NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4152 8.1927 115.2907 58.3242 64.3019 175.0757 2 N 4.2430 8.4887 122.6944 55.4641 40.0152 174.6447 3 I 3.9422 8.5541 118.7365 63.6287 39.7576 175.6982 4 I 4.0102 7.1198 120.5303 61.7328 38.6289 176.7684 5 K 3.4191 8.7253 120.4770 58.7723 32.4931 178.4452 6 Q 3.9968 8.6831 120.1315 58.7244 29.0338 177.6059 7 L 3.9348 7.7558 119.6008 57.1120 41.9009 178.7326 8 E 4.1134 8.0966 119.2758 58.8496 29.2696 178.6232 9 Q 4.2008 8.3076 117.9500 59.2193 28.4845 178.3709 10 E 3.6891 9.0976 122.1749 58.3516 29.3677 177.7970 11 Q 4.3781 8.1822 116.2640 56.2968 30.8209 176.1268 12 M 3.6277 7.1097 117.4270 55.6283 32.2533 176.5446 13 K 4.4692 8.5478 122.5436 56.2774 34.3415 175.9657 14 Q 4.5397 8.2038 114.9518 56.0190 30.0000 175.3986 15 D 4.6459 8.2883 114.9349 53.9916 41.3074 175.7391 16 V 4.1228 7.3744 111.6626 59.1816 32.9321 174.4490 17 P 4.5440 0.0000 0.0000 61.8917 33.3915 175.2554 18 S 4.1857 8.5017 112.6602 58.9020 62.8109 174.0671 19 F 5.4371 8.1942 124.7478 55.8681 42.5105 174.0711 20 R 4.3840 7.2117 119.5375 55.8470 31.9340 172.7705 21 P 4.2603 0.0000 0.0000 63.1926 30.9652 176.9995 22 G 3.8983 7.8168 108.2805 46.9462 0.0000 173.9316 23 D 4.5872 7.8576 118.6753 55.0946 41.5968 177.6429 24 T 3.8864 9.8177 118.0832 65.6431 69.1177 176.4582 25 V 3.2656 7.6936 114.8056 60.0841 31.0226 171.3791 26 E 4.9340 8.1068 119.8362 55.2178 32.3826 173.7064 27 V 4.3625 8.9610 128.2210 61.8163 33.3917 174.9559 28 K 4.9441 8.3322 126.5276 55.0553 33.9835 175.8506 29 V 4.3438 8.5878 119.2646 59.1059 34.9952 175.9871 30 W 5.1315 8.3408 120.4639 57.7411 29.5457 174.7768 31 V 4.4766 8.8104 117.8810 62.5987 37.5073 173.8779 32 V 3.7435 8.1392 123.1698 62.7995 31.6723 172.1810 33 E 3.6340 7.5518 117.6260 57.4177 31.3302 175.8771 34 G 3.7335 9.0132 106.0278 46.2206 0.0000 174.3136 35 S 4.5887 9.3051 115.4757 58.4740 63.5706 173.9896 36 K 4.6714 6.8285 120.5513 56.6467 34.1764 175.8006 37 K 4.3992 7.9992 113.5661 56.2254 32.0653 175.3109 38 R 4.0822 7.9459 120.3447 57.9930 31.6358 175.8007 39 L 4.9366 8.3228 119.0746 53.1659 43.3302 176.2308 40 Q 4.2899 9.2176 126.5543 55.8265 30.1481 175.4821 41 A 4.9592 8.6216 127.9911 51.7460 20.9802 177.0819 42 F 4.2625 9.0891 121.0997 58.0044 41.8443 172.7678 43 E 4.7344 8.7480 126.7843 55.6039 28.6660 176.2652 44 G 4.7567 8.1326 112.6926 44.2587 0.0000 171.6269 45 V 4.3195 8.4551 120.8552 61.2114 33.6994 174.1421 46 V 3.8358 7.7344 127.4010 63.6835 31.2872 175.0083 47 I 4.2757 8.7363 122.0040 61.4947 39.8852 175.1621 48 A 4.8202 7.7631 122.8582 50.3493 22.1627 173.8307 49 I 4.7413 7.7895 116.8077 59.6330 42.4191 177.3593 50 R 4.2811 8.4760 123.5424 56.0057 28.3013 177.9820 51 N 4.2356 9.8715 107.9327 52.8352 34.9155 174.4437 52 R 4.5237 8.7073 114.5852 56.0443 34.0165 177.6132 53 G 3.8090 8.1686 106.5762 45.8094 0.0000 175.4183 54 L 3.7568 8.7802 122.7048 58.4670 41.8615 177.1982 55 H 4.6617 7.6706 116.2328 55.9876 29.2186 175.3208 56 S 4.7149 8.4419 117.1119 57.6357 67.4344 174.3852 57 A 5.2792 8.6735 125.0384 49.8703 22.4222 175.3625 58 F 4.8350 9.0747 113.9592 59.3340 41.1974 174.4986 59 T 3.2625 7.9891 127.5308 63.2185 64.8449 170.1394 60 V 4.9971 8.4411 118.4671 59.3453 35.4253 175.3719 61 R 4.8457 8.4641 124.0478 56.2258 31.2553 176.2335 62 K 4.0031 8.4185 121.0775 57.5453 34.0848 176.0314 63 I 3.2845 7.6220 115.5790 61.8972 34.0615 174.6157 64 S 4.5377 7.2568 121.9875 58.1921 63.2209 178.2447 65 N 4.5952 8.7037 124.5650 54.2080 36.0843 173.1299 66 G 4.2419 8.1751 109.0059 45.1207 0.0000 172.4912 67 E 4.4272 7.6857 119.5404 53.9270 30.7830 175.8624 68 G 3.8353 8.4835 115.0527 45.9445 0.0000 172.7546 69 V 4.6658 7.9886 113.0424 59.4464 36.6212 173.8168 70 E 5.1486 8.7151 122.7353 54.5196 32.5996 174.4070 71 R 4.1264 8.7397 126.9656 54.6235 32.6115 174.8460 72 V 4.3289 7.9156 120.5404 59.5083 31.4808 176.5445 73 F 4.3881 7.5705 124.6540 57.4958 40.1137 174.9889 74 Q 5.1999 8.2077 115.8776 61.1002 29.2552 180.3822 75 T 2.7386 6.5729 110.5055 64.5582 70.6846 173.2922 76 H 4.5180 8.1478 120.7665 56.1029 28.8992 175.0978 77 S 4.6239 7.7799 115.0011 55.7859 63.8096 172.9224 78 P 4.0754 0.0000 0.0000 65.7942 31.5914 178.8573 79 V 3.0727 7.4560 