NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4387 0.0000 0.0000 62.2676 32.6344 175.6897 2 I 3.8259 8.1961 120.8877 60.6452 37.7532 170.7941 3 V 4.5361 8.4537 118.8147 59.7053 35.0454 175.3594 4 D 4.9298 8.5263 120.5344 53.1184 39.7546 175.3537 5 T 4.6704 7.4188 114.3331 63.5077 73.5708 176.0797 6 G 3.8007 8.7058 110.8726 46.6787 0.0000 174.3716 7 S 4.6629 8.3365 117.7195 56.6441 65.5241 173.2049 8 V 4.4581 7.8979 116.0580 58.9094 35.0293 175.8191 9 A 4.1090 8.3948 125.4302 51.4076 18.8503 175.8069 10 P 4.3769 0.0000 0.0000 62.6288 32.0264 176.0102 11 L 4.5178 8.0936 119.9495 54.0995 42.7107 177.9470 12 S 4.4947 9.2805 118.8259 57.5733 65.5727 175.3342 13 A 3.9704 8.5376 124.1583 55.2413 18.1041 180.0780 14 A 3.9486 7.9058 118.9392 55.4264 18.5326 179.5708 15 E 3.9677 8.1471 117.0690 59.4769 29.4445 179.6783 16 K 3.9557 8.2413 118.5997 59.7503 32.2108 179.5095 17 T 3.8917 7.7851 115.4827 66.5682 68.3035 176.8914 18 K 4.0264 7.9415 119.8405 59.4387 32.0072 179.2854 19 I 3.9026 7.9931 120.1446 64.8363 37.1260 178.5670 20 R 4.0723 8.3557 118.8558 59.4473 29.6122 179.4553 21 S 4.1133 7.8290 113.4527 61.7340 62.5264 176.2887 22 A 4.1336 8.3684 123.6795 54.7095 17.9345 179.6196 23 W 4.1934 8.9162 127.1389 60.8483 30.9064 178.0069 24 A 4.0258 8.0906 120.8552 54.9476 17.5948 177.7711 25 P 4.0943 0.0000 0.0000 65.5882 31.6792 178.7257 26 V 3.5348 6.8991 113.5910 66.2541 31.2381 177.5386 27 Y 3.8691 7.1436 117.5075 60.0851 38.5612 177.1398 28 S 4.1704 7.5957 113.9183 60.4409 63.4077 174.0743 29 T 4.4718 7.5265 111.3600 59.5687 68.7759 174.8580 30 Y 4.1352 7.5350 121.7847 61.4099 37.5483 177.6926 31 E 4.2130 7.3272 119.5676 58.9199 29.4862 178.9391 32 T 4.1002 7.6807 115.4919 65.9234 69.0358 177.0257 33 S 4.2056 8.0259 116.6077 61.7469 62.8700 176.6591 34 G 3.9070 8.5005 108.4573 48.2442 0.0000 175.7000 35 V 3.6502 7.3860 121.0715 65.6356 31.4431 177.8997 36 D 4.3621 8.2611 118.6741 57.4127 40.7045 178.7285 37 I 3.7831 8.0818 120.5965 64.4052 37.0498 178.3410 38 L 4.1523 8.2416 121.2348 58.1936 41.9951 179.1237 39 V 3.5815 8.3220 118.7567 65.6502 31.4893 177.9953 40 K 3.9648 8.5164 119.8815 59.4403 31.9100 178.5372 41 F 4.2098 8.1113 119.5219 61.2661 39.1344 176.5184 42 F 3.7756 8.5533 120.6587 61.4380 39.0099 177.2307 43 T 3.8133 7.8867 108.2535 64.2611 68.6618 175.6159 44 S 4.5438 7.5989 113.7831 58.0504 65.1263 174.5940 45 T 4.5035 6.9324 118.0986 60.1542 68.9527 172.2268 46 P 4.0652 0.0000 0.0000 65.8284 31.6157 177.9393 47 A 4.0368 7.9642 117.3272 54.6271 18.7247 178.4334 48 A 4.1130 7.7294 117.5121 52.9735 19.1075 179.2504 49 Q 4.2333 7.7629 117.6513 58.5830 28.5151 178.1117 50 E 4.0640 8.0450 116.1073 58.1973 29.6858 177.2174 51 F 4.5219 7.9556 117.2154 57.7248 39.6555 176.2655 52 F 4.5471 8.1495 120.7285 54.3898 38.7446 173.7188 53 P 4.2543 0.0000 0.0000 65.6981 31.6551 178.8796 54 K 4.2755 7.9948 113.6507 58.0543 32.1290 177.2337 55 F 5.0003 8.4148 118.0808 56.7452 39.4507 175.6567 56 K 4.1616 7.8780 121.0925 58.5160 32.3750 175.2713 57 G 4.2801 9.0879 110.9572 45.6712 0.0000 174.2952 58 L 4.2038 7.5594 119.2267 54.9401 42.1190 175.8112 59 T 4.6814 8.2896 112.4252 62.4526 71.9103 175.0537 60 T 3.9991 7.7562 114.0208 60.7675 70.8503 174.8400 61 A 4.0572 8.5400 124.4003 54.9744 18.2193 179.7439 62 D 4.2402 7.9221 115.9789 57.4240 41.7815 177.8496 63 Q 4.0965 8.4515 119.0106 58.9055 28.7168 178.5454 64 L 3.6576 7.5353 119.5089 57.8855 41.5448 179.7590 65 K 3.8666 7.6348 116.4560 58.7659 32.0891 178.3809 66 K 4.3093 7.4580 116.9540 56.0701 33.4744 176.8846 67 S 4.1484 7.5600 115.1255 57.8280 62.9799 174.8542 68 A 4.1572 8.5888 129.0347 54.9130 18.2408 179.5494 69 D 4.5082 7.8984 117.9862 57.5167 40.9138 179.0201 70 V 3.5799 7.6139 118.2726 66.0766 31.5248 178.1026 71 R 4.0153 7.9057 117.4313 58.9857 29.9104 178.9388 72 W 4.7250 8.4569 128.2151 60.9692 30.7742 177.5477 73 H 4.0177 8.5168 117.9605 59.2164 29.2220 177.1230 74 A 4.1023 8.4055 122.6520 55.2720 18.3199 179.4923 75 E 4.1197 8.6145 117.3066 59.5653 29.6197 179.9258 76 R 3.6871 7.7950 118.1525 59.0487 30.1326 179.0836 77 I 3.7062 7.6873 119.5958 64.5431 37.2579 178.4235 78 I 3.9570 8.1500 119.5673 64.1410 37.8202 177.4236 