NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.8490 8.3501 109.7403 45.0991 0.0000 173.1625 1 A 3.9441 8.3140 121.5996 50.8142 18.7972 175.9077 2 S 4.2904 9.3577 115.6404 58.9501 63.8902 173.1951 3 I 3.3760 6.9988 127.6193 63.1294 37.8582 175.8557 4 V 4.8325 6.5711 120.5488 60.9923 33.6020 175.2287 5 S 4.9774 8.8929 122.8887 56.5634 66.5320 172.8443 6 L 4.7054 8.8060 126.0948 55.0817 41.9852 175.7973 7 L 4.6321 9.2257 126.7814 56.1423 43.5952 177.2838 8 G 4.3633 7.8574 103.5713 45.0688 0.0000 172.0154 9 I 5.2077 8.2530 122.0966 59.1525 41.4183 173.7746 10 K 4.6016 9.1345 130.3535 54.4749 35.1105 174.9127 11 V 3.9084 8.5181 127.9068 62.5016 31.7269 175.4155 12 L 4.2355 8.4801 128.7239 53.5074 43.0174 176.5745 13 N 4.0383 8.3205 115.8704 54.2436 35.7949 173.9723 14 N 4.8080 7.3737 113.9430 50.9317 42.4896 172.0059 15 P 4.7739 0.0000 0.0000 62.9854 33.3353 174.2127 16 A 4.4899 8.2134 119.5612 50.8797 23.2607 176.0110 17 K 4.4394 8.9032 118.8550 56.1784 32.7450 178.6360 18 F 3.8631 8.5121 126.2821 61.5949 39.2927 176.4869 19 T 4.2622 7.8521 107.3421 62.2768 69.3099 174.5813 20 D 4.4641 7.5481 122.7173 53.4088 41.4541 174.4134 21 P 4.5059 0.0000 0.0000 62.9019 32.3696 175.7986 22 Y 4.1853 8.9274 120.9207 58.0337 39.4768 174.7465 23 E 5.1974 8.0776 121.5183 54.8934 34.1223 174.1525 24 F 5.1852 9.5405 123.3793 55.5609 42.9953 173.6098 25 E 4.7510 9.2071 125.2314 54.9899 31.0968 174.5544 26 I 4.8497 8.3935 128.3433 59.6890 40.4424 174.6429 27 T 5.2819 8.9459 123.8347 61.7545 71.2828 173.3361 28 F 5.7223 9.0921 120.7121 55.2951 42.3345 173.0860 29 E 5.1672 9.5428 116.9619 54.6785 33.1860 174.2954 30 C 5.1629 8.8103 120.8221 57.9232 33.9060 174.5980 31 L 4.2222 8.8243 127.4307 56.8541 41.9499 176.8498 32 E 4.6122 7.6338 113.9777 54.0671 32.5767 174.5908 33 S 4.1607 8.5257 114.2940 58.6183 62.8785 173.3722 34 L 5.0744 8.1264 126.2761 52.5933 44.4386 176.6302 35 K 4.1258 9.5931 124.0175 59.1219 32.4059 177.0042 36 H 4.8909 8.3817 114.3017 53.7385 30.3292 174.1338 37 D 4.8054 8.3570 121.3755 54.5273 42.4297 175.1497 38 L 4.6433 9.2491 120.4593 54.0199 43.7732 175.8603 39 E 4.9657 9.0295 124.4678 54.5334 31.4328 174.4610 40 W 5.1848 9.2346 128.3569 55.5153 31.1073 175.9616 41 K 5.4145 9.2505 122.5749 55.2926 36.3645 174.6007 42 L 5.0252 8.9271 122.9795 53.6120 45.0316 175.0195 43 T 4.9552 8.8720 123.0967 61.9338 71.6213 172.7074 44 Y 4.4549 9.1061 128.8898 56.4378 39.0913 175.9985 45 V 3.4017 8.4611 129.1165 63.9226 32.4412 176.7572 46 G 3.9318 7.5909 108.4568 46.2738 0.0000 173.1156 47 S 4.7074 9.1666 117.9651 56.3922 66.0874 175.3973 48 S 4.0829 8.8385 120.1602 60.8483 62.8916 175.6094 49 R 4.0761 8.0063 116.4186 57.4429 29.7248 175.5685 50 S 4.9166 7.7552 113.2052 56.8496 65.4603 173.9218 51 L 4.5827 8.4851 120.1992 55.0778 41.2763 176.8050 52 D 4.8544 8.0382 117.2354 53.2049 39.8913 176.2510 53 H 4.8214 7.9429 115.5238 56.4220 29.7247 174.2592 54 D 4.4016 8.4556 119.0921 55.5612 39.0491 174.1160 55 Q 4.3539 8.1093 117.6842 55.1074 30.4507 175.8680 56 E 4.5007 8.8299 125.9389 55.8600 29.3826 176.2084 57 L 4.2727 9.0170 128.5394 57.5816 42.1937 177.0170 58 D 4.8350 7.9119 115.7980 53.6129 44.6337 173.7054 59 S 5.5073 8.6006 115.4385 56.7969 66.6792 172.9874 60 I 4.6710 9.2707 121.2126 59.3179 41.2872 173.9716 61 L 4.8402 8.7444 129.4881 54.2953 42.6267 176.2409 62 V 4.1923 10.7603 125.5274 61.8544 33.5084 175.6177 63 G 4.6250 8.5165 114.8143 43.5291 0.0000 169.5099 64 P 4.3712 0.0000 0.0000 62.3334 31.7226 176.5161 65 V 4.1342 8.3295 123.0953 60.8798 32.2631 173.7728 66 P 4.3730 0.0000 0.0000 62.1313 31.8597 176.3590 67 V 3.6555 8.3296 122.4055 63.6411 32.3781 174.1182 68 G 3.7515 8.3802 112.6873 44.0637 0.0000 172.2823 69 V 4.2391 8.1503 120.3784 