NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.5326 8.1749 117.3746 63.7525 70.0845 173.0691 2 T 4.5948 9.4427 121.9631 60.4919 72.3871 171.4731 3 T 5.2635 8.4668 116.5311 59.9501 72.5642 172.6483 4 L 4.9027 9.0590 122.7281 54.9973 44.6357 174.4068 5 A 5.1746 8.3379 119.8569 51.0203 22.0829 175.6767 6 F 5.0765 8.6439 116.4318 55.3889 41.8950 173.7074 7 R 5.1915 8.8142 119.6073 55.5234 31.6573 175.5535 8 F 4.8796 9.5151 117.0334 55.7292 41.1811 174.5709 9 Q 3.7195 8.9862 121.6290 59.2774 28.4471 177.7922 10 G 3.5519 5.5183 102.9623 45.0028 0.0000 172.3783 11 G 4.1959 6.4157 108.3354 44.0413 0.0000 176.8363 12 I 5.2580 8.6192 123.6732 59.3060 40.8652 173.0377 13 I 4.2799 7.9842 126.8697 59.3830 39.4776 174.7983 14 V 4.8478 8.1984 125.3006 61.0321 34.0602 174.3703 15 A 4.8465 8.8345 128.7124 50.4374 22.4557 175.0485 16 V 4.9956 8.2345 113.2109 59.9793 36.2825 174.7715 17 D 4.8770 8.3931 123.0755 52.0990 42.1196 176.2528 18 S 4.8373 8.2118 111.2473 58.4131 64.3539 173.1475 19 R 5.0295 8.8809 120.5217 55.8563 31.6133 175.2015 20 A 4.8838 8.9275 126.9731 50.3079 21.8958 175.1038 21 T 5.0074 8.6180 111.6830 59.8594 72.3398 173.9767 22 A 4.5901 8.9270 126.5417 51.2632 20.7889 177.0110 23 G 4.1481 8.3191 114.4460 47.6511 0.0000 173.4104 24 N 4.7356 8.8821 121.9545 52.4343 39.2924 174.3216 25 W 4.4974 8.0081 130.8100 56.8442 31.2303 175.3360 26 V 4.0455 7.4570 125.8780 61.1081 30.0124 175.0025 27 A 3.6893 8.0962 131.4045 54.6959 18.6884 177.5924 28 S 4.4798 7.2131 107.1154 57.8119 64.9980 174.6057 29 Q 4.6472 8.5751 122.2163 55.8225 29.9346 175.5662 30 T 4.7435 7.8277 108.4326 61.1314 68.1090 174.2529 31 V 4.1799 7.9348 120.9240 62.9287 33.3145 175.4430 32 K 4.3583 8.5211 125.9445 55.6136 32.8893 176.6600 33 K 4.5891 8.7663 122.6067 55.8946 34.0196 175.2138 34 V 4.8284 7.7179 120.1319 61.1185 34.0439 174.5025 35 I 4.3665 9.2943 129.6888 59.8443 39.3852 175.4251 36 E 4.4422 8.7363 127.2764 54.4416 28.2465 175.7330 37 I 3.8157 8.0419 123.8917 63.5374 37.7435 175.5035 38 N 4.5616 7.8731 114.7174 51.4615 39.9882 173.1609 39 P 4.0975 0.0000 0.0000 64.8769 31.2107 177.2729 40 F 4.7872 9.3817 114.8830 56.7533 40.8074 175.1035 41 L 5.1643 8.2549 121.1261 52.7556 44.7848 175.5323 42 L 5.0679 9.1803 123.2284 52.8863 45.3659 175.7286 43 G 4.6580 9.3914 109.0370 43.5488 0.0000 171.8540 44 T 5.0229 8.5282 114.2001 60.3972 71.2092 173.8915 45 M 4.9295 8.9018 122.3433 53.6212 34.7944 175.1460 46 A 4.6425 8.7888 124.6581 50.4959 23.3164 174.6796 47 G 4.2586 9.3073 107.7554 44.3871 0.0000 177.1173 48 G 3.7865 9.3284 119.4108 44.1839 0.0000 173.7630 49 A 3.9717 8.9341 127.9418 55.1379 18.3746 179.0337 50 A 3.9320 7.9389 118.5483 55.3891 18.5656 179.2625 51 D 4.4277 8.1142 116.8517 57.8449 40.9096 178.7912 52 C 4.2256 8.3082 116.9671 62.9413 28.1633 175.7480 53 Q 3.9791 8.3172 121.2690 59.2921 28.6101 178.3981 54 F 3.7545 8.5238 121.6751 61.2469 39.4802 177.2903 55 W 4.4983 8.2252 118.3049 59.4902 28.6751 178.4451 56 E 4.2365 8.7125 119.0625 59.2529 29.0590 179.3567 57 T 3.8942 7.7876 115.7598 66.3131 68.5655 176.4207 58 W 4.0852 8.0782 130.3024 60.4005 30.5488 177.4603 59 L 3.7955 8.4808 120.4026 58.1836 41.4061 179.1142 60 G 3.6549 7.7751 104.9538 48.1575 0.0000 175.6806 61 S 4.0360 7.7045 117.2711 61.3751 62.7985 176.9471 62 Q 3.7726 7.5266 120.6978 58.7556 28.3500 178.3841 63 C 4.0487 8.2335 118.2528 62.7377 28.2245 176.0327 64 R 3.8731 8.1869 120.5714 59.5225 29.6614 178.5246 65 L 3.9826 7.7786 118.4380 57.8781 41.4565 179.0636 66 H 4.0781 8.0426 118.1335 59.4431 30.0121 177.3262 67 E 4.0858 8.1404 121.6193 58.7283 28.9691 179.4108 68 L 4.0189 7.6418 118.5825 57.5071 41.7593 179.1562 69 R 4.0208 7.7632 117.8227 59.0094 