79 N 4.5556 8.2062 116.3407 55.3315 38.4573 177.3820 80 A 3.9262 7.7252 122.3946 55.0291 18.4123 179.7350 81 V 3.3184 7.6004 116.3456 66.0808 31.4841 177.6174 82 N 3.9566 7.9717 116.2342 56.7987 38.4580 176.4922 83 D 4.2165 7.7552 119.0485 57.1312 41.1187 178.3671 84 A 3.9680 7.6020 121.1152 55.1267 18.2080 179.7698 85 V 3.2424 7.6103 116.8275 65.9690 31.2892 177.6761 86 A 4.2646 8.0120 118.4913 53.5221 18.5421 177.9455 87 S 4.6216 7.6654 112.8569 58.2509 63.5185 175.9019 88 M 4.2396 7.5014 120.7651 58.0770 31.6726 177.0466 89 D 4.6577 7.8954 115.9007 54.7146 42.0336 176.2416 90 D 4.7205 8.2317 119.2742 51.3823 41.2485 175.4061 91 T 3.8737 7.8603 116.9988 64.2803 67.7743 174.5859 92 E 3.9134 8.1116 121.2075 59.0986 29.8961 178.3637 93 K 3.9394 8.0363 119.7022 59.5668 32.2725 178.3937 94 M 3.9657 7.9672 118.5719 58.6660 32.0795 178.5145 95 S 4.0105 7.8781 114.6511 61.8054 63.0784 176.1467 96 M 3.9241 7.7043 120.8768 58.5478 31.8559 178.7484 97 K 3.8553 7.7885 118.7356 59.6358 32.3783 178.8299 98 L 3.9416 7.7083 118.6921 57.7522 41.5555 179.5978 99 R 3.9208 8.4357 118.4752 59.1484 29.9601 178.5590 100 D 4.2560 8.0049 117.8056 57.3743 41.3659 178.1576 101 L 3.9993 7.7365 120.5874 57.9619 41.9881 178.8683 102 S 4.1515 8.5283 113.8067 61.3105 62.3326 176.2753 103 G 3.5392 8.0490 108.3462 47.8105 0.0000 175.7310 104 K 3.6090 7.7358 120.3260 59.3731 31.9718 179.2155 105 H 4.3060 8.1428 116.0372 58.6585 28.4192 177.7261 106 A 3.6177 7.5129 121.6436 54.5586 18.4462 179.2800 107 K 4.0743 8.0264 115.6914 57.6479 32.4385 177.5427 108 S 4.5269 7.3887 112.2893 60.1694 64.5703 175.8419 109 F 4.5076 7.4303 116.7950 58.6815 39.4057 175.4164 110 Q 3.4914 7.9422 118.2035 56.8869 25.8987 173.7598 111 V 3.9888 7.7440 109.5529 59.3379 33.4838 176.4769 112 D 4.1907 6.9004 123.2565 53.4986 41.6334 175.3755 113 P 3.2524 0.0000 0.0000 64.5258 31.3202 178.2663 114 Q 3.8451 7.5498 117.0010 58.8060 28.7389 177.5416 115 Y 4.2893 6.9965 114.6668 59.3978 37.8970 177.3198 116 F 4.4241 7.1149 118.9720 60.8563 39.1287 177.8277 117 K 4.0662 8.1125 117.4307 59.6667 32.0167 179.2353 118 V 3.6775 7.7201 119.1910 65.9799 31.6238 177.6624 119 L 3.8064 8.1145 119.9619 57.8163 41.7801 178.5635 120 A 4.0188 8.1758 120.7326 55.0991 18.1647 179.4570 121 A 4.0135 8.1722 119.2451 55.3812 18.5087 180.0277 122 V 3.6355 7.6253 115.6216 66.3011 31.6292 178.3633 123 I 3.9041 8.0206 119.4418 64.2582 36.9189 178.3395 124 A 4.3528 8.3724 121.8530 55.2105 18.0387 179.3737 125 D 4.3335 8.2709 116.6681 57.9010 41.0398 178.8596 126 T 4.0165 7.6157 114.5834 66.6048 68.5456 176.7234 127 V 3.7302 7.6142 118.3533 64.7054 33.2782 177.0551 128 A 4.5218 7.6514 120.7000 50.2092 20.1694 174.3765 129 A 4.1896 7.8416 123.3267 53.3125 19.2559 177.7967 130 G 4.0823 8.9924 111.2566 45.7350 0.0000 173.9829 131 D 4.4212 8.0228 119.6655 54.1512 42.0550 176.7724 132 A 4.1670 8.7751 129.3931 54.9306 18.6645 179.3177 133 G 3.6793 8.1724 103.9459 48.2396 0.0000 175.5027 134 F 4.0743 8.7302 123.5049 60.8440 39.3927 177.0591 135 E 4.0479 8.1527 118.1196 59.0049 29.2613 179.2412 136 K 3.9026 8.1359 120.1638 59.2907 32.2701 178.7070 137 L 3.7957 7.5621 120.5180 58.3041 41.9095 178.8967 138 M 3.9022 7.7527 118.6523 58.0931 31.7297 178.9586 139 S 4.3253 7.7095 116.9023 61.2156 63.0007 176.4564 140 M 3.9728 7.7949 121.1535 58.4989 31.6585 178.9165 141 I 3.5810 7.3831 119.3396 64.5512 37.0932 178.3923 142 C 3.9939 8.1243 117.6010 62.7063 27.7174 176.1709 143 I 3.8443 7.8157 120.9440 64.4516 36.9852 178.2199 144 L 4.1045 7.9215 119.7933 57.5609 41.2522 179.3569 145 L 3.8869 7.8019 117.8199 56.5620 41.7575 178.5106 146 R 4.7875 7.4925 117.1388 56.1708 30.3568 178.0764 147 S 4.2197 7.9713 114.7427 60.8760 63.0205 174.9634 148 A 4.2589 8.2094 124.1652 53.3062 19.1477 176.7267 149 Y 4.1612 7.9040 117.8026 58.2468 37.9359 175.3915 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 P 0.00 4.44 0.00 2.20 2.14 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 2 I 8.20 3.83 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.68 0.90 0.00 0.00 3 V 8.45 4.54 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 0.78 0.00 0.00 0.91 0.00 0.00 4 D 8.53 4.93 0.00 2.74 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 5 T 7.42 4.67 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 6 G 8.71 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 7 S 8.34 4.66 0.00 3.76 3.66 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 8 V 7.90 4.46 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 0.75 0.00 0.00 0.88 0.00 0.00 9 A 8.39 4.11 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.38 0.00 2.03 1.99 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 11 L 8.09 4.52 0.00 1.59 1.56 0.84 0.82 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 12 S 9.28 4.49 0.00 4.