 0.00 50 Q 7.59 4.15 0.00 1.92 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 51 G 5.73 3.69 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 0.00 0.00 0.00 52 Y 8.36 5.25 0.00 3.15 3.14 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 53 R 8.85 4.70 0.00 1.91 1.77 0.00 3.08 0.00 0.00 3.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.28 0.00 54 V 8.25 4.74 2.23 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 1.24 0.00 0.00 1.01 0.00 0.00 55 Y 8.96 5.36 0.00 3.15 3.14 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 56 Y 8.54 5.77 0.00 3.15 3.08 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 0.00 0.00 0.00 57 T 7.91 4.61 3.93 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 -0.38 0.00 0.00 58 M 8.78 3.16 0.00 1.66 1.80 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 59 D 7.21 4.68 0.00 2.55 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 60 P 0.00 3.82 0.00 2.27 1.74 0.00 3.60 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.78 0.00 61 T 7.80 3.92 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 62 Q 7.50 4.55 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.66 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 63 H 8.50 4.20 0.00 3.16 3.12 0.00 5.68 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 V 7.67 2.25 1.11 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 -0.56 0.00 0.00 0.50 0.00 0.00 65 N 8.13 4.45 0.00 2.64 2.80 0.00 0.00 6.76 7.75 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 66 N 8.38 4.76 0.00 2.78 3.10 0.00 0.00 7.21 8.01 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 67 W 7.34 4.57 0.00 3.60 3.19 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 0.00 68 M 7.95 4.00 0.00 1.55 1.88 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.39 0.00 69 K 7.97 4.10 0.00 1.91 1.69 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.32 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.58 1.67 7.81 70 H 8.77 5.29 0.00 3.40 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.47 5.28 0.00 2.55 2.67 0.00 0.00 6.56 7.71 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 72 V 8.40 4.63 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 1.25 0.00 0.00 1.29 0.00 0.00 73 A 8.00 4.64 1.26 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 0.00 0.00 74 D 8.08 4.62 0.00 2.73 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 75 S 7.66 4.45 0.00 3.86 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 76 Q 8.02 2.52 0.00 2.01 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.69 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 77 I 6.30 4.17 1.57 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.45 0.81 0.00 0.00 78 T 8.97 4.78 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 1.43 0.00 0.00 79 T 8.59 4.93 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 1.20 0.00 0.00 80 I 7.90 4.33 1.46 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.28 0.41 0.00 0.00 81 G 7.80 4.16 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 0.00 82 N 8.70 4.13 0.00 2.84 2.91 0.00 0.00 6.75 7.80 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 83 L 7.72 4.81 0.00 1.45 1.19 0.47 0.82 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 84 V 8.09 4.47 2.16 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 0.98 0.00 0.00 0.98 0.00 0.00 85 P 0.00 4.50 0.00 2.22 2.11 0.00 3.94 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 86 Q 8.84 3.47 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 87 K 8.10 4.59 0.00 1.99 1.60 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.60 1.60 7.81 88 T 8.62 4.25 4.16 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 1.19 0.00 0.00 89 Y 8.66 4.57 0.00 3.00 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 90 S 8.13 5.52 0.00 3.39 3.99 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 91 V 8.51 5.22 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 1.12 0.00 0.00 1.04 0.00 0.00 92 K 9.33 4.83 0.00 1.99 1.66 0.00 1.44 0.00 0.00 1.12 0.00 0.00 2.58 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.71 7.81 93 V 8.33 4.94 1.57 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 -0.61 0.00 0.00 0.41 0.00 0.00 94 L 8.31 4.75 0.00 1.83 1.79 1.17 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.71 5.27 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 96 F 7.99 5.34 0.00 3.23 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 97 T 8.72 4.64 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 1.12 0.00 0.00 98 S 8.62 3.88 0.00 3.86 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 99 I 7.90 3.94 1.95 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 0.98 0.92 0.00 0.00 100 G 7.50 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 0.00 101 D 8.77 5.29 0.00 2.81 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 0.00 102 G 8.19 4.65 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 0.00 103 P 0.00 4.58 0.00 2.08 2.06 0.00 3.89 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 2.00 2.01 0.00 104 L 8.41 4.53 0.00 1.45 1.60 0.65 0.57 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 0.00 105 S 7.77 4.76 0.00 3.80 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 0.00 106 S 8.06 4.10 0.00 3.93 3.89 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 0.00 107 D 8.79 4.58 0.00 2.76 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 0.00 108 I 8.38 4.69 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.05 0.98 0.00 0.00 109 Q 8.47 5.00 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.03 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 110 V 8.64 4.77 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 0.75 0.00 0.00 0.96 0.00 0.00 111 I 8.42 4.46 1.90 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 1.42 0.59 0.94 0.00 0.00 112 T 8.41 4.41 4.26 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 1.20 0.00 0.00 113 Q 8.11 4.79 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.02 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 114 T 8.29 4.06 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 1.23 0.00 0.00 115 G 7.73 3.58 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 0.00 116 S 8.25 4.61 0.00 3.93 3.83 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 0.00 0.00 0.00 117 G 8.01 3.99 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 0.00 118 P 0.00 4.38 0.00 2.19 2.07 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 119 S 8.60 4.20 0.00 3.89 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 0.00 120 S 8.28 4.65 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 0.00 121 G 8.58 4.29 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 0.00