NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8331 8.3544 109.7406 45.3844 0.0000 173.5675 4 D 4.6341 9.4774 122.7059 49.8073 42.7048 174.8039 5 P 4.4162 0.0000 0.0000 65.7781 30.1706 177.8270 6 A 3.9747 8.5228 120.9869 55.0531 18.3344 179.5381 7 K 4.3075 8.3849 117.8084 59.2945 32.3140 179.0353 8 G 3.7245 8.4343 106.7205 47.7871 0.0000 175.2395 9 E 2.5400 7.7928 120.4290 58.4584 29.8398 178.5196 10 A 4.0786 7.2545 119.3720 54.9927 18.4092 179.7868 11 V 3.5640 7.7287 116.8657 65.9325 31.5865 177.8396 12 F 4.0177 8.3623 120.1324 60.4382 39.0336 177.0056 13 K 4.0279 7.8515 118.0753 59.3796 31.5779 178.5159 14 K 3.9821 7.9249 116.9487 57.8526 32.3951 177.7520 15 C 4.0082 7.5478 116.9332 60.4296 27.8696 175.5848 16 M 4.2531 7.1416 120.8233 57.3136 31.1796 178.3813 17 A 4.1897 7.7005 119.7138 54.3881 18.8805 177.3745 18 C 4.7303 7.5036 112.0328 59.3495 31.0875 173.8285 19 H 5.3199 8.3135 115.3990 53.8865 32.6668 172.8010 20 R 4.9430 8.4736 117.9735 54.7803 34.3626 174.6565 21 V 4.3471 8.3716 113.4691 60.0895 36.0077 174.0992 22 G 3.7582 7.9988 107.7912 43.3927 0.0000 171.7429 23 P 4.2796 0.0000 0.0000 64.1968 31.5400 175.8300 24 D 4.3408 8.8000 120.5180 55.0122 38.5834 173.8524 25 A 4.1094 8.0319 120.3771 52.0965 19.1302 178.0012 26 K 4.6550 8.1874 121.2578 54.2204 34.8513 176.0368 27 N 4.7232 8.4544 117.9228 53.5266 40.0763 175.1393 28 L 4.8088 8.0350 122.7553 54.3205 42.2205 179.4347 29 V 3.7279 8.8147 125.2947 65.9188 31.6532 175.6301 30 G 4.0770 7.8351 106.0140 42.9469 0.0000 171.1667 31 P 4.5959 0.0000 0.0000 61.7951 32.1450 176.1494 32 A 4.1824 8.6090 123.3839 52.3956 18.9232 177.6296 33 L 4.4382 8.6712 119.7870 54.5501 42.3268 176.6868 34 T 3.8790 7.6271 116.9336 64.6134 68.7005 174.4660 35 G 4.4568 8.7034 114.4060 45.4678 0.0000 175.1669 36 V 3.7812 7.5416 122.0747 63.6929 31.7763 176.5301 37 I 4.0623 7.6283 121.7888 62.6539 37.0518 175.3385 38 D 4.5496 9.1328 124.1620 54.4186 40.6480 173.3737 39 R 4.3097 8.0236 118.9643 56.0648 31.3932 175.4644 40 Q 4.0504 8.6158 126.9050 55.7506 30.0474 175.6781 41 A 3.9363 8.4161 128.7314 52.5422 19.7188 177.7260 42 G 2.3407 8.4679 108.5017 46.6682 0.0000 174.2332 43 T 4.5484 7.7312 105.6032 60.2715 69.9795 173.5422 44 A 4.1680 8.4412 126.9771 51.7625 18.8394 175.7750 45 P 4.2467 0.0000 0.0000 64.2284 31.7726 177.1608 46 G 3.9316 8.8399 109.2149 45.8154 0.0000 173.0527 47 F 4.3266 7.8052 122.0392 56.8013 40.3559 175.2380 48 N 4.5126 6.8492 124.9171 51.7906 37.8429 174.5834 49 Y 4.6236 8.2423 121.0349 57.0850 39.2454 176.5832 50 S 4.5219 8.7023 116.4143 57.9900 65.3869 175.0973 51 A 4.0593 8.5297 124.2558 55.4280 18.1663 179.9154 52 I 3.7348 7.7879 116.7248 64.1915 37.9717 177.5354 53 N 4.4322 8.3937 118.1163 56.8205 38.9207 176.4334 54 H 3.9930 8.4055 119.5218 59.2124 30.0258 177.0995 55 A 3.9482 8.5172 122.8113 55.0589 18.1246 179.4075 56 A 4.0808 8.1496 119.4476 55.2100 18.3535 180.1492 57 G 3.6010 7.4600 105.4049 47.5035 0.0000 175.8877 58 E 3.8905 7.7180 119.5125 58.5417 29.4910 178.3893 59 A 4.3002 7.5399 118.4402 51.9865 18.8397 177.7565 60 G 4.0722 7.8976 105.4729 44.7643 0.0000 173.9552 61 L 3.5671 8.1473 123.8957 54.9283 42.6730 175.3766 62 H 4.8027 8.2548 122.7650 53.2479 32.0821 174.7603 63 W 4.8948 8.4776 123.7053 55.9655 27.0937 176.2102 64 T 4.4282 7.7859 113.3332 60.2801 70.0258 174.5903 65 P 4.3000 0.0000 0.0000 66.4292 30.9475 178.4370 66 E 4.0287 8.2020 117.6375 59.3225 29.4621 178.9438 67 N 4.5028 8.2070 116.0287 56.3474 38.6141 177.6270 68 I 3.6830 8.0137 121.3471 64.3615 36.9598 178.4744 69 I 3.7194 7.6619 119.4578 64.4317 37.0440 178.0973 70 A 4.2160 7.8646 120.1879 54.5810 18.6629 178.8323 71 Y 3.9488 7.5492 118.5677 60.7080 38.8320 177.3550 72 L 3.7425 7.9564 120.1309 57.3815 41.4768 177.7926 73 P 4.4902 0.0000 0.0000 64.6533 32.4457 176.1179 74 D 4.4139 7.8031 113.9859 51.4764 43.3236 173.5624 75 P 3.8590 0.0000 0.0000 65.2764 31.4559 177.4217 76 N 4.4291 8.2382 114.0902 56.4099 38.5771 177.0538 77 A 4.0452 8.2574 121.9426 55.1461 18.4634 179.4586 78 F 4.1208 8.3976 119.0162 61.5880 39.5836 177.3713 79 L 4.1214 8.4453 118.6311 57.9428 41.4395 179.7943 80 R 3.9751 8.3597 118.1868 59.1499 29.9275 179.0823 81 K 3.9388 8.0652 119.4556 59.2401 