NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 K 4.2901 8.3149 119.9969 56.6049 33.6239 175.9498 13 K 3.9663 8.8465 122.1030 56.1884 33.3026 176.7434 14 A 4.0416 8.3567 122.7015 55.6057 18.8453 178.5131 15 S 4.2673 7.7421 109.7067 59.6653 63.0461 175.2752 16 D 4.7236 7.7179 122.1275 54.9164 41.9420 177.9648 17 V 3.9613 8.1277 118.6652 64.6659 31.9929 177.4899 18 A 4.0117 7.9511 120.1818 55.3171 18.0404 178.7413 19 D 4.4854 8.0889 114.1709 55.9993 41.0263 177.2962 20 L 4.5276 7.7447 119.2757 56.3893 43.4058 178.6167 21 L 4.1410 7.7553 117.7356 57.0672 41.4400 179.2648 22 Q 3.9514 8.1060 120.1955 59.1015 28.8830 177.8548 23 K 4.4789 7.6562 115.5946 56.5325 31.9565 177.1328 24 Q 4.2920 7.5107 120.6297 56.1486 31.5113 177.5501 25 L 3.9450 7.9318 119.6085 58.1259 41.5968 178.8290 26 S 4.2235 8.4964 113.4135 61.1573 62.1978 176.0759 27 T 4.2897 7.8543 118.3775 67.2185 68.2962 175.8588 28 Y 4.4201 7.3284 118.2873 61.0367 37.8474 178.4831 29 N 4.3619 8.3059 117.5309 56.5659 38.7650 177.0844 30 D 4.4289 8.9091 119.4021 56.7811 41.3796 177.9866 31 L 3.8880 8.0552 121.6996 58.3383 42.2038 178.5352 32 H 4.1254 8.6863 115.5012 58.6485 28.3265 177.2645 33 L 3.8753 7.5946 122.8861 57.8985 41.8293 179.1066 34 T 3.7183 7.4159 114.5873 66.0564 68.3638 176.3812 35 L 3.7615 7.4483 120.6817 57.9116 41.7988 179.3296 36 K 3.1914 7.4616 118.3729 59.5905 31.7699 177.8625 37 H 3.6288 6.8997 117.0479 59.2818 29.9759 177.0107 38 V 3.4940 7.8114 120.8878 65.1065 30.9152 177.5871 39 H 4.1520 8.1350 118.0491 58.1758 29.5990 176.1044 40 W 4.9578 7.3991 117.8191 57.1010 29.2954 176.1710 41 N 4.9834 8.6510 116.1065 53.3105 41.6599 174.3462 42 V 3.9871 7.9680 111.3056 62.2931 32.1218 176.2195 43 V 3.9549 9.0328 118.3377 59.8836 36.3640 174.9359 44 G 4.3667 9.4307 108.0260 42.9028 0.0000 172.4109 45 P 4.0262 0.0000 0.0000 65.4520 31.9183 177.5407 46 N 4.9469 7.8030 114.5018 53.3038 39.8619 177.9087 47 F 4.3369 8.2691 116.8282 60.2554 38.0197 176.2324 48 I 3.3663 6.7679 119.8023 63.5169 36.1517 178.0470 49 G 3.7847 7.8313 106.9262 48.0250 0.0000 175.6869 50 V 3.6723 7.8270 120.5880 65.7946 31.5296 177.2342 51 H 4.0078 8.1613 115.7782 59.4461 28.4356 177.5109 52 E 4.0563 8.5714 118.7547 58.7924 28.0779 178.4177 53 M 4.2510 7.6526 115.3675 56.6217 31.8492 178.6219 54 I 3.8645 7.8985 121.4360 64.3084 37.3111 177.5111 55 D 4.3924 7.7861 120.1154 57.1533 40.8627 177.5612 56 P 4.1653 0.0000 0.0000 65.5300 30.9917 178.3417 57 Q 3.4801 7.3749 117.3414 58.8980 28.9761 177.8485 58 V 3.4499 8.2070 120.3496 66.3642 31.4036 177.9300 59 E 3.8422 7.7582 118.0300 59.0251 29.4335 179.0602 60 L 3.5742 7.3694 119.9985 58.1341 42.1368 179.3504 61 V 2.9798 8.3373 118.8297 65.5856 31.4229 178.2109 62 R 3.9425 7.7980 118.2527 58.9567 29.7461 179.0745 63 G 3.6652 8.1391 105.4699 47.2379 0.0000 174.9202 64 Y 4.3867 7.1524 117.3511 60.0709 37.9668 177.5549 65 A 4.3596 7.8478 121.2058 55.3371 18.7477 179.2049 66 D 4.4660 8.0698 116.7306 57.7621 41.1409 178.5871 67 E 4.0968 8.0088 119.0803 59.2691 29.2058 179.0472 68 V 4.3219 7.6335 109.1226 61.2044 32.6149 176.4123 69 A 4.6422 8.5106 124.8416 53.3134 21.1488 179.8190 70 E 4.1283 8.1704 115.0687 59.5313 29.8481 178.8902 71 R 5.0738 7.3502 114.3912 56.1835 29.8774 177.6730 72 I 4.4081 7.6945 118.5458 61.9564 40.3511 177.9758 73 A 4.8269 7.9446 122.1147 54.7731 18.5151 179.5052 74 T 4.0232 8.5084 108.6699 64.8878 68.6851 176.9475 75 L 4.6359 7.8801 120.0101 53.4946 43.2429 176.6735 76 G 3.7863 7.8365 109.5153 45.2434 0.0000 173.3282 77 K 4.0203 7.1979 