NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3554 8.2493 123.5816 50.8178 21.0335 176.4357 2 K 4.2447 7.5289 112.4134 55.0281 35.3257 174.5167 3 K 4.3144 8.2264 123.2464 55.8528 34.8052 176.3109 4 V 4.4829 7.9637 122.5376 59.3537 34.3482 174.6422 5 Q 3.7490 8.3078 119.6106 56.0230 29.4649 176.0832 6 A 3.8559 9.0842 121.2961 53.9188 18.9817 177.1929 7 Y 3.4423 8.1529 121.4560 58.4602 36.5238 169.8493 8 V 4.2355 7.9245 116.9089 59.8458 34.2122 174.8929 9 K 4.9178 8.1098 120.5285 54.8738 35.8428 175.7758 10 L 4.3962 8.6253 122.0914 55.0350 44.2070 174.3024 11 Q 4.8218 8.7287 120.6479 54.5413 29.0400 174.9685 12 V 4.5274 7.9672 123.3960 59.0970 34.5243 175.2983 13 A 3.7747 8.7968 123.9430 52.4492 18.5521 176.4335 14 A 3.8620 8.3673 118.6952 53.4548 19.0991 179.2586 15 G 3.9879 7.3008 107.4662 41.0000 0.0000 172.0041 16 M 4.1187 7.5686 115.4879 55.4827 35.3244 173.5170 17 A 4.2464 8.5466 126.7366 52.2089 21.8040 174.3710 18 N 4.6216 9.3547 116.6108 53.3960 37.9473 173.2232 19 P 4.2725 0.0000 0.0000 62.8654 31.9546 176.6892 20 S 4.0177 8.6449 117.1392 61.1796 62.7415 173.5372 21 P 4.3874 0.0000 0.0000 65.3704 31.3155 176.1828 22 P 4.4466 0.0000 0.0000 65.2929 32.9274 177.2911 23 V 4.2040 7.5860 113.4896 61.4321 32.4842 181.1293 24 G 3.8429 9.3977 108.7480 45.2772 0.0000 172.9223 25 P 4.0952 0.0000 0.0000 66.0967 31.0684 175.8606 26 A 3.7999 7.7851 117.4947 55.5136 18.3819 178.7935 27 L 4.2049 7.5368 115.7933 56.6822 41.3223 179.0029 28 G 3.6137 8.1054 107.7021 47.8749 0.0000 175.6750 29 Q 3.9561 7.5519 119.2419 59.1209 28.8544 178.5914 30 Q 4.1350 7.4882 117.4569 57.6048 28.6301 177.6315 31 G 4.1412 7.3013 107.8904 45.4316 0.0000 174.0295 32 V 3.4054 7.3358 118.1383 62.1627 32.2589 176.5842 33 N 4.7099 8.1571 122.7623 52.1160 38.2600 175.8929 34 I 3.5478 8.2343 125.0748 64.9127 37.4066 176.9548 35 M 3.9348 8.0971 117.6802 59.0997 32.0714 177.7981 36 E 3.9903 8.4213 118.4136 59.5898 29.6329 178.5245 37 F 4.3736 8.5523 120.2324 61.4597 39.3894 176.1231 38 C 3.9939 8.3701 118.5942 62.8609 31.3475 176.0455 39 K 3.9710 8.0449 119.0779 59.1387 31.7456 179.2564 40 A 4.0789 8.4396 121.5311 55.6601 18.4000 178.9505 41 F 4.3438 8.7637 120.3181 61.5052 39.1961 176.7469 42 N 4.6335 8.5215 117.1340 54.9011 38.4320 177.3567 43 A 4.0669 7.5899 122.1849 55.3008 18.7251 179.7962 44 K 4.0923 7.6296 116.0297 59.0679 32.2471 179.5256 45 T 3.7981 7.5763 109.8678 63.9197 68.1834 176.2961 46 D 4.2486 7.2926 120.4797 57.5281 40.9382 177.8512 47 S 4.1798 7.8018 113.7510 61.4463 63.1108 174.9926 48 I 3.8194 7.1822 118.0262 60.0629 38.0942 174.8526 49 E 3.8486 8.7698 123.2148 56.8937 29.4484 177.1224 50 K 4.2516 8.4910 123.6577 57.1757 32.9242 177.7620 51 G 3.9475 8.9911 110.7164 45.0425 0.0000 172.7485 52 L 4.7832 7.2124 120.5973 51.8469 44.0052 173.8961 53 P 4.5451 0.0000 0.0000 63.2846 31.7733 175.3524 54 I 4.6164 7.9973 125.0745 58.1775 39.8522 173.1301 55 P 4.8103 0.0000 0.0000 62.6343 32.6453 175.3832 56 V 4.8357 8.8957 124.6814 59.6914 34.8823 174.8112 57 V 4.4913 8.0825 122.4125 61.3944 33.5390 174.2064 58 I 4.6795 7.9533 129.6566 60.2485 39.2426 174.8957 59 T 4.5328 8.7083 121.3328 60.2567 69.5906 173.1195 60 V 4.2262 8.2342 128.5018 61.8651 33.1414 174.3572 61 Y 4.8918 7.8893 122.5370 55.8017 40.4540 176.6833 62 A 4.2944 8.6847 122.7485 55.4896 18.5147 178.4073 63 D 4.4324 8.1985 114.3017 55.3869 41.4284 177.8241 64 R 4.1453 8.4849 116.3215 56.9173 29.1704 176.1243 65 S 4.6985 7.8067 113.5979 58.2752 63.4965 171.7498 66 F 5.0816 7.6931 114.6686 56.4158 39.8721 173.1438 67 T 5.0825 8.4499 108.9534 60.2847 72.5018 172.5937 68 F 5.7603 8.1375 115.7789 55.5831 41.4448 173.8573 69 V 4.3054 8.5196 114.4432 59.9412 33.8199 174.6581 70 T 4.4113 8.6589 121.6075 61.4584 67.4749 173.9915 71 K 4.5745 8.1233 133.8789 56.4350 32.8038 175.7166 72 T 4.6139 8.1073 118.1845 60.1498 69.1774 173.4407 73 P 4.4973 0.0000 0.0000 62.2643 31.9195 174.8336 74 P 4.3216 0.0000 0.0000 63.1122 33.1379 177.5347 75 A 3.9886 