NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8248 8.3049 120.2875 55.4344 33.7338 174.3709 2 R 4.5396 8.9433 119.5234 53.7290 34.9297 172.4553 3 I 4.8177 8.5288 122.8317 59.5139 40.9863 174.0984 4 G 5.0127 9.0002 114.4457 43.7445 0.0000 170.6453 5 H 5.4671 8.9896 122.0168 53.9807 32.8217 172.8151 6 G 4.7590 9.1566 111.9302 43.5106 0.0000 171.5534 7 F 5.4429 8.5965 124.2920 56.5693 42.3095 172.9723 8 D 4.7374 8.3360 124.8419 52.3714 45.0826 174.1588 9 V 4.5215 7.9242 122.2234 61.4623 34.7200 174.0824 10 H 5.0023 8.7612 123.7068 53.8085 32.5669 173.0119 11 A 4.4893 8.4391 123.8637 51.4192 19.9949 176.7102 12 F 5.0339 8.8393 119.7471 57.8173 39.7707 175.5529 13 G 3.8658 9.2033 106.1844 46.9092 0.0000 175.6650 14 G 3.9305 8.4477 110.8617 45.6543 0.0000 172.0250 15 E 4.5947 8.3308 119.2781 54.3520 33.0631 176.7961 16 G 4.1961 8.6256 109.2133 44.7740 0.0000 171.1134 17 P 4.9134 0.0000 0.0000 62.3082 32.6116 176.0269 18 I 4.2856 8.4374 114.3573 60.2535 40.0633 174.6886 19 I 4.7746 8.2767 123.7456 59.5792 40.4068 174.2100 20 I 4.8269 8.4487 131.0188 60.4070 39.6904 176.3884 21 G 3.9368 9.7514 114.0219 46.7786 0.0000 175.2264 22 G 3.9515 8.6249 107.1180 45.0896 0.0000 174.2509 23 V 4.4023 7.4815 120.7146 61.3594 33.2952 175.0027 24 R 4.7583 8.7705 127.6792 55.8180 30.6737 175.7655 25 I 4.3396 8.9819 126.7970 58.5383 39.2598 173.9511 26 P 4.7167 0.0000 0.0000 63.3288 31.3561 175.0809 27 Y 4.7529 8.4395 123.0188 56.4923 41.7959 174.5843 28 E 3.6514 7.7305 124.8964 58.3696 29.6932 177.2641 29 K 4.7861 7.0106 114.9303 54.4440 35.6980 176.1054 30 G 4.4045 7.8133 107.6515 44.4490 0.0000 171.6506 31 L 5.4993 8.3351 119.3201 52.7547 44.6984 176.8013 32 L 4.2743 8.6623 124.4738 54.5367 41.8720 176.6807 33 A 4.3295 7.9622 123.0556 52.2516 21.3367 176.5540 34 H 4.5716 9.1209 116.4549 56.5359 28.8787 175.3779 35 S 4.9372 7.2824 114.3703 56.6546 65.2809 173.1926 36 D 4.3633 8.6676 118.1212 55.1802 39.5055 176.5870 37 G 3.4778 7.6643 107.1524 46.4351 0.0000 174.5151 38 D 4.9756 7.4888 121.7996 51.5344 39.9356 175.7493 39 V 3.8680 8.2576 120.0570 63.1947 31.8044 177.4920 40 A 3.9297 7.8594 119.6666 55.4304 18.2698 179.6198 41 L 4.0319 8.2161 117.1360 57.7437 41.5782 179.5853 42 H 4.2229 8.4508 116.4232 58.8729 28.7175 177.6217 43 A 3.9484 8.1361 122.6736 54.9413 18.1730 179.4171 44 L 3.8742 8.0701 118.8721 58.5193 42.1625 179.2527 45 T 3.9046 8.1468 115.8422 66.9495 68.4018 176.2197 46 D 4.4064 8.4150 120.6571 57.3001 40.8172 178.8135 47 A 4.1068 7.9319 120.6778 55.1978 18.5948 179.5815 48 L 3.9817 8.0329 117.4370 58.0640 41.7910 179.8439 49 L 4.1875 8.5607 119.4087 57.3873 41.4719 179.8964 50 G 3.5498 8.5318 106.3057 47.7542 0.0000 175.7487 51 A 4.4424 8.1599 122.8968 53.8427 18.5439 178.4684 52 A 3.5033 7.5937 115.7656 50.9475 19.5787 176.7622 53 A 3.7023 7.4756 119.4533 53.5650 16.6495 177.7328 54 L 4.6588 8.5430 116.1616 55.1824 43.7701 178.4672 55 G 3.9335 9.5551 113.8013 45.6061 0.0000 176.6458 56 D 4.6192 8.4499 127.3992 50.7981 42.2235 175.4268 57 I 3.8759 9.2518 118.6917 64.3217 37.4226 178.1578 58 G 3.5919 8.0471 105.5552 47.3931 0.0000 175.1709 59 K 4.0279 8.6552 121.5438 59.2558 32.2907 178.3728 60 L 3.9224 7.5007 119.3691 56.2492 43.0190 176.7126 61 F 4.8183 7.8331 117.9749 54.7827 39.1027 172.7426 62 P 4.7486 0.0000 0.0000 61.4138 32.8866 177.4567 63 D 4.6124 8.4300 117.0720 56.1480 41.1005 178.1954 64 T 3.9237 7.9663 116.0655 65.9642 68.6530 173.9583 65 D 4.7526 7.6283 121.6834 52.0970 41.7915 174.4954 66 P 4.3697 0.0000 0.0000 64.7901 31.9222 177.9338 67 A 3.8061 8.0287 122.4104 55.3788 18.2660 178.4507 68 F 4.6099 8.1733 111.3112 57.0271 39.3035 175.7865 69 K 4.0437 7.7537 