NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5481 8.3649 120.3174 52.9584 40.6925 174.6864 2 I 3.9379 8.2589 122.5906 60.7499 37.7784 173.7545 3 Q 4.6118 9.9830 128.6883 54.5007 31.2710 174.4229 4 L 5.1384 8.5256 122.8946 53.3753 43.9983 175.7386 5 T 4.6166 9.3040 121.4624 61.8440 70.7968 173.0275 6 Q 5.3517 8.8132 128.0135 54.4187 31.2268 174.6194 7 S 4.8995 8.8885 119.8774 56.1004 67.0134 172.1922 8 P 4.7108 0.0000 0.0000 62.7148 32.4015 175.8678 9 S 4.5762 8.3937 111.3288 59.9352 64.3770 173.6436 10 S 5.1113 7.5618 112.8735 57.7386 65.3615 172.9281 11 L 4.4947 8.0970 122.1359 55.5629 43.9560 173.2706 12 S 5.2231 8.5799 114.0658 57.3282 66.8731 173.6855 13 A 4.6096 8.7232 123.4508 51.4623 22.7718 174.8978 14 S 4.8695 9.1856 111.1147 56.2318 66.9872 173.7764 15 L 4.2222 8.3822 121.3695 57.0098 41.4957 178.1452 16 G 3.9186 8.9989 112.9899 45.1093 0.0000 173.1059 17 D 4.6395 8.3964 120.0479 54.1108 42.6131 175.0257 18 R 4.9168 8.3056 119.4827 54.7981 32.3721 174.8868 19 V 4.5659 8.4345 118.9407 59.8315 35.6930 174.8338 20 T 4.9495 8.2084 118.1683 62.0180 71.9819 173.2865 21 I 4.5133 8.6735 127.5164 59.4968 40.1930 174.5817 22 S 5.3468 8.8323 121.0516 56.9630 65.0384 171.9648 23 C 5.5183 9.8080 125.5597 55.1448 45.4009 172.7074 24 R 5.3643 9.3315 124.7869 54.3930 32.9667 174.6872 25 A 4.9681 9.0133 126.3100 51.3622 19.8016 178.2584 26 S 4.4771 9.1795 116.0330 60.1501 63.4099 173.7148 27 Q 4.5362 7.6361 116.5196 54.9674 31.3351 173.3002 28 D 4.6234 8.7367 118.6156 54.9047 41.6466 175.7958 29 I 4.4548 8.6737 118.0213 59.8260 38.2070 175.7187 30 S 3.5208 9.8161 116.0656 60.1609 61.0976 172.8799 31 N 4.8031 8.2497 114.5570 54.4178 37.6628 175.0025 32 Y 4.6805 7.4408 118.3562 57.0780 36.4915 173.9073 33 L 4.8764 7.2489 122.4299 53.0459 45.7586 175.3389 34 N 5.4065 8.6468 122.7406 51.1659 42.6127 173.3547 35 W 5.2152 9.2015 121.1010 55.2137 32.7258 174.3304 36 Y 5.2506 9.5341 120.8845 56.2123 41.9300 174.1409 37 Q 4.6838 9.0941 122.5465 54.3388 31.8813 173.9834 38 Q 5.0358 8.8563 128.3594 53.9388 30.8568 175.1255 39 K 4.0386 8.5956 126.5470 55.6169 32.7608 176.8551 40 P 4.3820 0.0000 0.0000 65.0848 31.2589 177.3411 41 D 4.5382 7.9737 115.9100 53.4080 39.8502 176.8039 42 G 4.0396 8.0989 108.8657 45.6220 0.0000 174.5213 43 T 4.0193 8.5791 117.1617 64.1202 69.5197 173.4929 44 V 4.9874 8.2985 123.9878 61.2207 34.7027 174.6058 45 K 4.7985 9.0195 124.8220 54.5642 37.0709 175.4143 46 L 4.3852 8.5682 124.9450 54.8001 41.9539 176.4725 47 L 4.2155 8.7453 127.4602 57.2591 42.4541 177.1977 48 I 5.2891 7.6062 118.3032 59.8654 41.9016 173.6904 49 Y 5.1609 7.9541 121.4824 56.6300 41.1040 173.7746 50 Y 3.5888 9.2632 118.4717 58.6548 37.2200 170.6499 51 T 3.7932 8.6010 120.8910 63.6086 67.7624 174.0888 52 S 4.6961 7.4698 110.7297 57.6199 64.3819 173.4290 53 R 4.0953 7.6809 121.7480 55.7478 30.8034 175.6828 54 L 4.5118 8.3011 124.8922 54.4652 42.6022 176.4640 55 H 4.8652 9.3775 125.1360 55.5765 31.1735 174.9319 56 S 4.2311 8.4655 119.5789 59.9446 63.2534 174.6987 57 G 3.8977 9.0457 111.1782 45.1199 0.0000 172.9395 58 V 4.2915 7.0507 119.2332 59.9565 33.2150 173.7920 59 P 4.4834 0.0000 0.0000 62.7130 31.7448 177.2059 60 S 4.4444 8.5938 115.2253 59.5810 63.3746 175.2453 61 R 3.9982 7.9183 118.1052 57.9932 29.8344 175.6199 62 F 5.0591 8.0735 118.6740 56.3099 40.1732 175.5616 63 S 4.7472 9.4882 117.7648 56.4890 66.6595 173.0711 64 G 4.5650 8.8671 107.9253 43.6165 0.0000 171.8266 65 S 4.8106 9.2653 116.9658 56.2089 67.2294 173.4573 66 G 4.0442 8.0034 108.9848 44.9552 0.0000 171.5244 67 S 4.3537 7.4943 111.2685 58.2856 67.5539 177.8859 68 G 3.9547 8.9185 117.2062 47.0035 0.0000 175.3448 69 T 4.5999 8.9359 123.8607 63.1983 71.0967 173.1836 70 D 5.4422 7.7320 122.0961 52.5750 43.7766 174.9212 