NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2557 8.1727 120.1362 56.8071 34.7943 173.9233 2 V 4.4508 8.1050 122.0316 60.8821 32.4260 174.7397 3 F 4.4250 9.7646 128.8398 57.5200 40.1852 174.9862 4 E 4.3168 9.0440 121.2099 55.7605 31.0415 177.6071 5 R 3.3378 8.7695 121.0919 60.2264 30.1304 179.6531 6 C 4.3612 8.0389 115.3993 59.4380 35.5192 175.5712 7 E 3.9040 8.1264 120.8793 59.2769 29.2159 178.5092 8 L 3.6677 8.0721 120.1151 57.8569 42.0724 178.6306 9 A 3.9345 7.9237 120.7419 55.3587 18.3028 179.8551 10 R 3.8973 8.0485 116.4671 59.5653 30.1332 179.5057 11 T 3.8590 7.8403 115.3967 66.6637 68.5003 176.7640 12 L 3.8512 8.0347 121.1413 57.4053 41.5818 179.3535 13 K 3.8404 8.0870 119.6097 59.6627 31.9258 178.6034 14 R 3.9089 7.8240 117.3776 59.3677 30.0191 177.5117 15 L 4.3841 7.4423 115.4573 54.4790 41.6375 177.2963 16 G 3.8808 7.7737 106.9033 46.4600 0.0000 174.9144 17 M 3.9450 7.8946 120.6899 56.1963 32.3640 175.7477 18 D 4.4736 8.0235 118.4257 55.7454 41.3382 175.7220 19 G 3.9719 9.4659 115.6972 45.5427 0.0000 171.4965 20 Y 4.2436 8.3034 122.0800 58.4900 39.1432 175.8611 21 R 3.4993 8.8598 127.2007 57.3217 28.6258 176.6164 22 G 3.8376 8.0092 101.5385 45.3528 0.0000 173.8557 23 I 4.1470 7.6993 122.1406 59.0070 38.1944 175.9079 24 S 4.6243 8.3242 120.1720 57.6583 63.9994 174.7680 25 L 4.2084 8.9946 123.5085 58.7526 41.6391 179.3217 26 A 4.1376 8.2189 119.9230 55.4153 18.2769 179.2625 27 N 4.4418 8.1336 114.8066 56.3386 38.6324 177.7326 28 W 4.3286 8.0517 119.9138 59.9072 29.1648 178.4411 29 M 4.1684 8.6108 119.0788 58.5754 31.4421 177.6866 30 C 3.2104 8.1077 118.8455 59.3862 44.5149 175.5587 31 L 3.9937 8.1233 121.3301 58.3227 41.7124 178.8355 32 A 4.0957 8.2967 120.7234 54.8853 18.1250 179.2714 33 K 2.7797 8.0118 118.2298 59.3950 32.0488 178.9947 34 W 4.1296 7.8945 117.6621 58.7034 29.1068 178.3447 35 E 4.3348 8.2232 118.9495 58.5267 29.1734 177.5670 36 S 4.5073 8.0376 109.6921 56.4745 64.6163 174.3448 37 G 3.2419 8.4099 109.1559 46.9165 0.0000 173.2030 38 Y 3.5578 7.5067 113.2045 58.7199 35.4076 169.0248 39 N 5.1868 7.6022 117.7984 51.8455 40.2278 175.4575 40 T 4.0582 8.6278 117.0518 64.0547 69.0232 175.9383 41 R 4.3373 7.9572 119.3328 56.3047 30.8438 176.4290 42 A 4.2625 7.7025 122.2313 52.6886 19.1883 176.7863 43 T 5.0165 8.4432 111.7846 59.8570 72.4136 172.9320 44 N 4.9253 8.9968 122.1976 52.1213 41.9640 172.3298 45 Y 4.9049 8.6803 127.5051 56.8298 41.2230 173.8352 46 N 4.7967 8.3597 123.6116 51.1873 40.0999 175.2538 47 A 3.6476 8.3406 128.0340 54.5632 18.9006 179.0023 48 G 3.7097 8.0160 104.4551 47.9640 0.0000 173.8246 49 D 4.7250 7.4036 115.2188 52.0627 40.2725 175.5019 50 R 4.0361 8.1332 116.1976 57.0957 28.1752 175.7698 51 S 5.0314 7.7720 110.9044 56.9270 66.8021 172.5136 52 T 5.1352 8.8859 115.9633 61.9788 72.6770 172.7209 53 D 5.4997 8.9895 124.9119 53.0842 43.4109 174.9911 54 Y 4.9097 9.2653 120.8931 57.5593 41.2957 177.1533 55 G 4.1128 9.1506 112.1886 45.5738 0.0000 173.3405 56 I 3.9133 8.1494 116.7582 63.0116 37.9441 177.4054 57 F 4.7077 7.9871 115.7459 56.4679 39.7413 175.4839 58 Q 3.5259 7.8174 119.0058 57.0128 26.4945 173.6891 59 I 4.5829 8.2214 119.1573 60.5594 39.5650 176.6378 60 N 5.3154 9.2329 125.9935 53.4756 39.8278 175.5964 61 S 4.8819 9.0847 120.2194 60.0204 63.5118 175.5347 62 R 3.6999 8.8578 122.7508 59.4869 30.2478 177.8443 63 Y 4.0981 7.5699 115.2045 58.5373 39.4212 176.9227 64 W 4.8838 8.2256 118.5800 57.6448 31.5205 173.9840 65 C 5.6548 8.3291 112.3931 53.4985 44.4563 172.0549 66 N 5.2150 9.0364 119.0053 51.8419 40.5873 174.5095 67 D 4.7556 8.8027 123.8943 52.4696 40.2262 178.2735 68 G 4.0661 8.5526 109.2333 45.9709 0.0000 174.8856 69 K 4.4704 7.9670 116.4252 56.5824 32.9034 175.6080 70 T 4.6711 7.6811 117.4022 61.1020 69.8525 