NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 4.0504 8.2431 119.7038 56.4054 30.1643 174.1674 -1 G 4.0290 8.3414 109.5180 44.1477 0.0000 171.0683 0 S 4.2451 8.8919 116.0453 60.7707 64.0597 175.2021 1 M 4.1132 8.0621 120.6593 58.4444 32.0647 178.0149 2 A 4.3178 8.0268 121.8571 54.6124 18.7698 179.0603 3 L 3.7084 7.6380 118.6875 58.3939 42.2459 179.4530 4 K 4.0852 8.0848 117.9187 59.2380 32.0710 179.3775 5 R 4.0478 7.8669 118.8136 59.1559 29.9851 178.5481 6 I 3.3519 8.0585 120.2546 64.4951 36.7763 177.4678 7 H 4.5867 8.0566 116.8702 57.5625 29.5375 176.5667 8 K 4.0814 7.5736 120.3011 59.7187 32.2913 178.1889 9 E 4.1309 8.1314 118.6747 58.9132 29.3332 178.9403 10 L 4.3269 8.3698 121.0380 58.1421 42.2251 178.7123 11 N 4.3803 8.0591 116.6834 56.1473 37.3310 177.0322 12 D 4.4066 8.0447 121.2654 56.9063 40.7238 178.4723 13 L 4.1401 8.2880 120.4643 57.8968 42.1446 178.6142 14 A 4.1878 8.1685 120.5010 55.0263 18.5872 179.2182 15 R 4.2068 7.9000 113.4128 57.0812 31.5236 176.7374 16 D 4.6281 7.5614 116.6042 51.6420 41.4888 173.2658 17 P 4.3306 0.0000 0.0000 61.9739 31.6118 175.0493 18 P 4.3149 0.0000 0.0000 61.9249 32.0867 176.4090 19 A 3.7191 9.1491 122.8096 53.9614 17.9122 180.2199 20 Q 3.4311 7.2104 125.3787 55.3148 25.7124 176.2651 21 C 5.1841 8.2956 113.9946 57.9653 31.4878 175.4316 22 S 4.9300 9.0976 117.9495 56.7361 65.1226 172.7942 23 A 5.0614 7.9445 125.4179 51.4568 21.8917 175.6688 24 G 3.0623 8.7199 108.8061 44.1811 0.0000 170.9106 25 P 4.3724 0.0000 0.0000 61.9910 31.5525 177.3826 26 V 3.9748 8.0860 125.0733 61.4345 31.6177 172.9685 27 G 4.1443 6.7071 116.2290 45.0302 0.0000 173.4222 28 D 4.7863 8.8738 124.6924 53.4264 41.3230 174.3419 29 D 4.8663 7.8659 120.4042 52.7563 42.0153 176.7340 30 M 4.2124 8.8352 126.5636 57.8282 32.7655 176.4983 31 F 4.3250 9.2257 116.5690 58.1313 39.6686 174.0836 32 H 5.4257 8.4815 121.5320 54.4854 32.2820 172.4416 33 W 5.3994 9.6639 125.6746 55.0018 33.1027 174.4652 34 Q 5.1043 9.3130 120.9580 54.6802 32.4236 173.5056 35 A 5.8973 9.4462 125.7999 49.5291 23.3066 174.8660 36 T 4.6359 8.3289 110.2812 59.7485 72.1318 172.8233 37 I 4.7692 9.0212 126.7290 59.6306 40.5948 174.4798 38 M 4.7619 8.2693 128.3692 54.3134 32.3288 176.6894 39 G 4.2790 9.2190 111.8401 46.0637 0.0000 171.2650 40 P 4.5566 0.0000 0.0000 62.6437 32.2584 177.0998 41 N 4.4262 9.0243 118.4594 56.3040 38.6667 176.7742 42 D 5.0655 7.9654 116.2196 54.0997 41.8771 175.6765 43 S 4.9439 7.7696 112.3797 55.4939 66.2244 172.9162 44 P 4.3580 0.0000 0.0000 64.7984 31.2837 176.8801 45 Y 4.9790 7.8612 115.4692 56.9770 38.1178 175.3578 46 Q 4.4269 7.2777 118.4937 57.1004 28.8659 177.4753 47 G 3.9749 9.0255 108.2158 45.4581 0.0000 173.4746 48 G 3.9562 7.7995 107.1295 44.8086 0.0000 173.0445 49 V 4.6505 7.8935 121.7580 60.6536 33.7303 174.7285 50 F 5.0652 9.0413 126.8201 55.7861 41.8120 174.4683 51 F 5.2495 9.6730 122.5760 56.0412 41.4010 174.9409 52 L 5.1758 9.1739 121.1866 53.3489 46.3195 175.3666 53 T 4.8952 8.7800 118.2652 61.9909 71.2494 173.6170 54 I 4.8826 8.7857 126.1085 59.8008 41.0042 174.3786 55 H 5.4763 8.6501 122.7062 54.0417 32.0970 172.7235 56 F 4.3825 9.0393 123.6673 56.0157 39.5388 174.4987 57 P 4.5005 0.0000 0.0000 62.7712 31.8884 177.1000 58 T 4.2436 8.6619 113.2343 63.9456 67.3881 173.7603 59 D 5.0472 8.0161 118.2464 54.5047 42.5143 174.6926 60 Y 4.6516 8.6799 121.7071 57.8244 39.2943 174.6904 61 P 3.5832 0.0000 0.0000 62.4248 31.4644 177.2415 62 F 4.3807 8.2657 116.9626 59.1435 39.0504 175.5750 63 K 4.8819 7.9765 119.6535 53.5090 35.6043 174.3222 64 P 2.9700 0.0000 0.0000 61.2769 31.8109 174.3323 65 P 4.1638 0.0000 0.0000 62.5311 