30.2319 177.5441 70 E 4.3148 8.5014 115.0848 54.7895 30.4729 176.0171 71 K 3.9005 7.7791 117.6573 56.3891 30.6588 174.4677 72 E 4.5836 7.4952 114.7562 54.8578 32.6772 174.1954 73 R 3.9712 8.6398 125.6578 56.7179 30.4894 175.9473 74 I 3.8342 8.3427 125.5394 60.6416 38.8162 176.1819 75 S 4.4761 8.2199 121.2974 57.7903 65.4011 175.5760 76 V 3.5957 8.3038 122.3636 66.0224 31.4375 178.2191 77 A 3.9494 7.9851 119.9335 55.2360 18.3880 179.3601 78 A 3.9584 7.9998 119.0324 55.0328 18.3089 179.7835 79 A 3.9402 8.4172 120.1329 55.2720 18.3885 180.0461 80 S 4.1121 8.3463 113.0885 61.4913 63.0889 176.6451 81 K 3.9900 8.0915 122.7706 58.8370 31.8633 179.0249 82 I 3.7744 7.6426 120.0835 64.2343 36.9750 178.0805 83 L 4.2011 7.7935 121.2278 58.1750 42.0093 178.6395 84 S 4.1182 8.3973 113.4429 61.8510 62.1108 176.1042 85 N 4.4609 8.4943 117.8148 55.9533 38.4918 177.0745 86 L 4.0091 7.9991 121.9191 58.2534 42.3859 179.0583 87 V 3.3773 7.8466 118.3321 66.2851 31.3410 177.3571 88 Y 4.1107 8.1464 119.1157 60.6585 38.3689 177.9340 89 Q 3.8766 7.8566 118.3929 58.4306 29.0429 177.3074 90 Y 4.2424 7.5823 115.3287 56.2301 38.1258 175.0789 91 K 3.8079 6.8979 121.8749 58.4841 32.3927 176.1705 92 G 3.9776 9.0030 114.4249 45.5137 0.0000 174.1542 93 A 4.0241 8.0248 121.8310 53.3647 18.5324 178.2518 94 G 4.1825 8.3900 103.1908 45.2132 0.0000 174.0785 95 L 4.1550 7.7225 119.0112 54.7786 42.3257 176.8763 96 S 4.6839 9.6738 116.7470 57.0695 64.8624 172.3714 97 M 5.2246 8.5652 123.6092 53.8843 34.1434 174.2787 98 G 4.1845 9.4088 110.2538 44.7616 0.0000 171.7386 99 T 5.1174 8.5566 119.3768 60.5177 71.3965 172.6236 100 M 4.7959 8.7952 125.2131 53.6390 35.3340 174.5299 101 I 4.7609 8.5093 124.7960 60.0252 38.9008 174.8537 102 C 4.9222 9.2771 125.4600 57.9978 31.2461 173.5871 103 G 4.4327 8.4294 108.7191 45.9370 0.0000 172.3635 104 Y 4.7438 8.6142 120.4537 56.1426 39.8608 174.9025 105 T 4.2484 8.5911 115.9446 61.5436 69.1027 174.7127 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 T 8.17 4.53 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 2 T 9.44 4.59 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 3 T 8.47 5.26 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 1.26 0.00 0.00 4 L 9.06 4.90 0.00 1.71 1.80 1.02 0.98 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 5 A 8.34 5.17 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 6 F 8.64 5.08 0.00 3.08 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 7 R 8.81 5.19 0.00 1.81 1.97 0.00 3.20 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 8 F 9.52 4.88 0.00 3.33 3.30 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 9 Q 8.99 3.72 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.26 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 10 G 5.52 3.55 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 11 G 6.42 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 0.00 0.00 0.00 12 I 8.62 5.26 1.91 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 1.35 0.69 0.93 0.00 0.00 13 I 7.98 4.28 0.56 0.00 0.00 0.75 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 0.62 0.63 0.00 0.00 14 V 8.20 4.85 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 0.83 0.00 0.00 0.89 0.00 0.00 15 A 8.83 4.85 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 V 8.23 5.00 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 17 D 8.39 4.88 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 18 S 8.21 4.84 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 19 R 8.88 5.03 0.00 1.75 1.95 0.00 3.16 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 20 A 8.93 4.88 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 0.00 0.00 21 T 8.62 5.01 