172.1699 71 P 4.2527 0.0000 0.0000 63.9728 31.7826 176.5526 72 G 3.7476 8.8731 108.2269 45.7643 0.0000 173.3332 73 A 4.0273 7.3451 121.4282 52.3815 18.7129 178.4309 74 V 3.7300 8.6970 123.0092 62.8978 33.0108 175.5388 75 N 4.1103 8.0240 116.4930 54.4621 36.8138 174.7966 76 A 4.0161 8.4134 121.9388 55.4109 19.0863 178.5898 77 C 4.5601 8.5947 111.5266 57.6786 40.9459 173.0458 78 H 4.0687 7.9714 116.2232 56.8505 26.3603 174.7980 79 L 4.8317 8.2545 117.5099 52.5722 45.9993 177.0269 80 S 4.5746 8.4498 116.8486 58.3124 63.2087 175.8798 81 C 4.1804 8.8241 124.6971 59.5403 40.1417 176.5853 82 S 3.9078 7.7936 115.7225 60.9488 62.2840 176.2098 83 A 4.0003 7.7343 123.6559 54.4209 17.7976 178.4183 84 L 4.5277 7.8652 116.1338 54.8003 41.6732 177.4792 85 L 5.3707 7.5632 117.5560 53.8333 42.0480 176.7334 86 Q 4.3474 7.7495 117.7755 55.5606 29.4593 175.9957 87 D 4.3992 8.5005 119.7601 56.9470 41.2009 176.6006 88 N 4.5564 8.0480 118.0828 53.1500 38.9043 174.5552 89 I 4.2166 8.4677 119.2206 61.2185 37.9769 177.0023 90 A 3.9404 8.3849 125.0494 55.8966 18.1201 180.1104 91 D 4.2837 8.0713 116.5091 57.3404 41.0121 178.4546 92 A 4.0953 8.0659 120.8617 55.3321 18.2981 179.7331 93 V 3.3763 8.0903 116.4553 66.0743 31.4923 178.1160 94 A 3.8238 7.9814 120.5264 55.1915 18.1777 178.8620 95 C 4.1825 8.4167 116.8634 59.6642 37.9215 175.4710 96 A 3.8971 8.3271 122.8122 55.2081 17.5725 179.7328 97 K 3.7627 7.6929 116.1599 59.3738 32.4081 179.2267 98 R 4.0306 7.6840 118.9019 59.3025 29.9112 178.4665 99 V 2.2043 7.1480 117.9482 65.7620 31.1452 177.7658 100 V 3.9827 7.2655 107.4784 62.1447 31.6919 177.8235 101 R 4.1659 7.6595 117.6743 57.1093 30.5610 176.5718 102 D 4.6815 7.3125 119.9360 52.8798 41.5950 175.6701 103 P 4.2240 0.0000 0.0000 65.8624 31.4852 177.8828 104 Q 4.0239 8.1731 117.9952 56.6447 30.1336 177.1540 105 G 3.6088 7.9847 107.2106 46.7805 0.0000 176.3147 106 I 3.9264 7.7214 122.1288 62.5279 38.0476 177.5934 107 R 4.2633 7.3116 117.9096 58.5880 29.9623 177.5959 108 A 3.8853 7.5741 120.2244 53.8705 18.6136 177.2584 109 W 4.8146 8.2208 116.8204 55.0071 29.8631 177.4493 110 V 3.8074 8.6524 125.0216 64.7131 30.8246 177.9601 111 A 4.0639 8.3688 121.0678 54.7643 18.0918 179.2599 112 W 3.9607 8.4608 126.9699 60.6285 30.5815 178.4649 113 R 3.6358 8.1511 116.3607 59.3788 29.6899 178.3795 114 N 4.3157 8.1491 115.0833 55.6322 38.6261 176.2224 115 H 4.4050 7.6997 113.9087 55.5450 30.2736 174.1050 116 C 4.6055 7.1825 115.3150 57.7972 43.9776 174.3728 117 Q 3.5360 6.6925 117.1340 56.8209 28.5159 175.5146 118 N 4.2668 8.7130 117.1503 54.3057 35.8175 173.9812 119 R 4.5559 7.2236 115.7856 53.9374 33.2068 175.5330 120 D 4.5058 8.5536 119.3947 54.5953 40.8750 175.9022 121 V 4.6612 8.2838 119.5384 61.3864 32.3395 178.4812 122 R 4.1704 7.9966 121.4631 58.7013 29.8485 178.8048 123 Q 4.1507 8.2797 116.1090 59.4182 28.3122 178.6060 124 Y 4.1825 7.8846 114.9829 59.9282 38.1337 176.7341 125 V 4.3952 7.8089 111.3036 60.6037 32.8329 175.4785 126 Q 4.1653 7.6306 118.9959 57.2845 28.8114 177.0013 127 G 3.9716 8.9289 109.6090 45.8403 0.0000 174.5712 128 C 4.3968 7.9167 115.6045 56.8752 40.7691 173.4482 129 G 3.8057 8.1091 107.4029 46.7544 0.0000 174.1018 130 V 4.0233 7.6835 123.0001 61.4980 31.6132 175.2617 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 8.17 4.26 0.00 1.70 2.04 0.00 0.64 0.00 0.00 1.43 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 1.23 7.81 2 V 8.10 4.45 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 0.87 0.00 0.00 0.95 0.00 0.00 3 F 9.76 4.42 0.00 2.81 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 4 E 9.04 4.32 0.00 1.94 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 2.31 2.24 0.00 5 R 8.77 3.34 0.00 1.89 1.91 0.00 3.40 0.00 0.00 3.45 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 6 C 8.04 4.36 0.00 3.00 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 7 E 8.13 3.90 0.00 2.05 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 0.00 2.59 2.41 0.00 8 L 8.07 3.67 0.00 1.42 1.41 -0.