NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3574 8.3044 120.3249 55.9373 32.8504 175.0965 2 H 4.3721 8.0586 128.2131 53.4145 28.8004 173.7853 3 L 4.3959 7.1532 122.1192 53.8458 43.4158 176.1826 4 T 4.0551 8.7899 118.2311 60.6635 70.8576 173.3026 5 P 4.1866 0.0000 0.0000 66.1056 31.1744 178.8248 6 E 4.0231 8.0894 115.3936 59.2693 29.5714 178.8107 7 E 3.9400 7.7292 119.3315 58.9056 29.6726 178.9819 8 K 3.8978 8.3552 120.4781 59.2116 32.1398 179.1267 9 S 4.0918 8.1193 114.5738 61.4185 62.8366 176.3964 10 A 3.9749 7.7025 124.4593 54.5668 18.0724 179.7845 11 V 3.2882 7.6165 116.6189 66.4139 31.4597 178.4314 12 T 3.9380 7.7737 114.8457 66.5685 68.0807 176.5166 13 A 4.0551 8.1148 121.7466 55.2260 18.6890 179.1909 14 L 3.9111 7.8522 119.0179 57.8898 42.0597 178.8355 15 W 4.3365 8.6942 128.4500 60.2546 30.3168 178.1171 16 G 3.7081 7.8627 105.2436 47.3009 0.0000 175.0634 17 K 4.3087 7.9652 118.5002 56.2731 32.8952 177.3828 18 V 3.6884 6.6910 119.7744 62.4234 32.0744 176.1486 19 N 4.6148 8.1192 124.8762 51.8279 38.2061 175.3410 20 V 3.5509 7.9787 120.5978 64.2289 31.6830 177.2634 21 D 4.3656 8.2054 117.9022 57.5526 40.7727 178.4646 22 E 3.8860 8.0161 119.0140 59.4576 29.6914 179.0722 23 V 3.5695 8.1110 118.7963 65.7001 31.5135 178.0670 24 G 3.7509 8.5156 106.1116 47.9195 0.0000 175.9074 25 G 3.6151 7.8036 108.6985 47.4005 0.0000 175.7220 26 E 3.9372 8.1592 120.6250 58.9485 29.4998 179.3141 27 A 3.9073 8.2780 121.2450 54.9785 18.4749 179.4892 28 L 3.9643 7.9678 119.0143 58.1453 42.2597 179.1531 29 G 3.6456 8.1280 105.7389 48.1883 0.0000 175.7843 30 R 3.9101 8.1308 121.1223 58.5020 29.9976 178.9862 31 L 3.9947 7.9333 120.2149 58.2757 42.1542 179.1542 32 L 4.0303 7.9544 118.7077 57.1219 41.2007 179.6067 33 V 3.6062 7.2239 117.1652 65.6330 31.8328 177.9773 34 V 3.5064 7.9453 116.8160 64.3345 32.7029 175.5302 35 Y 3.8952 7.2502 116.4557 53.9160 37.8707 174.0288 36 P 4.7383 0.0000 0.0000 64.4831 31.5520 178.4495 37 W 4.3220 8.0433 116.6696 59.5345 27.9325 177.7955 38 T 4.2057 7.7629 110.1840 63.8820 68.0638 175.9029 39 Q 4.4642 8.2598 121.4684 57.8773 28.4858 177.9233 40 R 3.6883 7.5562 117.1488 58.9716 29.1611 177.8690 41 F 4.2478 6.9409 114.2924 57.3066 39.6184 175.8201 42 F 4.5695 7.7898 119.0572 56.7249 39.4601 176.7963 43 E 4.1991 8.3091 119.2043 58.1835 29.7813 177.2399 44 S 4.6156 7.9480 112.9583 58.7925 63.6678 174.6812 45 F 4.6689 8.2467 119.9105 58.6073 39.9444 176.7881 46 G 3.9507 8.1324 106.2868 44.3339 0.0000 174.1720 47 D 4.4580 8.6050 125.5400 54.5670 40.9606 175.6706 48 L 4.8784 8.3374 125.8228 54.3410 42.9439 177.9883 49 S 4.2722 8.0859 117.1113 61.0034 63.0303 174.6774 50 T 4.7424 7.4218 109.5290 58.2143 73.0697 172.7342 51 P 4.2017 0.0000 0.0000 65.9983 31.2805 178.7821 52 D 4.2519 8.0634 116.9130 57.1508 40.5708 178.3801 53 A 3.9789 7.7158 120.4598 55.1682 18.5019 179.6808 54 V 3.6829 8.0351 116.9420 66.4946 31.5566 178.1677 55 M 4.1318 8.6627 118.0756 58.0391 31.9175 178.3427 56 G 3.9510 8.0219 103.6711 44.2172 0.0000 173.3720 57 N 4.3114 7.5861 121.1995 53.0300 39.3758 173.5063 58 P 4.2238 0.0000 0.0000 66.1331 31.0991 178.5907 59 K 3.5888 8.2018 118.1247 58.9134 31.7013 179.5528 60 V 3.6190 7.5154 118.0634 65.8570 31.7000 178.0427 61 K 3.8888 8.0666 118.0191 59.4923 31.7785 179.2412 62 A 3.9914 8.0559 121.0551 55.3105 18.1987 179.2429 63 H 4.3057 8.3049 117.0303 59.2748 29.9350 177.5760 64 G 3.6896 8.3828 107.9327 47.8748 0.0000 175.4716 65 K 3.9570 7.9464 121.5458 58.8951 32.1524 178.8759 66 K 3.9231 7.7480 120.0699 59.4907 32.2285 178.8859 67 V 3.6374 8.0244 118.8261 66.2721 31.4977 178.0806 68 L 4.3284 8.3815 118.6876 57.2901 41.3582 179.8247 69 G 3.6648 8.1162 105.8344 47.9383 0.0000 175.7125 70 A 4.1361 8.1752 124.0784 54.5114 18.4733 179.5030 71 F 4.2485 8.5705 119.2913 61.7020 39.3074 177.4564 72 S 4.2103 8.7340 113.9192 61.9534 63.1039 176.1385 73 D 4.6133 8.3352 121.5897 57.3089 40.4945 179.1650 74 G 3.4926 7.7940 105.8251 47.6646 0.0000 175.5755 75 L 3.8398 7.3314 119.1535 56.1496 41.6068 178.1921 76 A 4.4549 7.3343 118.9179 51.9972 20.1346 176.3789 77 H 4.8691 8.0389 115.3127 54.6886 29.8274 175.3245 78 L 3.9194 