126.1394 56.6744 36.3377 173.3371 78 S 4.6282 8.3520 116.0665 55.6511 64.4543 172.3994 79 P 4.4185 0.0000 0.0000 62.3350 31.6651 176.3608 80 K 4.2333 8.8270 123.6979 55.4404 31.9365 178.0473 81 G 4.0683 8.3502 118.7717 44.6908 0.0000 170.7018 82 T 4.7112 7.1214 107.1454 58.7307 72.3862 172.4303 83 P 4.2151 0.0000 0.0000 65.9475 32.0129 178.8304 84 G 3.8037 8.3461 105.8169 49.0217 0.0000 175.7453 85 A 4.4525 7.4512 118.7079 52.1300 17.5902 177.9423 86 I 4.5870 8.7370 119.5662 63.3633 40.3064 178.3096 87 I 3.7337 7.3421 112.1147 63.5428 37.6293 177.7977 88 K 4.0120 8.0386 120.1863 59.2871 32.3443 177.8837 89 D 4.6419 7.7040 116.5448 52.9754 39.7443 175.3444 90 R 3.0868 7.1613 119.9510 56.6136 30.1598 176.0426 91 T 4.3592 6.9155 114.3568 60.8373 69.3359 173.8825 92 W 5.1243 6.5772 118.1002 55.6603 30.7859 173.1476 93 D 5.0683 8.7331 116.0317 52.2831 43.4757 175.8118 94 D 4.4954 8.6130 123.3197 54.1790 41.7089 175.4219 95 Y 4.0407 8.8756 127.7314 58.0914 39.0269 175.8927 96 S 4.8512 8.0697 120.1211 57.7253 63.8040 173.9120 97 V 3.6951 7.1851 121.3753 63.1575 31.9564 176.1071 98 E 4.3978 8.4436 128.7469 55.8898 31.1675 175.9942 99 R 4.1354 8.5449 121.6211 58.2230 29.6366 176.4142 100 D 4.8819 8.7557 123.5445 52.2018 45.8615 174.1758 101 T 4.8892 8.4629 116.0998 61.6510 68.3791 174.8492 102 V 3.6472 8.8483 125.9951 66.5812 31.1616 178.0318 103 Q 4.0336 8.2568 115.2696 60.0183 28.8398 178.6483 104 A 4.0179 8.1740 121.6292 53.9728 18.2462 178.9557 105 H 4.2047 8.0228 113.3487 58.1862 29.0304 177.3114 106 L 3.9425 8.0272 120.3453 58.4232 42.0179 178.5027 107 A 4.1122 7.9994 120.6196 54.9408 18.1184 179.0964 108 A 4.0256 7.9047 117.4235 53.8300 18.4650 178.3800 109 L 4.6059 7.9631 118.4135 56.1496 42.4977 177.9868 110 D 4.3342 8.3154 118.8257 57.3715 41.2262 177.9026 111 L 3.9615 7.9293 118.9390 57.9524 41.7848 179.2130 112 V 3.5485 7.4683 116.7159 66.6958 31.2706 177.7439 113 Y 3.7887 8.0459 116.2399 60.7460 37.7254 177.6808 114 N 4.3917 8.5197 118.4528 56.7522 39.0531 177.2010 115 G 3.5163 8.1727 107.0687 47.6586 0.0000 175.8563 116 V 3.3410 7.3650 120.1926 65.7806 31.1689 178.1339 117 I 3.9332 8.0360 119.0423 63.2945 36.8585 178.1003 118 E 3.9637 7.9337 121.0345 59.2355 29.5627 178.2621 119 D 4.3576 8.1552 118.8495 57.8938 40.7785 178.9408 120 T 4.1299 8.2978 116.1731 66.1880 68.3152 176.7475 121 R 3.9534 7.4981 119.1526 58.8802 30.3634 178.7207 122 K 3.9081 8.0523 117.9726 59.6781 32.0645 179.5233 123 S 4.0994 8.4590 115.5280 61.7714 62.5827 176.6157 124 I 3.6898 6.9954 120.5426 64.8780 36.9857 178.0701 125 E 4.2385 8.0176 117.6696 58.6679 29.3947 178.2881 126 K 4.3720 8.3217 117.5080 56.5989 31.5372 176.6020 127 L 4.8370 7.3801 117.6495 54.9876 43.4353 178.4389 128 E 4.1301 8.5668 118.9745 58.4800 29.0248 178.6505 129 D 4.7569 8.6922 124.3959 53.2239 38.8423 176.0612 130 L 4.5637 6.8998 116.2923 55.3848 46.0695 176.6574 131 D 4.8043 6.7964 118.6055 53.5676 43.0750 176.2906 132 L 4.6755 8.3645 121.7947 54.3742 44.2437 178.0821 133 V 4.1930 7.8137 116.6122 63.8974 33.0780 176.8818 134 S 3.9911 7.9721 112.9658 61.5787 62.0672 176.0527 135 Q 3.9294 8.0144 121.3627 59.5249 28.6659 177.9991 136 D 4.4643 7.8620 117.8785 56.7367 41.2913 178.1838 137 L 3.9760 8.7061 122.0618 58.0299 42.1352 178.5422 138 L 3.8062 8.0544 120.5711 58.3518 41.8917 178.7050 139 I 3.6352 8.1403 119.7604 64.5238 36.9424 177.9878 140 A 3.9394 7.6745 121.0073 55.5506 18.0770 179.4462 141 H 3.8911 7.7769 113.7887 58.7752 28.8346 177.4315 142 A 4.3341 8.2047 122.8397 55.3039 17.9429 179.7024 