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.92 3.93 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 10 R 8.05 3.90 0.00 2.01 1.99 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.84 3.86 4.30 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 1.22 0.00 0.00 12 L 8.03 3.85 0.00 1.74 1.58 0.93 0.81 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 13 K 8.09 3.84 0.00 1.94 2.00 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.47 7.81 14 R 7.82 3.91 0.00 2.05 2.01 0.00 3.30 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 15 L 7.44 4.38 0.00 1.56 1.56 0.85 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.77 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 0.00 0.00 0.00 17 M 7.89 3.94 0.00 1.28 1.95 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.22 0.00 18 D 8.02 4.47 0.00 2.68 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 19 G 9.47 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 20 Y 8.30 4.24 0.00 3.38 3.19 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 21 R 8.86 3.50 0.00 1.59 1.86 0.00 3.29 0.00 0.00 3.04 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 22 G 8.01 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 23 I 7.70 4.15 1.75 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.71 -0.05 0.00 0.00 24 S 8.32 4.62 0.00 4.07 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 25 L 8.99 4.21 0.00 1.99 1.84 1.03 1.35 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 26 A 8.22 4.14 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.13 4.44 0.00 2.79 2.75 0.00 0.00 6.97 8.97 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 28 W 8.05 4.33 0.00 3.54 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 29 M 8.61 4.17 0.00 2.17 2.37 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.91 0.00 30 C 8.11 3.21 0.00 2.65 3.21 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 31 L 8.12 3.99 0.00 1.95 1.88 0.61 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.30 4.10 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 33 K 8.01 2.78 0.00 1.63 1.66 0.00 0.68 0.00 0.00 1.30 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 0.21 7.81 34 W 7.89 4.13 0.00 3.26 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 35 E 8.22 4.33 0.00 2.00 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 2.53 2.56 0.00 36 S 8.04 4.51 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 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 0.00 0.00 0.00 38 Y 7.51 3.56 0.00 3.19 2.92 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 39 N 7.60 5.19 0.00 2.84 2.84 0.00 0.00 7.01 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 40 T 8.63 4.06 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 1.43 0.00 0.00 41 R 7.96 4.34 0.00 2.00 2.04 0.00 3.19 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 42 A 7.70 4.26 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 43 T 8.44 5.02 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 1.19 0.00 0.00 44 N 9.00 4.93 0.00 2.82 2.79 0.00 0.00 6.74 8.37 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 45 Y 8.68 4.90 0.00 3.05 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 46 N 8.36 4.80 0.00 2.62 2.58 0.00 0.00 6.76 7.93 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 47 A 8.34 3.65 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 48 G 8.02 3.71 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 0.00 0.00 0.00 49 D 7.40 4.73 0.00 2.70 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.13 