NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.1871 8.2644 123.5826 52.4816 19.8140 174.8521 3 R 4.5486 7.8007 115.5071 56.9930 31.2471 173.8214 4 I 4.0663 8.9786 127.0786 61.1374 38.8521 177.4789 5 A 4.1034 9.4915 134.5252 52.6325 19.2355 177.0678 6 G 4.1892 8.3051 109.1402 46.3096 0.0000 173.6676 7 V 3.3227 8.4619 116.0664 61.3910 30.2310 173.5641 8 E 4.1692 8.3522 120.2305 57.2165 30.2364 177.1968 9 I 4.5410 7.8314 121.4821 59.4135 38.5889 172.5866 10 P 4.2778 0.0000 0.0000 63.1145 32.2235 175.9270 11 R 4.1612 8.1460 117.4248 56.3311 33.2111 174.8936 12 N 3.8994 8.1879 117.9198 53.5753 36.8459 172.7855 13 K 4.3756 7.2437 122.1425 53.8969 35.7861 173.7260 14 R 4.2169 8.4910 122.0848 56.9155 31.4635 177.3437 15 V 3.5658 8.2279 125.1826 66.0469 31.4424 177.8872 16 D 4.4074 7.4262 116.1311 57.0007 39.2895 178.3152 17 V 3.6972 7.9896 119.4233 65.4483 31.4117 177.1918 18 A 3.8078 8.7337 120.2589 55.5828 18.0253 179.4587 19 L 4.0197 8.1197 116.1152 58.4005 41.8689 179.4060 20 T 4.0715 8.1448 115.6291 66.8977 68.2514 175.6632 21 Y 4.1097 8.1654 114.5422 59.3792 38.0893 176.2883 22 I 5.4069 7.7038 121.0072 59.0374 40.3095 174.2026 23 Y 4.3514 9.6820 121.9633 59.9221 37.3286 178.5598 24 G 3.5882 9.4063 102.7933 46.4127 0.0000 172.8144 25 I 4.1764 9.0146 120.1446 59.0444 39.6301 175.2880 26 G 4.1102 7.7243 111.7267 43.1464 0.0000 172.4076 27 K 3.7962 8.8765 117.2078 59.9766 31.8711 178.4673 28 A 3.9463 8.0123 119.8695 55.7886 18.2553 179.7095 29 R 3.8600 7.7029 114.7440 59.1222 29.9709 178.8485 30 A 4.0896 8.0846 120.9973 54.8946 18.5472 179.1989 31 K 3.7727 8.2108 117.1235 59.7542 32.1730 178.7757 32 E 4.0133 8.3057 118.6996 59.2127 29.4166 178.5706 33 A 4.5189 8.5282 120.8565 55.5384 18.5490 179.6441 34 L 4.0545 8.3488 117.5757 57.9824 41.5096 179.0777 35 E 3.9937 8.1375 119.3952 59.0953 29.3692 179.1208 36 K 4.4001 8.4016 115.4666 56.8487 32.0696 178.0518 37 T 4.4158 7.2611 112.4707 62.3850 72.2874 174.3625 38 G 3.9892 8.0457 108.1672 46.3000 0.0000 171.9024 39 I 4.4629 8.1688 118.7220 59.2958 41.1641 175.1586 40 N 4.2253 8.9600 123.6632 53.5126 39.0694 173.3605 41 P 4.2627 0.0000 0.0000 65.6216 31.8127 178.4493 42 A 4.0397 8.2787 120.1529 55.3518 18.5774 177.5854 43 T 3.7788 7.6953 105.3425 60.8239 69.4448 173.5140 44 R 4.0936 8.8739 127.6174 56.5312 30.6639 176.6954 45 V 3.9141 8.7519 128.5147 66.1551 31.2848 177.6673 46 K 4.0090 8.3436 117.1346 58.9955 32.8050 176.4624 47 D 4.9830 8.7454 121.2105 53.7954 40.7215 175.8130 48 L 4.9150 7.3247 117.6413 52.9017 44.9666 177.9052 49 T 4.0747 9.3397 119.3895 63.2297 70.1911 175.5444 50 E 3.8743 8.9410 125.1955 59.5539 29.6201 179.0760 51 A 4.0002 7.9930 120.0543 55.2175 18.4064 179.3244 52 E 3.8344 7.9826 116.3723 59.6422 29.6651 179.1949 53 V 3.5853 7.9172 118.4284 66.2851 31.4493 178.1420 54 V 3.5743 7.8151 117.4610 66.1104 31.3907 178.1283 55 R 3.9323 7.8773 117.5229 59.2622 29.8543 178.7495 56 L 4.0247 8.2559 119.0480 58.0262 41.6363 179.3553 57 R 3.9175 8.1920 118.3987 59.8238 30.0587 178.0465 58 E 3.9344 8.2697 117.9045 59.7485 29.3090 178.5908 59 Y 4.2159 8.2766 118.9492 61.2552 39.2118 178.1673 60 V 3.2684 8.1545 119.5791 65.2289 31.5539 177.5829 61 E 4.3391 8.4205 119.9767 57.8752 29.9496 177.1549 62 N 4.7768 8.6333 114.3056 52.7273 39.8799 174.0169 63 T 4.7412 7.3146 129.3799 62.5606 66.2789 172.4087 64 W 5.3321 6.9090 117.9484 54.5703 33.1895 174.2072 65 K 4.4020 8.6418 121.4816 55.6426 32.5262 175.7954 66 L 4.8259 8.1392 124.2142 53.6483 46.4752 175.7355 67 E 3.4734 9.4077 115.4538 58.9500 29.7896 177.2198 68 G 3.9551 8.0451 106.7093 48.4033 0.0000 