NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2057 8.2649 123.5787 51.9937 19.8741 175.8695 3 I 4.3781 7.9641 120.9715 57.8211 38.4480 170.5917 4 V 3.9511 8.2048 129.1827 61.8377 33.1908 176.3397 5 K 4.9201 8.5688 127.0267 54.9956 32.7058 174.9854 6 V 4.7359 8.6100 121.2584 60.2923 35.0287 174.4719 7 T 4.8686 8.9766 111.1537 59.7088 72.3486 174.5046 8 D 4.4676 9.5176 120.0381 56.7932 40.8995 179.3453 9 A 4.1001 7.6837 120.4153 54.3601 18.6512 177.7091 10 D 4.9272 7.9580 112.3778 52.5770 40.6518 177.1484 11 F 3.8839 8.4088 122.9906 62.1801 39.4485 176.9622 12 D 4.4549 8.4153 117.9402 57.1656 40.3429 178.6532 13 S 4.3083 7.8742 113.4425 60.7697 63.6166 176.1444 14 K 4.0151 7.7669 121.3030 58.4135 31.9628 178.5213 15 V 4.0828 7.2508 119.6788 62.7876 31.6615 177.6360 16 E 3.9915 7.3602 116.4530 59.7370 30.0754 182.4986 17 S 4.5749 7.5587 114.2416 60.1004 65.2736 176.7215 18 G 4.1617 8.3976 109.7391 45.7800 0.0000 176.4250 19 V 4.9399 8.8207 125.4089 61.4647 33.4086 173.2866 20 Q 4.9646 9.3111 126.1498 54.2854 33.7739 173.3393 21 L 4.8870 9.1503 125.9007 53.5413 44.2499 174.9612 22 V 4.6682 8.9267 127.1467 61.2827 33.8607 173.7607 23 D 4.9019 9.3324 129.0319 53.1610 42.7788 175.2349 24 F 5.1758 9.3774 126.9492 56.3718 40.3799 175.0793 25 W 5.1859 8.6730 121.1467 55.4859 32.1958 173.5639 26 A 3.6745 7.9476 117.8494 50.8293 20.9458 177.9524 27 T 3.9634 8.0016 110.9212 64.3323 68.8647 175.2802 28 W 4.4170 7.1365 116.1672 56.8614 28.6068 176.9193 29 C 4.6194 7.5397 121.2260 55.6352 37.6964 173.8963 30 G 3.5104 8.6787 115.6814 47.6720 0.0000 172.9657 31 P 4.4121 0.0000 0.0000 65.0992 31.4291 179.4667 32 C 4.4966 8.0210 118.0022 60.4874 39.8842 176.7800 33 K 3.8900 7.7854 124.1426 59.8019 31.2941 180.8322 34 M 4.4121 7.8703 117.6095 58.5121 32.6389 177.7159 35 I 4.1443 8.0289 111.8078 62.3963 38.1668 177.5405 36 A 3.8428 7.7810 123.5886 55.0560 18.1854 177.8228 37 P 4.2011 0.0000 0.0000 66.0111 31.3161 178.6798 38 V 3.6360 7.7519 117.5706 65.7169 31.4618 177.8908 39 L 3.9956 7.9473 118.9728 57.6359 40.9546 179.1429 40 E 4.0534 8.2137 120.8567 59.9318 29.3373 180.0319 41 E 3.9955 8.0388 117.8642 61.0389 29.6872 180.9081 42 L 4.3557 7.7891 120.2595 57.9516 42.4627 178.4980 43 A 4.1570 8.4730 120.7865 55.3053 18.1807 179.4858 44 A 3.9786 7.7133 118.3237 55.4656 18.2983 179.5075 45 D 4.4632 8.1669 115.6929 56.4213 40.9861 176.8957 46 Y 4.5129 7.7975 118.4252 57.8298 38.9742 175.5695 47 E 4.0785 7.8017 116.7922 57.8200 29.8935 181.3554 48 G 4.0511 9.2196 114.6149 45.0723 0.0000 174.5392 49 K 4.4081 8.6117 119.5050 55.5784 33.3220 181.8277 50 A 5.0358 7.6970 118.3664 50.1824 22.6408 174.7071 51 D 4.9170 8.5927 118.9509 52.7504 43.6086 175.6947 52 I 4.8990 8.2151 122.5464 59.6094 39.9629 174.5782 53 L 5.2220 9.1644 126.8808 52.7761 45.4599 175.5210 54 K 4.9984 8.6068 120.0343 54.5839 35.7635 175.1871 55 L 4.9765 9.3396 126.1574 52.9866 45.0825 175.1749 56 D 3.7716 8.6739 127.1228 53.8529 41.1892 177.3172 57 V 3.7281 8.3552 121.7734 64.2564 31.9542 177.8481 58 D 4.5243 8.1298 119.0934 57.2938 40.7385 177.1487 59 E 4.2840 8.3119 115.6797 57.3804 30.2466 176.3272 60 N 5.5884 7.9310 116.0517 49.4485 39.5004 173.6332 61 P 4.3781 0.0000 0.0000 65.9004 31.7153 178.5810 62 S 4.0910 8.1772 114.4627 62.0668 62.5163 176.7094 63 T 3.8158 8.6122 118.3315 66.4962 68.0055 176.6980 64 A 4.2300 7.8833 121.4029 55.0093 18.3800 179.6314 65 A 3.8821 8.4137 119.7772 55.1251 18.2818 179.5409 66 K 3.6586 8.0184 117.3023 59.4044 32.1450 177.6625 67 Y 4.5091 7.4675 113.8379 57.0050 38.9953 175.1995 68 E 3.6367 7.8657 117.0354 57.1971 27.7773 176.0618 69 V 3.6754 7.8576 119.1339 62.9185 31.0248 175.1310 70 M 4.2328 8.7546 129.3313 57.7035 32.7429 177.6412 