NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 5.1285 8.2048 119.7232 55.5208 33.5300 175.4637 2 T 4.1697 8.1352 118.0906 62.3985 70.7307 175.0641 3 I 3.7332 8.9089 124.6660 64.8782 37.7018 178.2367 4 D 4.2156 8.1175 119.1598 57.1842 40.6030 178.5057 5 E 3.9458 7.9265 119.4438 59.2651 29.8381 178.6106 6 I 3.7242 8.4614 120.9423 64.4846 37.2291 178.5120 7 I 3.7250 8.4290 121.2350 64.3568 36.6850 178.1400 8 E 4.2229 8.2822 120.4137 58.5467 29.6971 178.4561 9 A 4.1372 7.9559 121.0809 55.2011 18.4546 179.6813 10 I 3.6883 7.7844 118.3785 64.4964 37.3016 178.2733 11 E 4.1634 8.2645 118.4291 58.0918 29.1017 178.2981 12 K 4.4384 7.7470 117.0891 55.7676 32.8555 176.8383 13 L 4.4264 6.9695 119.8165 54.4047 42.4777 177.2757 14 T 4.3434 8.6672 112.1109 60.7675 71.3093 176.0501 15 V 3.5509 8.2470 120.6319 66.5798 31.3662 178.3011 16 S 4.1315 7.9997 114.1468 61.4979 62.7079 176.4076 17 E 3.9428 8.1511 121.3320 59.3696 29.2104 179.3053 18 L 3.9674 8.1516 118.9321 57.7122 41.6790 179.3728 19 A 3.9861 8.1273 120.6573 55.4650 18.3484 179.6545 20 E 3.9686 8.4121 117.0490 59.0233 29.4437 179.4227 21 L 3.8620 8.2981 121.0606 58.0644 42.2274 179.0218 22 V 3.5267 8.0817 118.5723 66.0436 31.4052 177.7365 23 K 3.8719 7.9827 119.2053 59.5224 31.9494 178.8086 24 K 3.8961 8.0410 118.6657 59.4436 31.5138 179.3331 25 L 3.5881 7.7926 119.2316 57.5823 41.4695 179.4826 26 E 4.1564 8.1852 118.5811 59.6201 29.2127 179.2048 27 D 4.4590 8.1608 118.1284 56.8263 40.8564 178.6213 28 K 3.9460 7.9972 119.9464 59.3244 32.4162 178.4200 29 F 4.9430 8.8168 116.2574 56.8968 39.9257 177.1717 30 G 4.1182 8.0438 105.5656 45.1717 0.0000 175.0989 31 V 3.6958 8.3362 113.2022 64.3041 32.0059 179.1680 32 T 3.9339 8.0010 115.5344 66.2924 68.5874 175.8006 33 A 4.1433 7.9716 122.0716 54.1858 19.0938 178.0218 34 A 4.3694 8.3562 117.9397 53.6141 19.5445 179.1239 35 A 4.0027 7.8294 118.4353 55.0707 18.2850 177.7091 36 P 4.1868 0.0000 0.0000 66.1182 31.4195 178.9903 37 V 3.6424 7.8310 115.9692 65.5704 31.3803 177.7280 38 A 3.9922 7.9686 120.7012 55.4108 18.0792 180.1283 39 V 3.5864 8.0071 109.6619 64.4623 31.7201 178.5270 40 A 4.1161 8.1099 119.2074 54.3730 18.4235 178.7795 41 A 4.2652 8.1884 118.7527 53.8267 19.1318 179.1515 42 A 3.9311 7.6647 120.0044 55.2905 18.3120 178.1527 43 P 4.1049 0.0000 0.0000 65.4902 31.5315 179.0469 44 V 3.5600 7.6580 116.6148 65.9325 31.5330 177.8589 45 A 4.1167 8.3896 120.9434 54.9289 18.2283 179.7098 46 G 3.6147 8.6886 104.6213 48.0780 0.0000 175.7644 47 A 4.0091 8.4274 123.3556 54.7484 18.2648 179.5959 48 A 3.9678 7.9091 118.7643 54.9710 18.4097 179.7615 49 A 4.0052 8.5097 120.1638 55.2507 18.4363 180.1543 50 G 3.5227 8.3268 104.1541 47.6435 0.0000 175.9021 51 A 3.9487 8.1043 122.9148 54.9455 18.4385 179.5000 52 A 3.9424 8.1519 120.8730 54.6743 18.2785 179.6466 53 Q 3.9055 7.8114 117.6090 59.4901 28.9451 178.4627 54 E 4.0012 7.9516 118.2971 58.7368 29.5378 178.1337 55 E 4.3253 8.0032 116.0361 55.0235 29.9052 176.0974 56 K 3.2962 7.2780 117.3998 57.5571 30.1380 176.3322 57 T 4.3540 7.5800 108.5252 62.1852 70.0312 173.7675 58 E 4.9709 7.0684 120.9987 54.9456 34.4724 174.0329 59 F 5.3774 9.6117 121.0983 55.6796 43.4368 173.6503 60 D 5.4895 8.9538 119.3671 51.6925 43.3760 174.5493 61 V 4.6135 9.0944 119.6938 61.1902 33.8823 174.3209 62 V 4.8757 8.8178 128.3205 60.9276 34.3260 174.0109 63 L 4.6291 8.8260 130.5586 54.7033 42.3097 177.0842 64 K 4.1870 9.5270 127.6883 57.9271 33.1154 176.9302 65 S 4.6294 7.2951 112.7932 58.0526 64.8424 176.9467 66 F 4.9352 7.5564 116.9273 55.1976 40.3068 176.5376 67 G 3.9277 7.0649 110.1836 46.8690 0.0000 175.1669 68 Q 4.2981 8.7966 119.9644 57.4872 