143 G 3.6998 8.3879 102.8193 48.2036 0.0000 175.4737 144 E 4.2978 8.9899 122.5512 59.0653 29.4714 179.1473 145 L 4.2794 9.0161 120.1681 58.1992 41.6043 179.4595 146 E 4.0357 8.3475 118.2052 59.5948 29.4327 179.4485 147 K 5.0362 8.2509 118.3345 59.9595 32.1657 179.1103 148 F 4.3504 8.2034 119.3962 61.2542 38.5867 176.7126 149 Q 3.6581 8.0684 119.1011 60.0185 28.9234 178.2625 150 W 4.3098 8.0772 117.5273 60.2504 28.9231 177.6942 151 F 3.8326 8.2029 121.0721 61.6890 39.0887 177.6388 152 V 3.5557 7.7132 116.9326 65.8087 31.5861 177.9339 153 R 4.1140 9.3661 117.2587 57.9053 29.7384 178.5485 154 A 4.4684 7.5042 121.4629 51.7598 19.1405 176.6953 155 H 4.6332 8.4487 119.1697 58.3245 30.3719 175.8510 156 L 4.8096 7.5332 115.2990 53.4586 41.9935 177.0254 157 E 4.2553 7.6796 121.0819 56.5796 30.4759 176.2202 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 12 K 8.31 4.29 0.00 1.88 1.74 0.00 1.53 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.47 7.81 13 K 8.85 3.97 0.00 1.92 1.87 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.50 7.81 14 A 8.36 4.04 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 15 S 7.74 4.27 0.00 3.85 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 16 D 7.72 4.72 0.00 2.75 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 17 V 8.13 3.96 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 1.02 0.00 0.00 1.01 0.00 0.00 18 A 7.95 4.01 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 19 D 8.09 4.49 0.00 2.62 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 20 L 7.74 4.53 0.00 1.81 1.65 0.92 0.45 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 21 L 7.76 4.14 0.00 1.68 1.72 0.93 0.83 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 22 Q 8.11 3.95 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.02 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 23 K 7.66 4.48 0.00 1.74 1.78 0.00 1.82 0.00 0.00 2.22 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.39 7.81 24 Q 7.51 4.29 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.82 0.00 0.00 0.00 0.00 0.00 2.13 1.89 0.00 25 L 7.93 3.95 0.00 2.01 1.88 1.02 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.50 4.22 0.00 3.89 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 27 T 7.85 4.29 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 1.06 0.00 0.00 28 Y 7.33 4.42 0.00 3.18 2.95 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 29 N 8.31 4.36 0.00 3.05 2.90 0.00 0.00 6.61 7.51 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 30 D 8.91 4.43 0.00 2.94 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 31 L 8.06 3.89 0.00 1.81 1.81 0.78 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 32 H 8.69 4.13 0.00 3.28 3.59 0.00 5.52 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.59 3.88 0.00 1.80 1.60 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.42 3.72 4.37 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 0.68 0.00 0.00 35 L 7.45 3.76 0.00 1.84 1.59 1.09 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.46 3.19 0.00 1.47 0.79 0.00 1.27 0.00 0.00 1.43 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 0.96 7.81 37 H 6.90 3.63 0.00 2.89 3.28 0.00 6.01 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.81 3.49 1.81 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 0.67 0.00 0.00 0.82 0.00 0.00 39 H 8.14 4.15 0.00 3.02 3.09 0.00 5.74 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 W 7.40 4.96 0.00 3.57 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 41 N 8.65 4.98 0.00 