NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2668 8.2549 117.2778 56.5265 31.6297 174.0643 3 H 4.7543 8.1725 116.0997 55.9031 29.4265 174.6605 4 L 3.9280 9.5690 124.0344 56.5720 42.1787 176.3593 5 K 4.5101 7.4906 115.6848 56.9917 31.2927 176.3616 6 S 4.5938 8.6902 113.5346 55.9983 66.2856 172.8603 7 G 3.8327 9.1764 108.6041 47.0985 0.0000 172.6135 8 R 3.4559 8.0136 124.4003 51.4305 33.2392 175.0973 9 K 4.1295 7.3932 118.8894 54.9766 34.3166 176.1223 10 L 4.5959 7.4314 115.7769 54.6466 43.3512 172.7499 11 N 4.7771 9.6050 121.8918 53.6082 39.7326 174.5334 12 R 4.3264 7.1169 125.3665 56.1178 35.1928 173.7840 13 H 5.0675 7.2062 115.5994 54.0089 33.1256 174.7661 14 S 3.2292 8.4073 109.3371 59.1501 64.4896 175.9769 15 S 4.0291 9.1968 118.1861 62.1717 63.2313 175.4144 16 H 4.1407 8.3470 121.4729 57.6113 29.6016 176.8536 17 R 3.3982 8.4243 120.3627 59.3737 30.1005 178.1747 18 L 3.6001 7.9457 119.7755 58.3152 42.0387 179.0473 19 A 4.0132 7.6507 119.7944 54.4782 18.2112 179.3695 20 L 3.8094 8.0655 119.6511 58.6410 42.1288 178.5401 21 Y 4.1889 7.3946 116.5566 61.2826 37.6969 179.2674 22 R 4.0491 7.6034 118.3365 59.5237 30.3850 178.8759 23 N 4.4948 8.5343 116.5607 56.2749 38.4085 177.5820 24 Q 3.9419 8.2516 119.2969 58.7809 28.9273 177.8737 25 A 4.0428 8.1814 122.0768 55.4955 18.3903 179.4939 26 K 3.8323 8.5097 116.9607 60.4137 32.1137 179.1915 27 S 4.1571 8.0839 114.6979 60.9638 62.4921 176.3541 28 L 3.9676 8.3703 124.0510 59.2604 42.3633 178.8661 29 L 3.9870 8.6664 119.5186 56.6814 41.0833 179.5686 30 T 3.8259 7.9206 118.9458 67.5271 68.8344 175.2694 31 H 4.4376 8.9208 115.7862 55.8645 28.8691 176.1077 32 G 4.2767 8.4709 113.7439 45.3584 0.0000 173.3356 33 R 5.0639 7.6464 117.9822 53.7150 33.3330 174.6986 34 I 4.8097 8.8755 122.5030 59.9108 42.0798 174.3363 35 T 5.0597 8.4552 120.1771 62.3771 71.3867 173.3349 36 T 4.5626 8.2611 118.2017 61.1970 72.3585 173.2422 37 T 4.5964 8.2204 110.2774 61.0663 69.9572 174.9155 38 V 3.4609 7.7856 121.4062 66.4756 31.4252 176.5055 39 P 4.2108 0.0000 0.0000 65.8087 31.2767 178.5059 40 K 3.8911 8.0420 116.4347 59.4911 32.1967 178.2227 41 A 4.1364 8.1901 121.2400 54.7322 18.3762 179.3360 42 K 3.7886 8.3888 116.8783 59.9172 31.1878 179.0228 43 E 3.9450 8.0733 118.7992 59.0272 29.5819 178.2961 44 L 3.9158 7.7631 120.6798 58.4371 42.0134 178.4713 45 R 3.9056 7.5345 115.5540 59.7983 29.0362 178.4365 46 G 3.8838 7.7833 106.7941 47.1600 0.0000 174.7351 47 F 3.9919 8.0775 121.1320 61.0308 39.6432 176.7863 48 V 3.6706 7.8064 116.9746 66.2488 31.4081 177.2586 49 D 4.1858 7.9312 118.3875 58.1199 40.7836 178.7792 50 H 4.1417 8.0950 117.9210 59.0394 29.4467 176.9046 51 L 4.0524 7.9565 120.0870 56.9710 41.9441 178.8605 52 I 3.7158 7.0969 119.3925 64.5740 37.1173 177.8131 53 H 3.8581 8.1608 119.0482 58.6028 29.3583 176.7470 54 L 4.1667 7.1185 119.6686 57.3160 41.9974 178.1821 55 A 5.0023 7.8644 120.2844 54.7934 18.3375 178.7864 56 K 4.0012 7.3097 115.2563 59.7542 32.3194 178.0596 57 R 4.0674 7.8416 116.0366 56.4201 30.4631 176.7817 58 G 3.6270 8.1448 107.2246 44.8730 0.0000 173.8566 59 D 4.3763 7.8325 120.1490 53.1793 41.0824 177.1940 60 L 3.8954 8.6067 122.9914 58.9968 42.0219 178.4656 61 H 4.0234 8.4469 116.9893 59.8428 29.7538 176.4789 62 A 4.0697 8.1593 121.5406 55.1443 18.1264 179.4887 63 R 4.3219 8.0437 117.2154 60.0804 30.1677 179.0750 64 R 4.0776 8.0957 116.1501 58.5461 29.7778 178.7794 65 L 4.1065 7.9844 119.5677 57.6225 41.7974 179.2686 66 V 3.6696 7.6751 117.3465 65.0669 31.2662 177.3820 67 L 4.1898 7.5957 118.7562 56.8894 41.9019 178.6530 68 R 4.1167 7.3386 116.4414 59.6919 30.3130 178.1335 69 D 4.6226 7.9052 116.5787 56.2038 41.2424 176.4812 70 L 4.3714 7.2283 118.7232 53.9961 42.2585 176.9081 71 Q 4.2593 8.5723 124.6579 57.6084 28.7511 175.5984 72 D 4.4583 7.9238 118.0952 53.5979 42.1110 176.1142 73 V 3.3949 8.4466 126.8649 66.0591 31.8196 177.2089 74 K 3.7871 8.1998 118.6544 59.9810 32.1295 177.8994 75 L 3.9478 7.6066 120.3076 58.1650 41.8800 179.1701 76 V 3.3609 7.7531 118.1889 66.1408 31.3437 177.8596 77 R 3.9713 7.9274 117.3332 58.9602 29.7913 178.7516 78 K 3.8076 7.3195 117.5873 59.6595 32.5067 176.8457 79 L 4.2957 8.1431 120.1515 56.7585 40.9146 177.8207 80 F 4.4740 8.8535 115.7622 60.7049 40.4389 175.7684 81 