NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1207 8.3144 121.7725 55.8575 33.3094 174.8285 2 V 3.5002 7.7345 122.1146 61.3863 32.2283 174.6334 3 K 3.9133 8.2194 122.7067 59.3468 32.8012 177.5854 4 F 4.5792 6.9197 111.1807 56.4032 39.1526 174.5830 5 T 4.5079 8.2667 115.7466 60.7451 69.0063 175.1022 6 E 4.1264 9.0314 124.5483 60.0653 29.2830 179.4046 7 E 3.9860 8.4541 117.6853 59.6519 29.4486 179.1434 8 E 3.8443 8.6947 119.4461 59.4020 29.4317 178.1129 9 D 4.3630 7.9586 117.9146 57.4897 40.8218 178.7063 10 L 3.8890 7.5536 119.0836 57.4964 41.7206 179.2920 11 K 3.9581 8.3784 118.8728 59.2995 31.8953 179.2096 12 L 3.9686 7.3325 119.0436 58.0246 41.3761 179.1583 13 Q 4.1018 7.5217 117.7922 59.3982 28.9740 178.5743 14 Q 4.1077 7.8057 118.2555 58.7257 29.0491 178.0478 15 L 3.8816 8.2943 120.0829 58.0339 41.8250 179.8347 16 V 3.3235 8.0867 118.3977 66.2356 31.0888 177.7080 17 M 4.2024 7.4946 117.3540 58.3025 32.0979 177.7790 18 R 3.8345 7.7718 118.4904 58.3659 30.3188 176.9692 19 Y 4.3882 7.3424 113.5913 57.8234 38.5765 175.5320 20 G 3.8955 7.9086 114.0155 43.4162 0.0000 174.1159 21 A 4.3785 6.1304 135.0000 50.7032 20.1421 177.1659 22 K 4.5419 6.5651 116.8587 56.4580 37.6215 176.8316 23 D 4.7268 7.0062 121.2790 53.6016 40.3577 177.9130 24 W 4.0957 7.5598 121.3213 59.6385 29.2167 178.0585 25 I 3.7625 7.6895 112.1430 63.6321 37.2715 178.0473 26 R 3.8672 7.7020 120.4931 59.3961 29.8812 178.4245 27 I 3.5198 7.1569 118.9434 64.4922 36.9330 178.4274 28 S 4.1982 8.4877 116.3318 61.2909 62.3901 176.5983 29 Q 4.0007 7.7701 120.4014 58.7401 28.4771 178.4261 30 L 4.1966 7.8288 118.4433 57.0812 43.4535 177.8896 31 M 4.6940 7.4329 118.8647 53.2151 31.3650 176.7371 32 I 4.2808 7.5240 111.4897 62.0246 38.1226 178.4553 33 T 4.2279 7.8473 117.5782 64.9229 68.3111 174.0381 34 R 4.7762 7.5028 116.9737 54.5702 32.8615 174.2975 35 N 4.8513 8.4384 115.9769 51.4318 40.2657 174.5309 36 P 4.5896 0.0000 0.0000 65.8709 30.9723 178.9390 37 R 3.7590 7.8631 116.8085 58.6427 29.7788 178.8344 38 Q 4.0342 7.9457 117.8225 59.2093 29.1488 178.1065 39 C 4.2693 7.9407 117.2012 62.3089 28.2471 175.9619 40 R 2.5100 7.0284 120.3713 58.8453 29.5939 178.1659 41 E 3.8607 8.3037 118.7343 59.8005 29.3978 179.8560 42 R 4.1922 7.9397 117.7343 58.6661 30.2121 178.2034 43 W 4.7785 8.4146 128.8536 61.1827 30.4339 177.7737 44 N 4.1205 8.2238 114.9424 55.1509 37.3094 175.0981 45 N 5.0163 7.9127 117.0578 53.0510 38.8757 174.9258 46 Y 4.5576 8.2490 119.1102 58.2283 45.2416 175.1779 47 I 4.6237 7.7091 112.3730 59.8183 40.3433 172.5521 48 N 4.1978 8.5052 131.3169 53.3593 41.4329 173.1860 49 P 4.4126 0.0000 0.0000 61.7326 32.8266 173.8860 50 A 3.5375 7.8425 120.2768 52.9848 14.7736 177.0602 51 L 4.5602 7.3225 116.5461 55.4043 41.6221 179.3208 52 R 4.0941 7.9826 115.8366 59.5512 29.7240 177.1635 53 T 4.6475 7.4367 114.2376 63.2206 71.2049 173.7606 54 D 4.8089 7.4438 123.2138 51.8101 41.6864 173.0900 55 P 4.0968 0.0000 0.0000 61.9016 32.5789 177.5875 56 W 4.5433 7.3460 118.7841 55.9788 29.9538 174.0281 57 S 4.9169 8.4896 113.2288 55.6360 65.8596 173.0474 58 P 4.4753 0.0000 0.0000 65.7335 30.6579 178.6076 59 E 3.9992 8.2417 117.3995 59.6032 29.3827 178.9266 60 E 3.8423 8.4677 118.5697 58.9915 29.4106 178.6845 61 D 4.6762 8.2071 117.7510 57.9677 40.1440 178.3461 62 M 4.1328 8.5325 119.3784 58.3234 31.9090 178.6218 63 L 4.1110 8.3110 118.8904 56.7254 41.7348 179.1236 64 L 3.8512 8.6122 122.2586 57.8724 41.9193 177.9112 65 D 4.2216 8.0469 118.0018 57.6419 40.6640 178.6703 66 Q 3.9978 7.5644 118.5474 58.5640 28.8777 178.5397 67 K 3.8239 7.6529 119.2493 59.6061 32.2078 178.5221 68 Y 4.0785 8.5269 120.0995 61.0207 38.3798 178.0969 69 A 3.9799 7.6352 120.0219 54.9923 18.3331 178.9447 70 E 3.8711 6.9275 115.6907 58.9489 30.0987 177.9430 71 Y 4.1661 7.4583 115.4141 60.1988 39.2022 175.8072 72 G 2.8185 8.3266 106.9607 43.5634 0.0000 172.6013 73 P 2.9700 0.0000 0.0000 62.5157 32.0499 