NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4035 8.3044 120.3212 54.7266 33.9476 175.0767 2 S 4.2723 8.2783 112.9431 56.1461 63.0248 173.2767 3 Y 4.2739 9.5498 128.4429 60.3631 38.1394 178.4171 4 A 3.5524 6.8167 121.2746 54.3287 18.4290 178.7529 5 D 4.5806 7.7718 116.6057 56.1425 41.0049 177.2500 6 S 4.7461 8.2201 113.8834 57.9509 63.8403 173.4073 7 S 5.6561 8.1541 115.5528 58.0833 66.9571 172.6513 8 R 4.6455 9.1958 116.9453 55.7711 32.0912 174.2040 9 N 4.3330 8.7519 111.9559 54.1441 36.0564 174.6068 10 A 4.6864 8.2227 119.0542 52.3535 19.2715 178.3421 11 V 4.8027 9.2133 114.9255 59.6911 36.8014 173.9269 12 L 4.8984 8.6472 124.3961 54.0908 43.6871 175.2233 13 T 4.5363 8.6558 119.9719 60.7591 71.5602 171.9331 14 N 4.2825 9.1718 116.9487 54.9267 36.5299 174.7098 15 G 3.6682 8.6494 100.7439 46.3619 0.0000 174.9391 16 G 3.9922 8.5299 105.8693 45.1723 0.0000 175.0354 17 R 4.2401 7.7359 118.8321 57.3221 31.1054 176.3396 18 T 4.9472 7.9757 114.9525 61.4116 71.4547 173.3476 19 L 4.5234 8.6264 129.3574 54.2724 43.5802 175.2088 20 R 5.1462 8.9529 126.6541 54.6807 33.1374 174.1298 21 A 4.9957 8.9311 126.0439 51.1243 23.8513 174.2376 22 E 5.1298 9.1782 118.7794 55.2858 31.6477 175.3881 23 C 5.2775 9.2686 122.6884 57.7838 31.1369 173.4584 24 R 3.8515 8.6334 125.5021 55.8854 30.5117 175.7419 25 N 4.7475 8.5222 123.5995 50.8121 39.7906 175.3858 26 A 3.9210 8.6401 120.6736 55.2999 18.3774 178.9100 27 D 4.3229 8.0054 114.4872 55.9072 41.1144 177.4391 28 G 3.7560 8.2239 107.0280 44.8801 0.0000 173.0124 29 N 4.8256 7.8701 117.0601 52.0525 40.8639 173.8825 30 W 5.0383 8.6829 119.6603 55.0191 31.7090 175.4198 31 V 4.4936 8.7520 125.2715 61.1699 33.6498 174.6756 32 T 4.7096 8.6219 124.8706 63.6371 69.1733 173.9030 33 S 4.7750 9.3835 120.9303 56.5206 66.1134 172.3730 34 E 5.2630 8.8252 124.4381 54.5229 33.0493 175.1437 35 L 4.5867 8.7568 124.1984 53.3191 45.8551 175.0209 36 D 4.8684 8.8059 126.2230 53.6963 40.9118 176.5362 37 L 4.1181 9.2074 128.8657 57.5091 42.0187 179.3370 38 D 4.6852 8.5336 118.4237 56.3542 40.8510 177.9434 39 T 4.3133 7.7680 108.8290 63.0982 69.3519 175.0880 40 I 4.5964 7.9008 113.1224 60.0925 40.4279 174.6404 41 I 4.7235 7.8462 124.1837 59.5646 40.7180 174.9108 42 G 4.5557 9.1157 113.8473 44.3665 0.0000 171.3014 43 N 5.1856 8.7098 118.2992 51.9608 40.3885 173.8569 44 N 4.5951 9.2673 127.4773 52.2842 39.0980 174.1426 45 D 4.4116 9.6577 128.4138 55.2626 39.6499 174.3237 46 G 3.8438 8.6883 103.8645 45.5019 0.0000 173.1284 47 H 4.8196 7.7661 116.3084 53.1256 31.8702 173.1832 48 F 4.6964 8.4855 121.3928 57.9597 39.7351 174.7141 49 Q 4.4297 9.0175 123.4588 53.8849 31.9161 174.2442 50 W 4.5485 8.8511 127.1817 58.3321 29.4102 177.0956 51 G 4.0766 9.5227 113.4211 45.3821 0.0000 173.9188 52 G 4.0211 7.5658 107.9457 44.7750 0.0000 172.4804 53 Q 4.7286 7.8888 114.7936 55.6036 31.7038 173.8667 54 N 4.0614 9.1917 114.3795 54.0076 36.5778 176.8956 55 F 4.2602 8.2054 115.6266 60.1455 38.0884 177.5354 56 T 3.4497 7.2794 111.1398 63.8489 68.6274 176.2955 57 E 4.0542 7.8423 121.5491 58.6972 29.7533 176.9935 58 T 4.8716 7.8363 109.3264 61.3989 69.5170 173.4501 59 A 5.5405 8.1096 122.0574 51.4099 22.3189 176.1043 60 E 4.5986 9.0880 118.9351 54.1282 34.1553 175.2616 61 D 4.4391 8.2703 117.5216 55.6098 38.3061 174.1085 62 I 4.7362 7.6250 118.6210 61.0760 38.4248 177.1917 63 R 4.8669 9.1972 122.6173 55.2091 33.3830 173.5313 64 F 5.4850 8.6875 120.8456 56.8456 42.8773 172.9003 65 H 4.5909 8.5618 125.2581 53.4996 31.6848 172.7602 66 P 3.9356 0.0000 0.0000 64.9800 32.1420 176.8070 67 K 4.5841 7.5564 117.7170 55.0050 33.1899 175.8277 68 E 3.5885 8.8011 121.6757 56.5569 31.0030 177.4906 69 G 3.9520 8.4568 113.9824 44.4801 0.0000 173.6238 70 A 3.9247 8.4360 120.0923 54.9852 18.3901 178.8162 71 A 4.0566 7.9628 