29.5014 176.6665 69 N 4.9733 7.7476 117.4645 52.4382 39.3537 176.7162 70 K 3.3344 8.3699 123.0150 59.8226 32.2999 176.9517 71 I 3.5925 7.6261 119.0177 64.5316 37.1604 178.0376 72 Q 3.9515 7.9974 119.7543 59.1779 28.9288 178.2488 73 V 3.6006 8.0937 119.5517 66.1682 31.5290 178.1528 74 I 3.6851 7.9442 119.6141 63.8728 36.8247 178.3617 75 K 3.8871 7.9391 120.8706 59.4859 32.0584 179.1001 76 V 3.7658 7.7502 118.5254 65.9362 31.4752 178.1003 77 V 3.6189 7.9349 118.0832 66.1394 31.2906 178.2130 78 R 3.9737 8.2083 117.8649 59.1368 29.6323 178.9068 79 E 3.9406 7.9435 117.4103 59.6181 29.6169 179.2469 80 I 3.8880 8.1104 118.9407 64.0296 37.2910 177.8138 81 T 4.3886 8.4809 108.7744 60.9996 69.6451 176.0026 82 G 3.9242 8.2652 109.0992 45.3095 0.0000 173.7860 83 L 4.0716 7.5271 119.2672 54.3980 42.2291 177.9100 84 G 3.9227 8.2954 108.4266 43.8783 0.0000 173.7666 85 L 3.9021 8.5389 120.1539 58.4945 41.6195 178.5516 86 K 3.9042 8.0616 116.9807 59.9999 32.1802 178.5792 87 E 3.9084 8.1360 116.3402 59.5343 29.4824 178.8385 88 A 3.8965 8.6293 122.3254 54.6568 18.4344 179.2831 89 K 3.6691 8.6776 118.6865 59.7108 31.9270 178.1733 90 D 4.2932 8.0231 117.2238 57.3116 41.3432 177.9027 91 L 4.0763 7.8304 120.5685 58.1988 42.1251 178.8297 92 V 3.6107 7.8490 118.2714 66.2274 31.2280 177.5534 93 E 4.3562 8.1793 115.9679 58.1072 29.5119 178.1936 94 K 4.3360 8.2468 118.4703 55.1217 32.4877 176.0784 95 A 4.3316 7.3912 122.9648 53.7860 18.8494 178.2716 96 G 4.0548 8.9748 109.6168 45.5460 0.0000 174.2778 97 S 4.5004 8.0776 114.7822 56.6635 63.2453 173.1285 98 P 4.3043 0.0000 0.0000 65.1661 31.1900 176.6772 99 D 4.8536 7.7582 115.8152 53.2394 40.0683 176.3346 100 A 4.3914 7.8669 121.3358 52.8539 18.8275 179.3209 101 V 4.2917 7.5240 121.8532 62.9846 31.7099 175.5773 102 I 3.9338 8.4476 129.6089 63.8616 37.3945 176.8574 103 K 4.6311 7.6040 119.4181 55.1389 34.9516 174.3365 104 S 4.9406 8.1669 118.1599 57.9627 66.0808 174.0626 105 G 4.1402 8.9129 107.4520 44.9066 0.0000 173.8677 106 V 4.1744 7.4800 113.6670 59.8729 33.3147 175.5278 107 S 4.9324 8.1483 116.0221 57.3096 65.4983 174.9165 108 K 3.4287 8.5149 122.9009 59.5572 31.6867 178.2929 109 E 3.8671 8.0381 118.8184 59.3668 29.5763 178.2133 110 E 3.8116 7.9642 119.1285 59.1388 29.6763 178.5583 111 A 3.9971 8.7740 121.7520 55.2019 18.4525 179.2313 112 E 3.8014 8.6395 117.5488 59.5743 29.6143 178.8712 113 E 3.8846 8.8747 119.8270 59.6827 29.5936 179.2201 114 I 3.6671 8.0374 119.5824 64.2714 37.1343 178.0670 115 K 3.8009 8.4091 120.8825 59.5978 31.8204 178.1104 116 K 3.8029 8.4190 119.9471 59.7754 32.1509 178.3621 117 K 3.8519 7.9318 119.0130 59.6031 32.1005 178.8117 118 L 4.1331 7.9723 119.1779 57.8585 41.7730 179.2904 119 E 4.6804 8.4377 120.0567 58.8918 29.0949 179.2540 120 E 4.0364 8.2892 118.1712 58.7307 29.5736 178.1352 121 A 4.4838 7.1706 116.9602 51.6685 19.1009 177.5404 122 G 4.0336 7.5527 105.3729 45.0658 0.0000 173.8461 123 A 4.8372 8.1071 121.8147 50.4111 21.9057 176.2962 124 E 4.6533 9.2956 120.6290 54.6484 31.5414 174.9064 125 V 4.8591 8.4418 126.6909 61.0047 34.5024 174.0742 126 E 4.7214 9.2315 127.4930 54.3773 32.4641 174.2608 127 L 5.0627 8.5986 126.6156 53.3739 43.5625 176.6810 128 K 4.3671 9.1051 122.4231 56.5592 32.8317 176.1005 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 M 8.20 5.13 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.74 0.00 2 T 8.14 4.17 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 1.25 0.00 0.00 3 I 8.91 3.73 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.87 0.91 0.00 0.00 4 D 8.12 4.22 0.00 2.72 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 5 E 7.93 3.95 0.00 2.04 