62.7733 32.3952 176.6681 70 N 5.0253 8.8968 124.0977 51.3455 42.8300 173.2859 71 K 5.2046 8.4160 121.7946 55.1049 35.5262 174.9519 72 F 4.9886 9.1486 120.8010 55.9641 42.0405 172.7436 73 V 4.4652 8.3476 119.3667 61.2785 32.9069 174.4416 74 F 4.6761 9.0583 131.3282 57.0486 40.5967 174.1893 75 S 5.5106 8.3105 120.3767 56.6138 65.1400 172.8744 76 A 4.7784 8.9646 126.7737 50.4026 22.6727 175.5611 77 D 4.8675 8.8540 122.0648 53.4717 41.7497 174.7648 78 P 4.6613 0.0000 0.0000 61.6053 32.1282 174.1183 79 P 4.4001 0.0000 0.0000 61.8365 32.2578 176.0211 80 S 4.0667 8.5593 112.9842 58.4981 62.1567 174.9150 81 A 4.0688 8.8590 130.3795 55.2501 18.2923 178.9962 82 E 4.1131 8.0906 114.3789 58.4559 29.5233 177.6028 83 L 4.5653 7.5185 116.3051 54.3201 42.7501 176.3716 84 I 4.1202 7.3100 120.5962 59.9511 37.8747 174.1110 85 P 4.6374 0.0000 0.0000 61.5702 32.8371 176.9271 86 A 4.0999 8.5091 121.1550 55.1055 18.2217 180.1028 87 S 4.2096 8.0948 112.2917 61.1834 62.8731 175.7289 88 E 4.2384 7.9097 120.3483 57.9136 29.3579 178.1452 89 L 4.2891 7.5118 118.6681 57.0042 41.9910 178.9429 90 V 3.7217 7.6071 117.0489 64.7015 32.0318 175.9952 91 S 4.8312 7.1705 112.3150 56.1136 65.6031 174.4251 92 V 4.0946 8.0947 116.0786 62.0050 32.2838 175.2841 93 T 4.7770 8.7456 113.1541 59.9274 72.6107 172.5247 94 V 5.0702 8.0831 120.0022 60.9862 34.8749 173.9573 95 I 4.9739 8.6236 120.1790 59.0184 40.7634 174.2533 96 L 4.9422 8.7529 124.4138 52.9617 44.7165 174.9907 97 L 4.8128 8.7568 127.5477 53.4573 43.6074 175.4064 98 S 4.9422 8.9814 120.3685 56.6152 67.1157 172.2542 99 C 4.5533 8.1350 120.6268 57.4068 33.7528 172.8947 100 S 5.0865 8.6066 120.3383 56.7944 67.3984 172.3992 101 Y 4.6722 8.6518 123.0702 55.9130 41.2077 174.9955 102 D 4.0243 9.2861 127.4345 55.0900 39.6600 174.2479 103 G 3.7664 8.3797 103.8029 44.9347 0.0000 173.9044 104 R 4.2952 7.6132 119.8266 53.8026 30.9683 175.2490 105 E 4.3585 8.7377 124.5656 55.4671 30.1939 176.0144 106 F 5.3965 8.5128 120.0387 56.6281 40.6010 175.1407 107 V 4.8696 6.6791 118.3733 60.2047 34.9718 173.7319 108 R 4.7844 8.9154 122.8696 54.6978 33.8120 173.5882 109 V 4.4977 9.3482 127.4179 61.1252 33.8786 174.2876 110 G 4.2678 8.6947 116.1781 44.9392 0.0000 171.6649 111 Y 5.1709 8.6509 120.0445 55.9356 42.2453 174.8066 112 Y 5.0286 8.6809 120.5537 58.1797 39.9364 174.7578 113 V 4.8475 9.2107 122.1519 61.3158 35.0308 173.5535 114 N 5.1321 9.3702 127.7103 52.2797 40.3939 173.0606 115 N 5.3660 8.7562 124.1691 52.1834 40.2837 174.5861 116 E 4.7038 8.9778 122.3061 54.4662 34.0023 174.8909 117 Y 4.9050 8.6282 121.3874 58.2371 38.6945 175.3936 118 D 4.9237 8.9609 121.8194 53.4812 40.4374 175.9600 119 E 4.7707 7.8688 117.8542 53.9114 33.8839 175.9395 120 E 3.9754 8.7716 121.6145 59.5232 29.7553 179.1085 121 E 3.9625 8.0764 118.2386 59.3276 29.2672 179.1833 122 L 3.7810 7.6797 118.5837 57.7222 41.4681 179.5860 123 R 4.1179 7.7777 117.1572 59.1944 30.0467 178.5799 124 E 4.2936 8.4490 117.9520 57.7173 31.0692 176.9570 125 N 5.0047 8.2000 115.3261 50.3511 38.7432 171.6509 126 P 4.4276 0.0000 0.0000 61.4074 32.4985 175.7224 127 P 4.4349 0.0000 0.0000 61.8155 32.1589 176.4009 128 A 4.0209 8.5448 124.6549 55.0747 18.5002 177.9928 129 K 4.0742 7.8415 115.3517 55.6852 31.2622 176.8584 130 V 3.6763 8.2390 124.5938 63.2767 31.8735 176.7128 131 Q 4.3358 8.5601 131.0404 54.1185 27.5433 175.7715 132 V 3.3512 7.8835 122.1204 65.5551 31.9800 177.4668 133 D 4.4405 8.1309 117.4504 56.7052 41.4401 175.8430 134 H 5.0582 8.6232 115.2513 55.7726 30.1897 174.1491 135 I 4.5753 7.8421 121.5545 60.6112 38.6857 174.8545 136 V 4.3599 8.9070 127.7266 61.4631 33.5151 174.3399 137 R 4.6851 9.2003 129.4844 55.1991 31.6446 174.3318 138 N 4.9725 9.0981 126.4219 51.7060 40.8833 173.4390 