32.2893 178.6385 82 F 3.7300 8.1117 121.0175 61.2334 39.2091 177.1749 83 L 4.0329 8.0894 118.4032 57.5749 41.4151 179.3914 84 A 3.9373 7.9877 120.7411 55.4066 18.1794 179.4573 85 D 4.2354 8.0329 116.0249 57.1713 40.9111 178.2691 86 A 4.1223 7.3045 118.7025 52.6164 18.6276 178.1021 87 G 3.8537 8.1086 105.5810 45.5964 0.0000 173.7387 88 H 4.9101 8.4328 115.3041 54.5494 29.7054 175.7166 89 A 4.0530 8.1451 124.5403 55.1806 18.7311 180.3119 90 E 3.9739 8.1910 112.6402 59.1309 29.6012 177.6462 91 Q 4.3319 8.0444 116.3407 56.0404 28.9423 175.6091 92 A 4.7068 7.8983 120.5183 52.0093 19.0627 178.5455 93 K 4.1719 8.0505 119.4860 59.3422 32.6777 177.6258 94 G 4.0195 7.7395 106.8152 44.5280 0.0000 172.2734 95 S 4.7380 8.1561 111.9375 56.3913 65.5157 173.9132 96 T 4.3743 8.3670 119.7061 61.6512 67.8485 174.9554 97 K 4.1103 8.6353 124.9507 58.2866 32.4426 177.1875 98 M 4.2884 7.8365 118.6879 54.9176 31.3019 176.2649 99 V 4.2062 7.8669 129.3723 60.0650 30.2863 174.3319 100 F 4.6992 7.4152 121.2404 56.7453 42.5816 173.1049 101 K 4.5963 7.2071 125.2296 54.4924 35.4900 176.2273 102 L 4.4883 8.2770 123.8907 52.1999 42.3270 174.2490 103 P 4.2699 0.0000 0.0000 64.9068 32.0278 178.1087 104 D 4.3173 8.0268 118.9211 54.0489 41.9208 176.1324 105 E 3.9194 8.8586 127.5880 59.4525 29.6814 178.4932 106 Q 3.9416 8.1037 118.9474 59.3446 29.1788 177.7865 107 E 3.9792 8.7982 119.8865 59.4824 29.4485 179.6731 108 R 3.9461 8.0514 118.0015 59.2259 30.1875 179.1943 109 K 3.9887 8.2437 118.3348 59.6428 32.0705 179.2153 110 D 4.4169 8.4835 119.6376 57.3655 40.7403 179.2475 111 V 3.8292 8.2426 120.1240 64.8271 31.3951 178.6556 112 V 3.6207 8.0186 118.8185 65.6702 31.1370 177.8761 113 A 4.0600 7.8943 119.9036 55.1614 18.5191 178.7558 114 Y 4.2554 8.1431 118.1646 60.9792 38.9486 178.1080 115 L 3.9389 8.2838 119.9641 57.5943 41.3033 179.5949 116 K 4.0921 8.2200 118.2628 59.0645 31.6964 178.9894 117 Q 3.9424 7.6551 117.1682 57.3951 28.7905 176.7532 118 F 4.6984 7.7327 118.2075 56.8765 39.5988 175.0699 119 S 4.8996 7.6377 116.0924 55.8027 66.7108 172.6368 120 P 4.3952 0.0000 0.0000 63.2531 31.0437 176.3450 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 3 G 8.35 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 4 D 9.48 4.63 0.00 2.74 2.68 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 0.00 0.00 0.00 0.00 5 P 0.00 4.42 0.00 2.50 2.51 0.00 3.78 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 6 A 8.52 3.97 1.43 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 0.00 0.00 7 K 8.38 4.31 0.00 1.88 1.96 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.56 7.81 8 G 8.43 3.72 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 0.00 0.00 0.00 9 E 7.79 2.54 0.00 1.64 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 0.00 2.14 1.94 0.00 10 A 7.25 4.08 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 11 V 7.73 3.56 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 1.11 0.00 0.00 0.97 0.00 0.00 12 F 8.36 4.02 0.00 3.09 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 13 K 7.85 4.03 0.00 1.92 1.80 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.56 7.81 14 K 7.92 3.98 0.00 1.78 1.92 0.00 1.75 0.00 0.00 1.88 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.47 7.81 15 C 7.55 4.01 0.00 1.42 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 16 M 7.14 4.25 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 17 A 7.70 4.19 1.16 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 0.00 0.00 18 C 7.50 4.73 0.00 2.64 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 19 H 8.31 5.32 0.00 2.98 3.14 0.00 5.56 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.47 4.94 0.00 1.80 1.75 0.00 3.24 0.00 0.00 3.38 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 21 V 8.37 4.35 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 0.00 0.00 0.19 0.00 0.00 0.01 0.00 0.00 22 G 8.00 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 0.00 0.00 0.00 23 P 0.00 4.28 0.00 2.21 2.10 0.00 3.98 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 24 D 8.80 4.34 0.00 2.81 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 25 A 8.03 4.11 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 26 K 8.19 4.66 0.00 1.74 1.73 