110.9114 63.7990 31.7255 178.7044 80 V 3.3348 7.8278 119.4534 62.6836 32.8971 178.9023 81 D 3.8839 7.4036 117.3364 55.0751 41.4644 176.4668 82 S 4.6100 8.5908 110.5721 57.6327 65.8597 173.0347 83 I 4.3794 7.6923 119.5183 60.5776 39.7312 174.3197 84 S 4.6718 9.4251 129.2421 58.2999 63.6135 173.2375 85 V 4.5745 8.5875 112.4589 60.9620 36.2055 179.0756 86 K 3.6110 7.8336 115.7180 57.0868 32.0376 176.6176 87 R 4.7727 8.9102 127.2965 55.3413 32.6540 174.0804 88 R 4.5465 8.5689 121.3644 54.6299 32.1045 174.9357 89 G 4.4218 8.6198 105.2070 44.4751 0.0000 172.4288 90 A 4.3425 9.1973 125.8312 51.9644 19.2106 177.2916 91 V 4.0664 7.9711 119.6881 64.2105 34.2091 175.4773 92 R 3.6937 8.2192 115.0782 55.4576 27.2711 175.0914 93 K 4.1789 7.1556 115.1223 56.1675 35.3695 173.9663 94 A 4.2312 8.7948 127.6293 53.5728 19.3151 178.0506 95 K 4.4400 7.7107 114.1120 54.6964 34.6927 176.7559 96 L 4.8550 8.5749 126.9775 54.5019 42.0665 178.4440 97 Y 4.4145 7.6347 118.2501 61.0755 38.3078 178.4070 98 Y 4.2047 8.1330 116.6795 59.0995 38.1081 176.4073 99 L 3.9737 7.2159 121.4571 55.2234 43.6235 177.4852 100 R 3.9986 8.4733 118.5671 57.9514 28.5640 178.8264 101 E 4.2793 9.2291 124.1196 57.5828 28.1846 176.4782 102 R 4.2810 7.6627 122.8173 58.4661 33.2231 176.9497 103 T 3.4610 7.7497 113.2398 61.9607 67.5651 171.3434 104 G 4.1218 8.3759 110.6990 47.1328 0.0000 172.8540 105 K 4.1381 8.8789 123.5387 57.4280 30.4866 178.5364 106 A 4.0546 7.8566 119.0863 54.4576 18.5401 178.0943 107 A 4.2767 7.8956 117.2992 52.9423 19.2614 178.0109 108 R 3.8956 7.4669 115.4318 56.7798 30.4765 175.8049 109 I 4.5380 8.1054 116.1402 58.5270 39.2177 175.6126 110 K 4.0580 8.8182 126.6514 56.5608 33.2112 176.9349 111 E 4.0450 8.8082 122.4183 56.9236 30.1607 176.7480 112 R 4.1039 8.7846 118.7143 56.6915 30.6075 175.1212 113 L 3.4995 7.6253 128.5665 55.1235 39.7237 174.2105 114 N 4.5938 8.3364 119.4824 52.8525 38.8810 174.8803 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 S 8.19 4.42 0.00 3.88 3.72 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 2 N 8.49 4.24 0.00 2.78 2.83 0.00 0.00 6.87 7.06 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 3 I 8.55 3.94 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 1.41 1.21 0.94 0.00 0.00 4 I 7.12 4.01 1.92 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 1.19 0.83 0.92 0.00 0.00 5 K 8.73 3.42 0.00 2.06 1.91 0.00 1.72 0.00 0.00 1.93 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.35 7.81 6 Q 8.68 4.00 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 7 L 7.76 3.93 0.00 1.63 1.72 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.10 4.11 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 9 Q 8.31 4.20 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 10 E 9.10 3.69 0.00 2.19 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 2.29 2.34 0.00 11 Q 8.18 4.38 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.51 0.00 0.00 0.00 0.00 0.00 2.27 2.50 0.00 12 M 7.11 3.63 0.00 1.84 2.08 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 2.65 2.11 0.00 13 K 8.55 4.47 0.00 1.84 1.82 0.00 1.50 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.41 7.81 14 Q 8.20 4.54 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.22 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 15 D 8.29 4.65 0.00 2.56 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 0.00 0.00 0.00 0.00 16 V 7.37 4.12 1.84 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 0.71 0.00 0.00 0.84 0.00 0.00 17 P 0.00 4.54 0.00 2.12 2.04 0.00 3.54 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 18 S 8.50 4.19 0.00 3.86 3.82 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 19 F 8.19 5.44 0.00 2.81 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 20 R 7.21 4.38 0.00 1.91 1.90 0.00 3.22 0.00 0.00 3.