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 1.15 0.00 0.00 22 A 8.93 4.59 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 23 G 8.32 4.15 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 0.00 24 N 8.88 4.74 0.00 2.80 2.92 0.00 0.00 6.72 7.68 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 25 W 8.01 4.50 0.00 3.25 3.21 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 26 V 7.46 4.05 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 0.60 0.00 0.00 0.78 0.00 0.00 27 A 8.10 3.69 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.21 4.48 0.00 3.78 3.60 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 0.00 0.00 0.00 0.00 29 Q 8.58 4.65 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.29 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 30 T 7.83 4.74 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 1.19 0.00 0.00 31 V 7.93 4.18 2.18 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 0.77 0.00 0.00 0.92 0.00 0.00 32 K 8.52 4.36 0.00 1.66 1.73 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.52 7.81 33 K 8.77 4.59 0.00 1.68 1.78 0.00 1.91 0.00 0.00 1.75 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.39 7.81 34 V 7.72 4.83 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 0.93 0.00 0.00 35 I 9.29 4.37 2.08 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 1.26 0.96 0.96 0.00 0.00 36 E 8.74 4.44 0.00 1.94 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 2.26 2.31 0.00 37 I 8.04 3.82 2.01 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 1.61 0.77 0.92 0.00 0.00 38 N 7.87 4.56 0.00 2.90 2.92 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 39 P 0.00 4.10 0.00 1.58 1.82 0.00 3.69 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 1.98 2.04 0.00 40 F 9.38 4.79 0.00 2.95 3.09 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 0.00 0.00 0.00 41 L 8.25 5.16 0.00 1.65 1.57 0.95 0.56 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 42 L 9.18 5.07 0.00 1.55 1.53 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 43 G 9.39 4.66 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 44 T 8.53 5.02 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 1.22 0.00 0.00 45 M 8.90 4.93 0.00 1.89 2.01 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.66 0.00 46 A 8.79 4.64 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 47 G 9.31 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 0.00 0.00 0.00 0.00 48 G 9.33 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 49 A 8.93 3.97 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 50 A 7.94 3.93 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 51 D 8.11 4.43 0.00 2.95 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 C 8.31 4.23 0.00 3.03 3.04 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 53 Q 8.32 3.98 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 54 F 8.52 3.75 0.00 3.04 2.63 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 0.00 0.00 0.00 55 W 8.23 4.50 0.00 3.67 3.30 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 56 E 8.71 4.24 0.00 2.25 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 2.45 2.55 0.00 57 T 7.79 3.89 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 1.13 0.00 0.00 58 W 8.08 4.09 0.00 3.04 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 59 L 8.48 3.80 0.00 2.17 1.94 0.97 0.96 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 60 G 7.78 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 61 S 7.70 4.04 0.00 3.84 3.78 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 62 Q 7.53 3.77 0.00 1.75 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 63 C 8.23 4.05 0.00 3.06 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 