D 4.9005 7.8056 121.4476 50.1924 38.5177 175.7038 82 E 5.6187 7.4518 134.4240 57.6871 30.6936 178.4710 83 I 4.0285 7.8567 119.8493 64.1485 37.2421 178.1952 84 A 4.2132 7.5836 118.9178 55.0042 18.2193 177.5832 85 P 4.2297 0.0000 0.0000 66.1224 31.2322 178.6598 86 R 3.8881 7.3497 114.0238 58.0024 30.0870 176.7730 87 Y 4.7136 7.8646 115.5185 57.4228 39.5097 177.4256 88 R 3.8538 8.1456 122.1989 59.5674 30.1460 176.6839 89 D 4.7650 8.0165 113.5650 53.9871 41.1160 176.0152 90 R 4.4290 8.3575 120.4059 55.1605 31.3464 176.2792 91 Q 4.4032 8.3977 124.7198 52.2903 28.4437 174.2578 92 G 3.7487 8.2802 107.5866 44.7623 0.0000 171.1901 93 G 3.8866 8.2028 102.7157 46.8313 0.0000 173.1098 94 Y 4.1772 8.7016 115.8846 58.6909 39.5709 176.7346 95 T 5.1253 7.8758 113.6388 60.1064 70.6420 172.7125 96 R 4.7665 8.9727 127.1162 54.5806 33.9988 174.5604 97 V 4.8666 8.2718 123.1940 61.5581 34.3065 174.0679 98 L 4.7250 8.8964 129.3489 52.6979 43.7781 176.3125 99 K 4.3677 8.6371 124.2270 56.3449 32.5134 177.2249 100 L 4.4093 8.3440 124.6841 54.3738 42.7718 176.4037 101 A 4.3645 8.4061 123.5731 50.9947 20.7573 173.8902 102 E 3.5987 8.5652 124.1275 56.2286 28.4764 175.1725 103 R 4.3817 8.2286 119.5610 54.0647 31.2214 176.0625 104 R 3.7942 8.2969 119.0957 57.0988 30.0616 176.4413 105 R 4.4218 8.4865 125.2878 55.2793 28.3350 175.7664 106 G 4.5858 8.2821 124.4743 44.5526 0.0000 171.0552 107 D 5.4364 8.5690 131.9160 52.7771 39.7069 176.3446 108 G 3.8690 7.4564 108.2256 46.9728 0.0000 173.2805 109 A 4.8268 7.8889 119.2835 49.1231 22.2017 175.6888 110 P 4.6062 0.0000 0.0000 63.1430 32.8721 176.1231 111 L 5.1526 8.4325 122.7105 53.5555 45.0586 174.5806 112 A 4.9777 8.7790 119.7778 51.0662 23.1235 174.9512 113 L 4.6148 9.2044 122.9202 53.5084 44.2918 175.4423 114 V 5.0476 8.7006 125.9683 61.1639 34.5888 174.1110 115 E 5.2785 9.0334 124.3602 55.0546 34.0019 173.6269 116 L 4.8194 7.8959 119.9219 53.4598 42.2239 177.5736 117 V 3.6941 8.2626 124.7547 63.4353 32.2233 175.6783 118 E 4.6264 8.5928 126.1346 57.1989 29.6527 175.7724 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 R 8.25 4.27 0.00 1.86 1.99 0.00 3.02 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.70 0.00 3 H 8.17 4.75 0.00 3.28 3.12 0.00 5.72 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.57 3.93 0.00 1.85 1.79 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.49 4.51 0.00 1.84 1.82 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.43 7.81 6 S 8.69 4.59 0.00 3.87 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 7 G 9.18 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 0.00 0.00 0.00 8 R 8.01 3.46 0.00 1.93 1.97 0.00 3.42 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 9 K 7.39 4.13 0.00 1.89 1.85 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.22 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.70 1.54 7.81 10 L 7.43 4.60 0.00 1.62 1.61 0.93 1.01 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 11 N 9.61 4.78 0.00 2.63 2.70 0.00 0.00 7.19 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 12 R 7.12 4.33 0.00 1.72 1.58 0.00 2.97 0.00 0.00 2.71 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.12 0.00 13 H 7.21 5.07 0.00 3.31 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.41 3.23 0.00 4.08 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 15 S 9.20 4.03 0.00 4.07 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 0.00 16 H 8.35 4.14 0.00 2.72 3.06 0.00 5.71 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 17 R 8.42 3.40 0.00 1.73 1.87 0.00 3.08 0.00 0.00 2.92 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.91 0.00 18 L 7.95 3.60 0.00 1.61 1.70 0.91 1.49 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 19 A 7.65 4.01 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 20 L 8.07 3.81 0.00 1.66 1.58 0.94 0.89 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 21 Y 7.39 4.19 0.00 2.44 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 22 R 7.60 4.05 0.00 1.97 2.19 0.00 3.18 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.97 0.00 23 N 8.53 4.49 0.00 2.86 2.88 0.00 0.00 7.11 6.86 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 24 Q 8.25 3.94 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.59 0.00 25 A 8.18 4.04 