NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5042 8.3049 118.2053 55.0483 32.5925 174.4488 2 I 3.9959 8.1789 121.5110 59.5189 37.0625 174.2710 3 Q 4.1171 8.1422 125.3590 54.3069 31.6811 170.4113 4 P 4.3543 0.0000 0.0000 66.2797 30.2962 174.1400 5 Q 5.2979 7.8203 133.2281 57.3802 30.9823 173.2099 6 T 4.5451 6.9225 116.4774 61.9361 71.7768 172.4974 7 Y 5.2282 8.2790 119.4277 57.3209 41.2509 175.3948 8 L 4.8838 8.6071 121.6908 53.1991 47.0205 174.6182 9 E 4.0392 9.0744 124.4194 55.0972 30.9281 175.3728 10 V 4.0142 7.9884 119.5582 61.6912 30.1420 175.5875 11 A 4.5413 9.2574 129.8919 53.3631 19.5050 176.9264 12 D 5.2268 7.9432 114.2573 52.6236 39.5130 177.6724 13 N 5.5217 8.1329 105.4331 52.8649 38.6889 172.7493 14 T 4.3025 7.5389 122.4899 62.9182 69.0532 174.8963 15 G 4.5380 9.4062 115.2132 46.2534 0.0000 171.0586 16 A 5.0951 7.7560 120.5099 50.7790 22.6008 176.1440 17 R 4.6849 9.3589 117.2705 56.0525 33.4006 175.9473 18 K 4.2261 7.6009 117.3152 55.6290 35.8598 173.9943 19 I 4.8867 8.1032 119.1213 59.9437 41.7375 173.0872 20 M 5.1685 8.2830 120.2733 54.1674 35.6806 173.7419 21 C 4.7009 8.4720 121.0942 58.0535 34.1233 172.3081 22 I 4.3404 8.0002 111.3045 61.5714 38.9023 175.3638 23 R 4.6450 7.5774 121.9018 54.1086 33.3889 173.8099 24 V 4.8012 8.4598 125.0573 60.5384 32.3410 174.1302 25 L 4.4656 8.5441 116.3548 54.5241 39.6617 175.9614 26 K 4.0364 9.9915 120.0486 54.6441 32.8884 174.2730 27 G 4.1121 6.9302 111.6121 44.4170 0.0000 175.0007 28 S 5.7080 7.3270 123.5907 59.6796 60.7269 178.5390 29 N 4.4401 7.7721 115.2462 52.3693 36.5750 174.4740 30 A 4.0437 8.3635 122.8994 52.7237 18.2979 177.6037 31 K 4.1320 8.4699 125.1391 57.7878 33.0346 180.4458 32 Y 4.6459 8.2936 123.2265 57.3180 37.5665 176.0226 33 A 4.3148 8.1546 129.8243 55.1349 23.1897 173.6930 34 T 4.3187 7.3283 108.7375 62.1390 70.4072 173.7846 35 V 3.8858 8.2676 119.8244 64.1861 32.0923 177.4171 36 G 3.9182 8.8405 111.2536 45.5152 0.0000 173.4953 37 D 4.7473 7.2803 119.9078 51.7952 41.2410 175.5953 38 V 3.8446 8.0082 124.2980 62.7081 33.0664 175.0890 39 I 5.3777 7.4654 119.2732 60.0971 40.7528 173.8790 40 V 5.2950 8.4257 109.9710 62.2264 35.8059 172.1732 41 A 4.6107 8.2645 124.7206 50.9597 22.5633 174.9074 42 S 4.6414 8.2318 113.4204 57.3119 64.7718 174.1109 43 V 3.5776 7.9401 121.4364 64.8897 32.1512 173.7289 44 K 4.1676 8.9075 126.3481 56.7847 33.0420 177.0114 45 E 3.9496 6.2093 135.0000 57.4376 31.2749 175.6313 46 A 4.8377 8.4426 129.8167 50.5379 20.6832 176.6053 47 I 3.9690 8.8286 124.8212 61.7523 37.8024 176.9615 48 P 3.6003 0.0000 0.0000 61.9764 32.4819 179.3529 49 R 3.7884 9.1768 123.4367 59.6628 30.4039 178.1609 50 G 3.8332 7.5594 106.8476 47.5048 0.0000 172.9397 51 A 4.1221 7.4416 127.7757 52.1999 17.6983 178.4698 52 V 3.7885 7.5690 122.1719 61.9446 30.9935 176.0896 53 K 4.9888 8.0643 128.0808 54.4016 34.4983 175.4668 54 E 3.7791 8.4014 118.1408 57.8559 29.9417 178.0330 55 G 3.8048 8.4019 109.5290 45.9131 0.0000 173.2937 56 D 4.8167 7.6299 120.4786 52.2229 42.6523 175.3618 57 V 5.0360 8.1418 123.6554 62.1980 32.6359 175.4317 58 V 4.4678 8.0569 118.7120 59.5210 36.8429 174.5345 59 K 5.3015 8.9200 123.6027 56.7617 30.0799 176.3001 60 A 5.2198 8.1914 134.9697 51.3664 21.2587 176.5110 61 V 4.1235 7.9199 110.1033 61.4262 33.9225 173.1095 62 V 3.9799 7.9768 122.4302 63.2972 32.2649 175.1069 63 V 4.1785 8.5368 117.2705 61.6860 35.2003 172.0738 64 R 3.4454 6.8130 116.2317 54.7817 30.7921 173.7928 65 T 4.9221 4.0000 113.4281 59.9287 69.4697 175.5388 66 K 5.1718 8.8888 115.8913 58.9593 33.9671 177.3136 67 K 5.3622 6.3405 111.0991 