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.61 7.81 27 N 8.45 4.72 0.00 2.81 2.97 0.00 0.00 6.72 7.85 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 28 L 8.03 4.81 0.00 1.73 1.05 0.89 1.09 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 29 V 8.81 3.73 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 0.78 0.00 0.00 0.91 0.00 0.00 30 G 7.84 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 0.00 0.00 0.00 0.00 31 P 0.00 4.60 0.00 1.83 0.89 0.00 3.33 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.55 0.00 32 A 8.61 4.18 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 33 L 8.67 4.44 0.00 1.61 1.56 0.76 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.63 3.88 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 1.30 0.00 0.00 35 G 8.70 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 0.00 0.00 0.00 0.00 36 V 7.54 3.78 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 0.70 0.00 0.00 0.83 0.00 0.00 37 I 7.63 4.06 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.82 0.95 0.00 0.00 38 D 9.13 4.55 0.00 2.79 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 39 R 8.02 4.31 0.00 2.20 2.03 0.00 3.21 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 40 Q 8.62 4.05 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.71 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 41 A 8.42 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.47 2.34 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 0.00 43 T 7.73 4.55 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 1.18 0.00 0.00 44 A 8.44 4.17 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.25 0.00 2.10 2.07 0.00 3.86 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 46 G 8.84 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 47 F 7.81 4.33 0.00 2.81 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 48 N 6.85 4.51 0.00 2.31 2.56 0.00 0.00 7.04 7.46 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 49 Y 8.24 4.62 0.00 3.12 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 50 S 8.70 4.52 0.00 4.16 4.13 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 0.00 0.00 0.00 51 A 8.53 4.06 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 52 I 7.79 3.73 1.95 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 1.75 1.68 1.04 0.00 0.00 53 N 8.39 4.43 0.00 3.07 3.05 0.00 0.00 6.84 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 54 H 8.41 3.99 0.00 3.30 3.55 0.00 5.65 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 55 A 8.52 3.95 1.43 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 0.00 0.00 56 A 8.15 4.08 1.26 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 0.00 0.00 0.00 57 G 7.46 3.60 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 0.00 0.00 0.00 58 E 7.72 3.89 0.00 2.03 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 0.00 2.20 2.29 0.00 59 A 7.54 4.30 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 60 G 7.90 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 61 L 8.15 3.57 0.00 0.27 0.82 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.25 4.80 0.00 2.93 3.08 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 W 8.48 4.89 0.00 3.46 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.79 4.43 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 1.24 0.00 0.00 65 P 0.00 4.30 0.00 2.32 2.40 0.00 3.75 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 2.12 2.10 0.00 66 E 8.20 4.03 0.00 2.15 2.12 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 2.45 2.51 0.00 67 N 8.21 4.50 0.00 3.04 2.99 0.00 0.00 7.06 7.46 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 68 I 8.01 3.68 2.01 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 1.34 1.30 0.81 0.00 0.00 69 I 7.66 3.72 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.77 0.94 0.00 0.00 70 A 7.86 4.22 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 71 Y 7.55 3.95 0.00 2.21 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 72 L 7.96 3.74 0.00 1.71 1.69 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.49 0.00 2.20 2.16 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 74 D 7.80 4.41 0.00 2.67 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 3.86 0.00 