7.9144 119.5064 57.1802 42.0465 178.6503 79 D 4.4252 7.9384 117.6233 56.2714 42.1378 175.7775 80 N 5.0008 8.1752 116.4291 51.2833 39.0771 174.4171 81 L 4.0438 7.8148 123.1659 57.6406 42.1915 179.0912 82 K 3.9405 8.0541 116.9154 59.4456 32.1696 179.1632 83 G 3.6729 7.9375 105.8636 48.0242 0.0000 175.5736 84 T 3.6955 7.5235 117.3434 66.1789 68.8115 175.7457 85 F 4.7111 8.3438 117.1119 57.2707 39.1386 177.5126 86 A 4.1463 7.7603 123.4531 55.7019 18.2336 180.3931 87 T 3.8872 7.8773 107.7438 64.8099 68.9131 176.3667 88 L 4.0646 7.9288 122.8007 57.7473 42.3367 178.5096 89 S 4.3952 8.5996 114.8892 60.9845 62.3110 175.9088 90 E 3.8941 8.2149 121.0720 59.3879 29.1409 179.2945 91 L 3.9144 7.9762 120.1079 58.6085 42.2311 178.7088 92 H 4.1194 8.4343 116.1386 59.5018 28.3623 176.5899 93 C 3.6485 7.7627 120.5551 61.7754 30.9856 175.2289 94 D 4.2890 8.3408 122.1494 56.8227 40.7916 177.8406 95 K 4.2948 7.9478 117.1804 58.2482 33.0003 178.0000 96 L 4.0493 7.9020 116.1725 54.9459 42.5558 176.5205 97 A 3.8772 7.7280 119.1850 51.8351 15.6824 177.4323 98 V 3.9349 8.2232 120.8228 60.7790 32.9176 175.0627 99 D 4.3538 8.7518 127.2455 53.8639 41.7308 175.2720 100 P 3.2710 0.0000 0.0000 64.9015 31.1974 178.1583 101 E 3.8923 8.0898 118.1715 59.1522 29.3651 178.4927 102 N 4.2704 7.8152 116.7288 56.2514 38.6022 177.2323 103 F 4.4862 7.4115 119.1482 60.6361 38.9537 177.9341 104 R 4.0535 7.8064 117.3302 58.8955 30.0183 178.7433 105 L 3.8032 7.8447 118.9233 57.7261 41.5349 179.2855 106 L 4.1022 8.1589 120.3622 57.9651 41.9804 179.1483 107 G 3.7169 7.9842 105.4667 48.1021 0.0000 175.4386 108 N 4.4587 8.1639 119.2899 55.8595 38.5350 177.8166 109 V 3.6149 7.9354 119.7997 65.7465 31.5772 177.7248 110 L 3.8600 8.2429 120.5571 58.1764 41.9080 179.0368 111 V 3.5260 7.8258 118.0035 66.3945 31.3895 177.7272 112 C 4.1034 8.0448 116.3178 62.7731 27.8786 176.3765 113 V 3.5029 7.7258 119.8061 65.9305 31.0911 178.1250 114 L 3.8350 7.8440 118.6680 57.4787 41.3021 179.4180 115 A 3.7024 7.3558 120.6374 55.2073 18.1285 178.8414 116 H 4.0280 8.0097 115.6749 60.0072 29.9284 176.8319 117 H 3.9976 8.0927 116.1425 58.4904 28.9476 177.1281 118 F 4.6002 8.7062 117.7565 57.1893 39.5488 177.2409 119 G 3.8208 8.6590 109.7030 45.8852 0.0000 176.5898 120 K 3.9968 8.9315 120.6323 59.5504 32.3637 178.0046 121 E 4.0988 8.2455 119.8431 58.4574 29.8508 176.9456 122 F 4.5825 8.2036 123.1326 57.0405 37.9108 175.5161 123 T 4.2401 7.5021 115.8354 59.8040 71.3983 173.4938 124 P 4.1657 0.0000 0.0000 65.7874 30.9649 177.1833 125 P 4.2531 0.0000 0.0000 65.3836 31.1977 178.8848 126 V 3.5621 7.2096 116.1134 65.5801 31.3434 177.8877 127 Q 3.4133 8.0068 119.6187 58.9615 28.8402 178.0299 128 A 4.0251 7.9930 121.5441 55.1546 18.3257 179.5495 129 A 3.8843 7.7221 118.7374 55.5669 18.4544 179.5395 130 Y 3.8916 8.1003 115.3088 61.0811 38.0040 178.6751 131 Q 4.1334 8.6834 119.5854 59.0753 28.8836 179.0795 132 K 3.9903 7.9092 119.0592 59.3221 31.9708 179.6717 133 V 3.4778 7.6638 118.4530 66.2156 31.4520 178.6520 134 V 3.8028 8.4288 112.3507 64.2160 31.3099 178.5511 135 A 4.0957 8.1166 120.7182 55.0185 18.2252 179.7799 136 G 3.5624 8.1338 104.3050 47.9816 0.0000 176.1026 137 V 3.2732 7.9576 120.6223 65.4267 31.3775 177.7421 138 A 3.9311 8.1635 120.8610 55.5042 17.9670 179.4474 139 N 4.2971 8.0829 113.3303 56.3775 38.5317 177.2696 140 A 4.1384 8.0835 122.2743 55.1132 18.1603 179.5342 141 L 3.8922 8.0741 116.8680 56.5867 41.7064 178.3648 142 A 4.6675 7.5747 119.9245 52.6098 19.2097 178.3855 143 H 4.2762 7.9221 113.3542 58.1120 28.5079 176.3062 144 K 4.3417 7.9620 118.2984 56.1409 32.2156 176.4186 145 Y 4.1882 7.9247 117.3665 58.4497 38.4625 175.5897 146 H 4.3957 8.3697 117.1220 56.3709 28.0152 173.5766 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 M 8.30 4.36 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 2 H 8.06 4.37 0.00 3.16 3.23 0.00 5.72 0.00 0.00 0.00 0.00 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.15 4.40 0.00 1.54 1.49 0.83 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.79 4.06 4.18 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 1.11 0.00 0.00 5 P 0.00 4.19 0.00 2.14 2.13 0.00 3.56 