NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3851 8.3044 120.3494 54.8384 33.3994 174.9284 2 I 3.6266 8.3941 126.1328 61.3104 38.7943 173.1989 3 Q 4.8514 8.3364 124.5496 54.1907 33.6823 173.7928 4 S 5.1912 8.5847 116.0257 56.9112 66.4184 173.1113 5 Q 4.8110 8.9184 120.5976 54.6598 30.2693 175.7881 6 I 4.3994 8.4187 112.0973 60.1559 38.8549 174.7621 7 N 4.8699 7.8373 120.1059 50.9669 40.8459 174.6058 8 R 4.0177 8.6879 123.8464 59.5177 29.3160 178.2811 9 N 4.2866 8.4896 117.2085 56.1001 38.4574 177.2980 10 I 3.6594 7.3916 120.0903 64.6748 37.2160 178.7547 11 R 4.0222 7.8910 118.1722 58.9646 29.9670 178.9874 12 L 3.9950 8.2227 119.3201 57.6705 41.6375 179.0267 13 D 4.3509 8.5890 119.3827 57.2663 40.7518 178.5296 14 L 3.9065 7.9002 120.3981 58.0890 42.0345 178.6469 15 A 4.2062 8.0892 122.1301 54.7704 18.3023 179.3287 16 D 4.3144 8.1194 116.8817 57.4766 40.9102 178.9311 17 A 4.0128 7.9657 121.1094 55.2196 18.3071 179.7357 18 I 3.6753 8.2249 118.7090 64.6077 37.1684 178.7336 19 L 4.0086 8.4043 120.2631 57.4510 41.3071 179.3631 20 L 3.9070 7.9966 120.3994 58.1658 42.0962 178.8585 21 S 4.0405 8.0380 113.0576 61.3174 62.3283 175.8890 22 K 3.7774 8.3538 122.3592 59.5665 31.8926 178.5819 23 A 3.9596 8.1304 120.9262 55.1315 18.0976 179.7930 24 K 3.9578 8.2120 116.3278 58.9952 32.2090 178.8058 25 K 4.2295 8.0268 115.9655 55.2191 32.7864 175.8049 26 D 4.3135 7.6612 117.8474 54.9993 40.1609 173.3740 27 L 4.5610 7.7157 116.3046 53.9292 43.1688 177.4888 28 S 4.6516 8.5721 116.3746 56.8128 66.4368 175.5363 29 F 4.1434 8.3796 121.3848 60.5668 38.4803 177.5263 30 A 4.0614 8.1917 119.3346 55.4557 18.3126 179.1020 31 E 4.1031 8.2983 115.8357 59.4452 29.5790 179.2474 32 I 3.6939 7.6067 119.9024 64.1198 37.3524 177.7964 33 A 4.2416 8.1336 120.7850 52.9515 18.4352 176.9719 34 D 4.3494 7.1548 117.9440 55.6628 41.6317 176.5090 35 G 3.9754 9.1017 114.5030 45.5967 0.0000 173.5087 36 T 4.1116 7.8512 113.9643 61.5804 67.9604 176.2845 37 G 3.9970 8.2908 107.4415 45.6130 0.0000 172.9344 38 L 4.7048 7.0732 118.2639 51.8949 44.7427 176.9390 39 A 4.1155 8.3578 123.0272 52.1548 20.1511 178.1969 40 E 3.9030 8.9858 123.4801 59.7863 29.6529 179.5776 41 A 3.9239 7.9961 119.8814 54.9470 18.4412 179.3021 42 F 3.8875 8.1314 118.7028 61.4317 39.6339 177.4524 43 V 3.6431 8.0443 117.8899 66.2266 31.3459 177.9938 44 T 3.7783 8.1160 115.3372 66.6848 68.2409 176.1046 45 A 3.8333 7.8333 122.2630 55.3135 18.2321 179.6161 46 A 4.1593 7.4866 120.1866 54.7826 18.5866 179.7354 47 L 3.9933 8.0429 117.5962 57.7540 41.4554 178.8203 48 L 4.5446 7.6502 116.1153 54.3695 41.6307 177.5034 49 G 3.8750 7.9917 106.7485 45.9655 0.0000 174.5379 50 Q 4.4622 8.1726 116.7135 55.5480 29.8487 175.1053 51 Q 4.4040 7.4151 115.8471 54.3834 33.0020 172.6202 52 A 4.9534 8.2940 120.5143 50.4099 21.2838 176.1226 53 L 4.7543 8.5551 121.4425 52.6615 43.8304 174.9973 54 P 4.4608 0.0000 0.0000 62.5904 32.5199 177.1985 55 A 3.9765 8.9112 123.3484 55.7435 18.2367 179.8834 56 D 4.2860 8.1219 116.3632 57.4925 40.9266 178.6850 57 A 4.0044 8.0665 120.4323 55.1806 18.3587 179.2990 58 A 3.9561 8.2297 119.2746 55.4208 18.4827 180.1289 59 R 3.8488 8.1640 116.5669 59.1809 30.2545 178.8911 60 L 3.9420 8.0071 120.0426 58.5451 42.1664 179.5981 61 V 3.8001 8.1305 112.4163 64.2561 31.3665 178.9139 62 G 3.6212 8.4215 105.6250 47.6154 0.0000 175.7203 63 A 4.0499 8.2059 123.1025 54.8897 18.1828 179.9015 64 K 3.9547 7.8984 116.0123 58.8470 32.2183 178.5711 65 L 4.4105 7.7688 116.0927 53.2917 42.6686 175.8629 66 D 4.3906 7.5525 117.9734 55.2261 38.8323 173.9733 67 L 4.3092 8.0589 117.9596 54.0935 43.0024 177.8489 68 D 4.7098 8.2619 121.7467 52.8559 41.9709 177.2905 69 E 4.0349 8.5465 