NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 D 4.7083 8.2227 120.5345 53.4763 42.3068 174.3307 21 W 4.0102 9.0009 133.7917 55.9418 30.7156 174.3796 22 S 4.4280 7.8280 119.6209 58.0682 64.7909 173.8852 23 G 3.7523 6.2750 110.2094 43.7243 0.0000 171.2574 24 P 4.5204 0.0000 0.0000 62.8945 31.6426 176.6211 25 I 4.7398 8.2708 120.7910 59.8185 37.2175 174.8717 26 E 4.8520 8.9733 120.8132 55.5268 30.9223 175.7776 27 Q 4.7060 7.9760 115.8585 53.8620 31.8755 172.9916 28 P 4.7559 0.0000 0.0000 64.3919 33.2703 175.1751 29 L 5.2315 7.6386 121.3714 52.9069 43.7958 175.4829 30 W 5.3721 8.9754 123.1415 54.8523 33.5180 175.1284 31 S 4.9019 9.3154 120.9131 58.6257 63.6253 173.2816 32 L 5.1652 8.6969 122.5106 51.9210 45.0119 174.8593 33 P 4.3621 0.0000 0.0000 63.0733 31.8376 175.8829 34 A 4.6638 8.0757 122.5391 50.2784 22.5383 175.9194 35 A 4.2249 8.3417 122.0695 51.1034 19.1714 175.7069 36 P 4.3699 0.0000 0.0000 64.4547 31.8428 177.4694 37 G 3.9895 9.1539 110.1918 45.0989 0.0000 172.4109 38 L 5.3856 7.5626 118.6435 52.7044 45.1181 175.9516 39 S 4.8507 9.3054 116.4030 56.5916 65.6407 172.7646 40 R 5.3542 8.7708 124.4452 54.2507 32.9470 174.0758 41 W 5.8690 9.0594 122.0917 55.2474 32.3586 173.2287 42 L 5.1763 9.2878 120.3364 53.9881 44.0198 175.2732 43 I 4.9514 8.3150 120.4498 59.4895 39.8995 175.0504 44 V 4.2964 8.9338 128.9264 63.1994 31.4234 175.5612 45 H 5.1221 9.6272 125.5992 55.8121 29.9841 175.3571 46 N 5.1824 8.0399 116.5247 51.9378 37.7868 176.5467 47 L 4.1409 8.7045 120.8200 59.3298 41.8123 180.0278 48 S 4.2851 8.1306 110.4520 60.0488 63.3944 174.5429 49 S 4.6153 8.0846 114.1789 57.3538 63.8485 175.5475 50 A 4.0135 7.8251 124.2616 55.2895 17.6123 179.9441 51 A 3.8044 7.7388 117.7739 55.3632 18.6965 179.2849 52 A 4.0609 7.7986 117.3870 55.4073 18.5958 179.1572 53 D 4.4366 8.4395 117.1550 55.4197 40.9691 178.1044 54 G 3.9463 8.6844 105.5290 45.3578 0.0000 172.8287 55 L 4.8110 7.1142 117.1936 53.2998 46.2599 174.8312 56 Y 4.6681 9.1101 119.7083 57.1240 40.1071 174.3348 57 H 5.3654 9.7537 121.6358 54.3208 31.2160 173.9260 58 V 5.1171 8.9260 116.2339 59.4885 36.4660 174.0638 59 E 4.9438 8.8726 122.4717 54.4080 32.7397 174.6313 60 V 4.6701 8.5786 125.9798 61.0649 34.3027 174.2915 61 L 5.0839 8.3174 127.0610 52.9285 45.8241 175.0058 62 E 5.3744 8.7969 120.4748 55.1423 33.6840 173.8989 63 R 5.0783 9.3710 125.5060 54.7107 34.4793 174.4083 64 R 4.5475 8.6637 124.0865 55.9809 31.4880 176.3099 65 Q 4.0328 8.7911 122.5682 57.3635 29.1984 177.0720 66 G 3.7997 8.7594 109.1732 45.9326 0.0000 173.3791 67 Q 4.2676 7.1088 117.5845 54.1976 30.2995 175.5547 68 Q 3.7722 8.4826 118.4187 54.6965 29.1256 176.0874 69 P 3.9776 0.0000 0.0000 65.2162 31.3431 178.0653 70 W 4.3970 6.9092 113.0614 58.2247 29.0156 176.3818 71 Q 4.3976 7.2478 121.2382 55.4024 27.1713 175.3459 72 F 5.2810 7.4220 112.1640 55.1758 41.1522 176.7617 73 Q 4.3235 9.4424 120.6965 55.2595 30.6518 174.9921 74 R 4.7918 8.3039 122.9296 54.7976 30.5347 175.5708 75 L 4.2729 8.6279 128.0477 57.4525 42.6358 178.1495 76 A 4.4645 7.6805 120.3233 50.7015 21.7380 177.2315 77 A 3.9261 8.9372 126.6829 55.2008 18.8350 177.1259 78 H 5.1399 7.7787 113.1786 54.6587 33.2873 172.6950 79 L 4.6264 8.7153 126.3651 53.3887 45.6647 174.3904 80 A 4.8894 8.6318 128.1474 50.8298 20.1464 176.1272 81 L 4.9218 9.0687 123.1935 52.8681 45.4118 177.0746 82 T 4.4003 8.4147 112.5024 60.9910 70.0492 175.0379 83 E 4.1277 8.9450 122.3781 59.6637 29.5614 178.6548 84 Q 3.9194 8.1260 118.7706 59.1345 29.2955 177.9397 85 A 3.9680 7.9034 121.4011 54.9568 18.4141 179.3582 86 L 3.7918 7.9862 118.8109 58.4727 42.1178 179.5582 87 R 3.8827 8.1664 117.7852 58.8211 29.7429 178.3278 88 A 4.4079 7.9068 120.0904 52.8183 18.6147 178.5364 89 S 4.4884 7.1060 111.8524 59.0184 64.6852 175.0716 90 I 4.0845 7.1641 114.0865 60.9626 37.8582 175.9019 91 V 4.6051 7.9296 114.9066 61.6522 34.0483 175.5317 92 A 4.4105 7.5344 119.2061 49.9985 22.1251 173.9727 93 P 3.5483 0.0000 0.0000 62.4162 32.2534 175.8389 94 L 4.2249 7.7651 125.3394 54.0551 41.6043 176.5654 95 K 4.0933 8.5907 126.8116 58.5271 33.4006 177.0218 96 R 4.3975 7.3427 113.7292 55.5240 32.2222 176.0483 97 G 3.5095 8.6632 108.3476 45.4573 