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 2.09 2.13 0.00 6 E 8.09 4.02 0.00 2.13 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 0.00 2.32 2.32 0.00 7 E 7.73 3.94 0.00 2.23 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 0.00 2.27 2.25 0.00 8 K 8.36 3.90 0.00 1.72 1.95 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.36 7.81 9 S 8.12 4.09 0.00 4.09 4.22 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 10 A 7.70 3.97 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 11 V 7.62 3.29 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 0.68 0.00 0.00 0.46 0.00 0.00 12 T 7.77 3.94 4.55 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 1.24 0.00 0.00 13 A 8.11 4.06 1.40 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 0.00 0.00 14 L 7.85 3.91 0.00 1.73 1.89 0.12 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.69 4.34 0.00 3.85 3.23 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 G 7.86 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 0.00 0.00 0.00 17 K 7.97 4.31 0.00 2.08 2.17 0.00 1.86 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.65 7.81 18 V 6.69 3.69 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 -0.01 0.00 0.00 0.66 0.00 0.00 19 N 8.12 4.61 0.00 2.71 2.60 0.00 0.00 7.15 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 20 V 7.98 3.55 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 0.80 0.00 0.00 1.02 0.00 0.00 21 D 8.21 4.37 0.00 2.82 2.71 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 22 E 8.02 3.89 0.00 1.97 2.13 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 2.29 2.28 0.00 23 V 8.11 3.57 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 0.92 0.00 0.00 0.67 0.00 0.00 24 G 8.52 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 25 G 7.80 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.16 3.94 0.00 2.20 1.96 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 2.31 2.47 0.00 27 A 8.28 3.91 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 28 L 7.97 3.96 0.00 1.78 1.64 0.92 1.09 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 29 G 8.13 3.65 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 30 R 8.13 3.91 0.00 1.97 1.93 0.00 3.07 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 31 L 7.93 3.99 0.00 1.87 1.86 1.04 0.54 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 32 L 7.95 4.03 0.00 1.84 1.71 0.71 0.98 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 33 V 7.22 3.61 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 0.72 0.00 0.00 0.91 0.00 0.00 34 V 7.95 3.51 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.77 0.00 0.00 35 Y 7.25 3.90 0.00 2.59 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 4.74 0.00 2.32 2.32 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.91 0.00 37 W 8.04 4.32 0.00 3.53 3.49 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 38 T 7.76 4.21 4.40 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 1.04 0.00 0.00 39 Q 8.26 4.46 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 40 R 7.56 3.69 0.00 1.59 1.93 0.00 3.01 0.00 0.00 2.74 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.50 0.00 41 F 6.94 4.25 0.00 1.64 2.42 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 42 F 7.79 4.57 0.00 2.88 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 0.00 0.00 0.00 0.00 43 E 8.31 4.20 0.00 2.09 2.07 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 2.24 2.29 0.00 44 S 7.95 4.62 0.00 4.12 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 45 F 8.25 4.67 0.00 3.22 3.16 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 46 G 8.13 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 47 D 8.60 4.46 0.00 2.67 2.64 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 48 L 8.34 4.88 0.00 1.67 1.64 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.09 4.27 0.00 3.94 4.06 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 50 T 7.42 4.74 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.06 4.25 0.00 2.67 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 53 A 7.72 3.98 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 54 V 8.04 3.68 