2.61 3.08 0.00 0.00 6.94 7.59 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 42 V 7.97 3.99 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 0.74 0.00 0.00 1.13 0.00 0.00 43 V 9.03 3.95 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 0.46 0.00 0.00 0.93 0.00 0.00 44 G 9.43 4.37 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 0.00 45 P 0.00 4.03 0.00 2.09 2.09 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.20 0.00 46 N 7.80 4.95 0.00 2.80 2.80 0.00 0.00 6.66 8.13 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 47 F 8.27 4.34 0.00 3.27 3.51 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 0.00 48 I 6.77 3.37 1.47 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 -0.17 0.77 0.00 0.00 49 G 7.83 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 50 V 7.83 3.67 2.28 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 1.12 0.00 0.00 1.01 0.00 0.00 51 H 8.16 4.01 0.00 3.34 3.38 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.57 4.06 0.00 2.06 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 2.47 0.00 53 M 7.65 4.25 0.00 2.30 2.20 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.76 0.00 54 I 7.90 3.86 1.92 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 1.65 1.17 0.86 0.00 0.00 55 D 7.79 4.39 0.00 2.62 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 56 P 0.00 4.17 0.00 2.14 2.22 0.00 3.60 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 2.11 2.01 0.00 57 Q 7.37 3.48 0.00 1.32 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.67 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 58 V 8.21 3.45 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.82 0.00 0.00 59 E 7.76 3.84 0.00 1.84 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 2.23 2.38 0.00 60 L 7.37 3.57 0.00 1.71 1.47 0.51 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.34 2.98 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 0.87 0.00 0.00 0.66 0.00 0.00 62 R 7.80 3.94 0.00 1.90 1.84 0.00 3.25 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.49 0.00 63 G 8.14 3.67 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 0.00 64 Y 7.15 4.39 0.00 2.45 1.74 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 65 A 7.85 4.36 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.07 4.47 0.00 2.84 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 67 E 8.01 4.10 0.00 2.10 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 0.00 2.41 2.83 0.00 68 V 7.63 4.32 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 1.08 0.00 0.00 1.13 0.00 0.00 69 A 8.51 4.64 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 70 E 8.17 4.13 0.00 2.07 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 2.42 2.51 0.00 71 R 7.35 5.07 0.00 1.89 1.96 0.00 3.07 0.00 0.00 3.08 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 72 I 7.69 4.41 2.06 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 1.35 0.85 0.95 0.00 0.00 73 A 7.94 4.83 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 74 T 8.51 4.02 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 75 L 7.88 4.64 0.00 1.64 1.73 0.97 0.89 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 76 G 7.84 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 77 K 7.20 4.02 0.00 1.79 1.69 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.18 1.32 7.81 78 S 8.35 4.63 0.00 3.85 3.76 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 79 P 0.00 4.42 0.00 2.19 2.07 0.00 3.76 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 2.00 2.30 0.00 80 K 8.83 4.23 