4.04 0.00 2.05 2.18 0.00 3.10 0.00 0.00 3.18 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 51 S 7.77 5.03 0.00 3.86 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 52 T 8.89 5.14 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 0.70 0.00 0.00 53 D 8.99 5.50 0.00 2.73 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 54 Y 9.27 4.91 0.00 2.96 2.90 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 55 G 9.15 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 0.00 0.00 0.00 56 I 8.15 3.91 1.69 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.76 0.17 0.00 0.00 57 F 7.99 4.71 0.00 3.20 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 58 Q 7.82 3.53 0.00 2.50 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.75 0.00 0.00 0.00 0.00 0.00 2.52 2.79 0.00 59 I 8.22 4.58 2.15 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.15 1.14 0.00 0.00 60 N 9.23 5.32 0.00 3.11 3.05 0.00 0.00 6.98 7.53 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 61 S 9.08 4.88 0.00 4.05 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 62 R 8.86 3.70 0.00 1.55 1.29 0.00 2.52 0.00 0.00 2.84 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.12 0.00 63 Y 7.57 4.10 0.00 1.70 1.58 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 64 W 8.23 4.88 0.00 3.52 3.25 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 0.00 0.00 0.00 0.00 65 C 8.33 5.65 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 66 N 9.04 5.22 0.00 2.81 2.68 0.00 0.00 7.13 8.76 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 67 D 8.80 4.76 0.00 2.95 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 68 G 8.55 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 69 K 7.97 4.47 0.00 1.84 1.89 0.00 1.56 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.44 7.81 70 T 7.68 4.67 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 1.19 0.00 0.00 71 P 0.00 4.25 0.00 2.15 2.05 0.00 3.87 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 1.97 1.97 0.00 72 G 8.87 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 0.00 0.00 0.00 73 A 7.35 4.03 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 74 V 8.70 3.73 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 0.89 0.00 0.00 75 N 8.02 4.11 0.00 2.93 2.70 0.00 0.00 7.11 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 76 A 8.41 4.02 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 77 C 8.59 4.56 0.00 3.30 3.25 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 0.00 0.00 0.00 0.00 78 H 7.97 4.07 0.00 3.32 3.37 0.00 5.79 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 79 L 8.25 4.83 0.00 1.71 1.51 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.45 4.57 0.00 3.83 3.70 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 81 C 8.82 4.18 0.00 2.33 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 82 S 7.79 3.91 0.00 3.99 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 83 A 7.73 4.00 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 84 L 7.87 4.53 0.00 1.91 1.81 1.08 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.56 5.37 0.00 1.76 1.73 1.12 1.40 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 86 Q 7.75 4.35 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 7.12 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 87 D 8.50 4.40 0.00 2.65 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 88 N 8.05 4.56 0.00 2.68 2.76 0.00 0.00 6.98 7.94 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 89 I 8.47 4.22 1.78 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.38 0.92 0.00 0.00 90 A 8.38 3.94 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 91 D 8.07 4.28 0.00 2.72 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 