2.21 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 1.03 0.00 0.00 1.02 0.00 0.00 55 M 8.66 4.13 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.86 0.00 56 G 8.02 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 57 N 7.59 4.31 0.00 2.96 2.85 0.00 0.00 6.77 8.60 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 58 P 0.00 4.22 0.00 2.22 2.26 0.00 3.71 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.20 3.59 0.00 1.64 0.74 0.00 1.68 0.00 0.00 1.35 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.09 1.22 7.81 60 V 7.52 3.62 2.29 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 1.17 0.00 0.00 1.06 0.00 0.00 61 K 8.07 3.89 0.00 1.96 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.61 7.81 62 A 8.06 3.99 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 63 H 8.30 4.31 0.00 3.55 3.49 0.00 5.80 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 64 G 8.38 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 65 K 7.95 3.96 0.00 1.87 2.08 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.47 7.81 66 K 7.75 3.92 0.00 1.99 2.03 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 8.02 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 1.04 0.00 0.00 0.93 0.00 0.00 68 L 8.38 4.33 0.00 2.01 1.85 1.04 0.92 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 69 G 8.12 3.66 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 0.00 0.00 0.00 70 A 8.18 4.14 1.51 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 71 F 8.57 4.25 0.00 3.33 3.31 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 72 S 8.73 4.21 0.00 4.24 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 0.00 73 D 8.34 4.61 0.00 2.92 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 74 G 7.79 3.49 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 0.00 75 L 7.33 3.84 0.00 1.59 1.44 -0.07 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.33 4.45 1.15 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 0.00 0.00 77 H 8.04 4.87 0.00 3.08 3.13 0.00 5.82 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 78 L 7.91 3.92 0.00 1.51 1.65 0.77 1.00 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 79 D 7.94 4.43 0.00 2.60 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 80 N 8.18 5.00 0.00 2.73 2.57 0.00 0.00 7.19 7.52 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 81 L 7.81 4.04 0.00 1.75 1.82 0.86 1.01 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 82 K 8.05 3.94 0.00 1.63 1.61 0.00 1.69 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.46 7.81 83 G 7.94 3.67 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 0.00 0.00 0.00 84 T 7.52 3.70 4.01 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 0.32 0.00 0.00 85 F 8.34 4.71 0.00 3.21 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 86 A 7.76 4.15 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 87 T 7.88 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 1.21 0.00 0.00 88 L 7.93 4.06 0.00 1.92 1.96 1.04 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.60 4.40 0.00 4.08 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 90 E 8.21 3.89 0.00 2.35 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 2.31 2.31 0.00 91 L 7.98 3.91 0.00 1.89 1.87 0.93 1.15 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 92 H 8.43 4.12 0.00 3.57 3.79 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.76 3.65 0.00 1.23 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 94 D 8.34 4.29 0.00 2.75 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 95 K 7.95 4.29 0.00 1.86 1.84 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.43 7.81 96 L 7.90 4.05 0.00 1.71 1.65 0.72 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.73 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 98 V 8.22 3.93 2.07 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 0.12 0.00 0.00 0.36 0.00 0.00 99 D 8.75 4.35 0.00 2.80 2.73 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 0.00 100 P 0.00 3.27 0.00 1.92 1.81 0.00 3.38 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.56 0.00 101 E 8.09 3.89 0.00 2.05 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 