NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 4.1477 8.2127 108.0232 45.4834 0.0000 173.0736 3 D 5.0512 7.8162 124.4784 52.1298 43.7486 173.2036 4 K 5.1223 8.7523 116.4547 55.6814 36.8322 174.5380 5 T 4.6557 8.8124 114.1591 61.2571 71.4788 171.8162 6 K 5.1634 8.4964 122.8234 54.8328 34.5847 176.6200 7 V 4.5410 8.6635 116.1296 59.3666 36.4860 174.7727 8 Q 4.4265 8.7652 125.6636 56.0532 29.9181 176.9986 9 V 3.5861 9.1713 125.9491 66.1966 31.6141 178.3035 10 S 4.2164 7.7068 113.1137 60.5901 62.8326 175.1311 11 K 4.2685 7.8702 119.0492 56.8993 32.4319 177.2124 12 L 4.2234 7.3596 119.0633 54.7126 42.3208 176.6394 13 K 4.6556 8.1081 119.4135 53.7880 36.1534 174.4234 14 P 4.5218 0.0000 0.0000 64.1153 31.8588 175.3958 15 G 3.9734 8.9077 109.8531 45.7034 0.0000 174.1516 16 R 4.2063 7.5378 117.8999 55.3004 32.1884 174.3368 17 Y 5.3008 8.1786 114.5743 57.1796 41.9551 174.7882 18 I 4.6952 9.0082 119.8843 59.9599 42.3044 173.3628 19 I 4.9201 8.8228 127.9292 59.7210 38.9494 175.4831 20 I 4.3719 8.2814 127.9567 60.3526 39.8655 175.5715 21 D 4.6748 9.3710 126.6922 56.0004 37.7732 173.8297 22 D 4.4022 8.1931 113.2985 54.8012 39.4363 173.3979 23 E 4.7132 7.7352 120.8484 53.4502 31.2010 173.0324 24 P 5.0130 0.0000 0.0000 63.0303 32.8209 174.9849 25 C 5.3524 9.5803 121.1362 57.7702 32.6899 173.0251 26 R 4.2078 8.8796 123.4083 55.5917 31.1251 175.5721 27 I 4.1058 8.4424 128.4108 61.7003 37.6546 176.8111 28 V 4.3295 8.4875 119.3987 61.1449 33.5717 175.4424 29 N 4.7413 7.6155 117.4443 52.6209 42.3710 173.0065 30 I 4.9788 8.3875 125.7397 59.9442 40.9627 174.5540 31 T 4.5791 9.1007 124.2078 61.6350 71.3641 173.1223 32 V 4.8352 8.3085 126.6707 60.8901 33.2355 175.5484 33 S 4.5171 8.6478 123.2520 57.6219 64.3566 174.1516 34 S 4.2146 8.4620 116.4699 57.8662 62.9418 173.1414 35 P 4.5177 0.0000 0.0000 62.5091 31.9110 176.5912 36 G 3.9710 8.9881 111.4050 44.1627 0.0000 174.5977 37 K 4.0166 8.4692 118.2307 59.3763 31.8873 177.9576 38 H 4.4905 7.7134 112.0066 55.8674 29.1551 176.0857 39 G 4.0488 8.6444 108.9774 45.3172 0.0000 174.3464 40 S 4.2572 7.8683 115.5502 58.6974 63.6669 172.6822 41 A 4.9607 8.1039 122.9574 50.6921 22.9817 174.9007 42 K 5.0034 8.4656 117.9207 54.6382 34.9631 175.4258 43 A 5.2510 9.2740 125.5654 50.1081 22.2554 174.9695 44 R 4.9430 9.1430 122.2168 54.6047 32.6685 174.6491 45 I 4.9935 9.0509 127.3314 59.5771 40.2007 174.2432 46 E 5.2062 9.0925 126.1944 54.6962 32.0775 174.9868 47 A 5.0238 9.3286 124.6204 50.4183 23.5508 174.9001 48 V 4.5904 8.6104 120.6349 60.6081 34.0021 175.3500 49 G 4.1048 8.8764 116.1474 46.7875 0.0000 174.3964 50 I 3.8476 8.7010 119.5650 63.1346 38.0473 177.2184 51 F 4.9111 8.1248 118.8016 59.4730 39.5806 176.4817 52 D 4.5564 8.6334 116.7724 52.8171 39.7117 176.9482 53 G 3.9087 8.0719 107.4201 46.0600 0.0000 173.4521 54 K 4.2051 8.6581 122.5437 55.9210 33.4085 175.9900 55 V 4.4682 8.3721 127.6036 62.5954 32.4019 175.1683 56 R 4.8587 9.4761 126.4344 54.4355 34.1328 174.4140 57 S 5.3171 8.5890 115.3300 56.6688 65.6697 172.9306 58 I 4.8200 9.0877 118.9432 59.2741 41.4824 173.8571 59 V 4.9323 8.3071 122.3183 61.2530 33.9572 174.7328 60 K 4.7669 9.1424 125.9610 54.1183 37.2063 174.2330 61 P 4.5671 0.0000 0.0000 62.7363 31.9639 177.7573 62 T 3.9661 8.8848 116.7634 64.2818 67.3835 175.6076 63 S 4.4732 7.8970 113.4576 58.7070 63.9096 173.7914 64 A 4.4535 7.8041 124.1899 51.7924 20.0628 176.0203 65 E 5.1453 8.5861 117.8496 54.8393 32.2102 176.1803 66 V 4.6207 8.4913 115.0390 59.5137 36.5309 174.3774 67 D 5.0997 8.5366 121.8394 54.1018 42.3041 176.0513 68 V 4.8937 9.0462 116.1124 58.8685 35.7041 172.9878 69 P 4.9662 0.0000 0.0000 62.2247 33.0791 175.0509 70 I 4.3056 9.0158 123.9218 60.0755 38.8851 174.5180 71 I 4.7012 8.1212 127.8322 59.6649 38.9648 174.7010 72 D 4.8660 8.7938 126.2677 52.3589 43.7336 175.1732 73 K 4.7968 8.3122 121.5791 54.7351 34.2534 175.5596 74 K 4.5466 8.4982 123.1489 55.1052 37.1680 