32.6943 176.0756 66 K 4.1668 8.6398 121.9073 55.4993 32.8854 175.6047 67 V 4.8121 8.0668 125.0246 60.9538 33.4925 174.6552 68 A 4.8271 8.5144 127.8869 50.3315 23.3656 174.8710 69 F 4.5856 9.3397 120.0012 57.6759 39.7438 176.6689 70 T 4.4944 9.2079 119.9900 64.3504 70.0000 175.0044 71 T 4.7393 8.1860 117.9026 61.8936 69.9074 175.3710 72 R 4.1455 8.7085 125.1241 56.6556 30.7784 175.8802 73 I 4.8260 8.1211 119.5949 60.2920 40.7381 174.0893 74 Y 3.8596 8.6304 128.0256 56.1990 37.4154 173.7490 75 H 4.7537 7.5557 124.2362 53.2844 33.3386 171.7021 76 P 4.2126 0.0000 0.0000 64.6247 31.8828 177.2204 77 N 4.8814 7.9400 115.7295 52.5841 38.8491 174.0933 78 I 5.1296 7.4649 119.1256 59.8108 40.1380 174.7095 79 N 4.7260 8.3988 126.0767 52.0475 39.3434 175.4966 80 S 4.2245 8.5865 111.2728 61.7847 63.3268 174.6402 81 N 4.4723 8.1032 115.9591 53.5995 38.6958 175.8424 82 G 4.3619 7.9498 106.9461 46.2951 0.0000 173.8355 83 S 4.4850 7.8270 116.3807 58.7824 63.7321 173.7128 84 I 5.2437 7.8007 125.2391 58.9068 39.2417 173.9267 84 L 5.4137 7.9607 127.1391 52.9068 42.8417 175.1267 87 D 4.5931 8.9827 126.7241 56.9753 38.6841 178.9411 88 I 4.0458 7.8115 115.2106 62.7279 37.1610 176.9890 89 L 4.3012 7.7567 117.6975 53.9050 41.8773 176.4720 90 R 4.7150 8.8746 119.7663 56.8949 35.6878 177.4224 91 S 4.1361 9.5252 118.6663 62.4832 63.5768 175.4167 92 Q 4.4388 7.9107 119.7921 55.9572 29.0014 174.6423 93 W 4.7077 7.6876 124.9882 55.6697 31.7289 175.3638 94 S 4.2882 6.3245 116.8591 55.6683 64.9208 173.1792 95 P 4.1090 0.0000 0.0000 64.5742 31.0985 177.1950 96 A 4.0072 7.2112 118.5171 52.5987 18.3888 177.2594 97 L 4.3207 6.9319 116.8766 53.7753 43.1329 176.5083 98 T 5.0565 7.8041 109.4731 59.3901 73.3058 174.8073 99 I 3.7520 9.1051 121.8017 63.7101 38.0326 178.4180 100 S 4.1363 8.0686 114.0005 61.5888 62.3875 176.1215 101 K 4.0930 8.2739 121.0720 59.1688 31.7594 179.6374 102 V 3.6725 8.0339 119.0769 65.9832 31.4107 178.1337 103 L 4.0259 8.1170 118.8067 57.5947 41.4372 179.3989 104 L 4.0207 7.8773 118.6744 58.0014 41.6015 179.7544 105 S 4.1745 8.3092 115.1329 61.5258 62.7365 176.9613 106 I 3.7143 7.7486 122.3666 64.6852 36.5682 178.0387 107 C 4.0405 8.4386 117.9553 63.1578 27.8970 176.6630 108 S 4.1363 8.1493 116.5637 61.4816 62.2352 176.2032 109 L 3.9614 7.6521 121.8431 58.3738 41.7568 178.8092 110 L 3.8679 7.7369 117.9347 57.6994 41.5691 178.7305 111 C 4.6639 7.5858 115.0572 60.8519 29.3370 173.7949 112 D 4.6615 8.3899 119.7518 51.7533 41.4667 172.6880 113 P 4.4401 0.0000 0.0000 62.1531 32.3731 177.0092 114 N 4.7632 8.0295 118.1278 50.5402 38.2439 172.8707 115 P 4.2231 0.0000 0.0000 64.5027 31.6089 177.5182 116 D 4.6516 7.9391 116.6933 53.9050 40.4196 176.0403 117 D 4.8158 7.8424 119.0335 52.4177 41.3572 173.6991 118 P 4.5164 0.0000 0.0000 62.5030 32.5652 176.9734 119 L 4.2817 9.0890 125.2265 55.7528 42.8854 176.7802 120 V 4.2885 7.0687 117.2420 59.2764 32.0858 173.5214 121 P 4.1500 0.0000 0.0000 65.1315 31.5586 177.0175 122 E 3.9480 8.2042 117.4652 59.5237 29.4726 178.8126 123 I 3.6392 7.6247 119.0758 64.1954 36.9300 178.1216 124 A 4.0211 7.6201 120.4295 54.9390 18.3140 179.4490 125 R 3.9728 7.9390 117.5435 59.6424 30.2321 178.4746 126 I 3.7121 7.8835 119.5412 64.9687 36.9305 177.7650 127 Y 3.8525 7.8064 119.2611 60.3214 38.6275 177.4579 128 K 3.9785 8.2399 119.2334 58.5326 32.4262 178.4857 129 T 4.4117 7.7429 107.7390 61.9298 71.3839 174.6947 130 D 4.7021 8.0699 120.9970 51.4222 41.9045 175.0012 131 R 3.8099 7.9977 123.7614 59.1114 30.3811 177.0064 132 E 3.9658 8.1724 116.8697 59.7333 29.4399 179.2874 133 K 4.0264 8.0933 119.0203 58.7466 32.0050 178.7061 134 Y 4.1034 