NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.8108 8.2076 120.5345 54.3859 42.3496 173.5772 2 V 4.5583 9.0630 119.8257 57.1269 34.1289 173.6109 3 P 4.4726 0.0000 0.0000 65.7056 31.9686 176.9328 4 Y 4.9821 6.9837 114.3667 54.0858 41.4221 174.4211 5 V 3.8018 8.6079 120.3319 63.6447 32.1889 175.0564 6 L 4.5124 9.3952 128.8269 53.3989 43.9111 175.9925 7 V 4.3632 8.1617 122.2807 61.1516 33.0201 174.4433 8 K 4.6772 8.5785 127.8006 55.0560 34.3073 175.9463 9 T 4.8730 8.1904 112.2603 59.4206 72.3047 172.5775 10 N 4.1762 8.4333 115.3864 54.6890 36.5066 173.8670 11 M 5.6415 7.7191 115.5170 53.6791 34.9531 176.5090 12 V 4.8624 8.0130 113.5320 59.6586 36.0793 174.7161 13 V 4.5362 8.7303 125.8038 62.8839 31.6143 175.6732 14 T 4.6088 9.1524 117.8447 61.6936 70.2818 173.4842 15 S 4.9801 7.1968 116.4782 58.8560 65.4380 172.7869 16 V 3.8694 7.7184 115.5429 61.9831 32.7606 170.6275 17 A 4.3447 7.1386 121.9793 52.3552 22.4426 174.5542 18 M 4.9038 8.2053 116.6596 54.4535 36.4539 174.6019 19 K 4.3381 8.0219 118.4119 56.4443 36.6076 172.5588 20 P 4.7544 0.0000 0.0000 61.4686 33.0016 175.1113 21 Y 4.7057 8.2220 120.5271 56.2769 38.5274 175.7984 22 E 4.0997 9.3397 128.2303 59.2784 29.9607 179.2902 23 V 3.7247 7.3853 111.3839 63.5446 31.9710 176.0828 24 T 4.6402 7.3484 106.7313 59.8504 71.5920 171.4456 25 P 4.7277 0.0000 0.0000 63.0788 31.6480 175.9390 26 T 4.5543 7.6882 108.0323 62.1857 70.1365 173.5652 27 R 5.4474 7.6524 120.0190 55.8337 35.0135 173.3648 28 M 4.8096 8.7871 115.4487 54.8539 35.0883 174.3765 29 L 5.1474 8.1943 120.5402 52.7648 44.2247 176.9966 30 V 4.4457 6.7598 116.9483 61.7327 30.2752 173.3256 31 C 4.3761 6.8871 119.3035 56.8529 36.6630 174.5974 32 G 3.3139 5.8095 106.1806 46.3376 0.0000 171.9003 33 I 5.1275 7.3701 119.8209 59.2069 40.5724 174.7685 34 A 5.4831 9.6591 127.2271 50.1545 22.5434 174.8438 35 A 5.1163 9.0687 121.0269 49.9889 23.1308 174.9951 36 K 4.9176 8.3979 121.7093 54.5300 34.0678 176.1871 37 L 4.1151 8.5604 127.6929 56.3862 41.9201 177.0111 38 G 4.2327 9.0018 113.4539 45.9471 0.0000 174.6480 39 A 3.8297 7.1948 120.3523 52.3705 18.7571 177.3490 40 A 4.2623 8.4518 125.2063 51.3235 19.3654 178.1707 41 A 4.0405 8.4554 122.5429 54.5624 18.7183 179.5744 42 S 4.2691 8.0133 110.1970 60.9194 63.6164 175.2766 43 S 4.2075 8.1340 116.4119 57.4058 62.6271 173.0432 44 P 4.3790 0.0000 0.0000 65.0539 31.8709 177.3829 45 D 4.5127 8.0218 117.7633 55.4741 41.0448 176.9405 46 A 4.4071 7.4571 121.4254 53.0512 19.4665 177.5205 47 H 5.0344 7.6803 112.7510 54.4974 29.3460 174.9131 48 V 4.2918 8.6584 120.4811 60.8929 32.6628 174.4884 49 P 5.2201 0.0000 0.0000 63.1340 32.7750 174.9596 50 F 4.9417 7.7253 114.6945 57.4045 41.8515 171.4813 51 C 5.2306 8.4587 113.9697 56.6547 42.6842 172.9035 52 F 5.2708 7.7090 114.6714 55.4348 41.5489 173.5902 53 G 4.2919 8.8028 106.1624 45.4304 0.0000 173.2175 54 K 4.7648 8.7918 122.5711 54.3926 35.8420 174.4964 55 D 5.0509 8.7672 127.3044 53.5875 42.2385 175.9989 56 L 4.5107 8.8111 125.4696 55.3990 41.4551 177.8414 57 K 4.1363 8.2869 119.9644 57.2375 33.0557 176.4870 58 R 4.3225 7.3647 118.1923 53.6954 29.3108 173.8049 59 P 4.2738 0.0000 0.0000 62.6388 31.9884 175.5947 60 G 3.8261 8.1512 107.3568 43.9810 0.0000 172.1382 61 S 4.9713 8.2128 115.8265 56.3610 64.8748 175.3572 62 S 4.3685 8.8225 120.5787 57.8714 64.8299 173.8868 63 P 4.2933 0.0000 0.0000 65.8740 31.0834 178.8446 64 M 4.0403 7.8886 116.9980 57.8232 31.8584 178.1464 65 E 4.2400 8.4592 119.5392 59.2250 29.3638 178.9978 66 V 3.6843 8.0384 118.1388 66.5331 31.4571 178.0499 67 M 4.0198 7.9931 117.4868 58.3285 32.1981 177.4925 68 L 4.0012 7.8281 120.6261 58.5994 42.0996 178.5270 69 R 4.0347 8.5850 118.2560 59.8189 30.0728 177.9436 70 A 4.0207 7.8116 119.3721 55.5853 18.4129 180.1001 71 V 3.7477 8.5941 110.7640 64.0228 31.5462 178.5779 72 F 4.4718 8.7757 121.4594 61.6371 39.1559 176.8549 73 M 3.5732 8.1461 117.8475 58.1980 