139 I 4.2762 8.7860 128.6786 61.0437 38.0467 177.9282 140 L 4.3758 9.0780 129.0064 53.8301 39.7861 177.4924 141 A 4.3097 7.9437 123.3193 54.3228 19.0150 178.6074 142 E 4.4487 8.1924 113.3651 56.8862 30.4177 176.4147 143 K 4.7440 7.8762 117.6428 54.6617 32.7695 174.6184 144 P 4.1374 0.0000 0.0000 62.7324 33.0463 177.6621 145 R 4.2897 8.5523 122.8412 54.8368 31.6371 174.5303 146 V 4.6015 8.1164 126.9187 61.7580 33.0001 175.0095 147 T 4.4565 8.7886 124.4434 61.6658 71.7105 173.0594 148 R 4.8281 8.1952 124.1428 54.3509 32.6048 175.3597 149 F 4.9799 8.6142 121.4312 55.5602 41.8927 175.0187 150 N 4.6076 9.0069 121.2149 52.9697 38.8174 174.5085 151 I 4.5064 7.9359 115.7984 58.3991 40.7570 175.0186 152 V 3.9549 7.9258 120.6816 62.3423 33.7384 173.2040 153 W 4.2067 9.0333 125.3304 57.3241 27.6512 176.0476 154 D 4.7002 9.5364 127.1027 55.2793 40.5005 176.0663 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 0 G 8.35 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 1 A 8.31 3.94 1.25 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 0.00 0.00 2 S 9.36 4.29 0.00 3.98 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 3 I 7.00 3.38 0.56 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 -0.26 -0.01 0.33 0.00 0.00 4 V 6.57 4.83 1.76 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 1.15 0.00 0.00 0.61 0.00 0.00 5 S 8.89 4.98 0.00 3.88 3.78 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 6 L 8.81 4.71 0.00 1.86 1.71 1.27 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 L 9.23 4.63 0.00 1.73 1.74 0.95 0.92 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 8 G 7.86 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 9 I 8.25 5.21 1.94 0.00 0.00 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 1.47 0.97 1.04 0.00 0.00 10 K 9.13 4.60 0.00 1.83 1.60 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.34 7.81 11 V 8.52 3.91 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 0.49 0.00 0.00 0.67 0.00 0.00 12 L 8.48 4.24 0.00 1.41 1.48 0.86 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.32 4.04 0.00 2.68 2.72 0.00 0.00 6.62 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 7.37 4.81 0.00 2.57 2.53 0.00 0.00 7.33 7.69 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 15 P 0.00 4.77 0.00 2.10 2.06 0.00 3.83 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 16 A 8.21 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.90 4.44 0.00 1.94 1.75 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 18 F 8.51 3.86 0.00 2.95 3.09 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 19 T 7.85 4.26 4.27 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 1.35 0.00 0.00 20 D 7.55 4.46 0.00 2.69 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.51 0.00 1.88 1.97 0.00 3.58 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 1.98 2.23 0.00 22 Y 8.93 4.19 0.00 3.07 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 23 E 8.08 5.20 0.00 1.68 1.68 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 2.26 2.26 0.00 24 F 9.54 5.19 0.00 2.81 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 25 E 9.21 4.75 0.00 1.98 1.79 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 2.19 2.22 0.00 26 I 8.39 4.85 0.91 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.46 0.65 0.00 0.00 27 T 8.95 5.28 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 1.27 0.00 0.00 28 F 9.09 5.72 0.00 3.54 3.42 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 29 E 9.54 5.17 0.00 2.01 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 2.25 2.26 0.00 30 C 8.81 5.16 0.00 3.22 2.83 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 31 L 8.82 4.22 0.00 1.35 1.58 0.86 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.63 