1.60 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 0.00 0.00 26 K 8.51 3.83 0.00 2.00 1.91 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.77 7.81 27 S 8.08 4.16 0.00 4.10 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.37 3.97 0.00 1.62 1.92 0.95 1.12 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 29 L 8.67 3.99 0.00 1.92 1.57 0.92 0.67 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 30 T 7.92 3.83 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 1.03 0.00 0.00 31 H 8.92 4.44 0.00 3.27 3.34 0.00 5.73 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 32 G 8.47 4.28 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 0.00 33 R 7.65 5.06 0.00 1.66 1.82 0.00 3.24 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 34 I 8.88 4.81 1.89 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 1.26 1.06 0.92 0.00 0.00 35 T 8.46 5.06 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 1.29 0.00 0.00 36 T 8.26 4.56 4.25 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 1.22 0.00 0.00 37 T 8.22 4.60 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 38 V 7.79 3.46 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 1.09 0.00 0.00 0.97 0.00 0.00 39 P 0.00 4.21 0.00 2.20 2.10 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 40 K 8.04 3.89 0.00 1.75 1.96 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.52 7.81 41 A 8.19 4.14 1.42 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 0.00 0.00 0.00 42 K 8.39 3.79 0.00 1.76 1.90 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.67 7.81 43 E 8.07 3.95 0.00 2.20 1.73 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 2.26 2.08 0.00 44 L 7.76 3.92 0.00 1.82 1.82 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.53 3.91 0.00 2.15 2.15 0.00 2.86 0.00 0.00 3.17 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.68 0.00 46 G 7.78 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 0.00 0.00 0.00 47 F 8.08 3.99 0.00 2.75 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 48 V 7.81 3.67 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 0.94 0.00 0.00 1.01 0.00 0.00 49 D 7.93 4.19 0.00 2.89 2.70 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 50 H 8.09 4.14 0.00 3.17 3.31 0.00 5.77 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.96 4.05 0.00 1.62 1.52 0.64 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.10 3.72 1.29 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.60 0.46 0.00 0.00 53 H 8.16 3.86 0.00 2.80 3.07 0.00 5.58 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 54 L 7.12 4.17 0.00 1.74 1.76 0.91 0.96 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 55 A 7.86 5.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.31 4.00 0.00 1.89 1.84 0.00 1.81 0.00 0.00 1.92 0.00 0.00 3.58 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.51 7.81 57 R 7.84 4.07 0.00 1.88 1.88 0.00 3.17 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 58 G 8.14 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 59 D 7.83 4.38 0.00 2.92 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 60 L 8.61 3.90 0.00 1.74 1.76 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.45 4.02 0.00 3.27 3.53 0.00 5.94 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.16 4.07 1.55 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 63 R 8.04 4.32 0.00 2.26 2.25 0.00 3.22 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.19 0.00 64 R 8.10 4.08 0.00 1.82 1.98 0.00 3.24 0.00 0.00 3.24 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 65 L 7.98 4.11 0.00 1.94 1.66 0.68 0.49 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 66 V 7.68 3.67 1.81 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 0.76 0.00 0.00 0.91 0.00 0.00 67 L 7.60 4.19 0.00 1.96 1.76 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.34 4.12 0.00 1.86 1.97 0.00 3.21 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 69 D 7.91 4.62 0.00 2.63 2.90 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 70 L 7.23 4.37 0.00 1.61 1.58 0.81 0.94 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 71 Q 8.57 4.26 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 72 D 7.92 4.46 0.00 2.78 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 73 V 8.45 