53.8458 35.5399 176.1683 68 E 4.5678 8.7000 111.9717 55.4301 33.6056 174.7725 69 V 4.7149 8.4977 122.4171 61.2594 31.4877 174.7618 70 K 4.4578 7.4332 118.1170 56.4969 33.5998 172.8798 71 R 4.7290 10.6400 117.5669 53.3696 33.7742 174.5933 72 P 4.1726 0.0000 0.0000 65.1970 30.9089 176.0991 73 D 4.3962 8.3538 118.4631 52.5586 41.3023 177.2271 74 G 3.6791 9.0889 116.6415 45.3577 0.0000 173.6127 75 S 3.8705 8.9853 120.4272 58.8591 59.6717 170.2083 76 A 4.3433 7.7191 121.5833 52.4923 19.0354 177.6646 77 I 4.2416 7.7015 117.7486 59.9365 41.4702 173.3636 78 R 4.1146 8.7083 130.1637 54.7146 31.2206 175.0765 79 F 4.9331 8.2305 120.4837 55.1110 40.7070 175.2930 80 D 5.2280 8.6844 120.4048 54.1113 41.3833 176.1024 81 D 4.4316 7.5694 120.4011 53.9135 43.6873 173.2917 82 N 5.3164 8.7892 109.4245 53.6826 42.7979 173.7102 83 A 5.1263 8.2817 123.2915 51.1926 22.9816 174.4569 84 A 5.1365 8.2186 117.8833 51.4831 23.6224 178.4489 85 V 4.4194 7.9593 117.4508 62.3661 33.4946 177.9993 86 I 4.8679 8.6782 115.9519 64.3395 38.9694 175.3089 87 I 3.6425 7.0415 122.1082 61.3657 32.7799 173.9415 88 N 4.2428 8.4470 120.4202 52.9236 39.9788 176.1103 89 N 4.1701 7.9357 118.4484 56.1822 38.9555 176.3201 90 Q 4.1978 7.6688 119.9817 56.4715 27.4161 174.7360 91 L 3.8193 7.4175 120.0187 56.4729 40.1507 175.4670 92 E 4.5215 9.7405 125.3120 52.4607 28.6198 172.9010 93 P 4.4981 0.0000 0.0000 61.8696 31.7533 178.9425 94 R 4.2463 8.4594 117.3187 56.7809 29.0080 178.3498 95 G 4.3097 9.0116 111.3873 44.9891 0.0000 175.0293 96 T 4.0731 7.9511 112.0125 62.8308 69.6033 175.0882 97 R 4.6298 7.3265 120.2032 55.0737 34.5461 173.6376 98 V 4.6959 7.4439 116.4411 59.9198 35.2143 175.0586 99 F 4.4058 7.9960 122.7638 57.5971 43.1359 176.2990 100 G 4.0316 9.0193 122.3324 45.3847 0.0000 169.7067 101 P 4.9931 0.0000 0.0000 61.8004 33.4992 174.4672 102 V 4.2902 8.2423 120.1212 61.3024 40.3000 175.1683 103 A 4.5545 9.4154 135.0000 52.9259 17.6539 178.7377 104 R 4.0857 9.0153 114.3911 57.4780 29.3976 179.1511 105 E 4.1659 8.2393 120.7748 59.1073 29.4699 178.6082 106 L 4.4061 7.9876 118.5230 57.3343 41.5421 179.1443 107 R 3.9863 8.0057 118.1009 59.4486 30.1911 177.8503 108 E 4.1296 7.5270 114.7367 59.0720 29.5604 179.0275 109 K 4.0864 7.5809 117.9688 58.8253 33.4593 175.8736 110 G 3.0183 5.7782 106.0147 45.1101 0.0000 173.8338 111 F 5.0942 7.2878 117.7768 56.5612 40.7661 177.0915 112 M 3.9822 8.4916 121.0690 58.8753 31.7355 179.9242 113 K 4.1306 6.8200 114.1386 58.6249 35.8129 179.0631 114 I 3.4669 8.8967 109.1728 64.0985 36.8962 179.3038 115 V 2.7075 5.5325 111.4520 62.1714 33.6109 175.0060 116 S 4.1627 7.0992 114.7251 61.8653 62.8344 175.5015 117 L 3.8744 8.2463 120.7804 57.5655 41.5886 176.9876 118 A 4.0089 7.5905 128.8750 51.3592 17.6250 174.9460 119 P 3.9842 0.0000 0.0000 65.2045 31.3853 176.4216 120 E 3.9827 9.6625 122.5094 56.1734 29.8029 172.8186 121 V 4.5995 7.8132 113.3444 61.1489 36.3447 174.3106 122 L 4.1122 10.8200 120.1339 55.4485 42.8931 175.6297 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 4.50 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.72 0.00 2 I 8.18 4.00 2.10 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 1.21 0.41 0.90 0.00 0.00 3 Q 8.14 4.12 0.00 1.87 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.03 0.00 0.00 0.00 0.00 0.00 2.22 2.12 0.00 4 P 0.00 4.35 0.00 2.53 2.05 0.00 3.78 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 5 Q 7.82 5.30 0.00 2.09 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.76 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 6 T 6.92 4.55 4.16 