2.13 1.80 0.00 3.53 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.43 0.00 76 N 8.24 4.43 0.00 2.81 2.94 0.00 0.00 6.92 7.15 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 77 A 8.26 4.05 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 78 F 8.40 4.12 0.00 3.38 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.45 4.12 0.00 1.96 1.86 1.26 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.36 3.98 0.00 1.97 2.01 0.00 3.18 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 81 K 8.07 3.94 0.00 1.84 1.93 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.40 7.81 82 F 8.11 3.73 0.00 2.77 2.98 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 0.00 0.00 0.00 83 L 8.09 4.03 0.00 1.80 1.94 0.98 1.10 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 84 A 7.99 3.94 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 85 D 8.03 4.24 0.00 2.55 2.55 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 86 A 7.30 4.12 1.14 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 87 G 8.11 3.85 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 0.00 0.00 0.00 88 H 8.43 4.91 0.00 3.28 3.25 0.00 5.83 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 89 A 8.15 4.05 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 90 E 8.19 3.97 0.00 2.10 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 2.29 2.36 0.00 91 Q 8.04 4.33 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.32 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 92 A 7.90 4.71 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 93 K 8.05 4.17 0.00 1.78 1.90 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.56 7.81 94 G 7.74 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 95 S 8.16 4.74 0.00 3.83 3.73 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 96 T 8.37 4.37 4.44 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 1.42 0.00 0.00 97 K 8.64 4.11 0.00 1.94 1.94 0.00 1.88 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.53 7.81 98 M 7.84 4.29 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 99 V 7.87 4.21 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 0.87 0.00 0.00 1.01 0.00 0.00 100 F 7.42 4.70 0.00 2.97 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 0.00 101 K 7.21 4.60 0.00 1.43 1.56 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.69 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.19 1.23 7.81 102 L 8.28 4.49 0.00 1.64 1.54 0.99 1.37 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 0.00 103 P 0.00 4.27 0.00 2.17 2.10 0.00 3.70 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.86 0.00 104 D 8.03 4.32 0.00 2.72 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 0.00 105 E 8.86 3.92 0.00 2.08 1.94 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 2.39 2.39 0.00 106 Q 8.10 3.94 0.00 2.21 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.66 0.00 0.00 0.00 0.00 0.00 2.44 2.69 0.00 107 E 8.80 3.98 0.00 2.20 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 2.52 0.00 108 R 8.05 3.95 0.00 2.08 2.00 0.00 3.34 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 109 K 8.24 3.99 0.00 1.98 1.89 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.74 7.81 110 D 8.48 4.42 0.00 2.83 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 0.00 111 V 8.24 3.83 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 0.90 0.00 0.00 1.17 0.00 0.00 112 V 8.02 3.62 2.31 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 1.03 0.00 0.00 0.98 0.00 0.00 113 A 7.89 4.06 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 0.00 114 Y 8.14 4.26 0.00 3.10 3.26 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 0.00 115 L 8.28 3.94 0.00 1.89 1.68 0.94 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.22 4.09 0.00 1.97 1.84 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.79 7.81 117 Q 7.66 3.94 0.00 1.55 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.22 0.00 0.00 0.00 0.00 0.00 2.23 2.45 0.00 118 F 7.73 4.70 0.00 3.00 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 0.00 119 S 7.64 4.90 0.00 3.82 3.69 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 0.00 120 P 0.00 4.40 0.00 2.03 1.98 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00