0.00 1.78 1.82 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.37 7.81 81 G 8.35 4.07 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 0.00 0.00 0.00 82 T 7.12 4.71 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 83 P 0.00 4.22 0.00 2.20 2.12 0.00 3.63 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 2.13 2.13 0.00 84 G 8.35 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 85 A 7.45 4.45 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 86 I 8.74 4.59 2.05 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 0.98 2.01 0.90 0.00 0.00 87 I 7.34 3.73 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.55 0.88 0.00 0.00 88 K 8.04 4.01 0.00 1.71 1.85 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.48 7.81 89 D 7.70 4.64 0.00 2.70 2.78 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 90 R 7.16 3.09 0.00 1.74 1.49 0.00 3.15 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.04 0.00 91 T 6.92 4.36 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 1.12 0.00 0.00 92 W 6.58 5.12 0.00 3.34 3.27 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 93 D 8.73 5.07 0.00 2.68 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 94 D 8.61 4.50 0.00 2.73 2.63 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 95 Y 8.88 4.04 0.00 3.14 2.78 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 96 S 8.07 4.85 0.00 3.98 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 97 V 7.19 3.70 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 0.62 0.00 0.00 0.56 0.00 0.00 98 E 8.44 4.40 0.00 2.04 1.96 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 2.36 2.27 0.00 99 R 8.54 4.14 0.00 1.85 1.92 0.00 3.36 0.00 0.00 3.13 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 100 D 8.76 4.88 0.00 2.85 2.33 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 0.00 101 T 8.46 4.89 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 1.25 0.00 0.00 102 V 8.85 3.65 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.05 0.00 0.00 103 Q 8.26 4.03 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.87 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 104 A 8.17 4.02 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 0.00 105 H 8.02 4.20 0.00 3.25 3.49 0.00 5.91 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.03 3.94 0.00 1.79 1.39 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.00 4.11 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 0.00 108 A 7.90 4.03 1.18 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 0.00 0.00 109 L 7.96 4.61 0.00 2.25 1.94 1.07 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.32 4.33 0.00 2.89 2.86 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 0.00 111 L 7.93 3.96 0.00 1.74 1.71 0.91 0.83 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 0.00 112 V 7.47 3.55 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 0.97 0.00 0.00 1.22 0.00 0.00 113 Y 8.05 3.79 0.00 3.34 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 0.00 114 N 8.52 4.39 0.00 3.00 2.92 0.00 0.00 7.08 8.04 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 0.00 115 G 8.17 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.37 3.34 1.75 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 0.95 0.00 0.00 0.42 0.00 0.00 117 I 8.04 3.93 1.88 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 1.47 1.16 0.91 0.00 0.00 118 E 7.93 3.96 0.00 2.22 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 2.31 2.34 0.00 119 D 8.16 4.36 0.00 2.89 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 