121.5694 57.7816 31.9627 177.5358 70 G 3.8443 9.0605 111.3890 45.5032 0.0000 172.6463 71 A 4.4107 7.3979 122.6082 50.6592 20.0094 178.4245 72 D 4.6178 8.2998 121.8096 53.2260 41.6848 177.9179 73 S 4.1894 9.1403 116.4322 61.5403 62.6876 177.3423 74 R 3.9310 7.9692 120.6779 59.1094 29.8088 178.6930 75 E 4.0104 8.1779 118.0433 59.3593 29.4880 179.1708 76 L 3.4644 7.6650 118.5993 57.3743 41.4845 179.3583 77 L 3.9946 8.2563 120.6880 58.3671 42.1037 179.3315 78 R 4.0882 8.2219 118.0817 59.1557 30.0163 178.7384 79 E 4.0551 8.6093 119.2196 59.1112 29.6398 178.6485 80 A 4.0639 8.4944 121.1715 54.9217 18.4142 179.3936 81 W 4.4998 8.6948 127.4456 60.7318 30.7443 178.4478 82 R 3.7588 8.1496 116.1426 59.2762 28.7280 179.0184 83 R 3.9253 7.7232 117.2632 58.4880 30.3452 178.8641 84 I 3.9301 7.7543 120.1866 64.5714 37.3171 178.4538 85 Q 4.1981 8.1277 120.2093 58.1108 28.1477 178.6202 86 A 3.9795 7.8487 121.2311 54.4426 18.4504 178.8966 87 K 4.0868 7.5736 116.7075 56.9361 32.3756 177.3437 88 G 3.9189 7.1553 107.0343 45.6270 0.0000 172.8164 89 Y 5.1033 7.6745 117.1221 56.3965 40.7005 174.7275 90 T 5.0977 8.5449 111.8018 59.7108 72.8970 172.0902 91 L 4.4581 8.8449 123.7952 54.5532 42.3806 175.6571 92 G 4.0228 9.3033 116.4788 46.7969 0.0000 172.7931 93 N 5.0260 7.5536 114.0685 51.3072 40.9038 173.3275 94 V 4.9474 8.6329 113.2926 59.7215 35.8113 174.3082 95 D 5.1187 9.0365 122.1193 52.6818 44.7036 174.0971 96 V 4.7022 8.9152 125.9691 61.4248 34.6389 174.3596 97 T 4.9517 9.1827 124.6927 61.6828 70.8515 172.8125 98 I 4.1609 8.9368 128.9825 61.0018 38.7141 175.4520 99 I 4.8586 8.9107 128.8661 59.9136 38.4526 174.3286 100 A 4.8012 8.7674 128.5837 50.5496 22.3371 176.9106 101 Q 3.9531 9.0318 123.6407 58.8269 29.5581 175.9669 102 A 4.5468 7.4067 116.9755 50.2525 21.8567 173.6995 103 P 4.5583 0.0000 0.0000 61.1835 32.7654 175.8215 104 K 4.0365 8.4346 119.8147 57.0396 32.4170 176.6741 105 M 4.3563 8.5734 125.4066 56.8945 32.1121 178.1277 106 L 3.9264 7.8688 120.4308 57.8010 42.0551 177.1413 107 P 4.2533 0.0000 0.0000 64.9445 31.5729 177.2306 108 H 4.6971 8.1188 113.8058 56.1858 29.2571 177.1178 109 I 3.6792 7.2515 122.0090 63.9393 37.0490 176.1711 110 P 4.1597 0.0000 0.0000 65.8565 31.2006 178.3649 111 Q 3.7312 7.8827 117.5469 58.8425 28.9791 177.8573 112 M 4.4241 7.7580 121.3747 57.9788 31.9562 178.8050 113 R 3.8869 8.0688 118.2620 59.0740 30.2079 179.1182 114 V 3.5123 7.4400 117.4672 66.1722 31.4738 178.0999 115 F 4.5959 7.6429 116.7220 60.7521 38.7946 177.7525 116 I 3.6722 8.0339 119.1700 64.3771 36.9431 178.3301 117 A 3.9526 8.2213 121.7182 55.1286 17.9499 179.5131 118 E 3.9517 8.0728 116.0507 59.8629 29.6839 179.1803 119 D 4.5128 8.1863 117.5226 56.5431 40.9535 177.8380 120 L 3.6431 7.7415 117.2280 53.2360 42.2471 176.8491 121 G 3.9156 8.1062 106.9980 46.6633 0.0000 172.9950 122 C 4.7548 7.7621 113.3438 55.6469 32.6925 172.7574 123 H 4.4855 8.1492 116.0543 55.6471 29.1331 176.6509 124 M 4.1538 8.4997 121.0485 57.9463 32.3455 177.4918 125 D 4.4848 8.0579 116.4653 56.3067 41.7209 175.8875 126 D 4.6680 7.9968 117.7727 54.4187 41.2597 175.3643 127 V 4.5392 7.4909 120.0788 61.0182 33.3897 174.1513 128 N 5.0861 8.8389 126.7997 51.7219 41.8300 173.2099 129 V 4.9610 8.3489 124.6424 61.0335 34.6642 174.2408 130 K 4.8851 9.4555 125.8180 55.1419 36.6340 174.6189 131 A 5.2647 8.4206 120.5890 50.6494 22.2871 175.6093 132 T 4.7851 9.0809 116.7056 62.0208 73.1796 174.0330 133 T 4.9197 8.7740 115.0789 60.0228 71.2189 174.1774 134 T 4.4209 8.3102 108.8966 61.2571 69.5258 174.2269 135 E 3.9228 8.7165 117.9430 58.5358 27.3850 175.5110 136 K 4.3877 8.7320 111.7609 56.6952 31.1206 176.2735 137 L 4.5625 7.6654 119.1653 53.9254 