175.4763 69 E 3.9364 8.3188 122.3763 58.7871 29.5078 178.5053 70 L 4.0520 8.8139 120.9363 58.4964 42.2222 178.5177 71 R 3.9471 8.3216 116.9270 59.8013 29.9426 178.2008 72 A 3.8045 8.4182 120.0176 55.6081 18.2459 179.2594 73 E 3.8365 7.9006 117.4342 59.3435 29.8363 178.8596 74 V 3.7012 8.0772 118.0974 66.3214 31.6349 177.7535 75 A 3.9867 8.8641 120.7104 55.2643 18.1744 179.5585 76 A 3.9345 8.0630 119.2654 55.4080 18.2121 179.4497 77 N 4.2750 8.8418 116.0100 56.5322 38.5400 177.8032 78 I 3.6271 7.8135 121.0091 64.2783 37.3639 178.3326 79 K 3.9640 8.0311 120.0329 59.9068 31.8312 177.6713 80 R 4.1299 7.9955 119.5558 58.4737 29.7473 177.8884 81 L 4.1232 8.0730 121.0770 58.3067 40.5172 178.8656 82 M 4.0752 7.6910 118.9037 58.3121 32.5753 177.3134 83 D 4.4847 8.2635 118.8186 55.7692 41.4003 176.8447 84 I 4.2757 7.3400 112.6624 59.2522 39.1076 176.8741 85 G 3.8495 8.5901 108.0500 46.6737 0.0000 173.2512 86 C 3.9604 8.0614 120.8436 59.7012 32.3002 174.1188 87 Y 4.1918 8.7150 125.8210 60.9098 39.0110 178.0305 88 R 3.7498 8.3645 118.5884 59.3094 29.9925 178.9328 89 G 3.9040 7.5396 106.1286 47.1686 0.0000 175.4902 90 L 3.9349 7.8075 121.8420 57.6210 41.6296 179.7106 91 R 3.7937 7.6652 117.1795 59.8801 29.7345 178.7138 92 H 4.1261 7.9799 114.4354 58.5711 28.6664 177.7564 93 R 4.1157 7.6659 119.5743 58.9303 30.0970 178.5721 94 R 4.1981 8.3685 116.7776 56.2089 30.4550 176.6553 95 G 3.8027 8.2686 106.5314 46.8206 0.0000 173.3497 96 L 4.7583 7.5807 117.6869 51.0442 44.7186 174.8054 97 P 4.0110 0.0000 0.0000 63.7945 31.1715 175.9693 98 V 4.1308 8.2801 120.1114 62.6298 31.6661 175.5897 99 R 4.6181 8.1643 117.4331 56.3340 30.8453 175.4203 100 G 4.0036 8.2118 101.0000 46.8219 0.0000 174.1001 101 Q 4.5856 7.8070 116.0842 53.4512 30.9211 176.4362 102 R 4.0596 8.4172 117.5037 56.7879 29.9016 176.6323 103 T 4.4580 8.2352 109.4828 61.3932 69.7707 175.2341 104 R 4.0582 7.9279 123.0805 59.4891 30.4255 176.2685 105 T 4.5281 7.5516 104.5975 61.7596 71.2828 173.4553 106 N 4.5498 9.0315 119.2082 53.4800 36.4997 174.6277 107 A 4.5981 7.5310 121.0278 52.5067 19.1163 180.2234 108 R 3.9616 8.2568 122.3392 61.0964 30.5647 179.9636 109 T 3.7813 7.9281 113.4299 66.5787 68.6808 175.5674 110 R 4.0708 7.9149 120.0566 58.7862 30.3773 177.3320 111 K 4.1379 8.3935 116.7253 56.6335 33.2549 179.1082 112 G 3.8561 8.7390 107.7654 44.7122 0.0000 171.7422 113 P 4.3634 0.0000 0.0000 62.6916 32.0074 175.8806 114 R 4.2251 8.3319 119.7253 56.0195 31.0351 178.0811 115 K 4.4168 8.1798 123.8090 54.7500 30.9184 175.7254 116 T 3.9348 7.7169 116.5833 63.7842 69.4215 174.3774 117 V 4.5488 7.9881 118.7259 59.3786 34.9650 174.8696 118 A 4.3529 8.4096 122.6859 52.1117 19.3327 176.7910 119 G 4.1368 8.0555 107.8519 42.8815 0.0000 173.1033 120 K 4.0594 8.3491 120.8684 55.8041 32.4618 176.6501 121 K 4.0239 8.4831 126.4391 57.2194 33.2244 176.3431 122 K 3.4978 9.2196 122.0112 55.5284 29.1141 177.2357 123 A 4.1947 7.0819 114.9559 51.0169 20.5234 174.3854 124 P 4.3058 0.0000 0.0000 63.5990 31.0404 177.1751 125 R 4.2094 8.5900 119.5916 56.0975 30.1348 176.5474 126 K 4.1815 7.9116 125.1019 56.9864 32.0618 175.5025 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 2 A 8.26 4.19 1.29 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 0.00 0.00 3 R 7.80 4.55 0.00 1.88 1.88 0.00 3.01 0.00 0.00 3.89 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 4 I 8.98 4.07 1.92 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 1.38 1.10 0.96 0.00 0.00 5 A 9.49 4.10 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 6 G 8.31 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.46 