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.44 0.00 21 P 0.00 4.26 0.00 2.16 2.12 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 22 G 7.82 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 0.00 0.00 0.00 23 D 7.86 4.59 0.00 2.60 2.61 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 0.00 0.00 0.00 0.00 24 T 9.82 3.89 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 1.29 0.00 0.00 25 V 7.69 3.27 2.47 0.00 0.00 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 1.10 0.00 0.00 26 E 8.11 4.93 0.00 2.05 1.82 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 2.35 2.37 0.00 27 V 8.96 4.36 2.04 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 0.09 0.00 0.00 1.05 0.00 0.00 28 K 8.33 4.94 0.00 1.65 1.76 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.39 7.81 29 V 8.59 4.34 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 0.60 0.00 0.00 1.11 0.00 0.00 30 W 8.34 5.13 0.00 3.31 3.03 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 0.00 0.00 0.00 0.00 31 V 8.81 4.48 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 0.66 0.00 0.00 1.08 0.00 0.00 32 V 8.14 3.74 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 0.71 0.00 0.00 0.93 0.00 0.00 33 E 7.55 3.63 0.00 2.08 1.12 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 2.20 2.35 0.00 34 G 9.01 3.73 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 0.00 0.00 0.00 35 S 9.31 4.59 0.00 3.85 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 36 K 6.83 4.67 0.00 1.75 1.74 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.48 7.81 37 K 8.00 4.40 0.00 1.27 1.56 0.00 1.46 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.06 1.06 7.81 38 R 7.95 4.08 0.00 1.82 1.98 0.00 3.07 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 39 L 8.32 4.94 0.00 1.55 1.69 1.21 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 9.22 4.29 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.79 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 41 A 8.62 4.96 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 42 F 9.09 4.26 0.00 3.27 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 43 E 8.75 4.73 0.00 1.85 1.91 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 2.33 2.27 0.00 44 G 8.13 4.76 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 0.00 0.00 0.00 45 V 8.46 4.32 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 0.87 0.00 0.00 0.94 0.00 0.00 46 V 7.73 3.84 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 0.43 0.00 0.00 0.37 0.00 0.00 47 I 8.74 4.28 1.92 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 1.41 0.87 0.99 0.00 0.00 48 A 7.76 4.82 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 49 I 7.79 4.74 1.82 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 1.57 0.73 0.93 0.00 0.00 50 R 8.48 4.28 0.00 2.07 1.74 0.00 3.37 0.00 0.00 3.50 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.76 0.00 51 N 9.87 4.24 0.00 2.95 2.97 0.00 0.00 6.62 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 52 R 8.71 4.52 0.00 2.04 1.92 0.00 3.46 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 53 G 8.17 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 0.00 0.00 0.00 54 L 8.78 3.76 0.00 1.43 1.44 0.82 0.90 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 55 H 7.67 4.66 0.00 3.13 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.44 4.71 0.00 3.81 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 57 A 8.67 5.28 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 58 F 9.07 4.83 0.00 3.33 3.25 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 59 T 7.99 3.26 4.33 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 0.00 0.00 0.00 1.27 0.00 0.00 60 V 8.44 5.00 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 1.06 0.00 0.00 1.16 0.00 0.00 61 R 8.46 4.85 0.00 1.73 1.85 0.00 3.39 0.00 0.00 3.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 62 K 8.42 4.00 0.00 1.73 1.71 0.00 0.87 0.00 0.00 0.86 0.00 0.00 2.47 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.16 1.31 7.81 63 I 7.62 3.28 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.52 0.90 0.00 0.00 64 S 7.26 4.54 0.00 3.82 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 65 N 8.70 4.60 0.00 2.68 2.80 0.00 0.00 6.92 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 66 G 8.18 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 67 E 7.69 4.43 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 68 G 8.48 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 0.00 0.00 0.00 69 V 7.99 4.67 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 0.97 0.00 0.00 1.07 0.00 0.00 70 E 