8.0277 120.1792 60.9466 38.6958 178.0509 135 N 4.3926 8.7092 117.4949 56.2369 38.5731 177.6780 136 R 3.8640 7.6402 119.5932 59.3380 30.1576 179.2085 137 I 3.6356 7.6841 119.2827 64.2349 36.6698 178.3133 138 A 3.7164 7.7126 121.8223 55.1103 17.8379 179.7148 139 R 4.3730 7.6995 117.7385 58.8769 30.4351 178.3857 140 E 4.1133 8.2159 118.5063 59.4145 29.5613 179.4040 141 W 4.1528 8.6527 118.9018 60.0891 28.9229 178.7389 142 T 4.2163 8.0060 115.5130 66.5431 67.5955 176.6334 143 Q 4.0339 7.9411 119.4572 58.4630 28.9654 178.0641 144 K 3.9241 7.6886 117.8644 58.1175 32.2560 177.3115 145 Y 4.7930 7.9499 113.8335 57.8629 40.5823 176.1089 146 A 4.4327 8.1156 120.4573 52.2925 20.4683 176.5704 147 M 4.1796 7.8915 120.1941 55.3853 32.1618 175.8959 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 -2 R 8.24 4.05 0.00 1.50 1.79 0.00 3.04 0.00 0.00 3.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.96 0.00 -1 G 8.34 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 0.00 0.00 0.00 0 S 8.89 4.25 0.00 3.92 3.96 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 1 M 8.06 4.11 0.00 2.20 2.13 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 2.78 2.82 0.00 2 A 8.03 4.32 1.65 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 0.00 0.00 3 L 7.64 3.71 0.00 1.88 1.81 0.92 0.56 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 4 K 8.08 4.09 0.00 2.20 1.87 0.00 1.63 0.00 0.00 1.61 0.00 0.00 3.30 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.50 7.81 5 R 7.87 4.05 0.00 2.09 2.20 0.00 3.06 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.93 0.00 6 I 8.06 3.35 1.63 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.67 0.30 0.00 0.00 7 H 8.06 4.59 0.00 3.22 3.28 0.00 5.77 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.57 4.08 0.00 2.24 1.89 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.62 7.81 9 E 8.13 4.13 0.00 2.32 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 2.41 2.57 0.00 10 L 8.37 4.33 0.00 2.26 1.84 0.64 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.06 4.38 0.00 3.05 3.24 0.00 0.00 7.03 7.74 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 12 D 8.04 4.41 0.00 2.85 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 13 L 8.29 4.14 0.00 1.99 1.98 0.99 1.08 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 14 A 8.17 4.19 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 15 R 7.90 4.21 0.00 2.03 2.00 0.00 3.20 0.00 0.00 3.31 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 16 D 7.56 4.63 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 17 P 0.00 4.33 0.00 2.09 2.08 0.00 3.75 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 2.05 2.30 0.00 18 P 0.00 4.31 0.00 2.07 2.01 0.00 3.75 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 19 A 9.15 3.72 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 20 Q 7.21 3.43 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 21 C 8.30 5.18 0.00 2.82 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 22 S 9.10 4.93 0.00 3.81 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 23 A 7.94 5.06 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 24 G 8.72 3.06 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 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.37 0.00 1.86 1.68 0.00 2.81 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 1.58 1.53 0.00 26 V 8.09 3.97 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 0.77 0.00 0.00 0.87 0.00 0.00 27 G 6.71 4.14 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 0.00 28 D 8.87 4.79 0.00 2.62 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 29 D 7.87 4.87 