92 A 8.07 4.10 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 93 V 8.09 3.38 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 0.82 0.00 0.00 0.88 0.00 0.00 94 A 7.98 3.82 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 95 C 8.42 4.18 0.00 3.05 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 96 A 8.33 3.90 0.78 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 0.00 0.00 97 K 7.69 3.76 0.00 1.61 1.43 0.00 1.32 0.00 0.00 0.86 0.00 0.00 2.33 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.96 7.81 98 R 7.68 4.03 0.00 1.89 2.10 0.00 3.27 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.89 0.00 99 V 7.15 2.20 1.80 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 -0.16 0.00 0.00 -0.35 0.00 0.00 100 V 7.27 3.98 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 1.03 0.00 0.00 1.39 0.00 0.00 101 R 7.66 4.17 0.00 2.08 2.04 0.00 3.24 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.09 0.00 102 D 7.31 4.68 0.00 2.98 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 0.00 103 P 0.00 4.22 0.00 2.15 2.18 0.00 3.77 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 1.97 1.98 0.00 104 Q 8.17 4.02 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.92 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 105 G 7.98 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 0.00 106 I 7.72 3.93 1.11 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 1.03 -0.76 0.00 0.00 107 R 7.31 4.26 0.00 2.02 2.02 0.00 3.28 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.89 0.00 108 A 7.57 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.22 4.81 0.00 3.69 3.19 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 0.00 110 V 8.65 3.81 2.17 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 0.90 0.00 0.00 0.98 0.00 0.00 111 A 8.37 4.06 1.56 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 0.00 0.00 112 W 8.46 3.96 0.00 3.49 3.54 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 0.00 113 R 8.15 3.64 0.00 2.07 1.97 0.00 3.37 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 114 N 8.15 4.32 0.00 2.41 2.53 0.00 0.00 6.92 8.02 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 0.00 115 H 7.70 4.40 0.00 2.69 2.14 0.00 5.79 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 C 7.18 4.61 0.00 1.80 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 0.00 117 Q 6.69 3.54 0.00 1.58 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.57 0.00 0.00 0.00 0.00 0.00 2.19 2.12 0.00 118 N 8.71 4.27 0.00 2.81 2.93 0.00 0.00 6.83 7.66 0.00 0.00 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 R 7.22 4.56 0.00 1.79 1.79 0.00 3.17 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 120 D 8.55 4.51 0.00 2.63 2.63 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 0.00 121 V 8.28 4.66 2.41 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 1.03 0.00 0.00 1.06 0.00 0.00 122 R 8.00 4.17 0.00 2.17 2.02 0.00 3.42 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 123 Q 8.28 4.15 0.00 2.01 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.91 0.00 0.00 0.00 0.00 0.00 2.29 1.82 0.00 124 Y 7.88 4.18 0.00 3.15 3.16 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 0.00 125 V 7.81 4.40 2.14 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 1.12 0.00 0.00 1.06 0.00 0.00 126 Q 7.63 4.17 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.57 0.00 0.00 0.00 0.00 0.00 2.56 2.30 0.00 127 G 8.93 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 0.00 128 C 7.92 4.40 0.00 3.05 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 0.00 129 G 8.11 3.81 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 0.00 0.00 0.00 130 V 7.68 4.02 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 0.79 0.00 0.00 0.94 0.00 0.00