NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 4.5331 8.2548 109.1365 45.7262 0.0000 175.7526 4 L 4.3761 7.7588 119.7775 55.4601 41.3670 176.9985 5 D 4.4099 8.4344 119.4311 57.6582 40.9012 178.4549 6 K 3.8422 7.8217 118.1640 58.8729 32.2735 177.5181 7 Y 4.5748 7.5479 115.0937 58.2327 40.0753 175.6624 8 L 4.8401 8.2891 119.2458 52.3121 42.2731 174.5080 9 P 4.2951 0.0000 0.0000 63.5907 31.9528 177.4055 10 G 3.7799 8.9991 110.8515 45.6828 0.0000 172.7649 11 I 4.3097 7.3276 120.7434 59.5764 37.5293 175.3474 12 E 4.4113 8.6272 125.6764 57.3714 30.7397 176.6141 13 K 5.2920 8.0236 117.3769 54.4755 35.9749 175.5482 14 L 5.0138 8.9785 122.3560 52.7717 46.1565 176.3705 15 R 4.7511 8.8854 120.6252 56.6521 31.8052 176.1518 16 R 4.9503 9.1250 122.7815 54.9734 33.4867 174.9669 17 G 3.6063 8.9519 116.7233 47.4100 0.0000 173.7853 18 D 4.8482 8.9517 124.0634 54.1094 41.9356 176.3279 19 G 4.3599 8.2699 109.3643 45.6970 0.0000 171.8914 20 E 5.5359 8.9830 122.1779 54.7619 33.7421 175.6241 21 V 4.6765 9.0174 114.4127 59.5499 36.3388 175.1007 22 E 4.7255 8.6476 121.8943 55.7805 30.5869 178.3075 23 V 3.6837 9.0574 122.7069 66.1647 31.5596 178.6878 24 K 4.0597 8.1960 117.7786 58.9286 31.6711 178.4358 25 S 4.4564 7.9931 112.9882 59.7691 63.2628 174.5385 26 L 4.4150 8.0080 122.4959 54.3435 41.8032 176.1160 27 A 4.1993 7.4715 122.2341 54.0767 18.4864 178.8291 28 G 3.9799 9.4302 110.9143 45.3636 0.0000 173.7188 29 K 4.7784 7.8470 119.3690 54.9579 34.7699 175.4120 30 L 4.5373 8.5325 124.3779 54.6994 43.5605 175.4814 31 V 4.5920 8.6634 126.6189 61.1600 33.9755 173.9637 32 F 4.9981 9.1133 127.5425 56.0122 41.1819 174.9440 33 F 4.9511 9.0276 123.5502 56.8088 40.3894 174.2417 34 Y 5.1862 8.8723 126.8339 56.1812 40.2527 174.3757 35 F 5.0163 8.9712 127.4186 55.9885 40.4221 175.3469 36 S 4.6001 8.1971 116.9004 57.7742 66.2386 172.0587 37 A 4.7968 7.8466 121.0920 50.6293 21.3861 177.8298 38 S 3.5209 8.8296 115.5720 60.5034 63.0369 175.7076 39 W 4.4168 7.1785 115.9084 57.1657 28.4884 175.3084 40 C 4.5456 7.5110 121.4786 55.3505 39.0647 171.9936 41 P 4.3564 0.0000 0.0000 65.2316 31.1574 176.8338 42 P 4.4731 0.0000 0.0000 65.3255 31.2694 178.8898 43 C 4.5654 8.0124 117.0228 59.8430 39.7753 175.9930 44 R 4.0464 7.8851 119.4315 59.3448 30.3641 178.9295 45 G 3.8060 8.1067 104.4683 46.9361 0.0000 175.5242 46 F 4.1652 8.2058 122.6689 61.3526 39.3977 177.2792 47 T 3.8487 8.3136 115.6598 66.5739 68.2829 174.7046 48 P 4.1674 0.0000 0.0000 65.3686 31.3339 178.7496 49 Q 3.9049 7.2887 115.6333 58.7535 28.5643 178.4277 50 L 3.8278 7.2795 121.3727 57.8483 41.9003 179.0882 51 I 3.9476 8.1011 120.3094 64.3702 37.0691 177.9222 52 E 3.9148 8.3618 120.2411 59.2423 29.4381 178.6668 53 F 4.1501 8.3926 120.7192 61.4363 39.4273 176.4296 54 Y 4.3895 8.9483 119.6575 61.1052 38.4672 177.8905 55 D 4.3363 8.4675 118.9443 57.2011 40.9458 178.6575 56 K 3.7093 7.6755 118.2475 58.4002 32.2239 177.8730 57 F 4.8911 7.8924 114.0238 55.7577 40.9579 176.6449 58 H 2.5800 7.9061 117.8432 57.8560 28.6568 177.7836 59 E 3.6998 7.4282 119.3516 58.9109 29.8187 179.0825 60 S 4.0698 7.8418 112.9379 60.5362 63.2767 175.4015 61 K 4.3104 8.2900 118.3092 54.9140 32.7093 175.9173 62 N 4.0840 7.7202 117.3062 54.5313 37.3395 171.6828 63 F 5.5990 7.9346 112.8568 55.3376 42.4043 175.1446 64 E 5.1476 9.6585 118.8476 54.6585 33.7425 173.8568 65 V 4.9165 9.2363 123.6401 61.0137 34.6748 174.4446 66 V 4.8847 8.8281 127.5224 60.8750 34.0679 174.2491 67 F 4.9743 9.8045 132.3719 58.6172 40.8654 173.7681 68 C 4.6907 8.8933 124.5161 57.7415 29.7502 173.0938 69 T 4.2896 7.7458 118.4995 61.7511 67.7052 173.8756 70 W 5.0967 8.9495 126.4329 56.7079 30.0158 176.3126 71 D 5.0941 8.7104 120.6735 54.6842 40.7945 176.1323 72 E 4.8394 9.0491 119.4411 56.1896 31.3154 175.7223 73 E 4.5211 8.1451 120.1738 54.7106 30.6042 176.3704 74 E 2.5400 8.4899 125.3341 58.7679 29.4547 178.1745 75 D 4.5894 7.9854 117.1099 56.0615 41.2600 177.5328 76 G 4.0236 7.8787 105.1046 44.6792 0.0000 175.4396 77 F 4.3158 8.1711 123.5558 61.3293 39.5327 176.6075 78 A 4.2899 8.4442 120.0430 55.4043 18.0150 179.7065 79 G 3.5499 8.0551 