NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 M 4.3686 8.3049 120.3505 55.1420 33.3108 174.6526 1 D 4.5072 8.3640 122.5191 53.4899 42.2094 173.9418 2 I 4.4248 9.3024 122.3957 60.0830 40.0249 175.2788 3 I 4.8533 8.3709 126.8296 59.7608 39.9159 174.4662 4 L 4.8865 8.9807 127.4853 52.9631 45.1859 176.2015 5 G 4.5510 8.3347 107.2052 45.1293 0.0000 172.1577 6 I 4.6703 8.9767 124.1239 59.2566 41.7894 173.4527 7 R 4.8256 8.7231 130.0257 55.2484 30.6738 175.6138 8 V 4.3368 8.1365 125.2735 60.8392 32.8610 176.0669 9 Q 4.1676 8.9213 122.3606 60.1039 29.0519 178.8354 10 D 5.1143 7.4992 115.4190 53.5757 42.2910 175.2216 11 S 4.6738 7.3877 111.6359 58.0418 64.8950 174.5921 12 V 4.8670 8.4029 120.0833 61.1356 34.0250 174.3453 13 I 4.5924 8.9871 128.1065 59.4496 39.8873 174.3772 14 L 5.2122 8.6187 125.8265 52.7854 44.3703 175.5453 15 A 4.8074 8.8279 125.2155 50.1891 21.8675 175.1794 16 S 5.0876 8.4680 117.7380 56.3036 66.5245 174.3167 17 S 4.2571 8.6774 119.8757 59.2152 62.9811 174.6624 18 K 4.7763 8.9647 119.2153 56.4186 33.4887 176.4065 19 A 4.5267 7.9571 122.1764 51.8229 19.5026 177.5689 20 V 4.2404 8.7628 120.8687 61.5681 33.9065 173.9176 21 T 4.8930 8.4428 123.9902 62.0147 70.1196 175.5123 22 R 4.4639 9.0462 125.0709 54.3631 32.5914 178.4628 23 G 3.8429 8.9729 116.7085 46.5027 0.0000 172.8152 24 I 4.0492 8.9909 124.4114 61.6482 39.3755 174.4365 25 S 4.6916 7.6141 115.0211 56.4932 65.2989 173.5369 26 V 4.3730 8.1263 123.7756 61.5431 30.9023 175.7318 27 L 4.1804 8.5850 129.2667 57.0799 42.0240 177.5451 28 K 4.6995 7.6329 117.4671 55.1812 35.2260 175.2536 29 D 5.0185 8.5363 119.7092 52.9096 40.3966 175.5351 30 S 4.7445 7.7816 113.0158 58.2248 62.7045 173.2653 31 D 4.5638 8.4694 120.9757 54.7800 42.6501 174.7572 32 D 4.8166 8.6678 126.3793 52.1066 41.3986 176.8739 33 K 3.9703 7.7810 131.7402 55.0465 31.4803 176.3178 34 T 4.8760 6.8390 112.4827 61.0001 71.3262 173.7218 35 R 4.8027 9.0426 124.2617 54.4649 34.8204 174.0853 36 Q 4.5462 8.5726 123.7103 55.0919 29.7042 176.3195 37 L 4.0828 8.7194 128.1043 57.3665 42.3455 177.1682 38 S 4.5860 7.8536 110.4170 56.4005 65.1881 173.8827 39 P 4.3698 0.0000 0.0000 65.3620 30.9352 176.6490 40 H 4.9290 9.5999 114.5667 55.2404 29.5235 172.8617 41 T 5.1258 8.5012 117.2035 61.8012 72.3616 172.7095 42 L 5.2531 9.3392 128.2733 53.3388 45.8838 174.5980 43 M 5.3983 9.0514 124.8925 53.8876 35.2768 174.6439 44 S 5.1148 8.9829 121.1393 57.3059 65.9975 172.8043 45 F 5.5511 7.6180 113.8337 56.4505 40.8427 173.0807 46 A 4.6621 8.7750 120.3682 50.9234 22.6674 176.4520 47 G 3.7265 8.8044 106.3623 44.6706 0.0000 172.4596 48 E 3.8779 8.7747 123.5735 56.3076 29.7250 177.7809 49 A 3.8953 8.4468 126.9644 56.5711 19.2432 179.8008 50 G 3.7493 8.0909 99.8634 47.6072 0.0000 175.0269 51 D 4.6629 8.2846 121.1707 58.1584 40.8069 178.5967 52 T 3.7014 7.8078 114.6132 67.6358 68.4180 176.4920 53 V 3.1501 7.4436 118.7972 65.8763 31.9790 178.1312 54 Q 4.0189 7.8929 117.4522 58.9904 28.5111 178.9622 55 F 3.6987 8.4728 121.5665 61.0032 39.3373 176.9430 56 A 3.7348 7.5217 120.3583 55.3724 18.0367 179.5572 57 E 3.8575 8.4048 117.3473 59.4965 29.5634 178.9932 58 Y 4.0714 7.8012 119.3795 60.6348 38.8139 178.1836 59 I 3.3442 7.5118 120.8208 64.1091 37.0921 177.9001 60 Q 3.8471 8.0897 120.3799 59.3346 28.8524 178.1915 61 A 3.9298 8.1178 121.7915 55.5768 18.3519 179.4377 62 N 4.1742 7.7309 114.1150 56.4765 38.5666 177.8532 63 I 3.6092 7.7743 121.2772 64.2612 37.1124 178.5442 64 Q 3.9977 8.2892 119.3404 58.6224 28.4748 178.4902 65 L 3.8832 7.8155 121.4962 58.2553 42.1151 178.2757 66 Y 3.7836 8.0121 119.4442 60.7428 38.6128 178.1965 67 S 5.0991 8.2346 117.2864 61.3169 62.7795 176.9109 68 I 3.6845 7.4492 120.7560 64.3769 36.9551 178.0893 69 R 3.9423 7.7908 118.1748 59.0544 30.0082 177.5311 70 E 4.2037 8.0548 115.0582 54.9629 31.0752 