43.9636 177.8956 138 G 4.2054 8.4611 110.4631 44.8910 0.0000 174.2123 139 F 4.3790 8.2936 113.1483 59.9253 37.7594 177.6056 140 T 4.2303 6.4355 111.4215 64.3024 68.8961 176.8485 141 G 3.6390 7.8917 108.8723 46.9555 0.0000 175.1008 142 R 4.3998 7.9612 117.9440 55.9203 30.5897 176.4406 143 G 4.0892 8.0319 106.6497 46.9414 0.0000 174.7730 144 E 4.4597 8.9997 121.2009 57.5737 30.4369 176.6564 145 G 3.3849 7.1356 104.8025 45.0548 0.0000 171.0771 146 I 4.6922 7.6081 118.9900 59.4005 40.6336 175.3967 147 A 4.9530 8.6781 128.1356 50.8474 22.1084 175.3031 148 C 5.0082 8.3322 118.9352 58.2107 35.3763 172.7924 149 E 5.3582 9.4918 125.7300 55.1644 32.0698 174.8936 150 A 5.1115 8.6903 123.1603 50.8006 23.2174 175.5921 151 V 4.9867 8.9969 114.7886 59.4484 35.4583 174.7215 152 A 5.0330 9.1113 125.4829 49.9953 22.6775 174.5832 153 L 5.0032 8.9943 124.0755 53.4590 44.4451 175.5712 154 L 5.2398 8.9098 126.5852 53.3362 45.1959 175.4199 155 I 4.6774 8.5168 121.1290 60.4056 40.1032 176.2484 156 K 4.1395 8.9916 126.7594 57.0035 33.0937 174.2631 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 8.30 4.82 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.63 0.00 2 R 8.94 4.54 0.00 1.61 1.78 0.00 3.27 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 3 I 8.53 4.82 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 1.28 1.32 0.91 0.00 0.00 4 G 9.00 5.01 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 0.00 5 H 8.99 5.47 0.00 3.14 3.16 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 G 9.16 4.76 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 0.00 0.00 0.00 7 F 8.60 5.44 0.00 2.98 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.34 4.74 0.00 2.69 2.36 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 9 V 7.92 4.52 1.95 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 0.68 0.00 0.00 0.93 0.00 0.00 10 H 8.76 5.00 0.00 2.98 3.02 0.00 5.66 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 11 A 8.44 4.49 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 12 F 8.84 5.03 0.00 3.14 2.96 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 13 G 9.20 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.45 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 15 E 8.33 4.59 0.00 1.95 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 2.27 2.30 0.00 16 G 8.63 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 0.00 0.00 0.00 0.00 17 P 0.00 4.91 0.00 2.14 2.09 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 18 I 8.44 4.29 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.82 1.15 0.00 0.00 19 I 8.28 4.77 1.87 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 1.52 1.47 0.89 0.00 0.00 20 I 8.45 4.83 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 1.19 0.95 0.89 0.00 0.00 21 G 9.75 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 0.00 0.00 0.00 22 G 8.62 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 0.00 0.00 0.00 23 V 7.48 4.40 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 0.99 0.00 0.00 1.13 0.00 0.00 24 R 8.77 4.76 0.00 1.77 1.90 0.00 3.23 0.00 0.00 3.24 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 25 I 8.98 4.34 1.79 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.92 0.77 0.00 0.00 26 P 0.00 4.72 0.00 1.98 2.03 0.00 3.73 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 27 Y 8.44 4.75 0.00 2.96 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.73 3.65 0.00 1.43 1.12 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 2.04 2.12 0.00 29 K 7.01 4.79 0.00 1.48 1.67 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.13 0.95 7.81 30 G 7.81 4.40 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 