118.3715 59.4933 29.3817 179.3039 70 D 4.3763 8.0872 118.7146 57.3377 40.9473 178.7766 71 S 4.1636 8.7923 116.1742 61.6554 62.6159 176.7674 72 I 3.7436 7.5891 121.5164 64.1917 37.1141 177.9685 73 L 4.2398 8.1330 121.2835 58.1622 41.9414 178.9232 74 L 4.0159 8.4294 119.3605 57.8793 41.5435 179.4856 75 L 4.1142 8.1004 118.4461 57.1356 41.2910 178.6765 76 Q 4.6592 7.7127 117.5899 55.4620 29.4738 175.9425 77 M 4.4811 7.2535 120.3518 55.0032 33.0210 176.4048 78 I 4.0327 8.9148 124.8286 60.7323 38.1209 174.2878 79 P 4.7011 0.0000 0.0000 62.2455 32.8477 176.2101 80 L 4.3269 8.2960 123.1591 54.1103 41.5717 176.5220 81 R 4.1975 8.3041 125.1362 55.8399 30.8908 175.2213 82 G 3.0433 8.1691 107.4394 45.1227 0.0000 173.3358 83 C 4.2963 8.1259 122.1235 58.9192 30.7292 174.5713 84 I 4.0730 7.5001 121.9275 60.3670 37.6608 174.9780 85 D 4.4495 8.8556 125.4711 57.1248 41.6427 176.5380 86 D 4.6373 7.3516 115.0462 53.2848 41.5434 173.8964 87 R 4.1858 8.1116 127.2882 56.8101 29.2594 177.0356 88 I 3.9774 7.1767 116.2015 58.3263 38.7998 174.0013 89 P 4.4236 0.0000 0.0000 62.9330 31.7983 176.5054 90 T 4.1736 8.3406 111.5170 63.3880 69.9437 175.4406 91 D 4.4990 7.9743 122.3263 53.1990 42.6767 174.6056 92 P 4.3616 0.0000 0.0000 66.1085 31.2028 178.7633 93 T 3.9499 7.9791 112.8461 67.1443 68.6309 176.1483 94 M 4.4693 8.2148 120.5278 58.5182 31.9520 178.0528 95 Y 4.0405 8.8181 120.1092 60.8766 38.9064 178.3602 96 R 3.8978 8.0446 118.5431 59.4878 29.7284 179.0310 97 F 4.1061 7.7691 117.3953 60.4877 38.8545 177.0938 98 Y 3.9593 7.9207 118.8444 60.6303 38.5500 177.5715 99 E 3.6753 8.1111 120.6022 59.3642 29.5792 178.6007 100 M 4.1147 8.0721 118.8486 58.3437 31.8918 178.7733 101 L 3.9245 7.4151 118.6270 57.9270 41.5908 179.5385 102 Q 3.7641 7.4570 116.7448 58.4520 28.5766 178.6182 103 V 3.7171 7.6943 118.4337 64.8044 32.2159 176.7508 104 Y 4.6883 8.0080 113.8056 57.1730 38.5700 177.5126 105 G 3.7873 8.1941 109.3157 48.4468 0.0000 176.1373 106 T 3.9963 7.8412 112.0854 64.3991 68.7628 176.6876 107 T 3.9091 7.8854 118.2861 66.4389 68.5428 176.4063 108 L 3.9892 8.5545 121.2871 57.6103 41.6351 179.4522 109 K 3.7838 8.1217 119.1626 59.4960 32.1946 178.5125 110 A 4.0369 8.1706 121.0752 55.4368 18.2533 179.6219 111 L 4.0561 8.2939 117.4973 57.4268 41.6555 179.8479 112 V 3.8174 8.0709 118.6889 66.4466 31.0579 177.8333 113 H 4.9454 8.2026 117.3059 58.3734 28.3038 177.4995 114 E 3.9694 8.1600 120.1128 59.3545 29.6325 178.6988 115 K 3.9450 8.2710 117.4052 57.9366 32.1973 177.4726 116 F 4.0067 9.3421 115.7561 59.7805 40.8908 175.6731 117 G 4.1412 6.9892 103.4960 44.1805 0.0000 171.8072 118 D 4.6647 8.5899 119.7457 54.2523 42.2796 175.4329 119 G 3.8673 7.9391 112.8090 45.3990 0.0000 172.0589 120 I 4.7935 8.4116 115.7699 59.2580 41.8594 174.7354 121 I 4.6560 8.1089 123.5639 59.8239 38.0138 175.9062 122 S 4.2335 8.8750 123.1118 58.4551 62.6695 173.8413 123 A 3.8548 8.5780 127.9302 52.1327 19.4752 177.0165 124 I 4.3059 7.6414 115.3748 63.0455 39.2202 176.5934 125 N 4.7992 8.1598 122.4391 51.9034 37.3075 172.4610 126 F 5.4286 7.9769 122.1929 56.5255 42.9447 172.5450 127 K 4.5110 8.2768 123.8585 55.1382 36.3781 174.6574 128 L 5.7267 8.1986 119.6973 53.4104 43.9007 174.9128 129 D 4.7783 8.3109 117.4668 52.1325 43.0725 173.8992 130 V 4.7788 8.3332 119.4580 61.1723 33.9711 174.6866 131 K 4.7108 8.9608 126.8849 54.3963 35.7474 174.9717 132 K 4.8771 8.6402 125.3178 55.4122 33.3668 175.7495 133 V 4.5609 8.7202 126.8789 60.5354 34.8064 174.5010 134 A 4.3478 8.7188 129.2758 52.2148 19.2876 176.3170 135 D 4.5639 8.9900 122.5161 52.5052 41.9813 175.7392 136 P 4.3059 0.0000 0.0000 65.5823 31.3041 176.8168 137 E 4.1914 8.3704 116.7076 55.9622 29.7668 