4.61 0.00 1.94 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 0.00 1.96 2.11 0.00 33 S 8.53 4.16 0.00 3.84 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 34 L 8.13 5.07 0.00 1.78 1.83 0.72 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 35 K 9.59 4.13 0.00 1.76 2.29 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.22 1.34 7.81 36 H 8.38 4.89 0.00 2.41 2.89 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 D 8.36 4.81 0.00 2.65 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 38 L 9.25 4.64 0.00 1.69 1.53 0.91 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 39 E 9.03 4.97 0.00 2.00 1.77 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 2.26 2.29 0.00 40 W 9.23 5.18 0.00 3.72 3.33 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 41 K 9.25 5.41 0.00 1.97 1.93 0.00 1.41 0.00 0.00 1.55 0.00 0.00 2.68 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.34 7.81 42 L 8.93 5.03 0.00 1.64 1.75 0.76 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.87 4.96 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 1.22 0.00 0.00 44 Y 9.11 4.45 0.00 2.96 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 45 V 8.46 3.40 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 0.90 0.00 0.00 0.89 0.00 0.00 46 G 7.59 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 S 9.17 4.71 0.00 3.94 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 48 S 8.84 4.08 0.00 3.90 3.95 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 49 R 8.01 4.08 0.00 1.96 2.11 0.00 3.01 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 50 S 7.76 4.92 0.00 4.04 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 51 L 8.49 4.58 0.00 1.68 1.73 0.94 0.99 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 52 D 8.04 4.85 0.00 2.91 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 53 H 7.94 4.82 0.00 3.39 3.51 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.46 4.40 0.00 2.87 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 55 Q 8.11 4.35 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 56 E 8.83 4.50 0.00 2.00 1.92 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 2.35 2.38 0.00 57 L 9.02 4.27 0.00 1.78 1.95 0.96 1.28 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 58 D 7.91 4.83 0.00 2.76 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 59 S 8.60 5.51 0.00 4.04 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 60 I 9.27 4.67 1.84 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 1.26 1.48 1.22 0.00 0.00 61 L 8.74 4.84 0.00 1.61 1.64 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 62 V 10.76 4.19 2.22 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 0.77 0.00 0.00 0.42 0.00 0.00 63 G 8.52 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.37 0.00 2.09 2.05 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 65 V 8.33 4.13 2.24 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 1.09 0.00 0.00 1.22 0.00 0.00 66 P 0.00 4.37 0.00 2.21 2.06 0.00 4.01 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 2.13 1.96 0.00 67 V 8.33 3.66 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 0.86 0.00 0.00 0.89 0.00 0.00 68 G 8.38 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 69 V 8.15 4.24 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 0.74 0.00 0.00 0.90 0.00 0.00 70 N 8.90 5.03 0.00 1.44 2.11 0.00 0.00 6.16 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 71 K 8.42 5.20 0.00 1.67 1.62 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.52 7.81 72 F 9.15 4.99 0.00 3.17 3.13 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 73 V 8.35 4.47 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 0.82 0.00 0.00 0.90 0.00 0.00 74 F 9.06 4.68 0.00 3.02 