8.5954 122.0439 55.1237 18.4190 180.0169 76 A 3.9227 7.9801 118.8611 55.3490 18.4914 179.8469 77 V 3.4975 7.7182 116.0183 66.2839 31.7663 177.8914 78 L 4.0127 8.0490 118.6928 58.0223 41.4006 179.6817 79 L 4.0562 8.3133 119.1061 57.5210 41.4490 179.6241 80 K 3.9856 7.9571 118.5527 59.3038 31.9299 179.5058 81 K 3.9214 8.0650 118.3904 59.4551 31.8400 179.0345 82 A 3.9648 7.8148 119.2931 55.4430 18.4003 179.3204 83 A 4.3046 8.3546 117.6278 52.9217 18.4834 178.5829 84 G 3.7938 7.9081 105.1283 46.0372 0.0000 173.5492 85 I 4.3514 7.6731 113.0350 59.2431 39.6009 175.3972 86 K 4.2875 8.4687 118.8390 57.3814 33.1529 176.1944 87 S 4.7730 7.5891 110.2636 55.9318 66.4422 174.7191 88 G 4.0340 8.4252 112.6308 45.5132 0.0000 174.1766 89 S 4.5178 8.1153 115.0513 57.2865 64.0408 175.3997 90 G 4.0616 8.3009 113.8263 45.8192 0.0000 174.7050 91 K 4.5297 7.2339 119.5898 52.3390 31.9384 173.8348 92 P 4.6556 0.0000 0.0000 63.2393 32.5231 175.9059 93 N 4.8850 8.9532 121.1712 53.9976 37.4025 176.1841 94 K 4.0376 7.8062 117.4329 58.6195 32.4220 176.3936 95 D 4.7736 7.7975 116.8850 51.9092 43.4476 174.4320 96 K 5.0353 8.5593 125.5472 55.8064 33.7197 176.8781 97 V 4.1163 8.3182 115.7161 62.4452 33.1906 175.3561 98 G 4.3050 7.6367 106.3021 45.3660 0.0000 171.7926 99 K 5.3272 8.3882 117.6860 55.3985 36.0359 175.9317 100 I 4.9420 8.9511 121.8736 59.5622 41.8454 175.3402 101 S 5.2023 9.0777 120.8302 57.4806 63.6082 175.5998 102 R 3.9571 8.6715 120.9698 59.3217 29.7912 179.3106 103 A 4.2694 7.8096 121.6703 54.6485 18.4860 179.3988 104 Q 4.1912 7.8423 117.5204 58.6676 28.8436 178.9973 105 L 4.0451 7.9849 119.3557 58.1420 41.7557 179.5600 106 Q 4.1145 7.8718 117.6360 58.8989 28.0611 178.7010 107 E 4.0949 8.0054 119.3068 59.5002 29.4398 179.4688 108 I 3.7990 8.3143 120.1329 64.2099 37.2151 178.3828 109 A 3.9931 8.5470 122.0832 54.9750 17.9272 179.4296 110 Q 3.9859 7.8833 117.6147 59.3058 29.1568 178.1199 111 T 4.0910 7.5518 116.2688 66.3981 68.8654 176.6372 112 K 4.1829 8.5982 119.2984 57.7220 32.0555 179.0228 113 A 3.9417 7.7288 121.9585 55.3664 18.0394 179.3006 114 A 3.9623 8.0293 117.1681 55.1589 18.5637 178.6038 115 D 4.6183 8.1612 114.5612 54.1784 41.8281 176.6974 116 M 4.4762 6.9309 119.3473 54.3861 33.2818 176.2706 117 T 4.1293 8.4902 115.2542 62.8022 68.0894 175.0087 118 G 3.8679 8.0487 108.5359 46.2741 0.0000 173.3244 119 A 4.1049 8.8242 128.2248 54.3343 19.0748 177.1525 120 D 5.0719 7.6277 114.0034 50.7245 43.9260 176.6246 121 I 3.7162 8.2037 113.3568 64.1756 37.2874 177.9374 122 E 3.9077 8.2611 119.5144 59.1458 29.2911 178.8889 123 A 3.9854 8.9661 120.8420 55.6074 18.3642 179.5377 124 M 3.9941 7.8973 116.6967 58.9004 32.0579 179.1474 125 T 3.8736 8.3342 116.2246 66.7225 68.5931 176.7086 126 R 4.1330 8.1157 121.9454 58.9102 29.8424 178.4428 127 S 4.1228 8.3194 115.2555 61.9390 62.7384 176.8292 128 I 3.9881 7.6386 122.2205 64.0095 36.4143 178.1365 129 E 4.0557 8.1771 119.7533 59.4029 29.0236 179.6433 130 G 3.6854 8.1637 105.2683 47.6328 0.0000 175.5603 131 T 4.1132 7.4135 112.0942 64.3882 68.8926 176.9541 132 A 3.9875 8.2125 123.8845 55.1358 18.2950 179.8876 133 R 3.8818 8.0843 115.0889 58.8850 30.1471 178.6894 134 S 4.4517 7.5781 113.5565 59.8103 61.9680 175.1093 135 M 4.4642 8.2288 120.8506 54.3097 32.2494 176.8924 136 G 3.9383 7.9655 107.4615 46.0400 0.0000 172.5018 137 L 4.8257 7.7266 119.5516 52.6224 42.9075 176.8449 138 V 3.9304 8.3719 124.6561 62.6344 33.2324 175.0283 139 V 5.5542 8.4393 123.8952 60.1645 34.2058 174.1761 140 E 4.5708 8.6661 126.5554 54.5151 31.6707 175.7500 141 D 4.4587 8.6562 122.9604 54.3617 41.3816 175.5472 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 A 8.25 4.36 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 2 K 7.53 4.24 0.00 1.90 1.75 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.45 7.81 3 K 8.23 4.31 0.00 1.70 1.76 0.00 1.60 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.48 7.81 4 V 7.96 4.48 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 0.75 