3.32 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 0.94 0.00 0.00 8 E 8.35 4.17 0.00 2.16 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 2.44 2.51 0.00 9 I 7.83 4.54 1.87 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 1.48 0.49 0.95 0.00 0.00 10 P 0.00 4.28 0.00 2.09 2.18 0.00 3.81 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 11 R 8.15 4.16 0.00 1.67 1.72 0.00 3.25 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.62 0.00 12 N 8.19 3.90 0.00 2.77 3.10 0.00 0.00 6.72 6.68 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 13 K 7.24 4.38 0.00 1.90 1.45 0.00 1.68 0.00 0.00 1.61 0.00 0.00 3.20 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.37 7.81 14 R 8.49 4.22 0.00 1.92 1.93 0.00 3.25 0.00 0.00 3.38 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.91 0.00 15 V 8.23 3.57 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 1.12 0.00 0.00 0.99 0.00 0.00 16 D 7.43 4.41 0.00 2.93 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 17 V 7.99 3.70 2.32 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 1.19 0.00 0.00 0.98 0.00 0.00 18 A 8.73 3.81 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 19 L 8.12 4.02 0.00 1.88 1.84 1.04 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 20 T 8.14 4.07 4.67 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 1.10 0.00 0.00 21 Y 8.17 4.11 0.00 3.09 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 22 I 7.70 5.41 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.19 1.00 0.00 0.00 23 Y 9.68 4.35 0.00 3.32 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 24 G 9.41 3.59 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 0.00 0.00 0.00 25 I 9.01 4.18 1.85 0.00 0.00 1.00 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 0.67 0.89 0.00 0.00 26 G 7.72 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.88 3.80 0.00 1.74 1.88 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.46 7.81 28 A 8.01 3.95 1.24 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 0.00 0.00 0.00 29 R 7.70 3.86 0.00 1.30 0.76 0.00 2.36 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.09 0.00 30 A 8.08 4.09 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 0.00 0.00 31 K 8.21 3.77 0.00 1.91 2.03 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.51 7.81 32 E 8.31 4.01 0.00 2.27 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 2.62 2.50 0.00 33 A 8.53 4.52 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.35 4.05 0.00 1.75 1.96 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.14 3.99 0.00 2.30 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 2.35 0.00 36 K 8.40 4.40 0.00 1.05 1.17 0.00 1.64 0.00 0.00 1.46 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.39 7.81 37 T 7.26 4.42 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 1.21 0.00 0.00 38 G 8.05 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 39 I 8.17 4.46 1.89 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 1.19 0.86 0.97 0.00 0.00 40 N 8.96 4.23 0.00 2.75 2.74 0.00 0.00 7.19 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 41 P 0.00 4.26 0.00 2.23 2.18 0.00 3.67 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 42 A 8.28 4.04 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 43 T 7.70 3.78 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 1.25 0.00 0.00 44 R 8.87 4.09 0.00 1.96 2.05 0.00 3.26 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 45 V 8.75 3.91 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 0.79 0.00 0.00 0.99 0.00 0.00 46 K 8.34 4.01 0.00 1.89 1.93 0.00 1.57 