0.00 31 L 8.34 5.50 0.00 1.49 1.51 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.66 4.27 0.00 1.57 1.60 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 33 A 7.96 4.33 1.15 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 34 H 9.12 4.57 0.00 3.17 3.37 0.00 5.64 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.28 4.94 0.00 4.00 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 36 D 8.67 4.36 0.00 2.76 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.66 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.49 4.98 0.00 2.81 2.45 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 39 V 8.26 3.87 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 1.00 0.00 0.00 0.86 0.00 0.00 40 A 7.86 3.93 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 41 L 8.22 4.03 0.00 1.72 1.74 0.98 1.02 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 42 H 8.45 4.22 0.00 3.42 3.30 0.00 5.64 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 43 A 8.14 3.95 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 44 L 8.07 3.87 0.00 1.88 1.86 0.87 0.66 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 45 T 8.15 3.90 4.45 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 1.31 0.00 0.00 46 D 8.42 4.41 0.00 2.82 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 47 A 7.93 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 48 L 8.03 3.98 0.00 1.95 1.90 0.84 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.56 4.19 0.00 1.70 1.71 0.95 0.81 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 50 G 8.53 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.16 4.44 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 52 A 7.59 3.50 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 53 A 7.48 3.70 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 54 L 8.54 4.66 0.00 1.55 1.62 0.93 0.90 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 55 G 9.56 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 56 D 8.45 4.62 0.00 3.05 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 57 I 9.25 3.88 2.01 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 1.60 1.88 0.91 0.00 0.00 58 G 8.05 3.59 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 0.00 0.00 0.00 59 K 8.66 4.03 0.00 1.65 2.10 0.00 1.65 0.00 0.00 1.60 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.41 7.81 60 L 7.50 3.92 0.00 1.45 0.54 0.69 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 61 F 7.83 4.82 0.00 3.05 2.89 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 62 P 0.00 4.75 0.00 2.23 2.27 0.00 3.77 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 2.07 1.98 0.00 63 D 8.43 4.61 0.00 2.69 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 64 T 7.97 3.92 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 65 D 7.63 4.75 0.00 2.68 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 66 P 0.00 4.37 0.00 2.26 2.30 0.00 3.81 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 2.08 1.97 0.00 67 A 8.03 3.81 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 68 F 8.17 4.61 0.00 3.20 2.89 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 69 K 7.75 4.04 0.00 1.93 1.78 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.53 1.63 7.81 70 G 9.06 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 0.00 0.00 0.00 71 A 7.40 4.41 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 72 D 8.30 4.62 0.00 2.99 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 73 S 9.14 4.19 0.00 3.86 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 74 R 7.97 3.93 0.00 1.99 1.96 0.00 2.81 0.00 0.00 3.05 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 75 E 8.18 