178.5503 74 K 3.9371 6.8625 118.7420 55.3436 28.4574 177.4179 75 W 4.6581 6.5735 120.1205 58.8879 29.4274 177.3109 76 N 4.3663 7.9037 116.8041 56.2626 38.4762 176.2278 77 K 4.0282 8.2826 120.1999 58.7251 32.1823 179.3761 78 I 3.8807 7.5556 119.8573 64.5457 37.2086 178.2840 79 S 3.6281 8.2719 115.1651 61.6148 62.2175 176.4925 80 K 3.9480 7.4735 120.2759 58.3686 31.9086 178.3622 81 F 4.2806 8.9180 117.8249 58.4681 39.3397 177.0467 82 L 4.3411 7.6777 118.2589 56.3556 42.2042 178.1727 83 K 3.9791 8.2281 114.2744 56.9752 30.5293 176.0010 84 N 4.8881 7.9634 114.5428 52.8498 40.5630 173.8214 85 R 4.7877 7.7985 115.2672 53.7694 34.2209 174.3763 86 S 4.8428 8.0452 112.3413 56.2852 67.1193 174.4200 87 D 4.4778 8.2698 122.4792 56.8095 38.4639 178.4508 88 N 3.9173 7.6978 118.2858 56.1138 38.7276 176.2990 89 N 4.3285 7.4443 118.2863 56.1396 39.0617 177.1494 90 I 4.1547 8.0908 121.6420 64.5739 37.0278 178.2432 91 R 2.5713 7.9811 120.0786 59.0406 29.8474 177.9157 92 N 4.3063 7.6776 115.9072 56.2929 39.1141 177.0382 93 R 3.8110 8.6436 121.0257 58.8558 30.0107 178.0389 94 W 4.6897 9.0788 129.2283 61.0327 30.1378 177.8425 95 M 3.3992 7.7054 118.1866 57.9556 31.0964 178.3203 96 M 3.9889 7.1552 116.7730 58.2852 32.8785 177.7934 97 I 3.8573 8.0109 119.8888 63.5415 37.5065 177.8454 98 A 3.4717 8.1282 122.1474 53.8951 17.8338 179.2735 99 R 3.8629 7.1502 115.3438 58.9383 30.1549 177.5214 100 H 4.2916 7.6008 117.1645 58.7385 30.0767 176.5688 101 R 4.2502 7.7280 116.6513 56.7603 30.3806 177.7368 102 A 4.1408 7.4572 121.1637 53.8984 18.5881 178.1938 103 K 3.8056 8.3214 115.1711 58.0761 30.9309 177.7463 104 H 4.7604 9.1171 119.4888 56.6805 32.3317 175.7309 105 Q 3.9042 8.2795 121.9007 58.2690 28.8122 177.1939 106 K 4.0226 7.9176 117.5269 59.3852 32.4093 176.0363 107 S 4.1370 8.0243 117.4351 58.9778 62.5349 173.4239 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 K 8.31 4.12 0.00 1.71 1.73 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.44 7.81 2 V 7.73 3.50 1.10 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 0.03 0.00 0.00 0.81 0.00 0.00 3 K 8.22 3.91 0.00 1.76 1.88 0.00 1.86 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.37 7.81 4 F 6.92 4.58 0.00 3.15 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.27 4.51 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 1.30 0.00 0.00 6 E 9.03 4.13 0.00 2.16 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 2.63 2.58 0.00 7 E 8.45 3.99 0.00 2.02 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 2.47 2.38 0.00 8 E 8.69 3.84 0.00 2.12 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 0.00 2.05 2.07 0.00 9 D 7.96 4.36 0.00 2.76 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 10 L 7.55 3.89 0.00 1.76 1.67 0.94 1.04 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 11 K 8.38 3.96 0.00 1.93 1.83 0.00 2.02 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.64 7.81 12 L 7.33 3.97 0.00 1.72 1.82 0.66 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 7.52 4.10 0.00 2.02 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.01 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 14 Q 7.81 4.11 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 15 L 8.29 3.88 0.00 1.81 1.90 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.09 3.32 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 0.63 0.00 0.00 0.97 0.00 0.00 17 M 7.49 4.20 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.48 0.00 18 R 7.77 3.83 0.00 1.50 1.28 0.00 3.05 0.00 0.00 2.77 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.33 0.00 19 Y 7.34 4.39 0.00 2.64 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 20 G 7.91 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 6.13 4.38 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 6.57 4.54 0.00 1.75 1.74 0.00 1.50 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.27 1.33 7.81 23 D 7.01 4.73 0.00 2.17 2.37 