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.47 7.81 47 D 8.75 4.98 0.00 2.61 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 48 L 7.32 4.92 0.00 1.60 1.56 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 49 T 9.34 4.07 4.35 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 1.26 0.00 0.00 50 E 8.94 3.87 0.00 2.07 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 2.38 2.46 0.00 51 A 7.99 4.00 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 52 E 7.98 3.83 0.00 2.15 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 2.40 2.37 0.00 53 V 7.92 3.59 2.24 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 1.08 0.00 0.00 0.98 0.00 0.00 54 V 7.82 3.57 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 0.98 0.00 0.00 1.03 0.00 0.00 55 R 7.88 3.93 0.00 2.09 1.97 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 56 L 8.26 4.02 0.00 1.97 1.79 0.98 0.80 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 57 R 8.19 3.92 0.00 2.03 2.13 0.00 3.11 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 58 E 8.27 3.93 0.00 2.22 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 2.67 2.48 0.00 59 Y 8.28 4.22 0.00 2.73 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 60 V 8.15 3.27 2.20 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 1.15 0.00 0.00 1.08 0.00 0.00 61 E 8.42 4.34 0.00 2.06 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 2.38 2.53 0.00 62 N 8.63 4.78 0.00 2.84 2.67 0.00 0.00 6.82 7.01 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 63 T 7.31 4.74 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 -0.75 0.00 0.00 64 W 6.91 5.33 0.00 3.52 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 65 K 8.64 4.40 0.00 1.77 1.75 0.00 1.76 0.00 0.00 1.89 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.82 7.81 66 L 8.14 4.83 0.00 1.70 1.63 1.07 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 67 E 9.41 3.47 0.00 2.12 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 2.43 2.47 0.00 68 G 8.05 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 0.00 0.00 0.00 69 E 8.32 3.94 0.00 2.07 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 0.00 2.42 2.40 0.00 70 L 8.81 4.05 0.00 1.98 2.04 0.74 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.32 3.95 0.00 1.98 1.90 0.00 2.97 0.00 0.00 3.07 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.30 0.00 72 A 8.42 3.80 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 73 E 7.90 3.84 0.00 2.15 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 0.00 2.32 2.33 0.00 74 V 8.08 3.70 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 0.98 0.00 0.00 0.97 0.00 0.00 75 A 8.86 3.99 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.06 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.84 4.28 0.00 2.87 2.88 0.00 0.00 7.08 5.12 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 78 I 7.81 3.63 1.95 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.73 0.68 0.00 0.00 79 K 8.03 3.96 0.00 1.81 1.80 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.72 1.48 7.81 80 R 8.00 4.13 0.00 2.17 1.79 0.00 3.18 0.00 0.00 3.22 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 81 L 8.07 4.12 0.00 1.88 1.93 0.94 0.78 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 82 M 7.69 4.08 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.56 0.00 83 D 8.26 4.48 0.00 2.91 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 84 I 7.34 4.28 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 1.42 0.86 0.96 0.00 0.00 85 G 8.59 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 0.00 0.00 0.00 86 C 8.06 3.96 