176.6355 138 G 4.0025 8.2206 107.3928 45.8205 0.0000 175.8708 139 G 3.8345 8.8613 108.4791 44.2375 0.0000 171.8592 140 E 5.1595 8.4318 116.6192 54.6334 33.4654 175.6305 141 R 4.7893 9.5383 120.9897 54.3909 34.0197 174.4393 142 A 4.9443 8.5718 123.8350 50.6121 20.8039 176.5739 143 V 4.1891 9.0255 124.0116 61.5045 33.2714 174.4168 144 I 4.9349 8.3821 129.2484 59.9326 39.2319 175.2836 145 T 4.5467 8.7861 124.5691 61.8300 70.5727 173.4368 146 L 4.8753 8.5550 126.7309 53.1558 43.6527 175.6603 147 D 4.6570 8.7559 123.4626 52.4536 43.6788 174.2200 148 G 4.6638 8.5614 112.2293 43.8104 0.0000 170.8654 149 K 4.3061 8.8617 124.6867 56.0516 33.2350 175.4613 150 Y 4.5152 8.8376 129.0502 57.6702 40.1921 174.3048 151 G 3.8615 8.9368 115.0951 43.4781 0.0000 170.6241 152 P 4.6548 0.0000 0.0000 62.4286 32.2684 176.0796 153 T 4.5133 9.0767 119.5761 62.2516 69.8274 174.1150 154 K 4.6765 8.4978 125.5406 53.4022 35.3000 174.5946 155 P 4.3780 0.0000 0.0000 62.9187 31.9419 176.5972 156 F 4.5686 7.8645 114.5878 57.1239 37.9852 174.7257 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 4.39 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.39 3.63 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 1.05 0.91 0.00 0.00 3 Q 8.34 4.85 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.50 2.27 0.00 4 S 8.58 5.19 0.00 3.80 3.77 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 5 Q 8.92 4.81 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 6 I 8.42 4.40 1.87 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 1.30 0.66 0.91 0.00 0.00 7 N 7.84 4.87 0.00 2.76 2.67 0.00 0.00 6.93 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 8 R 8.69 4.02 0.00 2.06 2.30 0.00 3.16 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.49 4.29 0.00 2.89 2.91 0.00 0.00 6.88 7.48 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 10 I 7.39 3.66 1.87 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 1.52 1.20 0.91 0.00 0.00 11 R 7.89 4.02 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.51 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.22 3.99 0.00 1.67 1.71 0.91 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.59 4.35 0.00 2.87 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 14 L 7.90 3.91 0.00 1.78 1.86 0.93 1.23 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 15 A 8.09 4.21 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 16 D 8.12 4.31 0.00 2.94 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 17 A 7.97 4.01 1.37 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 0.00 0.00 0.00 18 I 8.22 3.68 2.06 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 1.53 0.81 0.95 0.00 0.00 19 L 8.40 4.01 0.00 1.82 1.75 0.99 0.58 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 20 L 8.00 3.91 0.00 1.77 1.80 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.04 4.04 0.00 3.93 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 22 K 8.35 3.78 0.00 1.78 1.94 0.00 1.17 0.00 0.00 1.21 0.00 0.00 2.31 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.23 7.81 23 A 8.13 3.96 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 24 K 8.21 3.96 0.00 1.85 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.65 7.81 25 K 8.03 4.23 0.00 1.69 1.81 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.54 7.81 26 D 7.66 4.31 0.00 2.77 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 27 L 7.72 4.56 0.00 1.70 1.44 0.92 0.54 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 28 S 8.57 4.65 0.00 4.03 3.94 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 29 F 8.38 4.14 0.00 3.20 3.11 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 30 A 8.19 4.06 