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 24 W 7.56 4.10 0.00 3.37 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 25 I 7.69 3.76 1.84 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 1.49 0.43 0.93 0.00 0.00 26 R 7.70 3.87 0.00 1.58 1.34 0.00 3.00 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 27 I 7.16 3.52 1.81 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 -0.25 0.91 0.00 0.00 28 S 8.49 4.20 0.00 4.05 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 7.77 4.00 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 30 L 7.83 4.20 0.00 1.74 1.73 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 31 M 7.43 4.69 0.00 2.04 1.98 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 2.50 2.44 0.00 32 I 7.52 4.28 1.88 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 1.43 1.82 0.98 0.00 0.00 33 T 7.85 4.23 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 1.25 0.00 0.00 34 R 7.50 4.78 0.00 2.05 2.06 0.00 3.10 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 35 N 8.44 4.85 0.00 2.85 2.76 0.00 0.00 6.56 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 36 P 0.00 4.59 0.00 2.33 2.57 0.00 3.87 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 2.09 1.97 0.00 37 R 7.86 3.76 0.00 1.81 1.92 0.00 3.09 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 38 Q 7.95 4.03 0.00 2.31 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 39 C 7.94 4.27 0.00 3.10 3.10 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 40 R 7.03 2.51 0.00 0.67 1.24 0.00 2.60 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.04 0.00 41 E 8.30 3.86 0.00 2.22 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 2.28 2.42 0.00 42 R 7.94 4.19 0.00 2.15 2.34 0.00 3.82 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 43 W 8.41 4.78 0.00 3.59 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 44 N 8.22 4.12 0.00 2.78 2.71 0.00 0.00 6.19 8.12 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 45 N 7.91 5.02 0.00 3.01 2.89 0.00 0.00 6.39 7.10 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 46 Y 8.25 4.56 0.00 3.14 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 47 I 7.71 4.62 2.02 0.00 0.00 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 1.46 1.18 1.15 0.00 0.00 48 N 8.51 4.20 0.00 1.44 2.29 0.00 0.00 6.77 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.41 0.00 2.14 2.02 0.00 3.84 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.80 0.00 50 A 7.84 3.54 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 51 L 7.32 4.56 0.00 1.86 1.86 0.95 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 52 R 7.98 4.09 0.00 1.94 2.12 0.00 3.06 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 53 T 7.44 4.65 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 1.17 0.00 0.00 54 D 7.44 4.81 0.00 2.56 2.52 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 55 P 0.00 4.10 0.00 1.89 1.77 0.00 3.75 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.82 0.00 56 W 7.35 4.54 0.00 3.61 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.49 4.92 0.00 3.95 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 58 P 0.00 4.48 0.00 2.21 2.19 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 59 E 8.24 4.00 0.00 2.05 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 0.00 2.46 2.39 0.00 60 E 8.47 3.84 0.00 1.71 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 2.33 2.32 0.00 61 D 8.21 4.68 0.00 3.15 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 62 M 8.53 4.13 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.92 0.00 63 L 8.31 4.11 0.00 1.64 1.62 0.91 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 64 L 8.61 3.85 0.00 1.37 1.66 0.90 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.05 4.22 0.00 2.92 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 66 Q 7.56 4.00 0.00 2.36 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.60 