0.0000 174.2125 98 G 3.1847 8.2938 107.5435 45.7151 0.0000 174.5989 99 V 4.1772 7.3293 112.4020 61.6011 32.7447 177.2994 100 Y 4.1141 8.2081 120.5170 60.1945 38.5961 175.5211 101 P 4.3800 0.0000 0.0000 64.1899 31.7293 176.5883 102 E 3.9460 7.7938 118.8586 55.9557 30.0504 177.7391 103 S 4.4390 8.4916 117.8138 58.2211 65.3022 174.6833 104 Y 4.0734 8.6858 123.7634 61.1199 38.4320 178.2833 105 Q 4.0857 8.3566 119.8616 59.2216 29.1700 178.0618 106 F 4.0404 8.6218 121.4594 61.2698 39.6248 176.9733 107 A 3.9943 8.1294 120.4646 55.2744 18.0852 178.9679 108 Y 4.0500 8.0231 118.4384 60.8346 38.8369 178.1937 109 R 3.8518 8.0371 121.2501 58.8750 30.2167 178.4814 110 Q 3.8041 7.7959 117.8501 58.5301 28.6504 178.5845 111 W 4.0006 8.0336 128.9831 60.5505 30.3200 177.9983 112 Q 3.8812 8.3771 118.3083 59.0920 28.1255 178.8341 113 E 3.9481 8.0957 119.4910 59.2899 29.3573 179.6218 114 R 3.7891 7.6758 117.9978 58.8852 29.7916 178.8849 115 Q 3.4764 7.2663 118.4123 59.0449 29.1065 177.9156 116 A 4.0090 7.8374 120.4215 54.7546 18.3701 179.3424 117 A 4.1297 7.6348 118.8649 55.1299 18.6784 177.1297 118 G 3.6383 7.8387 111.1842 45.0068 0.0000 173.2874 119 Q 4.2199 7.8935 129.0028 53.0671 30.9262 174.6969 120 A 4.2984 7.9444 126.1019 49.2913 20.3421 175.0081 121 P 4.4898 0.0000 0.0000 62.6201 32.1362 175.9793 122 V 4.4490 8.2287 120.5689 61.0272 33.9660 175.1556 123 C 4.5317 8.9142 127.4456 56.4606 43.7339 172.8849 124 R 4.6913 8.6733 124.5494 55.7982 32.1229 175.6953 125 R 4.2703 8.4868 116.2453 56.0819 30.9711 177.8998 126 T 4.7438 8.6207 113.0809 59.4315 74.1143 174.3012 127 V 3.5594 8.3169 120.7238 66.3289 31.4863 177.4405 128 D 4.3470 8.1162 117.0111 57.6506 40.9840 178.0771 129 E 3.9956 8.1204 118.7361 59.6739 29.3267 178.7840 130 C 4.3902 8.4003 116.5937 59.8639 39.9872 176.1685 131 L 3.9245 7.9235 120.1601 57.6160 41.2597 179.1241 132 R 4.2328 7.9066 117.8276 57.9079 31.2276 176.4987 133 A 4.6045 8.0953 121.1271 49.1884 19.1583 173.5951 134 P 4.7367 0.0000 0.0000 61.7160 32.5272 176.5938 135 D 4.4733 8.3769 118.6912 53.6727 39.5026 175.5210 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 20 D 8.22 4.71 0.00 2.80 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 21 W 9.00 4.01 0.00 3.47 2.88 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 22 S 7.83 4.43 0.00 3.84 3.78 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 23 G 6.28 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 24 P 0.00 4.52 0.00 2.35 2.17 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 25 I 8.27 4.74 1.91 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.72 0.70 0.00 0.00 26 E 8.97 4.85 0.00 2.03 2.00 0.00 0.00 0.00 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 2.39 0.00 27 Q 7.98 4.71 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.07 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 28 P 0.00 4.76 0.00 2.38 2.71 0.00 3.69 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 2.25 2.21 0.00 29 L 7.64 5.23 0.00 1.40 1.54 0.92 1.04 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 30 W 8.98 5.37 0.00 3.20 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 31 S 9.32 4.90 0.00 3.88 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 32 L 8.70 5.17 0.00 1.51 1.57 0.92 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 33 P 0.00 4.36 0.00 2.06 2.01 0.00 3.68 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 2.12 0.00 34 A 8.08 4.66 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 35 A 8.34 4.22 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 36 P 0.00 4.37 0.00 2.06 2.02 0.00 3.71 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 2.04 2.11 0.00 37 G 9.15 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 38 L 7.56 5.39 0.00 1.68 1.61 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 39 S 9.31 4.85 0.00 3.81 3.94 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 0.00 0.00 0.00 0.00 40 R 8.77 5.35 0.00 2.11 1.86 0.00 3.37 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 41 W 9.06 5.87 0.00 3.55 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 42 L 9.29 5.18 0.00 1.84 1.72 1.03 1.14 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 