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 31 E 8.30 4.10 0.00 2.22 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 2.54 2.32 0.00 32 I 7.61 3.69 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 0.95 0.00 0.00 33 A 8.13 4.24 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 34 D 7.15 4.35 0.00 2.72 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 35 G 9.10 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 36 T 7.85 4.11 4.42 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 1.31 0.00 0.00 37 G 8.29 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 38 L 7.07 4.70 0.00 1.57 1.59 1.01 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.36 4.12 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 40 E 8.99 3.90 0.00 2.08 2.01 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 2.44 2.49 0.00 41 A 8.00 3.92 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 42 F 8.13 3.89 0.00 3.19 3.19 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 43 V 8.04 3.64 2.17 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 1.05 0.00 0.00 1.13 0.00 0.00 44 T 8.12 3.78 4.06 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 0.40 0.00 0.00 45 A 7.83 3.83 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 46 A 7.49 4.16 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 L 8.04 3.99 0.00 1.92 1.83 1.13 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.65 4.54 0.00 1.66 1.64 0.74 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 49 G 7.99 3.88 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 0.00 0.00 0.00 50 Q 8.17 4.46 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.35 6.63 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 51 Q 7.42 4.40 0.00 1.41 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.87 0.00 0.00 0.00 0.00 0.00 1.97 1.27 0.00 52 A 8.29 4.95 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 53 L 8.56 4.75 0.00 1.66 1.65 0.96 0.98 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 54 P 0.00 4.46 0.00 2.09 1.99 0.00 3.71 0.00 0.00 3.91 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 55 A 8.91 3.98 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 56 D 8.12 4.29 0.00 2.71 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 57 A 8.07 4.00 1.40 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 0.00 0.00 0.00 58 A 8.23 3.96 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 59 R 8.16 3.85 0.00 2.02 2.00 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 60 L 8.01 3.94 0.00 1.92 1.84 0.93 0.95 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 61 V 8.13 3.80 2.11 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 0.87 0.00 0.00 1.04 0.00 0.00 62 G 8.42 3.62 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 0.00 0.00 0.00 63 A 8.21 4.05 1.37 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 0.00 0.00 0.00 64 K 7.90 3.95 0.00 1.95 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.66 7.81 65 L 7.77 4.41 0.00 1.71 1.68 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.55 4.39 0.00 2.77 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 67 L 8.06 4.31 0.00 1.61 1.59 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.26 4.71 0.00 2.95 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.55 4.03 0.00 2.00 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 2.40 2.34 0.00 70 D 8.09 4.38 0.00 2.72 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 71 S 8.79 4.16 0.00 3.99 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 72 I 7.59 3.74 2.00 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 1.41 0.61 0.92 0.00 0.00 73 L 8.13 4.24 0.00 1.85 1.86 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.43 