2.31 2.39 0.00 102 N 7.82 4.27 0.00 2.49 2.68 0.00 0.00 6.88 8.20 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 0.00 103 F 7.41 4.49 0.00 3.08 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 0.00 104 R 7.81 4.05 0.00 1.84 1.98 0.00 3.12 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.92 0.00 105 L 7.84 3.80 0.00 1.69 1.36 0.59 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.16 4.10 0.00 1.82 1.74 0.93 0.98 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 0.00 107 G 7.98 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 0.00 0.00 0.00 108 N 8.16 4.46 0.00 2.94 2.95 0.00 0.00 6.72 7.70 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 0.00 109 V 7.94 3.61 2.13 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 1.03 0.00 0.00 1.14 0.00 0.00 110 L 8.24 3.86 0.00 1.73 1.83 0.86 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.83 3.53 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 1.30 0.00 0.00 1.19 0.00 0.00 112 C 8.04 4.10 0.00 3.19 2.94 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 0.00 113 V 7.73 3.50 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 0.82 0.00 0.00 0.94 0.00 0.00 114 L 7.84 3.83 0.00 0.91 1.00 0.51 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.36 3.70 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 0.00 116 H 8.01 4.03 0.00 3.21 3.57 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.09 4.00 0.00 2.78 2.64 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.71 4.60 0.00 3.30 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 0.00 119 G 8.66 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 0.00 0.00 0.00 120 K 8.93 4.00 0.00 1.92 2.03 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.43 7.81 121 E 8.25 4.10 0.00 2.33 2.25 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 2.38 2.33 0.00 122 F 8.20 4.58 0.00 3.05 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 0.00 123 T 7.50 4.24 4.22 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 1.28 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.17 0.00 3.59 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 2.13 2.22 0.00 125 P 0.00 4.25 0.00 2.11 2.06 0.00 3.46 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 2.08 2.11 0.00 126 V 7.21 3.56 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 0.87 0.00 0.00 0.89 0.00 0.00 127 Q 8.01 3.41 0.00 1.78 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.44 2.64 0.00 128 A 7.99 4.03 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 0.00 129 A 7.72 3.88 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 0.00 130 Y 8.10 3.89 0.00 3.38 3.29 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 0.00 131 Q 8.68 4.13 0.00 2.25 2.22 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 2.70 2.62 0.00 132 K 7.91 3.99 0.00 1.93 1.83 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.59 7.81 133 V 7.66 3.48 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 0.90 0.00 0.00 0.74 0.00 0.00 134 V 8.43 3.80 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 1.08 0.00 0.00 1.08 0.00 0.00 135 A 8.12 4.10 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 0.00 136 G 8.13 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.96 3.27 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 0.69 0.00 0.00 0.55 0.00 0.00 138 A 8.16 3.93 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 0.00 139 N 8.08 4.30 0.00 2.84 2.89 0.00 0.00 7.06 6.95 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 0.00 140 A 8.08 4.14 1.40 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 0.00 0.00 141 L 8.07 3.89 0.00 1.15 0.51 -0.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.57 4.67 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 0.00 143 H 7.92 4.28 0.00 3.35 3.68 0.00 5.75 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.96 4.34 0.00 1.73 1.82 0.00 1.64 0.00 0.00 1.47 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.91 1.65 7.81 145 Y 7.92 4.19 0.00 3.14 2.95 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 0.00 146 H 8.37 4.40 0.00 3.21 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00