174.9067 75 T 5.2733 8.1421 116.1503 62.3794 71.7515 173.4280 76 A 4.7065 8.7577 124.5356 51.4990 23.7300 174.5008 77 Q 5.0415 8.9590 120.5192 54.1623 32.0431 174.8692 78 V 4.2976 8.9651 127.1407 63.1108 32.0970 176.0192 79 I 4.5940 8.4605 120.4747 60.7404 39.1891 175.5060 80 A 4.5850 7.4799 122.8714 51.1621 22.4140 175.1230 81 I 4.9614 8.4260 121.9828 59.8364 40.4191 175.0083 82 T 4.7045 8.8534 122.2177 60.6573 71.8801 173.3650 83 P 4.0646 0.0000 0.0000 65.3154 31.4178 177.1326 84 D 5.1047 8.0785 114.7525 53.9941 43.2051 175.4348 85 T 5.2964 7.7797 108.6648 60.0454 73.2976 173.0012 86 V 4.9001 8.7365 120.3217 60.0277 35.0886 174.0235 87 Q 5.1597 9.3218 125.3994 54.2112 31.8648 174.1177 88 I 5.1172 9.0552 119.2176 59.4025 41.4387 173.9102 89 M 5.1859 9.0522 122.1909 53.9694 36.2345 173.6275 90 D 4.9545 9.1386 125.7886 53.4729 41.4993 176.6336 91 M 4.0343 8.9633 127.1180 58.6474 32.4197 178.3119 92 E 4.2086 8.4608 117.0965 59.5387 29.8906 178.1523 93 T 4.0595 8.1337 106.4574 62.3948 69.2441 174.9952 94 Y 3.5118 8.2934 121.8139 57.5490 38.4366 168.8013 95 E 4.2443 7.9964 118.6320 57.1909 30.6611 175.9617 96 T 4.8690 7.8417 111.9818 59.8346 72.2054 173.0933 97 F 4.7713 9.2105 121.7925 55.7289 42.6985 173.4388 98 E 5.1847 8.8899 123.8098 54.6142 32.4812 174.9388 99 V 4.7120 8.6244 118.2003 58.9519 36.9950 172.8111 100 P 4.7949 0.0000 0.0000 62.4655 32.0776 177.7080 101 I 3.7215 8.3799 122.6365 64.4318 37.1782 177.5557 102 D 4.5385 8.1065 118.9353 55.2062 39.6592 176.8741 103 T 4.6064 7.9909 107.7795 61.5708 70.8793 174.7924 104 G 4.0323 8.4780 110.1571 45.0979 0.0000 173.0424 105 V 4.7211 7.3663 118.5696 60.1853 34.6503 174.9082 106 A 4.0050 8.7428 130.2523 52.3883 19.2189 177.8262 107 D 4.4228 9.0006 122.5440 57.7135 41.1550 179.0733 108 E 3.9450 8.3064 116.8765 58.8053 29.6211 177.8258 109 I 4.3782 7.7720 109.3411 60.2146 38.2162 177.2269 110 R 3.8588 7.4332 121.3653 59.3992 29.9016 176.9624 111 D 4.9258 7.9818 114.1977 54.1083 41.4863 175.9032 112 Q 4.5653 8.2040 114.5730 54.8893 29.7875 175.9277 113 L 4.2864 7.6796 118.8657 54.2134 42.2665 176.1375 114 K 4.6543 8.1710 122.5375 54.1960 35.5159 175.0929 115 E 4.1837 8.5519 122.6739 57.6017 30.2059 176.9996 116 G 4.0483 9.3041 110.8042 45.0181 0.0000 173.7164 117 I 4.3046 7.3328 113.1435 60.1252 39.7777 174.7318 118 N 5.3135 8.5971 121.3027 52.6424 40.5002 174.5120 119 V 4.9183 8.9555 115.7940 59.5343 36.6012 173.9245 120 E 5.0511 9.2520 124.4462 55.1434 31.0560 174.4754 121 Y 5.3331 8.8265 124.9511 55.0745 41.7008 174.4010 122 W 5.3858 9.3758 120.8514 55.2564 32.2207 174.7301 123 E 5.3141 9.0014 123.5585 54.9696 32.7054 174.2582 124 T 4.7602 9.4414 119.1763 61.7919 71.5857 173.2250 125 L 3.4857 10.2094 128.0037 55.9869 39.6993 176.0738 126 G 4.0235 8.8385 105.8292 45.4455 0.0000 174.0955 127 R 4.8600 7.8104 118.6583 54.2179 33.4182 174.9215 128 I 5.3945 8.1646 113.4370 59.2736 41.2513 174.6784 129 K 4.8355 9.1558 123.8114 55.0121 35.7268 175.0734 130 I 4.3082 9.0896 129.6028 61.7705 37.4277 176.2528 131 M 4.1015 8.6913 127.5582 56.7069 33.5076 176.4019 132 R 4.6042 7.5534 112.4966 55.2952 33.5537 173.7616 133 I 4.6643 8.1009 120.0857 59.6108 39.0586 176.0229 134 K 4.2351 8.8175 127.0014 57.5239 32.4467 178.0638 135 G 3.8335 8.8094 110.0111 44.6571 0.0000 172.5677 136 E 3.7523 7.9500 119.4706 54.8275 27.7578 174.2918 137 G 3.5340 7.9608 110.7976 45.6461 0.0000 170.6712 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 2 G 8.21 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 3 D 7.82 5.05 0.00 2.91 2.46 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 4 K 8.75 5.12 0.00 1.83 1.76 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.40 7.81 5 T 8.81 4.66 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 1.21 0.00 0.00 6 K 8.50 5.16 0.00 1.64 1.69 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.56 7.81 7 V 8.66 4.54 