43 I 8.31 4.95 1.72 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.71 0.38 0.00 0.00 44 V 8.93 4.30 2.31 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 1.05 0.00 0.00 1.02 0.00 0.00 45 H 9.63 5.12 0.00 3.31 3.50 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.04 5.18 0.00 2.88 3.07 0.00 0.00 6.24 6.67 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 47 L 8.70 4.14 0.00 1.84 1.89 1.13 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.13 4.29 0.00 3.96 4.03 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 49 S 8.08 4.62 0.00 3.98 4.07 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 0.00 0.00 0.00 0.00 50 A 7.83 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.74 3.80 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 52 A 7.80 4.06 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 53 D 8.44 4.44 0.00 2.58 2.75 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 54 G 8.68 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 55 L 7.11 4.81 0.00 1.33 1.35 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 9.11 4.67 0.00 2.81 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 57 H 9.75 5.37 0.00 3.14 3.32 0.00 5.56 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.93 5.12 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 0.74 0.00 0.00 0.95 0.00 0.00 59 E 8.87 4.94 0.00 1.98 1.71 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 2.07 2.28 0.00 60 V 8.58 4.67 2.00 0.00 0.00 0.00 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 0.87 0.00 0.00 61 L 8.32 5.08 0.00 0.27 0.55 0.24 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.80 5.37 0.00 1.99 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 2.27 2.52 0.00 63 R 9.37 5.08 0.00 2.28 1.95 0.00 3.30 0.00 0.00 3.38 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.93 0.00 64 R 8.66 4.55 0.00 1.81 1.83 0.00 3.19 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 65 Q 8.79 4.03 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.98 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 66 G 8.76 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 0.00 0.00 0.00 67 Q 7.11 4.27 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.51 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 68 Q 8.48 3.77 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.78 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 69 P 0.00 3.98 0.00 1.26 1.82 0.00 2.93 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.87 0.00 70 W 6.91 4.40 0.00 3.44 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.25 4.40 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.64 0.00 0.00 0.00 0.00 0.00 2.40 1.73 0.00 72 F 7.42 5.28 0.00 3.07 3.15 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 73 Q 9.44 4.32 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 74 R 8.30 4.79 0.00 1.91 1.86 0.00 3.37 0.00 0.00 3.39 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.77 0.00 75 L 8.63 4.27 0.00 1.54 1.68 0.90 0.59 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 76 A 7.68 4.46 1.17 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 77 A 8.94 3.93 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 78 H 7.78 5.14 0.00 3.11 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.72 4.63 0.00 1.67 1.35 0.90 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.63 4.89 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 81 L 9.07 4.92 0.00 1.56 1.55 0.86 0.42 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 82 T 8.41 4.40 4.27 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 1.22 0.00 0.00 83 E 8.95 4.13 0.00 2.24 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 2.45 2.59 0.00 84 Q 8.13 3.92 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 85 A 7.90 3.97 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 86 L 7.99 3.79 0.00 1.56 1.55 0.59 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.17 3.88 0.00 1.87 2.09 0.00 3.18 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 88 A 7.91 4.41 1.33 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 0.00 0.00 0.00 89 S 7.11 4.49 0.00 4.00 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 