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 75 S 8.31 5.51 0.00 3.86 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.96 4.78 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 77 D 8.85 4.87 0.00 2.61 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 78 P 0.00 4.66 0.00 1.94 1.72 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 79 P 0.00 4.40 0.00 1.95 1.75 0.00 3.50 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.44 0.00 80 S 8.56 4.07 0.00 3.88 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 81 A 8.86 4.07 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 82 E 8.09 4.11 0.00 2.00 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 2.35 2.29 0.00 83 L 7.52 4.57 0.00 1.67 1.72 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.31 4.12 1.74 0.00 0.00 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 1.49 0.53 0.89 0.00 0.00 85 P 0.00 4.64 0.00 2.25 2.20 0.00 3.88 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 86 A 8.51 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 87 S 8.09 4.21 0.00 4.08 4.16 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 88 E 7.91 4.24 0.00 2.20 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 2.41 2.42 0.00 89 L 7.51 4.29 0.00 1.71 1.61 0.43 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.61 3.72 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 0.87 0.00 0.00 0.95 0.00 0.00 91 S 7.17 4.83 0.00 3.88 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 92 V 8.09 4.09 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 0.52 0.00 0.00 0.32 0.00 0.00 93 T 8.75 4.78 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 1.25 0.00 0.00 94 V 8.08 5.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.82 0.00 0.00 95 I 8.62 4.97 1.74 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 1.36 0.72 0.77 0.00 0.00 96 L 8.75 4.94 0.00 1.48 1.48 0.86 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.76 4.81 0.00 1.07 1.30 0.07 0.04 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 S 8.98 4.94 0.00 3.80 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 99 C 8.14 4.55 0.00 1.23 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 0.00 100 S 8.61 5.09 0.00 3.63 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 0.00 101 Y 8.65 4.67 0.00 2.91 2.43 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 0.00 102 D 9.29 4.02 0.00 1.88 2.30 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 0.00 103 G 8.38 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 0.00 0.00 0.00 104 R 7.61 4.30 0.00 1.83 1.72 0.00 3.01 0.00 0.00 3.01 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.41 0.00 105 E 8.74 4.36 0.00 1.70 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.15 0.00 106 F 8.51 5.40 0.00 3.25 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 0.00 107 V 6.68 4.87 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 0.11 0.00 0.00 0.89 0.00 0.00 108 R 8.92 4.78 0.00 2.09 1.72 0.00 3.05 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.50 0.00 109 V 9.35 4.50 1.92 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 0.55 0.00 0.00 0.88 0.00 0.00 110 G 8.69 4.27 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 0.00 111 Y 8.65 5.17 0.00 2.92 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.68 5.03 0.00 2.98 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 0.00 113 V 9.21 4.85 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 1.08 0.00 0.00 1.09 0.00 0.00 114 N 9.37 5.13 0.00 2.85 2.69 0.00 0.00 6.71 6.25 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 0.00 115 N 8.76 5.37 0.00 2.81 2.72 0.00 0.00 6.93 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 0.00 116 E 8.98 4.70 0.00 1.87 1.79 