0.00 2.74 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 30 M 8.84 4.21 0.00 1.82 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 2.48 2.54 0.00 31 F 9.23 4.33 0.00 3.38 3.20 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 32 H 8.48 5.43 0.00 3.27 3.28 0.00 5.73 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.66 5.40 0.00 3.28 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 34 Q 9.31 5.10 0.00 2.07 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 35 A 9.45 5.90 1.20 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 36 T 8.33 4.64 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 1.19 0.00 0.00 37 I 9.02 4.77 1.94 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.48 0.98 0.00 0.00 38 M 8.27 4.76 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 39 G 9.22 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.56 0.00 2.32 2.09 0.00 3.82 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 2.21 2.21 0.00 41 N 9.02 4.43 0.00 2.73 2.93 0.00 0.00 6.78 8.06 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 42 D 7.97 5.07 0.00 2.66 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 43 S 7.77 4.94 0.00 4.21 4.10 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 44 P 0.00 4.36 0.00 1.89 2.25 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 1.25 1.95 0.00 45 Y 7.86 4.98 0.00 3.28 3.41 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 46 Q 7.28 4.43 0.00 2.27 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.63 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 47 G 9.03 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 48 G 7.80 3.96 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 0.00 0.00 0.00 49 V 7.89 4.65 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 0.34 0.00 0.00 0.85 0.00 0.00 50 F 9.04 5.07 0.00 3.07 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 51 F 9.67 5.25 0.00 3.01 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 52 L 9.17 5.18 0.00 1.35 1.41 0.60 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.78 4.90 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 1.28 0.00 0.00 54 I 8.79 4.88 1.99 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 1.08 0.72 0.28 0.00 0.00 55 H 8.65 5.48 0.00 3.00 3.19 0.00 5.63 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.04 4.38 0.00 2.68 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 57 P 0.00 4.50 0.00 2.36 2.24 0.00 3.73 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 2.48 2.26 0.00 58 T 8.66 4.24 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 1.24 0.00 0.00 59 D 8.02 5.05 0.00 2.81 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 60 Y 8.68 4.65 0.00 3.39 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 61 P 0.00 3.58 0.00 1.75 1.19 0.00 3.70 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 1.26 1.56 0.00 62 F 8.27 4.38 0.00 3.22 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 63 K 7.98 4.88 0.00 1.88 1.74 0.00 1.82 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.54 7.81 64 P 0.00 2.97 0.00 1.43 0.50 0.00 3.69 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 1.68 1.70 0.00 65 P 0.00 4.16 0.00 1.26 0.91 0.00 2.27 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 66 K 8.64 4.17 0.00 1.56 1.70 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.70 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.48 7.81 67 V 8.07 4.81 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 0.65 0.00 0.00 0.69 0.00 0.00 68 A 8.51 4.83 1.20 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 69 F 9.34 4.59 0.00 3.13 3.03 