90 I 7.16 4.08 1.61 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.03 0.62 0.00 0.00 91 V 7.93 4.61 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 0.75 0.00 0.00 1.01 0.00 0.00 92 A 7.53 4.41 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 93 P 0.00 3.55 0.00 1.61 1.08 0.00 3.72 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.85 0.00 94 L 7.77 4.22 0.00 1.51 1.41 0.67 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.59 4.09 0.00 1.81 1.81 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.28 1.34 7.81 96 R 7.34 4.40 0.00 1.80 1.80 0.00 3.04 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.51 0.00 97 G 8.66 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 98 G 8.29 3.18 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 0.00 99 V 7.33 4.18 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 0.92 0.00 0.00 0.97 0.00 0.00 100 Y 8.21 4.11 0.00 2.93 2.99 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 0.00 101 P 0.00 4.38 0.00 1.84 1.53 0.00 3.94 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.67 0.00 102 E 7.79 3.95 0.00 2.11 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 1.92 2.29 0.00 103 S 8.49 4.44 0.00 4.18 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 0.00 104 Y 8.69 4.07 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 0.00 105 Q 8.36 4.09 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.69 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 106 F 8.62 4.04 0.00 3.25 3.22 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 0.00 107 A 8.13 3.99 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 0.00 108 Y 8.02 4.05 0.00 2.10 2.83 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 0.00 109 R 8.04 3.85 0.00 1.87 1.82 0.00 3.14 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.39 0.00 110 Q 7.80 3.80 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 1.94 2.21 0.00 111 W 8.03 4.00 0.00 3.41 3.32 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 0.00 112 Q 8.38 3.88 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.27 1.90 0.00 113 E 8.10 3.95 0.00 2.04 1.90 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 2.24 2.37 0.00 114 R 7.68 3.79 0.00 1.70 1.72 0.00 3.07 0.00 0.00 3.01 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 115 Q 7.27 3.48 0.00 0.93 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.16 2.04 0.00 116 A 7.84 4.01 1.21 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 0.00 0.00 0.00 117 A 7.63 4.13 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 0.00 118 G 7.84 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Q 7.89 4.22 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 120 A 7.94 4.30 0.03 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 0.00 0.00 121 P 0.00 4.49 0.00 2.33 2.30 0.00 3.70 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.06 0.00 122 V 8.23 4.45 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 1.24 0.00 0.00 123 C 8.91 4.53 0.00 3.00 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 0.00 124 R 8.67 4.69 0.00 1.82 1.91 0.00 3.24 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.82 0.00 125 R 8.49 4.27 0.00 1.77 1.62 0.00 3.17 0.00 0.00 3.29 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 126 T 8.62 4.74 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 0.00 127 V 8.32 3.56 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 1.03 0.00 0.00 0.93 0.00 0.00 128 D 8.12 4.35 0.00 2.83 2.66 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 0.00 0.00 0.00 0.00 129 E 8.12 4.00 0.00 2.06 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 2.34 2.50 0.00 130 C 8.40 4.39 0.00 2.99 3.15 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 0.00 131 L 7.92 3.92 0.00 1.79 1.75 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 132 R 7.91 4.23 0.00 1.96 2.11 0.00 3.34 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 133 A 8.10 4.60 1.20 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 0.00 0.00 0.00 134 P 0.00 4.74 0.00 2.07 2.02 0.00 3.68 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 135 D 8.38 4.47 0.00 2.75 2.59 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