175.1073 71 D 4.4426 8.1405 118.6958 54.2313 40.3398 171.8322 72 Y 4.5911 7.2715 117.6199 56.8016 42.0529 172.2166 73 E 4.7026 7.8146 125.4377 53.9056 30.5688 175.7510 74 L 4.1237 8.4788 126.7848 54.7952 42.4251 178.1172 75 S 4.3372 8.4539 116.8702 57.8014 64.9024 173.7488 76 P 4.2157 0.0000 0.0000 65.7552 31.1040 178.6910 77 Q 3.9451 8.0773 117.6708 59.1960 28.9933 178.1991 78 A 3.9865 8.0124 121.7538 55.1330 18.4272 179.7823 79 V 3.5726 7.9630 117.1348 66.1483 31.5957 178.4628 80 S 4.2453 8.5698 114.4955 61.4959 62.8513 176.7242 81 S 4.1566 8.2357 118.9245 61.2140 62.5644 176.3017 82 F 4.1970 8.3473 123.4662 61.3849 39.1879 177.3905 83 V 3.4738 7.9811 117.8962 65.7711 31.2808 177.9927 84 R 3.8596 8.1712 118.5502 59.4309 30.0577 178.0406 85 Q 3.9535 8.0726 119.3372 59.4419 28.9552 178.4059 86 E 3.9867 7.9576 119.2761 59.5520 29.6351 179.4583 87 L 3.9676 8.1391 118.7712 57.5893 41.4087 179.3668 88 A 4.0349 8.2919 120.5270 54.8584 18.4890 179.7122 89 K 4.0352 8.0559 116.9500 59.8168 32.2446 179.1774 90 S 4.0020 8.0116 113.3910 61.8848 61.9559 176.2456 90A I 3.7631 7.5739 119.5381 63.1127 37.6068 176.5292 90B R 4.5002 7.7881 117.0514 55.7065 30.3038 175.9989 91 S 4.5463 7.5044 114.3384 56.7342 64.8599 174.0987 92 R 3.8875 8.4201 119.7926 58.9727 29.7005 176.3846 93 R 4.3475 7.3431 117.8870 53.4193 30.8007 171.8150 94 P 4.2802 0.0000 0.0000 62.2532 31.9869 176.2153 95 Y 4.3700 8.7963 121.3844 58.5249 38.2703 176.8742 96 Q 4.4837 8.6581 125.9113 54.3130 27.7813 173.8600 97 V 4.8589 7.5619 119.9165 60.8406 35.3018 173.7504 98 N 5.1660 9.2816 124.5426 51.6543 41.4872 174.0299 99 V 5.1401 8.3872 114.5953 59.7250 36.4261 174.5695 100 L 4.8608 8.7443 121.5558 53.0634 45.0171 175.6770 101 I 4.7945 8.6242 123.9995 59.4990 39.6873 174.9834 102 G 4.1719 9.3695 115.5598 44.3819 0.0000 172.2911 103 G 4.6198 8.6473 111.1933 45.0100 0.0000 170.9899 104 Y 4.5971 8.5731 122.0540 55.3150 40.6107 175.2183 105 D 4.3655 8.1077 125.2180 54.4703 41.3899 175.6241 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 4.37 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 1 D 8.36 4.51 0.00 2.80 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 2 I 9.30 4.42 1.86 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 1.22 1.00 0.90 0.00 0.00 3 I 8.37 4.85 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.87 0.90 0.00 0.00 4 L 8.98 4.89 0.00 1.54 1.52 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.33 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 0.00 0.00 0.00 0.00 6 I 8.98 4.67 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 1.12 1.12 0.95 0.00 0.00 7 R 8.72 4.83 0.00 1.87 1.84 0.00 3.28 0.00 0.00 3.23 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 8 V 8.14 4.34 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 1.01 0.00 0.00 9 Q 8.92 4.17 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 7.52 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 10 D 7.50 5.11 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 11 S 7.39 4.67 0.00 3.95 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 12 V 8.40 4.87 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 0.86 0.00 0.00 1.03 0.00 0.00 13 I 8.99 4.59 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 1.23 0.68 0.91 0.00 0.00 14 L 8.62 5.21 0.00 1.46 1.52 0.92 0.76 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 15 A 8.83 4.81 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 16 S 8.47 5.09 0.00 3.61 3.61 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 17 S 8.68 4.26 0.00 3.88 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 18 K 8.96 4.78 0.00 1.73 1.90 0.00 1.93 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.26 7.81 19 A 7.96 4.53 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 20 V 8.76 4.24 