0.00 3.00 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 87 Y 8.72 4.19 0.00 3.02 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 88 R 8.36 3.75 0.00 1.90 2.00 0.00 3.25 0.00 0.00 3.38 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 89 G 7.54 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 90 L 7.81 3.93 0.00 1.74 1.67 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.67 3.79 0.00 1.68 2.00 0.00 2.98 0.00 0.00 2.61 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.17 0.00 92 H 7.98 4.13 0.00 3.30 3.32 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.67 4.12 0.00 2.01 1.97 0.00 3.15 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 94 R 8.37 4.20 0.00 1.68 1.96 0.00 3.39 0.00 0.00 3.21 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.75 0.00 95 G 8.27 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 96 L 7.58 4.76 0.00 1.54 1.51 0.90 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.01 0.00 2.35 2.09 0.00 3.71 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 1.99 1.99 0.00 98 V 8.28 4.13 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 0.76 0.00 0.00 0.63 0.00 0.00 99 R 8.16 4.62 0.00 1.87 1.87 0.00 3.36 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 100 G 8.21 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 0.00 0.00 0.00 101 Q 7.81 4.59 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 102 R 8.42 4.06 0.00 1.92 1.94 0.00 3.05 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 103 T 8.24 4.46 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 1.27 0.00 0.00 104 R 7.93 4.06 0.00 1.80 2.00 0.00 3.26 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 105 T 7.55 4.53 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 0.00 106 N 9.03 4.55 0.00 2.94 3.10 0.00 0.00 6.85 7.14 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 0.00 107 A 7.53 4.60 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 0.00 108 R 8.26 3.96 0.00 1.84 1.99 0.00 3.29 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 109 T 7.93 3.78 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 1.20 0.00 0.00 110 R 7.91 4.07 0.00 1.73 1.92 0.00 3.25 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.74 0.00 111 K 8.39 4.14 0.00 1.80 1.84 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.51 7.81 112 G 8.74 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.36 0.00 2.05 2.01 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 114 R 8.33 4.23 0.00 1.80 1.86 0.00 3.18 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 115 K 8.18 4.42 0.00 1.71 1.76 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.49 7.81 116 T 7.72 3.93 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 0.00 117 V 7.99 4.55 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 0.76 0.00 0.00 0.93 0.00 0.00 118 A 8.41 4.35 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 0.00 119 G 8.06 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 0.00 0.00 0.00 120 K 8.35 4.06 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.46 7.81 121 K 8.48 4.02 0.00 1.77 1.73 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.44 1.48 7.81 122 K 9.22 3.50 0.00 1.87 1.89 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.48 7.81 123 A 7.08 4.19 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 0.00 124 P 0.00 4.31 0.00 2.05 2.04 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 125 R 8.59 4.21 0.00 1.89 2.04 0.00 3.12 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 126 K 7.91 4.18 0.00 1.73 1.76 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.49 7.81