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.54 3.97 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 14 A 7.91 3.95 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 15 E 8.15 3.97 0.00 2.19 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 2.34 2.36 0.00 16 K 8.24 3.96 0.00 1.94 1.86 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.70 7.81 17 T 7.79 3.89 4.44 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 1.24 0.00 0.00 18 K 7.94 4.03 0.00 2.00 1.91 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.71 7.81 19 I 7.99 3.90 2.11 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.01 1.01 0.00 0.00 20 R 8.36 4.07 0.00 2.05 2.08 0.00 3.16 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.98 0.00 21 S 7.83 4.11 0.00 4.11 3.96 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 22 A 8.37 4.13 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 23 W 8.92 4.19 0.00 3.61 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.09 4.03 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 0.00 0.00 25 P 0.00 4.09 0.00 1.98 2.08 0.00 3.85 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 2.02 2.13 0.00 26 V 6.90 3.53 1.58 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 0.71 0.00 0.00 0.81 0.00 0.00 27 Y 7.14 3.87 0.00 1.87 2.68 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 28 S 7.60 4.17 0.00 4.11 3.93 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 29 T 7.53 4.47 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 1.10 0.00 0.00 30 Y 7.53 4.14 0.00 3.13 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 7.33 4.21 0.00 1.86 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 0.00 1.68 2.00 0.00 32 T 7.68 4.10 4.17 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 0.00 0.00 0.00 1.17 0.00 0.00 33 S 8.03 4.21 0.00 3.85 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 0.00 34 G 8.50 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 35 V 7.39 3.65 2.21 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 1.01 0.00 0.00 1.02 0.00 0.00 36 D 8.26 4.36 0.00 2.91 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 37 I 8.08 3.78 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.00 1.03 0.00 0.00 38 L 8.24 4.15 0.00 1.93 1.77 1.10 0.88 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 39 V 8.32 3.58 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 0.94 0.00 0.00 0.94 0.00 0.00 40 K 8.52 3.96 0.00 2.04 2.05 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.49 7.81 41 F 8.11 4.21 0.00 3.15 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 0.00 42 F 8.55 3.78 0.00 2.96 2.97 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 43 T 7.89 3.81 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 1.36 0.00 0.00 44 S 7.60 4.54 0.00 4.05 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 45 T 6.93 4.50 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 1.24 0.00 0.00 46 P 0.00 4.07 0.00 2.06 2.00 0.00 3.50 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 47 A 7.96 4.04 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 48 A 7.73 4.11 0.67 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 0.00 0.00 49 Q 7.76 4.23 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 1.16 1.88 0.00 50 E 8.04 4.06 0.00 1.83 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 1.56 1.47 0.00 51 F 7.96 4.52 0.00 3.09 2.91 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 52 F 8.15 4.55 0.00 3.08 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.25 0.00 2.16 2.13 0.00 3.49 