0.00 0.00 0.93 0.00 0.00 5 Q 8.31 3.75 0.00 2.45 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 6 A 9.08 3.86 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 7 Y 8.15 3.44 0.00 3.07 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 8 V 7.92 4.24 1.92 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 0.53 0.00 0.00 0.67 0.00 0.00 9 K 8.11 4.92 0.00 1.56 1.62 0.00 1.97 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.43 7.81 10 L 8.63 4.40 0.00 1.66 1.61 0.77 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.73 4.82 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 12 V 7.97 4.53 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 0.27 0.00 0.00 0.93 0.00 0.00 13 A 8.80 3.77 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 14 A 8.37 3.86 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 15 G 7.30 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 16 M 7.57 4.12 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 17 A 8.55 4.25 1.14 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 18 N 9.35 4.62 0.00 2.75 3.27 0.00 0.00 6.96 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 19 P 0.00 4.27 0.00 2.20 1.97 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 20 S 8.64 4.02 0.00 3.81 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 21 P 0.00 4.39 0.00 2.06 2.09 0.00 3.73 0.00 0.00 3.64 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 22 P 0.00 4.45 0.00 2.02 2.09 0.00 3.66 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 23 V 7.59 4.20 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 0.97 0.00 0.00 0.92 0.00 0.00 24 G 9.40 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 0.00 0.00 0.00 25 P 0.00 4.10 0.00 2.13 2.12 0.00 3.97 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 2.10 2.16 0.00 26 A 7.79 3.80 1.26 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 27 L 7.54 4.20 0.00 1.54 1.63 0.27 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.11 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 0.00 0.00 0.00 0.00 29 Q 7.55 3.96 0.00 1.94 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.69 0.00 30 Q 7.49 4.14 0.00 1.92 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.40 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 31 G 7.30 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 32 V 7.34 3.41 1.65 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 -0.63 0.00 0.00 0.58 0.00 0.00 33 N 8.16 4.71 0.00 3.18 2.92 0.00 0.00 6.88 7.34 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 34 I 8.23 3.55 1.88 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 1.49 0.95 0.93 0.00 0.00 35 M 8.10 3.93 0.00 2.17 2.12 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 2.72 2.73 0.00 36 E 8.42 3.99 0.00 2.22 2.41 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 2.46 2.45 0.00 37 F 8.55 4.37 0.00 3.40 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 38 C 8.37 3.99 0.00 3.10 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 39 K 8.04 3.97 0.00 1.87 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.61 7.81 40 A 8.44 4.08 1.62 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 41 F 8.76 4.34 0.00 1.51 2.38 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 42 N 8.52 4.63 0.00 2.76 2.80 0.00 0.00 6.56 8.86 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 43 A 7.59 4.07 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 44 K 7.63 4.09 0.00 1.89 1.80 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 45 T 7.58 3.80 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 -0.13 0.00 0.00 46 D 7.29 4.25 0.00 2.76 2.73 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 47 S 7.80 4.18 0.00 3.94 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.18 3.82 1.82 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 1.29 0.74 0.89 0.00 0.00 49 E 8.77 3.85 0.00 2.03 1.93 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 2.41 2.32 0.00 50 K 8.49 4.25 0.00 1.73 