102.1802 48.0265 0.0000 174.8533 80 Y 4.1930 8.0874 122.0907 60.4900 38.8175 177.8360 81 F 3.8651 8.4745 121.6966 60.8094 39.1673 176.9264 82 A 3.5210 7.6909 119.7179 54.3432 18.1714 178.8233 83 K 3.8793 7.1361 114.8303 56.5803 32.6346 176.6803 84 M 3.7167 6.5126 119.4257 52.6496 33.8483 174.1609 85 P 4.3292 0.0000 0.0000 62.3564 32.9482 176.0577 86 W 4.9884 6.2535 117.7816 56.4285 30.8303 174.9760 87 L 5.3566 9.1329 119.1011 53.9788 44.2869 175.3638 88 A 5.2237 8.6168 120.3519 50.4861 22.8958 175.8182 89 V 4.0024 8.2975 121.3427 61.8651 32.2726 174.7109 90 P 4.2755 0.0000 0.0000 62.1891 32.3173 177.0331 91 F 3.4353 7.7919 122.5167 61.0786 39.3243 177.3112 92 A 4.1237 7.9275 121.9310 54.3829 18.6277 177.4568 93 Q 4.5933 7.7453 115.1832 55.9901 29.4942 178.2849 94 S 3.9249 7.5873 117.2219 61.6014 62.6354 175.7684 95 E 4.0801 8.3127 122.6664 58.5994 29.3230 178.5876 96 A 3.9559 7.8938 120.6551 55.0788 18.3366 179.7514 97 V 3.6093 7.5969 116.2646 66.3484 31.7318 178.1816 98 Q 4.0065 8.3392 117.9439 58.8549 28.4209 178.8510 99 K 4.1087 8.2950 119.7634 59.2762 32.0114 179.2079 100 L 4.0270 8.2439 120.7993 58.1295 41.9940 179.1606 101 S 3.9846 8.6242 115.6437 61.3561 62.7597 176.6302 102 K 3.9533 8.1596 122.3911 59.6804 31.7655 178.2217 103 H 3.9793 8.2245 117.6596 59.0618 29.7623 176.2197 104 F 4.6422 8.0595 116.2545 56.1004 39.5370 175.0307 105 N 4.0654 8.0400 116.1409 54.4076 37.5991 174.8033 106 V 3.8600 8.2429 117.4570 62.4368 31.9698 174.9212 107 E 4.8519 8.8416 125.9848 56.3816 31.5849 175.8787 108 S 4.9367 7.7759 111.4044 56.4647 66.1670 173.0230 109 I 4.2292 7.9253 114.0882 58.1978 39.8100 173.1352 110 P 4.7563 0.0000 0.0000 62.5303 32.9011 175.2444 111 T 4.6235 8.4196 116.8884 61.9643 73.0898 172.8169 112 L 5.2288 8.4734 125.8638 53.6884 45.5147 174.7673 113 I 4.8543 9.0152 127.9410 59.4560 39.9984 174.8475 114 G 3.9144 9.1429 115.2470 44.4901 0.0000 172.8698 115 V 4.9746 8.3805 118.1089 59.2162 36.0422 174.3789 116 D 4.7189 9.0068 123.9336 53.9780 41.7606 176.8577 117 A 4.0461 9.0075 128.5805 55.5283 18.9283 179.5700 118 D 4.3099 8.3455 114.2430 56.9917 41.1791 177.6007 119 S 4.3871 8.5359 112.1409 58.0812 63.8819 175.4715 120 G 4.1488 8.6123 108.4831 45.1325 0.0000 173.2305 121 D 4.6688 8.1812 120.7108 54.0260 42.1047 175.9644 122 V 3.9798 8.5740 123.0702 63.5161 31.9181 175.2127 123 V 4.1239 8.9921 128.2074 64.6607 33.1439 175.3583 124 T 5.2651 7.5795 113.7479 60.8043 70.7307 173.7355 125 T 4.5083 9.3436 116.4150 61.5851 69.7903 174.5263 126 R 4.5321 7.7573 121.0652 55.7767 31.2373 177.5086 127 A 4.1797 7.6945 123.2864 54.0636 18.2326 180.4325 128 R 3.3752 7.6662 117.1079 59.4353 29.9470 178.3910 129 A 3.9145 7.5182 118.8148 55.2350 18.6969 179.1587 130 T 3.7005 7.5531 108.2122 64.2629 68.9566 176.9019 131 L 3.1003 7.0392 123.2962 57.7075 41.7861 179.3466 132 V 3.7245 7.1220 109.7029 63.2793 31.5141 177.5638 133 K 4.4805 7.3039 115.9033 55.6667 33.7718 176.8691 134 D 4.9065 7.8907 119.3098 52.5219 42.0135 173.9338 135 P 4.4819 0.0000 0.0000 65.3818 31.5025 177.8944 136 E 4.7409 8.5850 116.7573 55.5686 30.1316 176.2525 137 G 4.1146 8.8049 107.7842 46.6754 0.0000 176.2740 138 E 4.0316 8.1226 118.0033 58.2881 29.8372 178.3002 139 Q 4.5564 9.0343 116.6694 55.1264 29.4442 174.8760 140 F 2.7136 7.5313 121.3919 57.6573 39.4247 173.2030 141 P 2.9700 0.0000 0.0000 61.2030 31.6331 174.9485 142 W 3.6279 7.3255 115.2813 57.9652 26.8980 175.3389 143 K 4.2155 7.9340 115.7318 57.0198 32.2444 178.3284 144 D 4.5995 8.7461 124.3462 53.9258 41.7782 176.4297 145 A 4.2420 8.5201 121.6508 52.4665 18.0361 177.5412 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 3 G 8.25 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.76 4.38 0.00 1.90 1.93 1.03 1.04 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 5 D 8.43 4.41 0.00 2.75 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 6 K 7.82 3.84 0.00 1.51 1.44 0.00 1.55 0.00 0.00 1.36 0.00 0.00 2.70 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.42 1.15 7.81 7 Y 7.55 4.57 0.00 3.22 2.80 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 8 L 8.29 4.84 0.00 