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 54 K 7.99 4.28 0.00 1.81 2.19 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.45 7.81 55 F 8.41 5.00 0.00 3.14 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 56 K 7.88 4.16 0.00 1.83 1.84 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.74 7.81 57 G 9.09 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 0.00 0.00 0.00 0.00 58 L 7.56 4.20 0.00 1.77 1.50 0.84 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.29 4.68 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 1.26 0.00 0.00 60 T 7.76 4.00 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 61 A 8.54 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 62 D 7.92 4.24 0.00 2.67 2.68 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 63 Q 8.45 4.10 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 64 L 7.54 3.66 0.00 1.68 1.42 0.86 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.63 3.87 0.00 1.72 1.86 0.00 1.66 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 1.44 1.67 7.81 66 K 7.46 4.31 0.00 1.87 1.82 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.50 7.81 67 S 7.56 4.15 0.00 3.73 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.59 4.16 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 69 D 7.90 4.51 0.00 2.87 3.06 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 70 V 7.61 3.58 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 0.72 0.00 0.00 -0.18 0.00 0.00 71 R 7.91 4.02 0.00 2.02 2.25 0.00 3.21 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 72 W 8.46 4.73 0.00 3.47 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 H 8.52 4.02 0.00 3.60 3.66 0.00 5.66 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.41 4.10 1.53 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 75 E 8.61 4.12 0.00 2.52 2.29 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 2.82 2.62 0.00 76 R 7.80 3.69 0.00 1.62 1.68 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 77 I 7.69 3.71 2.07 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.27 0.98 0.00 0.00 78 I 8.15 3.96 2.25 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 1.15 0.00 0.00 79 N 8.21 4.56 0.00 2.96 2.80 0.00 0.00 6.81 7.36 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 80 A 7.73 3.93 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 81 V 7.60 3.32 2.29 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 0.49 0.00 0.00 0.95 0.00 0.00 82 N 7.97 3.96 0.00 2.92 2.81 0.00 0.00 7.26 8.57 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 83 D 7.76 4.22 0.00 2.81 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 84 A 7.60 3.97 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 7.61 3.24 1.70 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 0.81 0.00 0.00 -0.05 0.00 0.00 86 A 8.01 4.26 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 87 S 7.67 4.62 0.00 3.88 3.93 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 88 M 7.50 4.24 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.40 0.00 89 D 7.90 4.66 0.00 2.64 2.68 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 90 D 8.23 4.72 0.00 2.56 2.44 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 91 T 7.86 3.87 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 92 E 8.11 3.91 0.00 2.05 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 2.35 2.33 0.00 93 K 8.04 3.94 0.00 1.90 1.89 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.41 7.81 94 M 7.97 3.97 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 95 S 7.88 4.01 0.00 4.05 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 96 M 7.70 3.92 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.54 0.00 97 K 7.79 3.86 0.00 1.96 1.75 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.46 7.81 98 L 7.71 3.94 0.00 1.74 1.58 0.79 1.03 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 99 R 8.44 3.92 0.00 1.75 1.94 0.00 3.09 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 100 D 8.00 4.26 0.00 2.91 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 0.00 101 L 7.74 4.00 0.00 1.97 1.81 1.04 0.69 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 0.00 102 S 8.53 4.15 0.00 3.97 