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 2.37 2.40 0.00 6 I 8.46 3.72 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.70 0.92 0.00 0.00 7 I 8.43 3.72 2.03 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 1.41 1.27 0.91 0.00 0.00 8 E 8.28 4.22 0.00 2.04 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 0.00 2.32 2.23 0.00 9 A 7.96 4.14 1.38 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 10 I 7.78 3.69 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.91 0.00 0.00 11 E 8.26 4.16 0.00 2.37 1.99 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 2.33 2.68 0.00 12 K 7.75 4.44 0.00 1.92 1.84 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.65 7.81 13 L 6.97 4.43 0.00 1.76 1.59 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 14 T 8.67 4.34 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 15 V 8.25 3.55 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 1.05 0.00 0.00 0.96 0.00 0.00 16 S 8.00 4.13 0.00 3.90 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 17 E 8.15 3.94 0.00 2.24 1.99 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 2.32 2.34 0.00 18 L 8.15 3.97 0.00 1.82 1.71 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.13 3.99 1.38 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 20 E 8.41 3.97 0.00 2.13 1.99 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 2.32 2.56 0.00 21 L 8.30 3.86 0.00 1.79 1.84 0.92 0.84 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 22 V 8.08 3.53 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 0.94 0.00 0.00 0.98 0.00 0.00 23 K 7.98 3.87 0.00 1.96 1.77 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.62 7.81 24 K 8.04 3.90 0.00 1.95 1.73 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.62 7.81 25 L 7.79 3.59 0.00 1.86 1.71 0.98 0.82 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 26 E 8.19 4.16 0.00 2.17 1.99 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 2.35 2.51 0.00 27 D 8.16 4.46 0.00 2.67 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 28 K 8.00 3.95 0.00 1.45 1.14 0.00 1.64 0.00 0.00 1.59 0.00 0.00 3.11 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.97 1.05 7.81 29 F 8.82 4.94 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 30 G 8.04 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.34 3.70 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 0.89 0.00 0.00 0.94 0.00 0.00 32 T 8.00 3.93 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 1.22 0.00 0.00 33 A 7.97 4.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.36 4.37 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 35 A 7.83 4.00 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 36 P 0.00 4.19 0.00 2.18 2.14 0.00 3.69 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 2.12 2.17 0.00 37 V 7.83 3.64 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.99 0.00 0.00 38 A 7.97 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.01 3.59 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 0.76 0.00 0.00 1.03 0.00 0.00 40 A 8.11 4.12 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 41 A 8.19 4.27 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.66 3.93 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 43 P 0.00 4.10 0.00 2.17 2.11 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 44 V 7.66 3.56 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.93 0.00 0.00 45 A 8.39 4.12 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.69 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 47 A 8.43 4.01 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 48 A 7.91 3.97 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 