1.71 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.48 7.81 51 G 8.99 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 52 L 7.21 4.78 0.00 1.60 1.60 0.93 0.91 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 53 P 0.00 4.55 0.00 2.10 2.13 0.00 3.74 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 2.01 1.99 0.00 54 I 8.00 4.62 1.96 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.31 1.18 0.00 0.00 55 P 0.00 4.81 0.00 2.19 2.21 0.00 3.83 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 56 V 8.90 4.84 2.41 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 0.56 0.00 0.00 1.34 0.00 0.00 57 V 8.08 4.49 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 0.49 0.00 0.00 0.94 0.00 0.00 58 I 7.95 4.68 1.42 0.00 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.25 0.63 0.00 0.00 59 T 8.71 4.53 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 1.24 0.00 0.00 60 V 8.23 4.23 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 0.93 0.00 0.00 0.70 0.00 0.00 61 Y 7.89 4.89 0.00 3.14 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 62 A 8.68 4.29 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 63 D 8.20 4.43 0.00 2.77 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 64 R 8.48 4.15 0.00 2.05 2.17 0.00 3.25 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 65 S 7.81 4.70 0.00 4.17 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 66 F 7.69 5.08 0.00 3.00 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 67 T 8.45 5.08 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 1.40 0.00 0.00 68 F 8.14 5.76 0.00 3.18 3.01 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 69 V 8.52 4.31 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 0.83 0.00 0.00 1.00 0.00 0.00 70 T 8.66 4.41 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 1.25 0.00 0.00 71 K 8.12 4.57 0.00 1.96 2.11 0.00 1.95 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.59 7.81 72 T 8.11 4.61 4.27 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 1.30 0.00 0.00 73 P 0.00 4.50 0.00 2.24 2.18 0.00 3.87 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 74 P 0.00 4.32 0.00 2.19 2.06 0.00 3.68 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 75 A 8.60 3.99 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 76 A 7.98 3.92 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 77 V 7.72 3.50 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 0.95 0.00 0.00 78 L 8.05 4.01 0.00 1.90 1.72 0.98 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.31 4.06 0.00 1.86 1.72 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.96 3.99 0.00 2.04 2.03 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.73 7.81 81 K 8.07 3.92 0.00 1.96 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.69 7.81 82 A 7.81 3.96 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 83 A 8.35 4.30 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 84 G 7.91 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 85 I 7.67 4.35 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 1.43 0.71 0.95 0.00 0.00 86 K 8.47 4.29 0.00 1.75 1.89 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.40 7.81 87 S 7.59 4.77 0.00 3.76 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 88 G 8.43 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 89 S 8.12 4.52 0.00 4.21 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 0.00 90 G 8.30 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 0.00 0.00 0.00 0.00 91 K 7.23 4.53 0.00 1.83 1.73 0.00 1.59 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 P 0.00 4.66 0.00 2.03 2.09 0.00 3.80 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 93 N 8.95 4.89 0.00 2.90 3.02 0.00 0.00 6.92 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 94 K 7.81 4.04 0.00 1.68 2.03 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.37 7.81 95 D 7.80 4.77 0.00 2.60 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.56 5.04 0.00 1.97 1.80 0.00 