116.3834 52.7666 19.2961 176.8381 72 E 3.8366 7.6125 114.2769 57.4378 27.4815 173.9567 73 Q 4.7702 8.1229 118.4439 53.2989 33.0233 175.3092 74 P 5.0044 0.0000 0.0000 62.5149 32.1502 174.2311 75 I 4.8906 8.5324 127.4398 59.5732 39.6206 174.4395 76 L 5.1185 8.8263 129.9686 53.8168 43.6922 175.3743 77 R 5.4465 9.1312 124.7532 54.8568 34.0341 174.3742 78 A 5.3299 8.7734 121.6393 52.1168 23.6530 175.4245 79 R 4.8803 9.1123 119.5874 55.4268 31.6901 175.7654 80 L 5.1357 8.7617 124.5872 52.8133 44.4880 175.7026 81 R 4.0098 8.1816 124.5510 55.4395 30.7781 176.2130 82 D 4.6251 8.8407 126.7902 52.3313 40.8516 176.8183 83 C 4.1968 9.1987 116.5947 61.8366 27.9896 174.5919 84 N 4.5450 8.2404 115.9039 52.9777 38.3986 175.7288 85 G 3.7921 8.2426 106.7429 45.4287 0.0000 173.0744 86 E 4.6174 8.1719 119.1078 54.5284 31.7150 175.3733 87 F 4.8785 8.6244 121.7029 57.1586 40.5988 174.9264 88 H 4.9818 8.9301 118.2899 53.9170 33.2003 172.1719 89 D 4.9325 8.8735 122.3781 54.3747 41.7478 175.3998 90 R 5.0307 9.2713 124.8712 54.4641 34.2518 174.2014 91 D 5.6191 8.6935 118.6922 52.1571 42.8130 175.0614 92 V 4.4556 8.5419 119.2874 60.1367 35.1073 173.3540 93 N 5.0469 8.8559 122.8462 52.6252 39.7014 174.4028 94 L 4.9770 9.3214 126.3097 55.4001 41.5291 178.0222 95 N 4.7443 8.7289 116.4965 54.0897 37.3230 177.1954 96 R 3.6612 7.7248 118.2002 58.8138 30.4267 176.8057 97 I 4.3233 7.8287 119.9898 61.1127 38.3633 175.5653 98 Q 5.0684 9.2972 125.7258 54.3563 32.1062 174.3895 99 N 5.1141 8.7444 120.0326 52.5318 39.9935 174.9699 100 V 3.9607 8.9124 128.8524 61.7882 30.8866 175.1727 101 N 3.9171 9.7298 129.1834 54.4363 37.1897 174.7955 102 G 4.0064 9.0945 103.9345 44.6687 0.0000 173.4068 103 R 4.6504 7.9009 120.1496 53.9725 33.3570 174.3750 104 L 4.6570 8.7423 127.0396 54.9246 42.2629 176.8270 105 V 4.4589 8.8060 123.8594 61.1310 35.3599 175.0179 106 F 4.5217 8.9322 128.2872 58.4432 39.3147 175.0867 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 4.40 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 2 S 8.28 4.27 0.00 3.89 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 3 Y 9.55 4.27 0.00 3.25 3.34 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 4 A 6.82 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 D 7.77 4.58 0.00 2.76 2.72 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 6 S 8.22 4.75 0.00 3.88 3.96 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 7 S 8.15 5.66 0.00 4.14 4.20 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 8 R 9.20 4.65 0.00 1.75 1.80 0.00 2.25 0.00 0.00 2.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.38 0.00 9 N 8.75 4.33 0.00 2.88 2.94 0.00 0.00 6.88 7.35 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 10 A 8.22 4.69 1.61 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 0.00 0.00 11 V 9.21 4.80 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 0.79 0.00 0.00 1.02 0.00 0.00 12 L 8.65 4.90 0.00 1.53 1.64 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.66 4.54 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 1.24 0.00 0.00 14 N 9.17 4.28 0.00 3.00 2.84 0.00 0.00 6.86 8.22 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 15 G 8.65 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 16 G 8.53 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 17 R 7.74 4.24 0.00 1.95 2.12 0.00 3.14 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 18 T 7.98 4.95 4.32 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 1.18 0.00 0.00 19 L 8.63 4.52 0.00 1.50 1.34 0.44 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.95 5.15 0.00 1.85 1.71 0.00 3.16 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 1.52 1.71 0.00 21 A 8.93 5.00 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 22 E 9.18 5.13 0.00 2.04 