71 Y 5.2392 9.2234 120.4112 56.4436 42.8428 174.4463 72 S 5.3293 9.6690 115.2397 57.0325 67.3337 172.3145 73 L 4.7423 8.8538 123.3936 53.3856 44.5124 175.0111 74 T 4.8388 8.9243 122.8979 61.7310 71.6370 172.9327 75 I 4.4140 8.0050 127.0280 59.6244 39.3278 175.6365 76 S 4.5882 8.4021 123.3892 56.2095 65.0547 173.6077 77 N 4.1053 8.4146 115.9016 54.1433 36.0548 175.1381 78 L 3.5585 7.7821 118.4275 55.4814 43.0291 175.5742 79 E 4.8987 9.0080 125.8770 53.8884 32.5741 176.3542 80 Q 4.0210 8.4998 122.5565 58.9812 29.2342 177.2446 81 E 4.2491 8.2090 112.3873 57.1824 29.5267 176.6463 82 D 4.8146 7.7154 118.2986 54.7534 41.5075 176.5164 83 I 3.8049 7.6288 120.1292 62.1186 36.3834 174.4288 84 A 4.5937 8.1707 125.8317 51.3580 23.0942 173.8685 85 T 4.8771 7.9373 112.6590 62.2644 71.5567 173.4021 86 Y 5.1021 8.9002 124.1209 56.6148 40.4823 174.8447 87 F 5.6166 9.5042 121.0544 56.0061 43.5098 171.6994 88 C 4.9292 8.9667 116.0849 53.9606 45.8359 172.2019 89 Q 4.7488 8.1209 119.8215 54.8534 31.6479 173.1690 90 Q 4.6794 8.7203 124.7651 54.6119 31.0860 175.8548 91 G 3.1159 8.5813 108.3525 46.1765 0.0000 174.1705 92 N 4.4191 9.3070 120.9744 55.4642 39.3252 175.3427 93 T 4.7636 7.9235 105.5429 59.3968 71.7930 173.5195 94 L 3.5380 8.1849 124.6720 53.8715 42.2851 175.1161 95 P 4.1609 0.0000 0.0000 61.4425 32.4089 176.2717 96 W 4.8098 7.9262 120.4235 57.5687 29.8362 175.5489 97 T 4.8911 7.9817 107.7002 60.0659 71.7633 172.7398 98 F 5.3094 8.9252 120.9289 55.5752 42.3907 175.2432 99 G 4.0504 8.9975 109.0458 45.5873 0.0000 174.3914 100 G 3.8650 8.8387 108.1439 46.5958 0.0000 175.1946 101 G 3.4665 9.0878 105.6441 45.7610 0.0000 173.3342 102 T 4.6638 8.2837 116.3769 61.2635 72.2262 173.2329 103 K 4.4796 8.7337 129.5605 55.8092 33.8674 175.1367 104 L 4.9876 9.0369 130.5694 53.5832 44.1261 174.8678 105 E 4.9614 8.8432 124.9108 54.6053 33.4557 174.7624 106 I 4.6071 8.3050 123.8644 60.0190 38.6636 175.7050 107 K 4.1953 9.4025 128.7891 56.6093 31.6662 176.2809 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 D 8.36 4.55 0.00 2.78 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 2 I 8.26 3.94 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.69 0.94 0.00 0.00 3 Q 9.98 4.61 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 4 L 8.53 5.14 0.00 1.53 1.58 0.87 0.80 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 5 T 9.30 4.62 4.29 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 1.26 0.00 0.00 6 Q 8.81 5.35 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.59 2.43 0.00 7 S 8.89 4.90 0.00 3.94 3.93 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 8 P 0.00 4.71 0.00 2.43 2.14 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 9 S 8.39 4.58 0.00 3.95 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 0.00 10 S 7.56 5.11 0.00 3.87 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 11 L 8.10 4.49 0.00 1.76 1.71 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.58 5.22 0.00 3.71 3.74 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 0.00 0.00 0.00 13 A 8.72 4.61 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 14 S 9.19 4.87 0.00 3.88 3.70 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 15 L 8.38 4.22 0.00 1.61 1.62 0.92 0.98 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 16 G 9.00 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 0.00 0.00 0.00 0.00 17 D 8.40 4.64 0.00 2.66 2.56 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 18 R 8.31 4.92 0.00 1.69 1.70 0.00 3.10 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 19 V 8.43 4.57 1.97 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 0.77 0.00 0.00 nan 0.00 0.00 20 T 8.21 4.95 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 1.15 0.00 0.00 21 I 8.67 4.51 1.60 