1.22 0.00 0.00 2.36 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.41 7.81 97 V 8.32 4.12 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 0.73 0.00 0.00 0.97 0.00 0.00 98 G 7.64 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 99 K 8.39 5.33 0.00 1.90 1.73 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.44 7.81 100 I 8.95 4.94 1.87 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 1.29 0.77 0.95 0.00 0.00 101 S 9.08 5.20 0.00 4.01 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 0.00 102 R 8.67 3.96 0.00 1.89 2.04 0.00 3.29 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 103 A 7.81 4.27 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 0.00 104 Q 7.84 4.19 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.27 0.00 105 L 7.98 4.05 0.00 1.84 1.73 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.87 4.11 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.68 0.00 107 E 8.01 4.09 0.00 2.23 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 2.33 2.63 0.00 108 I 8.31 3.80 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 1.46 0.97 0.92 0.00 0.00 109 A 8.55 3.99 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 0.00 110 Q 7.88 3.99 0.00 2.18 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 111 T 7.55 4.09 4.39 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 1.22 0.00 0.00 112 K 8.60 4.18 0.00 1.76 1.86 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.61 7.81 113 A 7.73 3.94 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 0.00 114 A 8.03 3.96 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 0.00 115 D 8.16 4.62 0.00 2.66 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 0.00 116 M 6.93 4.48 0.00 1.96 1.99 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 2.79 2.48 0.00 117 T 8.49 4.13 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 0.00 118 G 8.05 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 0.00 119 A 8.82 4.10 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 0.00 120 D 7.63 5.07 0.00 3.00 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 0.00 121 I 8.20 3.72 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 1.64 1.37 0.91 0.00 0.00 122 E 8.26 3.91 0.00 2.31 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 2.40 2.45 0.00 123 A 8.97 3.99 1.39 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 0.00 0.00 124 M 7.90 3.99 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.59 0.00 125 T 8.33 3.87 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 1.28 0.00 0.00 126 R 8.12 4.13 0.00 2.01 2.03 0.00 3.16 0.00 0.00 3.27 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 127 S 8.32 4.12 0.00 4.09 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 0.00 128 I 7.64 3.99 2.01 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 1.53 0.87 0.92 0.00 0.00 129 E 8.18 4.06 0.00 2.22 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 2.33 2.58 0.00 130 G 8.16 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 0.00 0.00 0.00 131 T 7.41 4.11 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 1.26 0.00 0.00 132 A 8.21 3.99 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 0.00 133 R 8.08 3.88 0.00 1.79 2.02 0.00 3.16 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 134 S 7.58 4.45 0.00 3.97 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 0.00 135 M 8.23 4.46 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.53 0.00 136 G 7.97 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 0.00 0.00 0.00 137 L 7.73 4.83 0.00 1.62 1.63 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.37 3.93 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 0.82 0.00 0.00 0.93 0.00 0.00 139 V 8.44 5.55 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 1.00 0.00 0.00 0.96 0.00 0.00 140 E 8.67 4.57 0.00 2.04 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 0.00 2.28 2.23 0.00 141 D 8.66 4.46 0.00 2.64 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00