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 0.71 0.00 0.00 0.94 0.00 0.00 8 Q 8.77 4.43 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 9 V 9.17 3.59 2.32 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 0.91 0.00 0.00 0.98 0.00 0.00 10 S 7.71 4.22 0.00 3.96 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 11 K 7.87 4.27 0.00 1.89 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.39 7.81 12 L 7.36 4.22 0.00 1.75 1.59 0.92 0.75 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 13 K 8.11 4.66 0.00 1.72 1.59 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.42 7.81 14 P 0.00 4.52 0.00 1.99 1.94 0.00 3.61 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 2.00 2.05 0.00 15 G 8.91 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.54 4.21 0.00 1.94 1.90 0.00 3.18 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 17 Y 8.18 5.30 0.00 2.80 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 18 I 9.01 4.70 1.89 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 1.25 1.48 1.00 0.00 0.00 19 I 8.82 4.92 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.84 0.95 0.00 0.00 20 I 8.28 4.37 1.90 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 1.32 1.11 0.93 0.00 0.00 21 D 9.37 4.67 0.00 2.85 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 22 D 8.19 4.40 0.00 2.86 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 23 E 7.74 4.71 0.00 2.13 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 2.28 2.33 0.00 24 P 0.00 5.01 0.00 2.11 2.22 0.00 3.96 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.24 0.00 25 C 9.58 5.35 0.00 2.84 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 26 R 8.88 4.21 0.00 1.98 1.77 0.00 3.04 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.99 0.00 27 I 8.44 4.11 1.87 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 1.19 0.46 0.86 0.00 0.00 28 V 8.49 4.33 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 0.67 0.00 0.00 0.93 0.00 0.00 29 N 7.62 4.74 0.00 2.78 2.58 0.00 0.00 6.95 7.75 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 30 I 8.39 4.98 1.85 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 1.33 0.76 0.90 0.00 0.00 31 T 9.10 4.58 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 1.21 0.00 0.00 32 V 8.31 4.84 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 33 S 8.65 4.52 0.00 3.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.46 4.21 0.00 3.88 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 35 P 0.00 4.52 0.00 2.05 2.19 0.00 3.67 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 36 G 8.99 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.47 4.02 0.00 1.62 1.87 0.00 1.56 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.48 7.81 38 H 7.71 4.49 0.00 3.20 3.43 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 8.64 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 0.00 0.00 0.00 0.00 40 S 7.87 4.26 0.00 3.52 3.65 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 41 A 8.10 4.96 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 42 K 8.47 5.00 0.00 1.70 1.70 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.51 7.81 43 A 9.27 5.25 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 44 R 9.14 4.94 0.00 1.83 1.77 0.00 3.14 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 45 I 9.05 4.99 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 1.22 0.52 0.90 0.00 0.00 46 E 9.09 5.21 0.00 1.85 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 2.22 2.37 0.00 47 A 9.33 5.02 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 48 V 8.61 4.59 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 1.02 0.00 0.00 0.93 0.00 0.00 49 G 8.88 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.70 3.85 1.60 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 -0.36 1.03 0.00 0.00 51 F 8.12 4.91 0.00 3.30 3.05 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 0.00 52 D 8.63 4.56 0.00 