31.9091 177.6510 74 Q 4.2672 7.8876 113.9212 55.1194 29.5884 175.2510 75 Q 3.5199 8.1529 116.7261 56.8879 26.9017 174.1467 76 R 4.3188 8.0864 115.3915 55.6223 31.5717 176.1027 77 P 5.0583 0.0000 0.0000 62.3026 33.8041 174.3754 78 L 4.8653 9.1462 119.8973 55.1116 44.4140 173.9019 79 R 4.8967 9.2640 121.3260 55.4367 31.7170 174.8496 80 M 5.0671 9.3874 126.0836 53.6380 35.8701 174.8798 81 F 4.8085 9.5492 123.2272 55.9217 40.1537 174.4103 82 L 5.1646 8.6647 124.4712 54.8422 43.5428 175.8043 83 G 3.8854 8.6018 106.6600 43.8363 0.0000 171.6174 84 P 4.5484 0.0000 0.0000 63.8588 32.7159 176.6615 85 K 4.9874 7.9360 120.2190 56.2353 33.4504 175.7315 86 Q 5.1497 8.5915 120.4609 54.2583 31.8712 174.8009 87 L 4.9903 9.4615 122.5016 53.3140 46.3027 175.3019 88 T 5.2984 8.4215 117.1702 62.3764 70.1053 174.5833 89 F 4.6811 9.3192 128.2745 57.9667 42.6394 173.6495 90 E 3.2383 9.1314 128.8415 57.3041 27.3957 174.3615 91 G 3.9070 8.3523 101.3764 45.8045 0.0000 173.5579 92 K 4.8514 7.3608 118.2717 53.3525 37.0060 173.7307 93 P 5.0907 0.0000 0.0000 62.8977 32.4880 175.6512 94 A 4.7626 9.8453 124.1575 50.2375 23.0456 175.2857 95 L 4.4877 8.7282 122.3510 54.4723 42.4139 176.7541 96 E 4.2250 8.8674 126.0958 57.0233 30.5771 175.5626 97 L 5.0347 8.7272 129.2456 54.2165 42.7430 176.1978 98 I 4.3886 8.4201 117.8486 60.2133 39.5604 175.5054 99 R 4.4175 7.1905 119.5183 56.0815 32.7198 172.6511 100 M 5.3249 8.4290 121.4368 54.0450 34.9537 174.3060 101 V 4.4104 8.9787 119.5225 61.1104 35.3951 173.6426 102 E 4.4289 8.9261 128.8212 56.8090 30.2938 176.8157 103 C 4.4560 8.4994 123.9318 57.1772 40.2683 173.7476 104 S 4.1686 8.8954 119.0483 59.8522 62.7211 173.6703 105 G 3.9839 7.6410 106.9077 44.9455 0.0000 173.6751 106 K 4.6895 8.3922 117.1701 59.0857 32.3636 178.8605 107 Q 4.1231 8.1180 116.7321 58.3392 28.3074 176.6592 108 D 4.8150 8.2115 114.0954 53.1527 42.0771 175.1671 109 C 4.9253 7.8784 117.6106 54.0597 41.0505 172.3674 110 P 4.4686 0.0000 0.0000 62.9151 30.8842 176.5503 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 D 8.21 4.81 0.00 2.74 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 2 V 9.06 4.56 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 0.55 0.00 0.00 0.85 0.00 0.00 3 P 0.00 4.47 0.00 2.55 2.34 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 4 Y 6.98 4.98 0.00 2.94 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 5 V 8.61 3.80 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 0.77 0.00 0.00 0.99 0.00 0.00 6 L 9.40 4.51 0.00 1.65 1.44 0.51 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.16 4.36 1.78 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 0.50 0.00 0.00 -0.25 0.00 0.00 8 K 8.58 4.68 0.00 1.70 1.66 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.46 7.81 9 T 8.19 4.87 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 10 N 8.43 4.18 0.00 2.89 2.90 0.00 0.00 6.73 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 11 M 7.72 5.64 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 12 V 8.01 4.86 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 0.86 0.00 0.00 1.02 0.00 0.00 13 V 8.73 4.54 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 1.20 0.00 0.00 1.07 0.00 0.00 14 T 9.15 4.61 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 1.31 0.00 0.00 15 S 7.20 4.98 0.00 3.84 3.77 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 16 V 7.72 3.87 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 0.17 0.00 0.00 0.71 0.00 0.00 17 A 7.14 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 18 M 8.21 4.90 0.00 1.78 1.85 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 2.39 2.39 0.00 19 K 8.02 4.34 0.00 1.92 1.92 0.00 1.53 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.19 1.32 7.81 20 P 0.00 4.75 0.00 2.10 2.05 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 21 Y 8.22 4.71 0.00 2.92 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 22 