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 0.00 0.00 0.00 0.96 0.00 0.00 7 Y 8.28 5.23 0.00 2.73 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 8 L 8.61 4.88 0.00 1.54 1.45 0.84 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 9 E 9.07 4.04 0.00 1.84 1.83 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 1.67 1.84 0.00 10 V 7.99 4.01 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 0.71 0.00 0.00 1.26 0.00 0.00 11 A 9.26 4.54 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 12 D 7.94 5.23 0.00 2.84 2.42 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 13 N 8.13 5.52 0.00 2.86 2.91 0.00 0.00 6.77 7.15 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 14 T 7.54 4.30 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 1.21 0.00 0.00 15 G 9.41 4.54 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 0.00 0.00 0.00 16 A 7.76 5.10 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 17 R 9.36 4.68 0.00 1.54 1.98 0.00 3.37 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 18 K 7.60 4.23 0.00 1.74 1.57 0.00 1.60 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.53 7.81 19 I 8.10 4.89 2.18 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 1.10 0.55 0.93 0.00 0.00 20 M 8.28 5.17 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.77 0.00 21 C 8.47 4.70 0.00 2.98 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 22 I 8.00 4.34 1.86 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 1.46 0.75 0.91 0.00 0.00 23 R 7.58 4.64 0.00 1.90 1.73 0.00 3.19 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 24 V 8.46 4.80 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 1.01 0.00 0.00 0.99 0.00 0.00 25 L 8.54 4.47 0.00 1.70 1.48 0.95 0.39 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 26 K 9.99 4.04 0.00 1.95 1.93 0.00 1.84 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.44 7.81 27 G 6.93 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 28 S 7.33 5.71 0.00 4.13 4.13 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 29 N 7.77 4.44 0.00 2.87 2.97 0.00 0.00 5.97 7.26 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 30 A 8.36 4.04 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 31 K 8.47 4.13 0.00 1.96 2.07 0.00 1.84 0.00 0.00 1.91 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.54 7.81 32 Y 8.29 4.65 0.00 2.82 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 33 A 8.15 4.31 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 34 T 7.33 4.32 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 1.33 0.00 0.00 35 V 8.27 3.89 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 0.88 0.00 0.00 0.95 0.00 0.00 36 G 8.84 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 37 D 7.28 4.75 0.00 3.05 2.60 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 38 V 8.01 3.84 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 1.03 0.00 0.00 0.82 0.00 0.00 39 I 7.47 5.38 1.85 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 1.32 1.95 1.00 0.00 0.00 40 V 8.43 5.30 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 0.71 0.00 0.00 0.92 0.00 0.00 41 A 8.26 4.61 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 42 S 8.23 4.64 0.00 3.95 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 43 V 7.94 3.58 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 0.93 0.00 0.00 0.98 0.00 0.00 44 K 8.91 4.17 0.00 1.89 1.49 0.00 1.73 0.00 0.00 1.54 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.25 7.81 45 E 6.21 3.95 0.00 2.05 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 2.31 2.49 0.00 46 A 8.44 4.84 