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 0.00 103 G 8.05 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 0.00 0.00 0.00 104 K 7.74 3.61 0.00 1.73 0.99 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.26 1.53 7.81 105 H 8.14 4.31 0.00 3.68 3.86 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.51 3.62 0.28 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 0.00 107 K 8.03 4.07 0.00 1.61 1.76 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.30 7.81 108 S 7.39 4.53 0.00 3.26 3.72 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 0.00 109 F 7.43 4.51 0.00 3.15 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 0.00 110 Q 7.94 3.49 0.00 2.30 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 111 V 7.74 3.99 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 0.78 0.00 0.00 1.03 0.00 0.00 112 D 6.90 4.19 0.00 2.32 2.35 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 0.00 113 P 0.00 3.25 0.00 1.70 0.49 0.00 3.48 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.46 0.00 114 Q 7.55 3.85 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.03 0.00 0.00 0.00 0.00 0.00 1.73 1.16 0.00 115 Y 7.00 4.29 0.00 3.06 3.28 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 0.00 116 F 7.11 4.42 0.00 3.11 2.92 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 0.00 117 K 8.11 4.07 0.00 2.00 2.09 0.00 1.50 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.49 7.81 118 V 7.72 3.68 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 1.44 0.00 0.00 1.06 0.00 0.00 119 L 8.11 3.81 0.00 0.47 1.33 0.76 0.91 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 0.00 120 A 8.18 4.02 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 0.00 121 A 8.17 4.01 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 3.64 2.34 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 1.19 0.00 0.00 1.19 0.00 0.00 123 I 8.02 3.90 2.21 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.01 1.29 0.00 0.00 124 A 8.37 4.35 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.27 4.33 0.00 2.85 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 0.00 126 T 7.62 4.02 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 127 V 7.61 3.73 1.47 0.00 0.00 0.00 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 1.31 0.00 0.00 128 A 7.65 4.52 1.01 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 0.00 0.00 129 A 7.84 4.19 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 0.00 130 G 8.99 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 0.00 0.00 0.00 131 D 8.02 4.42 0.00 2.86 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 0.00 132 A 8.78 4.17 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 0.00 133 G 8.17 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 0.00 134 F 8.73 4.07 0.00 3.31 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 0.00 135 E 8.15 4.05 0.00 2.26 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 2.42 2.63 0.00 136 K 8.14 3.90 0.00 1.90 1.94 0.00 1.60 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.40 7.81 137 L 7.56 3.80 0.00 1.48 1.29 0.37 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 138 M 7.75 3.90 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.29 0.00 139 S 7.71 4.33 0.00 4.02 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 0.00 140 M 7.79 3.97 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.51 0.00 141 I 7.38 3.58 1.85 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.55 0.73 0.00 0.00 142 C 8.12 3.99 0.00 2.92 2.97 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 0.00 143 I 7.82 3.84 1.94 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 1.48 0.57 0.93 0.00 0.00 144 L 7.92 4.10 0.00 1.59 1.62 0.83 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 145 L 7.80 3.89 0.00 1.18 0.35 0.27 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.49 4.79 0.00 1.84 1.99 0.00 3.29 0.00 0.00 3.47 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.92 0.00 147 S 7.97 4.22 0.00 4.03 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 0.00 148 A 8.21 4.26 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 0.00 149 Y 7.90 4.16 0.00 3.16 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