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.60 1.10 0.00 0.00 22 S 8.83 5.35 0.00 3.96 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 23 C 9.81 5.52 0.00 3.08 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 9.33 5.36 0.00 1.78 1.89 0.00 3.21 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.63 0.00 25 A 9.01 4.97 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 26 S 9.18 4.48 0.00 3.88 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 27 Q 7.64 4.54 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 28 D 8.74 4.62 0.00 2.70 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 29 I 8.67 4.45 1.90 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.45 0.95 0.00 0.00 30 S 9.82 3.52 0.00 4.12 3.97 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 31 N 8.25 4.80 0.00 2.49 2.35 0.00 0.00 6.96 7.61 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 32 Y 7.44 4.68 0.00 3.12 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 33 L 7.25 4.88 0.00 0.82 0.91 0.26 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.65 5.41 0.00 2.60 2.40 0.00 0.00 6.39 6.99 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 35 W 9.20 5.22 0.00 3.17 3.07 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 36 Y 9.53 5.25 0.00 3.14 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 37 Q 9.09 4.68 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.74 0.00 0.00 0.00 0.00 0.00 2.05 1.69 0.00 38 Q 8.86 5.04 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 39 K 8.60 4.04 0.00 1.99 1.74 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.58 7.81 40 P 0.00 4.38 0.00 2.05 2.13 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 41 D 7.97 4.54 0.00 2.76 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 42 G 8.10 4.04 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 0.00 0.00 0.00 43 T 8.58 4.02 4.31 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 1.22 0.00 0.00 44 V 8.30 4.99 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 0.82 0.00 0.00 0.89 0.00 0.00 45 K 9.02 4.80 0.00 1.73 1.67 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.39 7.81 46 L 8.57 4.39 0.00 1.72 1.47 0.73 0.86 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 47 L 8.75 4.22 0.00 1.68 1.51 1.03 0.05 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 48 I 7.61 5.29 2.03 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 1.37 0.95 1.02 0.00 0.00 49 Y 7.95 5.16 0.00 3.31 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 50 Y 9.26 3.59 0.00 3.29 3.07 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 51 T 8.60 3.79 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 1.30 0.00 0.00 52 S 7.47 4.70 0.00 3.86 3.98 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 53 R 7.68 4.10 0.00 0.67 1.31 0.00 3.22 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 54 L 8.30 4.51 0.00 1.50 1.61 1.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 55 H 9.38 4.87 0.00 3.39 3.40 0.00 5.61 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.47 4.23 0.00 3.98 3.85 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 57 G 9.05 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 58 V 7.05 4.29 2.30 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 0.67 0.00 0.00 0.95 0.00 0.00 59 P 0.00 4.48 0.00 2.48 2.06 0.00 3.82 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.18 0.00 60 S 8.59 4.44 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.92 4.00 0.00 1.84 2.15 0.00 2.94 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.20 0.00 62 F 8.07 5.06 0.00 3.08 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 63 S 9.49 4.75 0.00 3.74 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 64 G 8.87 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 