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 67 K 7.65 3.82 0.00 1.73 1.96 0.00 1.46 0.00 0.00 1.08 0.00 0.00 2.58 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.18 1.45 7.81 68 Y 8.53 4.08 0.00 2.71 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 69 A 7.64 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 6.93 3.87 0.00 1.16 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 2.01 2.18 0.00 71 Y 7.46 4.17 0.00 2.75 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 72 G 8.33 2.82 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 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 2.97 0.00 1.81 2.08 0.00 3.41 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.93 0.00 74 K 6.86 3.94 0.00 1.66 1.62 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.35 7.81 75 W 6.57 4.66 0.00 3.38 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 7.90 4.37 0.00 2.70 2.77 0.00 0.00 7.05 6.88 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 77 K 8.28 4.03 0.00 1.47 1.19 0.00 1.59 0.00 0.00 1.19 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.22 1.29 7.81 78 I 7.56 3.88 2.04 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 1.93 1.25 0.90 0.00 0.00 79 S 8.27 3.63 0.00 4.06 4.33 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 80 K 7.47 3.95 0.00 1.69 1.61 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.53 7.81 81 F 8.92 4.28 0.00 3.06 3.04 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 82 L 7.68 4.34 0.00 1.88 1.72 1.09 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.23 3.98 0.00 1.87 1.89 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.36 7.81 84 N 7.96 4.89 0.00 2.69 2.84 0.00 0.00 6.93 8.73 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 85 R 7.80 4.79 0.00 1.82 1.93 0.00 3.29 0.00 0.00 3.51 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.78 0.00 86 S 8.05 4.84 0.00 3.67 3.75 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 87 D 8.27 4.48 0.00 3.16 3.15 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 88 N 7.70 3.92 0.00 2.32 2.50 0.00 0.00 6.69 6.73 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 89 N 7.44 4.33 0.00 2.79 2.92 0.00 0.00 7.11 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 90 I 8.09 4.15 1.67 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 1.47 1.02 0.43 0.00 0.00 91 R 7.98 2.57 0.00 1.67 1.88 0.00 3.31 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.10 0.00 92 N 7.68 4.31 0.00 2.91 2.88 0.00 0.00 6.71 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.64 3.81 0.00 1.54 1.68 0.00 2.27 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 94 W 9.08 4.69 0.00 3.09 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 95 M 7.71 3.40 0.00 1.95 2.24 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.63 0.00 96 M 7.16 3.99 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.43 0.00 97 I 8.01 3.86 1.88 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.95 0.97 0.00 0.00 98 A 8.13 3.47 0.27 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 99 R 7.15 3.86 0.00 1.92 2.03 0.00 3.21 0.00 0.00 3.09 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 100 H 7.60 4.29 0.00 3.14 3.37 0.00 5.99 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 0.00 101 R 7.73 4.25 0.00 1.70 1.94 0.00 3.22 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 102 A 7.46 4.14 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 0.00 103 K 8.32 3.81 0.00 1.75 1.55 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.38 7.81 104 H 9.12 4.76 0.00 3.27 3.42 0.00 5.50 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.28 3.90 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.03 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 106 K 7.92 4.02 0.00 1.78 1.86 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.47 7.81 107 S 8.02 4.14 0.00 3.83 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00