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 0.00 2.34 2.34 0.00 23 C 9.27 5.28 0.00 2.93 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 24 R 8.63 3.85 0.00 0.67 1.28 0.00 2.90 0.00 0.00 2.61 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.00 25 N 8.52 4.75 0.00 3.06 2.87 0.00 0.00 6.70 6.66 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 26 A 8.64 3.92 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 27 D 8.01 4.32 0.00 2.80 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 28 G 8.22 3.76 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 29 N 7.87 4.83 0.00 2.66 2.78 0.00 0.00 6.79 6.98 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 30 W 8.68 5.04 0.00 3.16 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 31 V 8.75 4.49 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 0.98 0.00 0.00 0.94 0.00 0.00 32 T 8.62 4.71 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 1.24 0.00 0.00 33 S 9.38 4.77 0.00 4.01 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 34 E 8.83 5.26 0.00 1.84 1.78 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 2.18 2.26 0.00 35 L 8.76 4.59 0.00 1.65 1.38 0.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.81 4.87 0.00 2.71 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 9.21 4.12 0.00 1.99 1.71 0.78 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 38 D 8.53 4.69 0.00 2.92 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.77 4.31 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 40 I 7.90 4.60 1.06 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 1.17 1.20 0.93 0.00 0.00 41 I 7.85 4.72 1.71 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.77 0.38 0.00 0.00 42 G 9.12 4.56 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 43 N 8.71 5.19 0.00 2.71 2.74 0.00 0.00 6.74 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 9.27 4.60 0.00 2.88 2.70 0.00 0.00 6.61 8.08 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 45 D 9.66 4.41 0.00 2.75 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 46 G 8.69 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 47 H 7.77 4.82 0.00 3.28 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 8.49 4.70 0.00 2.78 2.49 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 49 Q 9.02 4.43 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.99 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 50 W 8.85 4.55 0.00 3.31 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 51 G 9.52 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 0.00 0.00 0.00 0.00 52 G 7.57 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 0.00 0.00 0.00 53 Q 7.89 4.73 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.28 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 54 N 9.19 4.06 0.00 2.92 2.91 0.00 0.00 6.99 7.91 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 55 F 8.21 4.26 0.00 3.27 3.45 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 56 T 7.28 3.45 3.92 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 0.30 0.00 0.00 57 E 7.84 4.05 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 2.28 2.16 0.00 58 T 7.84 4.87 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 1.18 0.00 0.00 59 A 8.11 5.54 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 60 E 9.09 4.60 0.00 1.56 1.63 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 2.10 2.06 0.00 61 D 8.27 4.44 0.00 2.84 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 62 I 7.62 4.74 1.97 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 1.63 0.56 1.17 0.00 0.00 63 R 9.20 4.87 0.00 1.87 2.05 0.00 2.93 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 64 F 8.69 5.49 0.00 2.93 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 65 H 8.56 4.59 0.00 3.07 2.86 0.00 5.64 