71 S 5.0320 7.7892 112.7544 56.0634 65.3912 174.9780 72 I 4.9519 7.9625 113.6794 58.2553 40.6684 173.3718 73 P 4.7721 0.0000 0.0000 63.5078 32.7388 175.1395 74 T 5.0934 8.5597 116.8637 61.8788 72.8853 172.7494 75 L 5.5103 9.2739 125.4073 53.0463 45.2962 175.4577 76 I 4.8949 8.8021 124.0910 59.4405 40.7309 174.6230 77 V 4.4806 8.5748 127.3278 61.9287 32.8387 174.5284 78 F 5.0480 9.6979 127.7642 55.7282 41.7837 174.9978 79 K 4.7182 9.1327 123.5810 54.5337 34.6650 175.9192 80 D 5.5305 9.3425 130.7441 54.4564 38.7067 175.7175 81 G 4.1749 8.2242 103.7310 45.6562 0.0000 172.5897 82 Q 4.8469 7.9592 119.5164 52.9644 31.2505 173.2018 83 P 3.9687 0.0000 0.0000 62.7271 31.7751 176.2603 84 V 4.3340 8.3620 115.4641 61.2729 33.9811 175.0236 85 D 4.7332 7.5154 118.4060 52.8962 44.9025 173.6272 86 K 5.0133 8.3603 122.7576 54.8101 35.6191 175.3288 87 V 4.4859 9.1287 126.6680 61.0692 34.6473 174.2210 88 V 4.7017 8.4075 126.7143 62.1017 34.3011 176.0664 89 G 4.0025 8.9018 115.4312 44.1879 0.0000 173.0163 90 F 4.2002 8.5977 120.4475 58.5544 39.7551 174.2639 91 Q 4.2597 6.7140 124.3442 53.4333 32.9541 173.1721 92 P 4.3339 0.0000 0.0000 61.7715 32.4231 177.2504 93 K 3.8668 8.8751 123.9713 60.5687 31.9820 179.4622 94 E 3.9941 8.1584 117.8628 61.4144 29.5117 181.0171 95 N 4.6116 8.0499 117.0113 55.8511 38.5977 177.7032 96 L 3.9386 7.7812 119.9591 57.5228 41.8042 178.9803 97 A 3.9709 8.3536 123.4184 55.6308 18.3477 180.0707 98 E 3.9232 8.0181 116.3065 61.4835 29.6200 181.4873 99 V 3.7984 7.2431 118.1938 65.7584 31.7579 177.9386 100 L 4.1015 7.8026 118.4624 57.9824 41.4082 179.0362 101 D 4.6640 8.3752 118.9868 57.2718 40.5401 178.4321 102 K 4.1620 7.8615 118.0369 58.1697 32.2310 176.5815 103 H 4.8838 8.3573 113.4163 55.7608 30.5573 173.4850 104 L 4.3092 7.6390 125.4376 54.8718 41.5694 176.3016 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 8.26 4.21 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 3 I 7.96 4.38 1.78 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 1.34 0.70 0.91 0.00 0.00 4 V 8.20 3.95 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 0.66 0.00 0.00 0.90 0.00 0.00 5 K 8.57 4.92 0.00 1.57 1.63 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.00 7.81 6 V 8.61 4.74 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 0.95 0.00 0.00 0.95 0.00 0.00 7 T 8.98 4.87 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 8 D 9.52 4.47 0.00 2.73 2.78 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 9 A 7.68 4.10 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 10 D 7.96 4.93 0.00 2.77 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 11 F 8.41 3.88 0.00 3.36 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 12 D 8.42 4.45 0.00 2.91 2.77 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 13 S 7.87 4.31 0.00 3.99 3.97 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 0.00 0.00 0.00 14 K 7.77 4.02 0.00 1.61 1.66 0.00 1.51 0.00 0.00 1.85 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.38 7.81 15 V 7.25 4.08 1.49 0.00 0.00 0.00 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 -0.61 0.00 0.00 16 E 7.36 3.99 0.00 2.22 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 2.27 2.26 0.00 17 S 7.56 4.57 0.00 3.82 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 18 G 8.40 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 19 V 8.82 4.94 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 0.99 0.00 0.00 1.00 0.00 0.00 20 Q 9.31 4.96 0.00 1.92 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.56 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 21 L 9.15 4.89 0.00 1.65 1.48 0.91 0.70 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 22 V 8.93 4.67 2.44 