49 A 8.51 4.01 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.33 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 51 A 8.10 3.95 1.38 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 52 A 8.15 3.94 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 53 Q 7.81 3.91 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 54 E 7.95 4.00 0.00 2.10 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 2.31 2.55 0.00 55 E 8.00 4.33 0.00 1.87 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 2.37 0.00 56 K 7.28 3.30 0.00 1.79 1.88 0.00 1.50 0.00 0.00 1.79 0.00 0.00 3.18 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.37 7.81 57 T 7.58 4.35 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 1.19 0.00 0.00 58 E 7.07 4.97 0.00 1.76 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 2.29 2.28 0.00 59 F 9.61 5.38 0.00 2.96 3.11 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 60 D 8.95 5.49 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 61 V 9.09 4.61 2.11 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 0.95 0.00 0.00 0.96 0.00 0.00 62 V 8.82 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 0.95 0.00 0.00 0.96 0.00 0.00 63 L 8.83 4.63 0.00 1.85 1.59 1.02 1.07 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 64 K 9.53 4.19 0.00 1.68 1.83 0.00 1.90 0.00 0.00 1.63 0.00 0.00 3.08 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.39 7.81 65 S 7.30 4.63 0.00 3.75 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 F 7.56 4.94 0.00 3.19 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 67 G 7.06 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 0.00 0.00 0.00 68 Q 8.80 4.30 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 7.50 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 69 N 7.75 4.97 0.00 2.91 2.96 0.00 0.00 6.47 7.97 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 70 K 8.37 3.33 0.00 1.73 1.71 0.00 1.37 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.09 0.24 7.81 71 I 7.63 3.59 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.81 0.89 0.00 0.00 72 Q 8.00 3.95 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 73 V 8.09 3.60 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 1.01 0.00 0.00 1.07 0.00 0.00 74 I 7.94 3.69 1.94 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.42 0.85 0.00 0.00 75 K 7.94 3.89 0.00 1.92 1.97 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.44 7.81 76 V 7.75 3.77 2.19 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 0.87 0.00 0.00 1.05 0.00 0.00 77 V 7.93 3.62 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 0.79 0.00 0.00 0.98 0.00 0.00 78 R 8.21 3.97 0.00 2.01 1.95 0.00 3.54 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.79 0.00 79 E 7.94 3.94 0.00 2.15 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 2.65 0.00 80 I 8.11 3.89 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 0.92 0.00 0.00 81 T 8.48 4.39 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 1.29 0.00 0.00 82 G 8.27 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.53 4.07 0.00 1.68 1.61 0.92 0.76 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 84 G 8.30 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.54 3.90 0.00 1.74 1.63 0.89 0.55 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 86 K 8.06 3.90 0.00 1.82 1.85 0.00 1.72 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.53 7.81 87 E 8.14 3.91 0.00 2.15 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 0.00 2.55 2.35 0.00 88 A 8.63 3.90 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.68 3.67 0.00 1.83 1.98 