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 1.00 0.00 0.00 0.95 0.00 0.00 21 T 8.44 4.89 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 22 R 9.05 4.46 0.00 1.74 1.82 0.00 3.37 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 23 G 8.97 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 24 I 8.99 4.05 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 1.42 0.89 0.91 0.00 0.00 25 S 7.61 4.69 0.00 3.93 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 26 V 8.13 4.37 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 0.85 0.00 0.00 0.93 0.00 0.00 27 L 8.59 4.18 0.00 1.77 1.72 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 28 K 7.63 4.70 0.00 1.74 1.59 0.00 1.67 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.43 7.81 29 D 8.54 5.02 0.00 2.76 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 30 S 7.78 4.74 0.00 3.82 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 31 D 8.47 4.56 0.00 2.76 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 32 D 8.67 4.82 0.00 2.71 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 33 K 7.78 3.97 0.00 1.59 1.41 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.42 7.81 34 T 6.84 4.88 4.08 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 1.26 0.00 0.00 35 R 9.04 4.80 0.00 1.87 1.80 0.00 3.39 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.76 0.00 36 Q 8.57 4.55 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.60 0.00 37 L 8.72 4.08 0.00 1.69 1.68 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.85 4.59 0.00 4.00 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 39 P 0.00 4.37 0.00 1.99 2.20 0.00 3.30 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 1.98 0.00 40 H 9.60 4.93 0.00 3.36 3.50 0.00 5.75 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.50 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 1.23 0.00 0.00 42 L 9.34 5.25 0.00 1.68 1.47 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 43 M 9.05 5.40 0.00 2.20 1.92 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.65 0.00 44 S 8.98 5.11 0.00 3.78 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 45 F 7.62 5.55 0.00 3.09 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 46 A 8.77 4.66 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 47 G 8.80 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 48 E 8.77 3.88 0.00 2.02 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 2.46 2.35 0.00 49 A 8.45 3.90 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 50 G 8.09 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 51 D 8.28 4.66 0.00 2.77 3.01 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 52 T 7.81 3.70 4.41 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 1.27 0.00 0.00 53 V 7.44 3.15 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 1.12 0.00 0.00 0.99 0.00 0.00 54 Q 7.89 4.02 0.00 2.45 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.60 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 55 F 8.47 3.70 0.00 2.20 2.89 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 56 A 7.52 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.40 3.86 0.00 1.98 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 2.33 2.42 0.00 58 Y 7.80 4.07 0.00 3.10 3.02 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 59 I 7.51 3.34 1.70 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 -0.15 0.88 0.00 0.00 60 Q 8.09 3.85 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 61 A 8.12 3.93 1.35 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 0.00 0.00 62 N 7.73 4.17 0.00 2.71 2.52 0.00 0.00 7.07 7.12 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 63 I 7.77 3.61 1.89 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.87 0.89 0.00 0.00 64 Q 8.29 4.00 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 