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 0.49 0.00 0.00 0.85 0.00 0.00 23 D 9.33 4.90 0.00 2.79 2.63 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 24 F 9.38 5.18 0.00 3.24 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 25 W 8.67 5.19 0.00 3.44 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 26 A 7.95 3.67 0.05 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 0.00 0.00 27 T 8.00 3.96 4.31 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 1.19 0.00 0.00 28 W 7.14 4.42 0.00 3.59 3.27 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 29 C 7.54 4.62 0.00 2.24 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 30 G 8.68 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 P 0.00 4.41 0.00 2.26 2.22 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 32 C 8.02 4.50 0.00 3.25 3.26 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 33 K 7.79 3.89 0.00 1.85 1.73 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.32 7.81 34 M 7.87 4.41 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 35 I 8.03 4.14 1.82 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 1.67 0.50 1.15 0.00 0.00 36 A 7.78 3.84 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 37 P 0.00 4.20 0.00 2.28 2.31 0.00 3.80 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 2.20 2.04 0.00 38 V 7.75 3.64 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 1.02 0.00 0.00 39 L 7.95 4.00 0.00 1.83 1.62 0.85 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.21 4.05 0.00 2.18 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 2.26 2.41 0.00 41 E 8.04 4.00 0.00 1.98 1.95 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 2.24 2.18 0.00 42 L 7.79 4.36 0.00 1.74 1.89 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.47 4.16 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 44 A 7.71 3.98 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 45 D 8.17 4.46 0.00 3.04 2.65 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 46 Y 7.80 4.51 0.00 3.04 2.93 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 47 E 7.80 4.08 0.00 1.93 1.77 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 2.27 2.15 0.00 48 G 9.22 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 0.00 0.00 0.00 49 K 8.61 4.41 0.00 1.73 1.70 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.74 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.22 7.81 50 A 7.70 5.04 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 51 D 8.59 4.92 0.00 2.62 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 52 I 8.22 4.90 1.83 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 1.27 0.94 0.85 0.00 0.00 53 L 9.16 5.22 0.00 1.40 1.44 0.62 0.57 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 54 K 8.61 5.00 0.00 1.65 1.78 0.00 1.30 0.00 0.00 0.90 0.00 0.00 2.44 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.18 1.16 7.81 55 L 9.34 4.98 0.00 1.46 0.97 0.85 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.67 3.77 0.00 2.32 2.35 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 57 V 8.36 3.73 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 0.89 0.00 0.00 1.04 0.00 0.00 58 D 8.13 4.52 0.00 2.80 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 59 E 8.31 4.28 0.00 2.17 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 2.32 2.15 0.00 60 N 7.93 5.59 0.00 2.75 2.87 0.00 0.00 6.99 7.92 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 61 P 0.00 4.38 0.00 2.27 2.33 0.00 3.67 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 62 S 8.18 4.09 0.00 4.21 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 63 T 8.61 3.82 4.14 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 0.48 0.00 0.00 64 A 7.88 4.23 