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.56 1.36 7.81 90 D 8.02 4.29 0.00 2.79 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 91 L 7.83 4.08 0.00 1.82 1.78 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 92 V 7.85 3.61 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 0.55 0.00 0.00 0.87 0.00 0.00 93 E 8.18 4.36 0.00 2.17 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 2.27 2.53 0.00 94 K 8.25 4.34 0.00 2.02 1.85 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.74 7.81 95 A 7.39 4.33 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 96 G 8.97 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 97 S 8.08 4.50 0.00 3.81 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 98 P 0.00 4.30 0.00 2.08 2.12 0.00 3.72 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 2.03 2.09 0.00 99 D 7.76 4.85 0.00 2.78 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 0.00 100 A 7.87 4.39 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 0.00 101 V 7.52 4.29 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 0.88 0.00 0.00 0.98 0.00 0.00 102 I 8.45 3.93 1.89 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 1.21 0.94 0.92 0.00 0.00 103 K 7.60 4.63 0.00 1.75 1.60 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.44 7.81 104 S 8.17 4.94 0.00 3.96 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 0.00 105 G 8.91 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.48 4.17 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 0.88 0.00 0.00 1.08 0.00 0.00 107 S 8.15 4.93 0.00 4.09 4.04 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 0.00 0.00 0.00 0.00 108 K 8.51 3.43 0.00 1.30 1.66 0.00 1.23 0.00 0.00 0.74 0.00 0.00 2.24 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 1.32 7.81 109 E 8.04 3.87 0.00 2.04 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 2.36 2.35 0.00 110 E 7.96 3.81 0.00 2.04 2.04 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 0.00 2.32 2.34 0.00 111 A 8.77 4.00 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 0.00 112 E 8.64 3.80 0.00 2.13 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 2.46 2.39 0.00 113 E 8.87 3.88 0.00 2.01 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 0.00 2.32 2.53 0.00 114 I 8.04 3.67 2.03 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 1.42 0.55 0.92 0.00 0.00 115 K 8.41 3.80 0.00 1.84 2.00 0.00 1.65 0.00 0.00 1.56 0.00 0.00 3.10 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.44 1.47 7.81 116 K 8.42 3.80 0.00 1.81 2.04 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.49 7.81 117 K 7.93 3.85 0.00 1.91 1.81 0.00 1.57 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.54 7.81 118 L 7.97 4.13 0.00 2.01 1.72 0.94 0.99 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 0.00 119 E 8.44 4.68 0.00 2.21 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 2.52 2.32 0.00 120 E 8.29 4.04 0.00 2.14 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 2.35 2.58 0.00 121 A 7.17 4.48 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 0.00 122 G 7.55 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 0.00 123 A 8.11 4.84 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 E 9.30 4.65 0.00 1.97 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 2.19 2.21 0.00 125 V 8.44 4.86 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 0.85 0.00 0.00 0.96 0.00 0.00 126 E 9.23 4.72 0.00 2.02 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 0.00 2.21 2.26 0.00 127 L 8.60 5.06 0.00 1.57 1.61 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 128 K 9.11 4.37 0.00 2.02 1.67 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.39 7.81