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 I 8.83 3.97 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 1.34 1.22 0.92 0.00 0.00 48 P 0.00 3.60 0.00 2.20 1.57 0.00 3.63 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 49 R 9.18 3.79 0.00 1.92 2.05 0.00 3.24 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 50 G 7.56 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 0.00 0.00 0.00 51 A 7.44 4.12 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 52 V 7.57 3.79 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 1.11 0.00 0.00 0.93 0.00 0.00 53 K 8.06 4.99 0.00 1.85 1.74 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.56 1.64 7.81 54 E 8.40 3.78 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 2.50 2.33 0.00 55 G 8.40 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 56 D 7.63 4.82 0.00 2.78 2.60 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 57 V 8.14 5.04 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 0.91 0.00 0.00 0.95 0.00 0.00 58 V 8.06 4.47 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 0.68 0.00 0.00 0.93 0.00 0.00 59 K 8.92 5.30 0.00 1.80 1.71 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.23 7.81 60 A 8.19 5.22 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 61 V 7.92 4.12 1.95 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 0.61 0.00 0.00 0.74 0.00 0.00 62 V 7.98 3.98 2.03 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 0.72 0.00 0.00 1.03 0.00 0.00 63 V 8.54 4.18 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 0.67 0.00 0.00 0.98 0.00 0.00 64 R 6.81 3.45 0.00 2.28 2.35 0.00 3.06 0.00 0.00 3.45 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 65 T 4.00 4.92 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 0.86 0.00 0.00 66 K 8.89 5.17 0.00 1.82 1.96 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.40 1.46 7.81 67 K 6.34 5.36 0.00 1.97 1.68 0.00 1.92 0.00 0.00 1.94 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.65 7.81 68 E 8.70 4.57 0.00 1.96 1.69 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 2.21 2.11 0.00 69 V 8.50 4.71 1.95 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 0.66 0.00 0.00 0.95 0.00 0.00 70 K 7.43 4.46 0.00 2.13 1.95 0.00 1.51 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.17 1.17 7.81 71 R 10.64 4.73 0.00 2.11 1.92 0.00 3.15 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 72 P 0.00 4.17 0.00 2.17 2.21 0.00 3.73 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 2.00 1.99 0.00 73 D 8.35 4.40 0.00 2.73 2.67 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 74 G 9.09 3.68 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 0.00 0.00 0.00 75 S 8.99 3.87 0.00 4.12 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 76 A 7.72 4.34 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 77 I 7.70 4.24 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.34 0.69 0.00 0.00 78 R 8.71 4.11 0.00 2.21 1.73 0.00 3.09 0.00 0.00 3.94 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.94 0.00 79 F 8.23 4.93 0.00 3.25 3.15 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 80 D 8.68 5.23 0.00 2.60 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 81 D 7.57 4.43 0.00 2.57 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 82 N 8.79 5.32 0.00 2.77 2.56 0.00 0.00 7.26 7.43 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 83 A 8.28 5.13 1.10 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 0.00 0.00 84 A 8.22 5.14 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.96 4.42 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 