4.02 0.00 1.85 1.71 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.10 4.11 0.00 1.89 1.73 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.71 4.66 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.86 0.00 0.00 0.00 0.00 0.00 2.55 2.40 0.00 77 M 7.25 4.48 0.00 1.92 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 2.80 2.53 0.00 78 I 8.91 4.03 1.88 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 1.49 0.99 0.92 0.00 0.00 79 P 0.00 4.70 0.00 2.14 2.02 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 80 L 8.30 4.33 0.00 1.67 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.30 4.20 0.00 1.82 1.87 0.00 3.23 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 82 G 8.17 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 0.00 0.00 0.00 83 C 8.13 4.30 0.00 3.06 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 84 I 7.50 4.07 1.85 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 1.29 0.54 0.90 0.00 0.00 85 D 8.86 4.45 0.00 2.63 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 86 D 7.35 4.64 0.00 2.60 2.48 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 87 R 8.11 4.19 0.00 1.97 2.03 0.00 3.22 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.18 3.98 1.75 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.70 0.64 0.00 0.00 89 P 0.00 4.42 0.00 2.19 2.05 0.00 3.37 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 90 T 8.34 4.17 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 91 D 7.97 4.50 0.00 2.85 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 92 P 0.00 4.36 0.00 2.23 2.13 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 93 T 7.98 3.95 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 94 M 8.21 4.47 0.00 2.11 2.21 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 2.69 2.59 0.00 95 Y 8.82 4.04 0.00 3.19 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 96 R 8.04 3.90 0.00 1.48 1.68 0.00 3.34 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.75 0.00 97 F 7.77 4.11 0.00 3.30 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 98 Y 7.92 3.96 0.00 2.92 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 99 E 8.11 3.68 0.00 1.88 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 2.29 2.36 0.00 100 M 8.07 4.11 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.58 0.00 101 L 7.42 3.92 0.00 1.52 1.56 0.90 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 0.00 102 Q 7.46 3.76 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.89 0.00 0.00 0.00 0.00 0.00 1.65 2.33 0.00 103 V 7.69 3.72 1.91 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 0.18 0.00 0.00 0.83 0.00 0.00 104 Y 8.01 4.69 0.00 3.25 2.90 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 0.00 105 G 8.19 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 0.00 106 T 7.84 4.00 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 1.20 0.00 0.00 107 T 7.89 3.91 4.60 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 1.34 0.00 0.00 108 L 8.55 3.99 0.00 1.84 1.73 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.12 3.78 0.00 1.83 1.99 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.45 7.81 110 A 8.17 4.04 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 0.00 111 L 8.29 4.06 0.00 1.79 1.76 0.95 1.13 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 0.00 112 V 8.07 3.82 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 1.08 0.00 0.00 0.95 0.00 0.00 113 H 8.20 4.95 0.00 3.38 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.16 3.97 0.00 2.04 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 2.29 2.33 0.00 115 K 8.27 3.95 0.00 1.59 1.20 0.00 1.76 