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 70 T 9.21 4.49 4.37 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 1.25 0.00 0.00 71 T 8.19 4.74 4.84 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 1.58 0.00 0.00 72 R 8.71 4.15 0.00 1.39 1.47 0.00 2.73 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.31 0.00 73 I 8.12 4.83 1.74 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.65 0.34 0.00 0.00 74 Y 8.63 3.86 0.00 1.88 2.48 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 75 H 7.56 4.75 0.00 2.80 2.82 0.00 5.97 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.21 0.00 2.06 2.09 0.00 2.87 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.46 0.00 77 N 7.94 4.88 0.00 2.79 2.79 0.00 0.00 6.92 7.32 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 78 I 7.46 5.13 1.55 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.64 0.62 0.00 0.00 79 N 8.40 4.73 0.00 2.89 2.96 0.00 0.00 5.96 7.40 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 80 S 8.59 4.22 0.00 4.03 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 81 N 8.10 4.47 0.00 2.75 2.91 0.00 0.00 7.02 7.65 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 82 G 7.95 4.36 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 0.00 83 S 7.83 4.49 0.00 4.01 3.79 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 84 I 7.80 5.24 1.89 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.29 0.93 0.00 0.00 84 L 7.96 5.41 0.00 1.34 1.42 1.05 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.98 4.59 0.00 3.01 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 88 I 7.81 4.05 2.10 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.97 0.00 0.00 89 L 7.76 4.30 0.00 1.81 1.61 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.87 4.71 0.00 1.85 1.61 0.00 3.14 0.00 0.00 3.15 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 91 S 9.53 4.14 0.00 3.89 3.96 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 92 Q 7.91 4.44 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 7.05 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 93 W 7.69 4.71 0.00 3.51 3.08 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 94 S 6.32 4.29 0.00 3.58 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 95 P 0.00 4.11 0.00 1.68 1.41 0.00 3.51 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 96 A 7.21 4.01 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 97 L 6.93 4.32 0.00 0.37 1.08 0.60 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.80 5.06 4.41 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 1.22 0.00 0.00 99 I 9.11 3.75 1.69 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 1.45 1.23 0.96 0.00 0.00 100 S 8.07 4.14 0.00 4.01 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 0.00 101 K 8.27 4.09 0.00 2.02 1.86 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.46 7.81 102 V 8.03 3.67 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 1.25 0.00 0.00 103 L 8.12 4.03 0.00 2.07 1.71 0.87 0.48 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 0.00 104 L 7.88 4.02 0.00 1.92 1.73 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.31 4.17 0.00 4.06 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 0.00 106 I 7.75 3.71 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.11 0.97 0.00 0.00 107 C 8.44 4.04 0.00 3.10 3.01 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 0.00 108 S 8.15 4.14 0.00 4.08 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 0.00 109 L 7.65 3.96 0.00 1.74 1.83 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.74 3.87 0.00 1.84 1.54 -0.20 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.59 