E 9.34 4.10 0.00 2.09 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 2.38 2.49 0.00 23 V 7.39 3.72 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 0.37 0.00 0.00 -0.27 0.00 0.00 24 T 7.35 4.64 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 1.15 0.00 0.00 25 P 0.00 4.73 0.00 2.20 2.18 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 26 T 7.69 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 1.22 0.00 0.00 27 R 7.65 5.45 0.00 1.91 2.03 0.00 3.34 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 28 M 8.79 4.81 0.00 2.08 2.29 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 2.42 2.49 0.00 29 L 8.19 5.15 0.00 1.44 1.35 0.72 -0.01 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 30 V 6.76 4.45 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 0.48 0.00 0.00 0.58 0.00 0.00 31 C 6.89 4.38 0.00 1.30 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 32 G 5.81 3.31 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 0.00 33 I 7.37 5.13 1.88 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.73 0.99 0.00 0.00 34 A 9.66 5.48 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 35 A 9.07 5.12 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 36 K 8.40 4.92 0.00 1.95 1.67 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.61 7.81 37 L 8.56 4.12 0.00 1.55 1.60 1.01 1.09 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 38 G 9.00 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 0.00 0.00 0.00 0.00 39 A 7.19 3.83 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 40 A 8.45 4.26 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 41 A 8.46 4.04 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 42 S 8.01 4.27 0.00 4.00 4.01 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 43 S 8.13 4.21 0.00 3.85 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 44 P 0.00 4.38 0.00 2.26 2.29 0.00 3.73 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 2.06 1.98 0.00 45 D 8.02 4.51 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 46 A 7.46 4.41 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 47 H 7.68 5.03 0.00 2.99 3.21 0.00 5.65 0.00 0.00 0.00 0.00 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.66 4.29 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 1.04 0.00 0.00 1.02 0.00 0.00 49 P 0.00 5.22 0.00 2.30 2.20 0.00 3.96 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 50 F 7.73 4.94 0.00 3.18 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 51 C 8.46 5.23 0.00 2.74 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 52 F 7.71 5.27 0.00 2.94 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 53 G 8.80 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 0.00 0.00 0.00 0.00 54 K 8.79 4.76 0.00 1.81 1.70 0.00 1.93 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.40 7.81 55 D 8.77 5.05 0.00 2.89 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 56 L 8.81 4.51 0.00 1.59 1.69 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.29 4.14 0.00 2.10 1.86 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.37 7.81 58 R 7.36 4.32 0.00 1.83 1.89 0.00 3.28 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 59 P 0.00 4.27 0.00 2.22 2.05 0.00 3.81 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 60 G 8.15 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 61 S 8.21 4.97 0.00 3.87 3.82 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 62 S 8.82 4.37 0.00 4.10 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 63 P 0.00 4.29 0.00 2.13 2.11 0.00 3.57 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 2.08 2.16 0.00 64 M 7.89 4.04 0.00 1.10 1.61 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 65 E 8.46 4.24 0.00 2.34 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 2.43 2.60 0.00 66 V 8.04 3.68 2.26 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 1.01 0.00 0.00 1.05 0.00 0.00 67 M 