2.83 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.07 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 54 K 8.66 4.21 0.00 1.84 1.80 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.40 7.81 55 V 8.37 4.47 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 0.84 0.00 0.00 0.93 0.00 0.00 56 R 9.48 4.86 0.00 1.73 1.77 0.00 3.15 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 57 S 8.59 5.32 0.00 4.11 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 58 I 9.09 4.82 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.69 0.92 0.00 0.00 59 V 8.31 4.93 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 0.89 0.00 0.00 0.93 0.00 0.00 60 K 9.14 4.77 0.00 1.64 1.61 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.57 7.81 61 P 0.00 4.57 0.00 2.16 1.95 0.00 3.59 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 2.10 2.07 0.00 62 T 8.88 3.97 4.29 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 1.22 0.00 0.00 63 S 7.90 4.47 0.00 4.00 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 64 A 7.80 4.45 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 65 E 8.59 5.15 0.00 1.84 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 66 V 8.49 4.62 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 0.74 0.00 0.00 0.98 0.00 0.00 67 D 8.54 5.10 0.00 2.62 2.60 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 68 V 9.05 4.89 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.02 0.00 0.00 69 P 0.00 4.97 0.00 2.04 2.06 0.00 3.85 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 1.93 2.04 0.00 70 I 9.02 4.31 2.01 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 1.20 1.02 0.86 0.00 0.00 71 I 8.12 4.70 1.36 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.23 0.35 0.00 0.00 72 D 8.79 4.87 0.00 2.49 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.31 4.80 0.00 1.46 1.64 0.00 1.52 0.00 0.00 1.87 0.00 0.00 2.25 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.57 0.95 7.81 74 K 8.50 4.55 0.00 0.79 1.32 0.00 1.52 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.19 1.12 7.81 75 T 8.14 5.27 4.26 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 1.29 0.00 0.00 76 A 8.76 4.71 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 77 Q 8.96 5.04 0.00 2.20 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.94 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 78 V 8.97 4.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.98 0.00 0.00 79 I 8.46 4.59 1.83 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.79 0.92 0.00 0.00 80 A 7.48 4.59 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 81 I 8.43 4.96 1.86 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 1.34 0.71 0.90 0.00 0.00 82 T 8.85 4.70 4.35 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 1.26 0.00 0.00 83 P 0.00 4.06 0.00 2.03 2.11 0.00 3.61 0.00 0.00 3.65 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 84 D 8.08 5.10 0.00 2.62 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 85 T 7.78 5.30 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 1.20 0.00 0.00 86 V 8.74 4.90 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 0.76 0.00 0.00 0.92 0.00 0.00 87 Q 9.32 5.16 0.00 2.05 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 88 I 9.06 5.12 1.92 0.00 0.00 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 1.29 1.19 0.89 0.00 0.00 89 M 9.05 5.19 0.00 1.93 1.72 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 90 D 9.14 4.95 0.00 3.04 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 91 M 8.96 4.03 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.66 0.00 92 E 8.46 4.21 0.00 2.14 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 2.35 2.40 0.00 93 T 8.13 4.06 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 1.29 0.00 0.00 94 Y 8.29 3.51 0.00 3.08 3.14 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 95 E 8.00 4.24 0.00 1.98 