3.39 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 0.98 0.00 0.00 0.93 0.00 0.00 74 K 8.20 3.79 0.00 1.93 1.89 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.60 7.81 75 L 7.61 3.95 0.00 1.87 1.80 0.88 0.90 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 76 V 7.75 3.36 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 0.74 0.00 0.00 0.76 0.00 0.00 77 R 7.93 3.97 0.00 2.14 1.97 0.00 3.25 0.00 0.00 3.13 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 78 K 7.32 3.81 0.00 1.81 2.03 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.48 1.63 7.81 79 L 8.14 4.30 0.00 1.82 1.61 0.66 0.90 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 80 F 8.85 4.47 0.00 3.17 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 81 D 7.81 4.90 0.00 2.81 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 82 E 7.45 5.62 0.00 2.02 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 0.00 2.07 2.09 0.00 83 I 7.86 4.03 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.01 1.14 0.00 0.00 84 A 7.58 4.21 1.55 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 85 P 0.00 4.23 0.00 2.17 2.15 0.00 3.76 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 86 R 7.35 3.89 0.00 1.12 1.74 0.00 3.00 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.82 0.00 87 Y 7.86 4.71 0.00 3.31 3.10 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 88 R 8.15 3.85 0.00 1.89 1.99 0.00 3.42 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 89 D 8.02 4.76 0.00 2.70 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 90 R 8.36 4.43 0.00 1.73 1.74 0.00 2.82 0.00 0.00 2.99 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.45 0.00 91 Q 8.40 4.40 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.31 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 92 G 8.28 3.75 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 0.00 0.00 0.00 93 G 8.20 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 0.00 0.00 0.00 94 Y 8.70 4.18 0.00 2.78 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 0.00 0.00 0.00 0.00 95 T 7.88 5.13 4.25 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 1.38 0.00 0.00 96 R 8.97 4.77 0.00 1.90 1.72 0.00 3.10 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 1.51 1.54 0.00 97 V 8.27 4.87 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 0.87 0.00 0.00 0.93 0.00 0.00 98 L 8.90 4.73 0.00 1.60 1.56 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.64 4.37 0.00 1.64 1.76 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 100 L 8.34 4.41 0.00 1.71 1.60 0.92 1.03 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 0.00 101 A 8.41 4.36 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 0.00 102 E 8.57 3.60 0.00 2.12 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 2.22 2.28 0.00 103 R 8.23 4.38 0.00 2.00 1.92 0.00 3.06 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 104 R 8.30 3.79 0.00 2.03 2.07 0.00 3.08 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 105 R 8.49 4.42 0.00 1.84 1.89 0.00 3.37 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 8.28 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 5.44 0.00 2.86 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.46 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 0.00 0.00 0.00 109 A 7.89 4.83 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 0.00 110 P 0.00 4.61 0.00 2.13 2.20 0.00 3.67 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 2.07 2.00 0.00 111 L 8.43 5.15 0.00 1.57 1.71 0.98 0.99 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 0.00 112 A 8.78 4.98 1.19 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 0.00 0.00 113 L 9.20 4.61 0.00 1.75 1.54 0.97 0.93 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 0.00 114 V 8.70 5.05 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 1.08 0.00 0.00 0.93 0.00 0.00 115 E 9.03 5.28 0.00 2.07 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 2.21 2.32 0.00 116 L 7.90 4.82 0.00 1.51 1.89 1.04 0.89 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 0.00 117 V 8.26 3.69 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 0.76 0.00 0.00 1.03 0.00 0.00 118 E 8.59 4.63 0.00 2.10 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 1.99 2.14 0.00