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 3.94 0.00 2.25 2.40 0.00 3.42 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.94 0.00 67 K 7.56 4.58 0.00 1.73 1.74 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.41 7.81 68 E 8.80 3.59 0.00 1.72 1.68 0.00 0.00 0.00 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 2.01 0.00 69 G 8.46 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 70 A 8.44 3.92 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 71 A 7.96 4.06 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 72 E 7.61 3.84 0.00 2.05 1.93 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 2.24 2.35 0.00 73 Q 8.12 4.77 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.98 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 74 P 0.00 5.00 0.00 2.61 2.50 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.01 0.00 75 I 8.53 4.89 1.83 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 1.29 1.12 0.93 0.00 0.00 76 L 8.83 5.12 0.00 1.77 1.36 1.05 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 77 R 9.13 5.45 0.00 1.81 1.86 0.00 3.26 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 78 A 8.77 5.33 1.46 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 0.00 0.00 79 R 9.11 4.88 0.00 1.85 2.00 0.00 3.07 0.00 0.00 3.32 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 80 L 8.76 5.14 0.00 1.51 1.36 -0.17 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.18 4.01 0.00 0.88 1.45 0.00 3.03 0.00 0.00 2.91 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.56 0.00 82 D 8.84 4.63 0.00 3.15 2.76 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 83 C 9.20 4.20 0.00 2.98 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 84 N 8.24 4.55 0.00 2.81 2.82 0.00 0.00 7.05 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 85 G 8.24 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.17 4.62 0.00 2.02 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 2.22 2.23 0.00 87 F 8.62 4.88 0.00 2.88 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 88 H 8.93 4.98 0.00 2.96 3.09 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.87 4.93 0.00 2.73 2.62 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 90 R 9.27 5.03 0.00 1.46 1.79 0.00 3.23 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 91 D 8.69 5.62 0.00 2.64 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 92 V 8.54 4.46 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 -0.78 0.00 0.00 0.63 0.00 0.00 93 N 8.86 5.05 0.00 2.83 2.89 0.00 0.00 7.13 7.78 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 94 L 9.32 4.98 0.00 2.13 1.98 0.85 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.73 4.74 0.00 2.97 3.17 0.00 0.00 7.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 7.72 3.66 0.00 0.67 1.17 0.00 3.04 0.00 0.00 2.93 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.50 0.00 97 I 7.83 4.32 2.18 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.88 0.82 0.00 0.00 98 Q 9.30 5.07 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.23 0.00 99 N 8.74 5.11 0.00 2.85 2.81 0.00 0.00 6.86 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 0.00 100 V 8.91 3.96 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 0.92 0.00 0.00 101 N 9.73 3.92 0.00 2.79 2.78 0.00 0.00 7.53 7.98 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 0.00 102 G 9.09 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 0.00 0.00 0.00 103 R 7.90 4.65 0.00 1.89 1.85 0.00 3.10 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 104 L 8.74 4.66 0.00 1.52 1.52 0.80 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.81 4.46 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 0.91 0.00 0.00 0.97 0.00 0.00 106 F 8.93 4.52 0.00 2.96 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00