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 2.26 2.28 0.00 96 T 7.84 4.87 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 0.98 0.00 0.00 97 F 9.21 4.77 0.00 2.72 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 98 E 8.89 5.18 0.00 1.89 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 2.15 2.35 0.00 99 V 8.62 4.71 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 0.63 0.00 0.00 0.95 0.00 0.00 100 P 0.00 4.79 0.00 2.44 2.15 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 101 I 8.38 3.72 1.87 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 1.35 0.61 0.91 0.00 0.00 102 D 8.11 4.54 0.00 2.79 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 0.00 103 T 7.99 4.61 4.32 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 1.29 0.00 0.00 104 G 8.48 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 0.00 105 V 7.37 4.72 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 0.83 0.00 0.00 0.93 0.00 0.00 106 A 8.74 4.01 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 9.00 4.42 0.00 2.69 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 0.00 108 E 8.31 3.95 0.00 1.89 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 2.29 2.35 0.00 109 I 7.77 4.38 1.85 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 1.31 1.32 0.88 0.00 0.00 110 R 7.43 3.86 0.00 1.91 2.08 0.00 3.25 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.75 0.00 111 D 7.98 4.93 0.00 2.57 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 0.00 112 Q 8.20 4.57 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.96 6.62 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 113 L 7.68 4.29 0.00 1.63 1.59 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.17 4.65 0.00 1.71 1.57 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.41 7.81 115 E 8.55 4.18 0.00 2.11 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 2.27 2.30 0.00 116 G 9.30 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 0.00 0.00 0.00 0.00 117 I 7.33 4.30 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.05 0.95 0.00 0.00 118 N 8.60 5.31 0.00 2.69 2.80 0.00 0.00 6.76 7.68 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 0.00 119 V 8.96 4.92 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 0.89 0.00 0.00 1.05 0.00 0.00 120 E 9.25 5.05 0.00 2.03 1.84 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 2.39 2.31 0.00 121 Y 8.83 5.33 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 0.00 122 W 9.38 5.39 0.00 3.22 2.99 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 0.00 123 E 9.00 5.31 0.00 2.21 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 2.28 2.31 0.00 124 T 9.44 4.76 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 1.32 0.00 0.00 125 L 10.21 3.49 0.00 1.91 1.80 1.01 1.06 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 0.00 126 G 8.84 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 0.00 127 R 7.81 4.86 0.00 1.65 1.27 0.00 2.23 0.00 0.00 2.94 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.43 0.00 128 I 8.16 5.39 1.87 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 1.20 0.64 0.74 0.00 0.00 129 K 9.16 4.84 0.00 2.17 1.70 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.15 1.40 7.81 130 I 9.09 4.31 1.86 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 1.23 0.53 0.92 0.00 0.00 131 M 8.69 4.10 0.00 1.30 1.68 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.15 0.00 132 R 7.55 4.60 0.00 1.82 1.94 0.00 2.96 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 133 I 8.10 4.66 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 1.34 1.14 0.89 0.00 0.00 134 K 8.82 4.24 0.00 1.81 1.75 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.55 7.81 135 G 8.81 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 7.95 3.75 0.00 2.15 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 2.22 2.24 0.00 137 G 7.96 3.53 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