1.00 0.00 0.00 0.93 0.00 0.00 86 I 8.68 4.87 1.97 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 1.43 -0.11 0.91 0.00 0.00 87 I 7.04 3.64 1.82 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 1.32 0.53 0.86 0.00 0.00 88 N 8.45 4.24 0.00 3.06 2.79 0.00 0.00 7.24 8.00 0.00 0.00 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 N 7.94 4.17 0.00 2.72 2.83 0.00 0.00 6.89 7.69 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 90 Q 7.67 4.20 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 6.21 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 91 L 7.42 3.82 0.00 1.86 2.25 1.01 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 92 E 9.74 4.52 0.00 1.92 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 0.00 2.22 2.22 0.00 93 P 0.00 4.50 0.00 2.31 2.25 0.00 3.95 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 94 R 8.46 4.25 0.00 1.80 2.00 0.00 3.36 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.92 0.00 95 G 9.01 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 0.00 0.00 0.00 0.00 96 T 7.95 4.07 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 1.21 0.00 0.00 97 R 7.33 4.63 0.00 1.62 1.65 0.00 3.21 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.77 0.00 98 V 7.44 4.70 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 0.89 0.00 0.00 0.96 0.00 0.00 99 F 8.00 4.41 0.00 3.06 2.39 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 0.00 100 G 9.02 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 0.00 0.00 0.00 101 P 0.00 4.99 0.00 2.15 2.26 0.00 3.86 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 1.94 2.00 0.00 102 V 8.24 4.29 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 0.79 0.00 0.00 0.98 0.00 0.00 103 A 9.42 4.55 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 0.00 104 R 9.02 4.09 0.00 2.02 2.20 0.00 3.08 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 105 E 8.24 4.17 0.00 2.09 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 0.00 2.37 2.54 0.00 106 L 7.99 4.41 0.00 1.91 2.13 1.02 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.01 3.99 0.00 1.86 2.18 0.00 3.26 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 108 E 7.53 4.13 0.00 2.06 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 2.36 2.50 0.00 109 K 7.58 4.09 0.00 1.52 1.82 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.89 1.80 7.81 110 G 5.78 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 0.00 0.00 0.00 111 F 7.29 5.09 0.00 3.19 2.93 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 0.00 112 M 8.49 3.98 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 113 K 6.82 4.13 0.00 1.91 1.80 0.00 1.71 0.00 0.00 1.84 0.00 0.00 3.10 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.64 7.81 114 I 8.90 3.47 1.89 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 1.66 1.34 0.97 0.00 0.00 115 V 5.53 2.71 2.15 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 1.03 0.00 0.00 1.16 0.00 0.00 116 S 7.10 4.16 0.00 4.00 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 0.00 117 L 8.25 3.87 0.00 1.81 1.69 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.59 4.01 1.31 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 0.00 0.00 0.00 119 P 0.00 3.98 0.00 2.19 2.13 0.00 3.87 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 120 E 9.66 3.98 0.00 2.13 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 0.00 2.19 2.40 0.00 121 V 7.81 4.60 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 0.68 0.00 0.00 0.96 0.00 0.00 122 L 10.82 4.11 0.00 1.70 1.50 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00