1.73 1.62 1.17 0.92 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 9 P 0.00 4.30 0.00 2.16 2.14 0.00 3.43 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.89 0.00 10 G 9.00 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 0.00 0.00 0.00 11 I 7.33 4.31 1.91 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 1.31 0.69 0.97 0.00 0.00 12 E 8.63 4.41 0.00 1.95 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 2.39 2.36 0.00 13 K 8.02 5.29 0.00 1.63 1.71 0.00 1.92 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.41 7.81 14 L 8.98 5.01 0.00 1.62 1.73 1.04 0.92 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 15 R 8.89 4.75 0.00 1.72 2.14 0.00 3.37 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.90 0.00 16 R 9.12 4.95 0.00 2.02 1.85 0.00 3.35 0.00 0.00 3.31 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.89 0.00 17 G 8.95 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 18 D 8.95 4.85 0.00 2.70 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 19 G 8.27 4.36 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 0.00 20 E 8.98 5.54 0.00 1.87 1.88 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 2.27 2.37 0.00 21 V 9.02 4.68 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 0.83 0.00 0.00 1.08 0.00 0.00 22 E 8.65 4.73 0.00 2.07 1.89 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 2.42 2.33 0.00 23 V 9.06 3.68 2.14 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 1.11 0.00 0.00 1.06 0.00 0.00 24 K 8.20 4.06 0.00 1.84 1.88 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.48 7.81 25 S 7.99 4.46 0.00 4.07 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 26 L 8.01 4.42 0.00 1.86 1.76 1.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.47 4.20 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 28 G 9.43 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 29 K 7.85 4.78 0.00 1.85 1.80 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.55 7.81 30 L 8.53 4.54 0.00 1.75 1.62 0.60 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.66 4.59 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 0.36 0.00 0.00 0.90 0.00 0.00 32 F 9.11 5.00 0.00 2.90 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 33 F 9.03 4.95 0.00 2.89 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 0.00 0.00 0.00 34 Y 8.87 5.19 0.00 2.74 2.79 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 35 F 8.97 5.02 0.00 2.66 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 0.00 0.00 0.00 0.00 36 S 8.20 4.60 0.00 2.72 3.43 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 37 A 7.85 4.80 0.38 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 38 S 8.83 3.52 0.00 3.74 3.24 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 39 W 7.18 4.42 0.00 3.39 3.23 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 40 C 7.51 4.55 0.00 2.05 2.79 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 41 P 0.00 4.36 0.00 2.26 2.15 0.00 3.80 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 42 P 0.00 4.47 0.00 2.26 2.32 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 2.21 2.07 0.00 43 C 8.01 4.57 0.00 3.16 3.31 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 44 R 7.89 4.05 0.00 2.00 2.04 0.00 3.21 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 45 G 8.11 3.81 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 0.00 0.00 0.00 46 F 8.21 4.17 0.00 3.15 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 47 T 8.31 3.85 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 1.28 0.00 0.00 48 P 0.00 4.17 0.00 2.10 2.03 0.00 3.61 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 49 Q 7.29 3.90 0.00 1.88 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 50 L 7.28 3.83 0.00 0.80 1.40 0.61 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.10 3.95 1.92 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.58 0.80 0.00 0.00 52 E 8.36 3.91 0.00 2.03 2.14 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 2.32 2.30 0.00 53 F 8.39 4.15 0.00 3.41 3.33 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 54 Y 8.95 4.39 0.00 3.58 3.46 