4.01 0.00 2.28 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 2.43 2.42 0.00 76 L 7.67 3.46 0.00 1.68 1.26 0.76 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.26 3.99 0.00 1.84 1.88 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.22 4.09 0.00 2.15 2.07 0.00 3.24 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.85 0.00 79 E 8.61 4.06 0.00 2.27 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 0.00 2.03 2.47 0.00 80 A 8.49 4.06 1.54 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 81 W 8.69 4.50 0.00 3.50 3.32 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 82 R 8.15 3.76 0.00 2.07 2.19 0.00 2.87 0.00 0.00 3.45 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.81 0.00 83 R 7.72 3.93 0.00 1.90 1.99 0.00 3.09 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 84 I 7.75 3.93 1.97 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.09 0.92 0.00 0.00 85 Q 8.13 4.20 0.00 1.60 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.75 1.16 0.00 86 A 7.85 3.98 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 87 K 7.57 4.09 0.00 2.00 2.03 0.00 1.88 0.00 0.00 2.14 0.00 0.00 3.12 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.45 7.81 88 G 7.16 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 89 Y 7.67 5.10 0.00 2.85 2.84 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 90 T 8.54 5.10 4.39 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 1.25 0.00 0.00 91 L 8.84 4.46 0.00 1.78 1.70 0.70 0.82 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 92 G 9.30 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 93 N 7.55 5.03 0.00 2.85 2.88 0.00 0.00 5.77 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 94 V 8.63 4.95 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 0.64 0.00 0.00 0.92 0.00 0.00 95 D 9.04 5.12 0.00 2.72 2.45 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 96 V 8.92 4.70 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 0.84 0.00 0.00 0.90 0.00 0.00 97 T 9.18 4.95 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 1.22 0.00 0.00 98 I 8.94 4.16 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 1.20 0.62 0.87 0.00 0.00 99 I 8.91 4.86 1.84 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 1.17 1.07 0.85 0.00 0.00 100 A 8.77 4.80 1.17 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 0.00 0.00 0.00 101 Q 9.03 3.95 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.67 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 102 A 7.41 4.55 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 0.00 103 P 0.00 4.56 0.00 2.18 2.11 0.00 3.45 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.70 0.00 104 K 8.43 4.04 0.00 1.74 1.80 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.53 7.81 105 M 8.57 4.36 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.67 0.00 106 L 7.87 3.93 0.00 1.74 1.65 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 107 P 0.00 4.25 0.00 1.78 1.99 0.00 3.64 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 1.97 2.13 0.00 108 H 8.12 4.70 0.00 3.25 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.25 3.68 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 1.51 0.76 0.92 0.00 0.00 110 P 0.00 4.16 0.00 2.08 2.06 0.00 3.63 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 2.07 2.11 0.00 111 Q 7.88 3.73 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.22 1.83 0.00 112 M 7.76 4.42 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.62 0.00 113 R 8.07 3.89 0.00 1.96 1.94 0.00 3.11 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 1.62 1.77 0.00 114 V 7.44 3.51 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.89 0.00 0.00 115 