65 L 7.82 3.88 0.00 1.74 1.81 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.01 3.78 0.00 3.02 2.98 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 0.00 0.00 0.00 67 S 8.23 5.10 0.00 4.13 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 68 I 7.45 3.68 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 1.40 0.46 0.89 0.00 0.00 69 R 7.79 3.94 0.00 1.68 1.71 0.00 2.99 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 70 E 8.05 4.20 0.00 1.74 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 1.99 2.18 0.00 71 D 8.14 4.44 0.00 2.73 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 72 Y 7.27 4.59 0.00 3.24 2.85 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 0.00 0.00 0.00 73 E 7.81 4.70 0.00 1.87 1.67 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 2.17 2.28 0.00 74 L 8.48 4.12 0.00 1.48 1.42 -0.06 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.45 4.34 0.00 4.03 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 0.00 76 P 0.00 4.22 0.00 2.16 2.14 0.00 3.56 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 77 Q 8.08 3.95 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 78 A 8.01 3.99 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 79 V 7.96 3.57 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 1.07 0.00 0.00 0.88 0.00 0.00 80 S 8.57 4.25 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 81 S 8.24 4.16 0.00 4.10 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 82 F 8.35 4.20 0.00 3.03 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 83 V 7.98 3.47 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 1.13 0.00 0.00 1.06 0.00 0.00 84 R 8.17 3.86 0.00 2.05 2.02 0.00 3.17 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 85 Q 8.07 3.95 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 86 E 7.96 3.99 0.00 2.22 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 0.00 1.68 1.98 0.00 87 L 8.14 3.97 0.00 1.80 1.61 0.86 0.05 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 88 A 8.29 4.03 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 K 8.06 4.04 0.00 2.06 1.88 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.70 7.81 90 S 8.01 4.00 0.00 4.07 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 0.00 90A I 7.57 3.76 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.78 0.92 0.00 0.00 90B R 7.79 4.50 0.00 1.80 1.87 0.00 3.20 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 91 S 7.50 4.55 0.00 3.90 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 92 R 8.42 3.89 0.00 1.74 1.93 0.00 3.15 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 93 R 7.34 4.35 0.00 1.66 1.64 0.00 3.26 0.00 0.00 3.17 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.57 0.00 94 P 0.00 4.28 0.00 2.03 2.01 0.00 3.67 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 1.98 2.17 0.00 95 Y 8.80 4.37 0.00 2.68 2.54 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 96 Q 8.66 4.48 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 97 V 7.56 4.86 1.65 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 0.82 0.00 0.00 0.84 0.00 0.00 98 N 9.28 5.17 0.00 2.66 2.68 0.00 0.00 6.54 7.62 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 99 V 8.39 5.14 2.34 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 0.95 0.00 0.00 1.05 0.00 0.00 100 L 8.74 4.86 0.00 1.59 1.54 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 101 I 8.62 4.79 1.91 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 1.34 0.67 0.94 0.00 0.00 102 G 9.37 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 0.00 103 G 8.65 4.62 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 0.00 104 Y 8.57 4.60 0.00 3.00 2.89 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 0.00 105 D 8.11 4.37 0.00 2.53 2.28 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