8.72 5.15 0.00 1.90 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 2.15 2.28 0.00 71 R 8.74 4.13 0.00 1.25 0.76 0.00 2.32 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.77 0.00 72 V 7.92 4.33 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 0.72 0.00 0.00 0.82 0.00 0.00 73 F 7.57 4.39 0.00 2.34 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.21 5.20 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.60 6.14 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 75 T 6.57 2.74 4.44 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 1.20 0.00 0.00 76 H 8.15 4.52 0.00 3.32 3.24 0.00 5.69 0.00 0.00 0.00 0.00 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.78 4.62 0.00 3.83 3.59 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 78 P 0.00 4.08 0.00 1.96 1.87 0.00 3.55 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 2.05 2.03 0.00 79 V 7.46 3.07 2.04 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 0.92 0.00 0.00 0.84 0.00 0.00 80 V 7.83 3.33 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 0.56 0.00 0.00 0.45 0.00 0.00 81 D 7.40 3.88 0.00 2.38 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 82 S 8.59 4.61 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 83 I 7.69 4.38 1.83 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.05 0.83 0.00 0.00 84 S 9.43 4.67 0.00 3.90 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 85 V 8.59 4.57 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 0.78 0.00 0.00 0.99 0.00 0.00 86 K 7.83 3.61 0.00 1.89 1.47 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.66 1.42 7.81 87 R 8.91 4.77 0.00 1.89 1.77 0.00 3.12 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 88 R 8.57 4.55 0.00 1.91 1.87 0.00 3.08 0.00 0.00 3.24 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 89 G 8.62 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 0.00 0.00 0.00 0.00 90 A 9.20 4.34 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 91 V 7.97 4.07 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 0.96 0.00 0.00 0.97 0.00 0.00 92 R 8.22 3.69 0.00 1.97 1.95 0.00 3.31 0.00 0.00 3.11 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.58 0.00 93 K 7.16 4.18 0.00 1.68 1.66 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.32 1.39 7.81 94 A 8.79 4.23 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 95 K 7.71 4.44 0.00 1.33 0.74 0.00 1.46 0.00 0.00 1.58 0.00 0.00 3.10 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.83 0.79 7.81 96 L 8.57 4.85 0.00 1.70 1.28 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 7.63 4.41 0.00 3.07 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 98 Y 8.13 4.20 0.00 3.11 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 99 L 7.22 3.97 0.00 1.25 1.45 0.87 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 100 R 8.47 4.00 0.00 2.01 1.69 0.00 3.28 0.00 0.00 3.45 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 101 E 9.23 4.28 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 2.30 2.42 0.00 102 R 7.66 4.28 0.00 1.82 2.01 0.00 3.68 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.49 0.00 103 T 7.75 3.46 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 0.00 104 G 8.38 4.12 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 0.00 0.00 0.00 105 K 8.88 4.14 0.00 1.97 1.97 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.37 7.81 106 A 7.86 4.05 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 0.00 107 A 7.90 4.28 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 0.00 108 R 7.47 3.90 0.00 2.04 1.93 0.00 3.12 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 109 I 8.11 4.54 1.88 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 1.33 0.65 0.97 0.00 0.00 110 K 8.82 4.06 0.00 1.79 1.80 0.00 1.59 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.53 7.81 111 E 8.81 4.05 0.00 2.08 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 2.37 2.39 0.00 112 R 8.78 4.10 0.00 1.84 1.92 0.00 3.44 0.00 0.00 3.15 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 113 L 7.63 3.50 0.00 1.87 1.74 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.34 4.59 0.00 2.72 2.67 0.00 0.00 7.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00