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 A 8.41 3.88 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 K 8.02 3.66 0.00 1.64 1.78 0.00 1.65 0.00 0.00 1.45 0.00 0.00 2.70 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.48 1.16 7.81 67 Y 7.47 4.51 0.00 2.90 2.93 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 68 E 7.87 3.64 0.00 2.06 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 2.22 2.34 0.00 69 V 7.86 3.68 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 0.63 0.00 0.00 -0.01 0.00 0.00 70 M 8.75 4.23 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.62 0.00 71 S 7.79 5.03 0.00 3.60 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 72 I 7.96 4.95 2.04 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.09 1.05 0.00 0.00 73 P 0.00 4.77 0.00 2.20 2.30 0.00 3.71 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 74 T 8.56 5.09 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 1.10 0.00 0.00 75 L 9.27 5.51 0.00 1.53 1.56 0.88 0.76 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 76 I 8.80 4.89 2.16 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.84 0.37 0.00 0.00 77 V 8.57 4.48 1.94 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 0.80 0.00 0.00 0.90 0.00 0.00 78 F 9.70 5.05 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 79 K 9.13 4.72 0.00 1.67 1.64 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.54 7.81 80 D 9.34 5.53 0.00 2.84 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 81 G 8.22 4.17 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 0.00 0.00 0.00 82 Q 7.96 4.85 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 83 P 0.00 3.97 0.00 1.92 1.47 0.00 3.84 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 84 V 8.36 4.33 1.95 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 0.67 0.00 0.00 0.65 0.00 0.00 85 D 7.52 4.73 0.00 2.57 2.40 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 86 K 8.36 5.01 0.00 1.67 1.56 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.66 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.28 1.37 7.81 87 V 9.13 4.49 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 0.83 0.00 0.00 0.90 0.00 0.00 88 V 8.41 4.70 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 0.88 0.00 0.00 0.93 0.00 0.00 89 G 8.90 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.60 4.20 0.00 3.03 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 6.71 4.26 0.00 1.75 1.72 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 2.36 2.22 0.00 92 P 0.00 4.33 0.00 2.15 1.99 0.00 3.51 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 93 K 8.88 3.87 0.00 1.90 1.83 0.00 1.84 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.09 7.81 94 E 8.16 3.99 0.00 2.01 1.95 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 2.32 1.98 0.00 95 N 8.05 4.61 0.00 2.83 2.84 0.00 0.00 7.07 6.41 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 96 L 7.78 3.94 0.00 1.72 1.60 0.80 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.35 3.97 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.02 3.92 0.00 2.01 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 2.25 2.20 0.00 99 V 7.24 3.80 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 1.00 0.00 0.00 0.98 0.00 0.00 100 L 7.80 4.10 0.00 1.65 1.49 0.21 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 101 D 8.38 4.66 0.00 2.83 2.78 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 0.00 102 K 7.86 4.16 0.00 1.97 1.88 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.35 7.81 103 H 8.36 4.88 0.00 3.18 3.24 0.00 5.69 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.64 4.31 0.00 1.65 1.62 1.15 0.83 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