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.49 7.81 116 F 9.34 4.01 0.00 2.52 1.45 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 0.00 117 G 6.99 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 0.00 118 D 8.59 4.66 0.00 2.75 2.77 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 0.00 119 G 7.94 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 0.00 120 I 8.41 4.79 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.72 0.92 0.00 0.00 121 I 8.11 4.66 1.81 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.66 0.90 0.00 0.00 122 S 8.88 4.23 0.00 3.93 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 0.00 123 A 8.58 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.64 4.31 1.88 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 1.27 0.95 0.94 0.00 0.00 125 N 8.16 4.80 0.00 2.79 2.75 0.00 0.00 6.72 8.26 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 0.00 126 F 7.98 5.43 0.00 3.12 2.96 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 0.00 127 K 8.28 4.51 0.00 1.61 1.66 0.00 1.22 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.13 1.13 7.81 128 L 8.20 5.73 0.00 1.70 1.39 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.31 4.78 0.00 2.66 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 0.00 130 V 8.33 4.78 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 0.88 0.00 0.00 0.91 0.00 0.00 131 K 8.96 4.71 0.00 1.72 1.64 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.47 7.81 132 K 8.64 4.88 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.64 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.44 7.81 133 V 8.72 4.56 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 0.94 0.00 0.00 134 A 8.72 4.35 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 0.00 135 D 8.99 4.56 0.00 2.72 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 0.00 136 P 0.00 4.31 0.00 2.22 2.18 0.00 3.81 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 1.99 2.00 0.00 137 E 8.37 4.19 0.00 2.13 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 0.00 2.32 2.25 0.00 138 G 8.22 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 0.00 139 G 8.86 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 0.00 140 E 8.43 5.16 0.00 1.82 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 2.21 2.31 0.00 141 R 9.54 4.79 0.00 1.68 1.79 0.00 3.22 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 142 A 8.57 4.94 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 0.00 143 V 9.03 4.19 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 0.97 0.00 0.00 0.94 0.00 0.00 144 I 8.38 4.93 1.99 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.85 0.94 0.00 0.00 145 T 8.79 4.55 4.42 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 1.18 0.00 0.00 146 L 8.56 4.88 0.00 1.65 1.96 1.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.76 4.66 0.00 2.61 2.43 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 0.00 148 G 8.56 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 0.00 149 K 8.86 4.31 0.00 1.93 1.71 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.45 7.81 150 Y 8.84 4.52 0.00 2.69 2.90 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 0.00 151 G 8.94 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 0.00 152 P 0.00 4.65 0.00 2.05 1.97 0.00 3.48 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 153 T 9.08 4.51 4.41 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 1.30 0.00 0.00 154 K 8.50 4.68 0.00 1.76 1.73 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.43 7.81 155 P 0.00 4.38 0.00 2.02 1.93 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 156 F 7.86 4.57 0.00 3.08 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