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 0.00 0.00 0.00 55 D 8.47 4.34 0.00 2.65 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 56 K 7.68 3.71 0.00 0.79 0.74 0.00 1.34 0.00 0.00 1.10 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.01 1.28 7.81 57 F 7.89 4.89 0.00 2.69 2.59 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 58 H 7.91 2.58 0.00 2.33 2.22 0.00 5.26 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.43 3.70 0.00 1.79 1.82 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 2.11 1.55 0.00 60 S 7.84 4.07 0.00 3.97 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 61 K 8.29 4.31 0.00 1.67 1.25 0.00 0.61 0.00 0.00 0.74 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.03 7.81 62 N 7.72 4.08 0.00 2.89 2.80 0.00 0.00 6.69 7.40 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 63 F 7.93 5.60 0.00 3.33 3.23 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 64 E 9.66 5.15 0.00 2.19 1.89 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 2.35 2.48 0.00 65 V 9.24 4.92 1.46 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 -0.39 0.00 0.00 0.96 0.00 0.00 66 V 8.83 4.88 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 1.16 0.00 0.00 1.01 0.00 0.00 67 F 9.80 4.97 0.00 3.57 3.26 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 68 C 8.89 4.69 0.00 2.12 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 69 T 7.75 4.29 4.05 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 0.00 0.00 1.33 0.00 0.00 70 W 8.95 5.10 0.00 3.14 3.54 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 71 D 8.71 5.09 0.00 3.06 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 72 E 9.05 4.84 0.00 2.02 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 2.29 2.44 0.00 73 E 8.15 4.52 0.00 2.11 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 0.00 2.38 2.36 0.00 74 E 8.49 2.54 0.00 1.49 1.67 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 2.06 1.67 0.00 75 D 7.99 4.59 0.00 2.65 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 76 G 7.88 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 0.00 0.00 0.00 77 F 8.17 4.32 0.00 3.24 3.20 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 78 A 8.44 4.29 1.46 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 0.00 0.00 0.00 0.00 0.00 79 G 8.06 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 80 Y 8.09 4.19 0.00 3.17 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 81 F 8.47 3.87 0.00 2.63 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 82 A 7.69 3.52 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 83 K 7.14 3.88 0.00 1.45 1.58 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.39 7.81 84 M 6.51 3.72 0.00 0.59 1.44 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.89 0.00 85 P 0.00 4.33 0.00 2.03 1.84 0.00 2.20 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.45 0.00 86 W 6.25 4.99 0.00 3.41 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 0.00 0.00 0.00 87 L 9.13 5.36 0.00 1.92 1.89 1.06 1.04 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 88 A 8.62 5.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.30 4.00 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 0.71 0.00 0.00 0.95 0.00 0.00 90 P 0.00 4.28 0.00 2.15 1.93 0.00 3.64 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.10 0.00 91 F 7.79 3.44 0.00 2.06 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 92 A 7.93 4.12 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 93 Q 7.75 4.59 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 94 S 7.59 3.92 0.00 3.48 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 95 E 8.31 4.08 0.00 1.96 1.89 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 2.34 2.20 0.00 96 A 7.89 3.96 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 97 V 7.60 3.61 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 1.44 0.00 0.00 0.85 0.00 0.00 98 Q 8.34 4.01 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.24 2.49 0.00 99 K 8.29 4.11 0.00 1.91 1.84 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.56 7.81 100 L 8.24 4.03 0.00 1.90 2.00 