65 S 9.27 4.81 0.00 3.84 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 66 G 8.00 4.04 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 0.00 0.00 0.00 67 S 7.49 4.35 0.00 3.65 3.48 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 0.00 0.00 0.00 0.00 68 G 8.92 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 69 T 8.94 4.60 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 1.33 0.00 0.00 70 D 7.73 5.44 0.00 2.44 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 0.00 0.00 0.00 0.00 71 Y 9.22 5.24 0.00 3.05 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 72 S 9.67 5.33 0.00 3.81 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 73 L 8.85 4.74 0.00 0.27 0.31 0.47 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.92 4.84 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 1.09 0.00 0.00 75 I 8.01 4.41 1.51 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.57 0.18 0.00 0.00 76 S 8.40 4.59 0.00 3.63 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 77 N 8.41 4.11 0.00 2.69 2.76 0.00 0.00 6.81 7.85 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 78 L 7.78 3.56 0.00 1.84 1.63 0.77 0.81 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 79 E 9.01 4.90 0.00 1.98 1.87 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 2.35 2.20 0.00 80 Q 8.50 4.02 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 81 E 8.21 4.25 0.00 2.17 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 0.00 2.38 2.43 0.00 82 D 7.72 4.81 0.00 2.89 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 83 I 7.63 3.80 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.69 0.99 0.00 0.00 84 A 8.17 4.59 0.99 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 85 T 7.94 4.88 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 0.79 0.00 0.00 86 Y 8.90 5.10 0.00 3.11 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 87 F 9.50 5.62 0.00 3.24 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 88 C 8.97 4.93 0.00 1.94 1.18 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 89 Q 8.12 4.75 0.00 1.84 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.87 0.00 0.00 0.00 0.00 0.00 1.69 1.16 0.00 90 Q 8.72 4.68 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.66 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 91 G 8.58 3.12 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 92 N 9.31 4.42 0.00 2.93 3.10 0.00 0.00 6.78 7.57 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 93 T 7.92 4.76 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 94 L 8.18 3.54 0.00 1.36 1.30 -0.40 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.16 0.00 2.11 1.91 0.00 3.72 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 96 W 7.93 4.81 0.00 3.24 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 97 T 7.98 4.89 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 1.31 0.00 0.00 98 F 8.93 5.31 0.00 2.90 3.06 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 99 G 9.00 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.84 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 0.00 0.00 0.00 101 G 9.09 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 8.28 4.66 4.37 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 1.28 0.00 0.00 103 K 8.73 4.48 0.00 1.88 1.70 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.40 7.81 104 L 9.04 4.99 0.00 1.91 1.84 0.84 1.09 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 0.00 105 E 8.84 4.96 0.00 1.96 1.79 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 2.23 2.27 0.00 106 I 8.31 4.61 1.88 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 1.24 0.39 0.91 0.00 0.00 107 K 9.40 4.20 0.00 1.65 1.72 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.39 7.81