F 7.64 4.60 0.00 3.23 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 0.00 116 I 8.03 3.67 1.85 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 1.02 0.82 0.00 0.00 117 A 8.22 3.95 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 0.00 118 E 8.07 3.95 0.00 2.27 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 2.40 2.59 0.00 119 D 8.19 4.51 0.00 2.75 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 0.00 120 L 7.74 3.64 0.00 1.25 0.79 0.53 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.11 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 0.00 122 C 7.76 4.75 0.00 3.03 2.88 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 0.00 123 H 8.15 4.49 0.00 3.29 3.26 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 M 8.50 4.15 0.00 2.04 2.05 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 2.78 2.50 0.00 125 D 8.06 4.48 0.00 2.67 2.67 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 0.00 126 D 8.00 4.67 0.00 2.91 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 V 7.49 4.54 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.87 0.00 0.00 128 N 8.84 5.09 0.00 2.86 2.76 0.00 0.00 6.14 7.73 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 0.00 129 V 8.35 4.96 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 0.88 0.00 0.00 0.91 0.00 0.00 130 K 9.46 4.89 0.00 1.75 1.84 0.00 1.31 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.36 7.81 131 A 8.42 5.26 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 0.00 132 T 9.08 4.79 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 1.20 0.00 0.00 133 T 8.77 4.92 4.46 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 1.26 0.00 0.00 134 T 8.31 4.42 4.21 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 1.13 0.00 0.00 135 E 8.72 3.92 0.00 2.11 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 2.25 2.40 0.00 136 K 8.73 4.39 0.00 1.90 1.94 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.51 7.81 137 L 7.67 4.56 0.00 1.76 1.53 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.46 4.21 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 0.00 139 F 8.29 4.38 0.00 3.29 3.35 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 0.00 140 T 6.44 4.23 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 0.87 0.00 0.00 141 G 7.89 3.64 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 0.00 0.00 0.00 142 R 7.96 4.40 0.00 1.96 2.06 0.00 3.28 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 143 G 8.03 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 0.00 0.00 0.00 0.00 144 E 9.00 4.46 0.00 2.29 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 0.00 2.42 2.52 0.00 145 G 7.14 3.38 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 0.00 146 I 7.61 4.69 1.68 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 1.09 0.23 0.88 0.00 0.00 147 A 8.68 4.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 C 8.33 5.01 0.00 2.86 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 0.00 149 E 9.49 5.36 0.00 1.94 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 2.53 2.53 0.00 150 A 8.69 5.11 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 0.00 151 V 9.00 4.99 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 0.77 0.00 0.00 0.99 0.00 0.00 152 A 9.11 5.03 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 0.00 153 L 8.99 5.00 0.00 1.74 1.53 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.91 5.24 0.00 1.53 1.71 0.78 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.52 4.68 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.34 0.97 0.00 0.00 156 K 8.99 4.14 0.00 1.87 1.74 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.36 7.81