7.99 4.02 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 68 L 7.83 4.00 0.00 2.23 2.08 1.11 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.58 4.03 0.00 2.11 2.00 0.00 3.22 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 70 A 7.81 4.02 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 71 V 8.59 3.75 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 0.79 0.00 0.00 1.11 0.00 0.00 72 F 8.78 4.47 0.00 3.09 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 73 M 8.15 3.57 0.00 1.93 2.19 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 74 Q 7.89 4.27 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 75 Q 8.15 3.52 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 76 R 8.09 4.32 0.00 1.86 1.88 0.00 3.64 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 1.68 1.78 0.00 77 P 0.00 5.06 0.00 2.08 1.98 0.00 3.64 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 2.09 2.09 0.00 78 L 9.15 4.87 0.00 1.62 1.72 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 79 R 9.26 4.90 0.00 2.11 2.00 0.00 3.27 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 80 M 9.39 5.07 0.00 1.76 1.80 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 81 F 9.55 4.81 0.00 3.01 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 82 L 8.66 5.16 0.00 1.69 1.72 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.60 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 0.00 0.00 0.00 84 P 0.00 4.55 0.00 2.30 2.33 0.00 3.73 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 2.07 2.03 0.00 85 K 7.94 4.99 0.00 1.78 1.82 0.00 1.93 0.00 0.00 2.00 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.75 1.35 7.81 86 Q 8.59 5.15 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 87 L 9.46 4.99 0.00 1.62 1.47 0.75 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.42 5.30 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 1.28 0.00 0.00 89 F 9.32 4.68 0.00 2.87 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 90 E 9.13 3.24 0.00 1.16 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 1.73 2.04 0.00 91 G 8.35 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.36 4.85 0.00 1.53 1.63 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.41 7.81 93 P 0.00 5.09 0.00 2.10 2.06 0.00 3.74 0.00 0.00 3.66 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 94 A 9.85 4.76 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 95 L 8.73 4.49 0.00 1.60 1.68 0.94 0.88 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 96 E 8.87 4.23 0.00 2.11 1.89 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 2.37 2.35 0.00 97 L 8.73 5.03 0.00 1.87 1.50 0.64 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.42 4.39 1.87 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 1.38 0.92 0.94 0.00 0.00 99 R 7.19 4.42 0.00 1.67 1.51 0.00 2.87 0.00 0.00 2.87 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.14 0.00 100 M 8.43 5.32 0.00 1.88 1.95 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 2.38 2.39 0.00 101 V 8.98 4.41 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 0.85 0.00 0.00 0.81 0.00 0.00 102 E 8.93 4.43 0.00 2.02 1.84 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 2.30 2.37 0.00 103 C 8.50 4.46 0.00 2.95 3.02 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 0.00 104 S 8.90 4.17 0.00 3.79 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 0.00 105 G 7.64 3.98 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 0.00 0.00 0.00 106 K 8.39 4.69 0.00 1.95 2.10 0.00 1.69 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.40 7.81 107 Q 8.12 4.12 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 108 D 8.21 4.82 0.00 2.77 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 0.00 109 C 7.88 4.93 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 0.00 110 P 0.00 4.47 0.00 2.03 1.99 0.00 3.70 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 2.23 0.00