0.00 120 T 8.30 4.13 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 1.29 0.00 0.00 121 R 7.50 3.95 0.00 2.10 1.96 0.00 3.13 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 122 K 8.05 3.91 0.00 1.82 1.87 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.61 7.81 123 S 8.46 4.10 0.00 3.92 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 0.00 124 I 7.00 3.69 2.13 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 1.52 0.47 0.91 0.00 0.00 125 E 8.02 4.24 0.00 2.20 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 2.34 2.38 0.00 126 K 8.32 4.37 0.00 1.84 1.91 0.00 1.74 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 1.43 1.47 7.81 127 L 7.38 4.84 0.00 1.74 1.58 0.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.57 4.13 0.00 1.95 1.76 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 2.32 2.35 0.00 129 D 8.69 4.76 0.00 2.78 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 0.00 130 L 6.90 4.56 0.00 1.57 1.47 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 131 D 6.80 4.80 0.00 2.62 2.54 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 0.00 132 L 8.36 4.68 0.00 1.63 1.66 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.81 4.19 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 1.07 0.00 0.00 0.93 0.00 0.00 134 S 7.97 3.99 0.00 3.87 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 0.00 135 Q 8.01 3.93 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 136 D 7.86 4.46 0.00 2.76 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 0.00 137 L 8.71 3.98 0.00 1.62 1.79 0.92 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.05 3.81 0.00 2.00 1.73 1.01 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 139 I 8.14 3.64 2.06 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.53 0.90 0.00 0.00 140 A 7.67 3.94 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 0.00 141 H 7.78 3.89 0.00 3.31 3.22 0.00 5.67 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 0.00 142 A 8.20 4.33 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 0.00 143 G 8.39 3.70 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 0.00 0.00 0.00 144 E 8.99 4.30 0.00 2.21 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 2.70 2.73 0.00 145 L 9.02 4.28 0.00 1.83 1.94 1.08 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.35 4.04 0.00 2.36 1.73 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 2.19 2.39 0.00 147 K 8.25 5.04 0.00 2.33 2.21 0.00 2.07 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.19 0.00 0.00 0.00 0.00 2.04 2.16 7.81 148 F 8.20 4.35 0.00 3.22 3.16 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 0.00 149 Q 8.07 3.66 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.35 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 150 W 8.08 4.31 0.00 3.79 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 0.00 151 F 8.20 3.83 0.00 3.20 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 0.00 152 V 7.71 3.56 1.80 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 0.69 0.00 0.00 -0.41 0.00 0.00 153 R 9.37 4.11 0.00 2.12 1.96 0.00 3.14 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 154 A 7.50 4.47 1.21 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 0.00 0.00 155 H 8.45 4.63 0.00 3.15 3.26 0.00 5.71 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 L 7.53 4.81 0.00 1.59 1.53 0.94 0.86 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 0.00 157 E 7.68 4.26 0.00 1.92 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 0.00 2.19 2.28 0.00