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 2.21 2.44 0.00 117 Y 8.63 4.91 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 0.00 118 D 8.96 4.92 0.00 2.73 2.84 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 0.00 119 E 7.87 4.77 0.00 1.87 1.77 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 2.29 2.17 0.00 120 E 8.77 3.98 0.00 2.08 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 0.00 2.38 2.46 0.00 121 E 8.08 3.96 0.00 1.94 1.92 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 2.37 2.31 0.00 122 L 7.68 3.78 0.00 1.64 0.78 0.55 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 123 R 7.78 4.12 0.00 2.00 2.05 0.00 3.20 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.98 0.00 124 E 8.45 4.29 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.45 0.00 125 N 8.20 5.00 0.00 2.68 2.69 0.00 0.00 7.08 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 0.00 126 P 0.00 4.43 0.00 2.33 2.38 0.00 3.43 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 127 P 0.00 4.43 0.00 2.21 1.96 0.00 3.56 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.91 0.00 128 A 8.54 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 0.00 129 K 7.84 4.07 0.00 1.76 1.82 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.43 7.81 130 V 8.24 3.68 2.05 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 0.64 0.00 0.00 1.00 0.00 0.00 131 Q 8.56 4.34 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.50 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 132 V 7.88 3.35 1.98 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 0.94 0.00 0.00 0.27 0.00 0.00 133 D 8.13 4.44 0.00 2.65 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 0.00 134 H 8.62 5.06 0.00 3.40 3.53 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 7.84 4.58 2.03 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.80 0.96 0.00 0.00 136 V 8.91 4.36 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 0.93 0.00 0.00 0.97 0.00 0.00 137 R 9.20 4.69 0.00 1.90 1.86 0.00 3.10 0.00 0.00 2.76 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 138 N 9.10 4.97 0.00 2.81 2.68 0.00 0.00 6.78 7.89 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 0.00 139 I 8.79 4.28 1.86 0.00 0.00 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 1.33 0.68 0.68 0.00 0.00 140 L 9.08 4.38 0.00 2.03 1.77 1.07 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 141 A 7.94 4.31 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 0.00 142 E 8.19 4.45 0.00 2.03 2.04 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 2.33 2.37 0.00 143 K 7.88 4.74 0.00 1.83 1.78 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.42 7.81 144 P 0.00 4.14 0.00 1.76 1.60 0.00 3.83 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 1.93 1.99 0.00 145 R 8.55 4.29 0.00 1.68 1.63 0.00 2.97 0.00 0.00 2.96 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.41 0.00 146 V 8.12 4.60 2.00 0.00 0.00 0.00 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 0.83 0.00 0.00 147 T 8.79 4.46 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 0.54 0.00 0.00 148 R 8.20 4.83 0.00 1.55 1.79 0.00 3.16 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 149 F 8.61 4.98 0.00 3.03 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 0.00 150 N 9.01 4.61 0.00 2.76 2.81 0.00 0.00 6.80 7.45 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 0.00 151 I 7.94 4.51 1.54 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 -0.36 0.91 0.00 0.00 152 V 7.93 3.95 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 0.84 0.00 0.00 0.92 0.00 0.00 153 W 9.03 4.21 0.00 3.15 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 0.00 154 D 9.54 4.70 0.00 2.75 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