64 R 8.19 3.87 0.00 1.88 2.03 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 65 L 7.78 3.98 0.00 2.01 1.66 0.90 0.83 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 66 H 8.04 4.08 0.00 3.24 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.14 4.09 0.00 2.18 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 0.00 2.57 2.45 0.00 68 L 7.64 4.02 0.00 1.80 1.71 0.91 0.90 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 69 R 7.76 4.02 0.00 1.98 1.87 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 70 E 8.50 4.31 0.00 1.74 1.86 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 2.11 2.22 0.00 71 K 7.78 3.90 0.00 1.82 1.79 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.33 7.81 72 E 7.50 4.58 0.00 1.90 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 2.20 2.19 0.00 73 R 8.64 3.97 0.00 1.59 1.70 0.00 2.40 0.00 0.00 2.79 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.41 0.00 74 I 8.34 3.83 1.71 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.73 0.90 0.00 0.00 75 S 8.22 4.48 0.00 4.07 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 76 V 8.30 3.60 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 1.13 0.00 0.00 0.99 0.00 0.00 77 A 7.99 3.95 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 78 A 8.00 3.96 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 79 A 8.42 3.94 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 80 S 8.35 4.11 0.00 4.08 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 K 8.09 3.99 0.00 2.09 1.85 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.61 1.47 7.81 82 I 7.64 3.77 2.08 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.67 0.94 0.00 0.00 83 L 7.79 4.20 0.00 1.90 1.92 1.16 0.96 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 84 S 8.40 4.12 0.00 4.06 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 85 N 8.49 4.46 0.00 2.85 2.94 0.00 0.00 7.08 7.87 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 86 L 8.00 4.01 0.00 1.91 1.74 -0.99 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.85 3.38 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 0.96 0.00 0.00 0.76 0.00 0.00 88 Y 8.15 4.11 0.00 3.14 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 89 Q 7.86 3.88 0.00 2.11 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.62 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 90 Y 7.58 4.24 0.00 2.99 2.87 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 91 K 6.90 3.81 0.00 1.52 1.42 0.00 1.81 0.00 0.00 1.50 0.00 0.00 3.14 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.38 7.81 92 G 9.00 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 0.00 0.00 0.00 93 A 8.02 4.02 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 94 G 8.39 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 0.00 0.00 0.00 95 L 7.72 4.16 0.00 1.62 1.59 0.51 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 96 S 9.67 4.68 0.00 3.80 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 97 M 8.57 5.22 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.58 0.00 98 G 9.41 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 0.00 0.00 0.00 99 T 8.56 5.12 4.30 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 1.26 0.00 0.00 100 M 8.80 4.80 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 101 I 8.51 4.76 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.87 0.94 0.00 0.00 102 C 9.28 4.92 0.00 2.80 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 8.43 4.43 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 0.00 104 Y 8.61 4.74 0.00 2.90 2.74 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 0.00 105 T 8.59 4.25 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