0.98 0.13 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 0.00 101 S 8.62 3.98 0.00 4.19 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 0.00 102 K 8.16 3.95 0.00 1.83 1.94 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.42 7.81 103 H 8.22 3.98 0.00 3.10 3.32 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.06 4.64 0.00 3.05 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 0.00 105 N 8.04 4.07 0.00 2.81 2.86 0.00 0.00 7.04 7.29 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 0.00 106 V 8.24 3.86 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 0.40 0.00 0.00 0.24 0.00 0.00 107 E 8.84 4.85 0.00 2.02 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 2.26 2.48 0.00 108 S 7.78 4.94 0.00 3.94 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 0.00 109 I 7.93 4.23 1.50 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.38 -0.42 0.00 0.00 110 P 0.00 4.76 0.00 2.04 2.20 0.00 3.61 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.95 0.00 111 T 8.42 4.62 4.09 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 1.12 0.00 0.00 112 L 8.47 5.23 0.00 1.78 1.49 0.84 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 113 I 9.02 4.85 1.75 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.83 -0.04 0.00 0.00 114 G 9.14 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 0.00 0.00 0.00 115 V 8.38 4.97 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 0.59 0.00 0.00 0.89 0.00 0.00 116 D 9.01 4.72 0.00 2.78 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.01 4.05 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 0.00 118 D 8.35 4.31 0.00 2.70 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 0.00 119 S 8.54 4.39 0.00 4.01 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 0.00 120 G 8.61 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 0.00 121 D 8.18 4.67 0.00 2.66 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 0.00 122 V 8.57 3.98 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 0.83 0.00 0.00 1.35 0.00 0.00 123 V 8.99 4.12 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 0.68 0.00 0.00 0.87 0.00 0.00 124 T 7.58 5.27 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 125 T 9.34 4.51 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 1.24 0.00 0.00 126 R 7.76 4.53 0.00 1.75 1.81 0.00 3.12 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 127 A 7.69 4.18 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 0.00 128 R 7.67 3.38 0.00 1.41 1.57 0.00 2.95 0.00 0.00 2.79 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.07 0.00 129 A 7.52 3.91 1.19 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 0.00 130 T 7.55 3.70 3.41 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 1.08 0.00 0.00 131 L 7.04 3.10 0.00 0.84 1.43 0.35 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 132 V 7.12 3.72 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 0.98 0.00 0.00 0.93 0.00 0.00 133 K 7.30 4.48 0.00 1.61 1.80 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.35 7.81 134 D 7.89 4.91 0.00 2.85 2.80 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 0.00 135 P 0.00 4.48 0.00 2.38 2.28 0.00 3.89 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 2.11 2.07 0.00 136 E 8.59 4.74 0.00 2.29 2.16 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 2.49 2.36 0.00 137 G 8.80 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 0.00 138 E 8.12 4.03 0.00 2.18 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 0.00 2.37 2.34 0.00 139 Q 9.03 4.56 0.00 2.47 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 140 F 7.53 2.71 0.00 2.32 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 0.00 141 P 0.00 2.97 0.00 1.50 0.60 0.00 3.67 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 142 W 7.33 3.63 0.00 3.59 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 0.00 143 K 7.93 4.22 0.00 1.62 1.74 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.38 7.81 144 D 8.75 4.60 0.00 2.57 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 0.00 145 A 8.52 4.24 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