4.66 0.00 3.13 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 0.00 112 D 8.39 4.66 0.00 2.53 2.53 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 0.00 0.00 0.00 0.00 113 P 0.00 4.44 0.00 1.64 1.68 0.00 3.69 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.09 0.00 114 N 8.03 4.76 0.00 2.75 2.67 0.00 0.00 6.62 7.71 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 0.00 115 P 0.00 4.22 0.00 2.30 2.35 0.00 3.83 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 2.05 2.21 0.00 116 D 7.94 4.65 0.00 2.80 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 0.00 117 D 7.84 4.82 0.00 2.58 2.57 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 0.00 118 P 0.00 4.52 0.00 2.13 2.01 0.00 3.73 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 1.96 1.93 0.00 119 L 9.09 4.28 0.00 1.48 1.74 0.90 0.89 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 0.00 120 V 7.07 4.29 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 0.90 0.00 0.00 0.90 0.00 0.00 121 P 0.00 4.15 0.00 2.19 2.08 0.00 3.64 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 122 E 8.20 3.95 0.00 2.09 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 0.00 2.44 2.53 0.00 123 I 7.62 3.64 1.72 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 0.86 0.97 0.29 0.00 0.00 124 A 7.62 4.02 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 0.00 125 R 7.94 3.97 0.00 1.94 2.08 0.00 3.15 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 126 I 7.88 3.71 2.10 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.90 1.08 0.00 0.00 127 Y 7.81 3.85 0.00 2.70 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 0.00 128 K 8.24 3.98 0.00 1.88 1.81 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.68 7.81 129 T 7.74 4.41 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 0.00 130 D 8.07 4.70 0.00 2.64 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 0.00 131 R 8.00 3.81 0.00 1.67 1.79 0.00 2.81 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.04 0.00 132 E 8.17 3.97 0.00 2.23 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 0.00 2.55 2.42 0.00 133 K 8.09 4.03 0.00 1.88 1.92 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.13 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.97 7.81 134 Y 8.03 4.10 0.00 3.16 3.17 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 0.00 135 N 8.71 4.39 0.00 2.98 2.89 0.00 0.00 7.08 7.98 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 0.00 136 R 7.64 3.86 0.00 1.97 1.93 0.00 3.12 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 137 I 7.68 3.64 1.08 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.64 -0.39 0.00 0.00 138 A 7.71 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.70 4.37 0.00 1.83 2.18 0.00 3.10 0.00 0.00 3.07 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 140 E 8.22 4.11 0.00 2.32 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 2.32 2.62 0.00 141 W 8.65 4.15 0.00 3.45 3.68 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 0.00 142 T 8.01 4.22 4.55 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 1.41 0.00 0.00 143 Q 7.94 4.03 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.01 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 144 K 7.69 3.92 0.00 0.88 0.74 0.00 1.43 0.00 0.00 1.23 0.00 0.00 2.76 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.10 1.23 7.81 145 Y 7.95 4.79 0.00 3.12 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 0.00 146 A 8.12 4.43 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 0.00 147 M 7.89 4.18 0.00 2.03 1.97 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 2.73 2.65 0.00