NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 K 4.0785 8.3144 120.1315 56.5487 32.6653 171.3558 23 D 4.0704 8.6487 130.5905 52.7366 42.0021 172.6333 24 S 4.0941 9.4940 122.8397 61.5185 63.3091 175.3002 25 L 3.9041 8.0853 121.2038 57.8809 41.3904 179.4998 26 R 3.9079 8.8567 118.8237 59.4840 30.0797 178.7174 27 V 3.6531 7.7441 118.0033 65.9590 31.5506 177.5478 28 E 3.9709 9.0020 119.9704 59.3097 29.4941 179.1159 29 S 4.1524 7.9786 115.3246 61.5722 62.9881 175.8869 30 Y 3.9107 8.2282 122.3996 60.6771 38.5065 178.4562 31 G 3.7600 8.5453 106.7753 48.1915 0.0000 175.8303 32 T 4.1209 8.0224 117.6964 66.0882 68.3911 177.0216 33 I 3.8249 7.6639 122.0070 63.9378 37.1044 177.8594 34 D 4.2253 7.9503 119.0930 57.1311 41.1944 177.6888 35 E 3.9828 8.5681 120.3297 59.2836 29.6418 178.4362 36 L 4.0228 8.0823 120.1699 58.4383 42.2742 178.2378 37 N 4.3563 8.6049 117.2401 56.9795 38.7036 176.8149 38 S 4.0580 8.2230 116.2705 61.8401 62.9431 176.6177 39 F 3.9003 8.1726 120.0414 60.7195 38.5393 177.9468 40 I 3.8372 8.0218 119.6755 64.1565 36.8993 178.5022 41 G 3.6956 8.2054 106.7967 47.8121 0.0000 175.5137 42 L 3.9552 7.7299 121.9504 57.7958 42.2609 178.7162 43 A 4.0066 8.2944 121.0525 54.9471 18.1944 179.4262 44 L 3.9351 8.4615 119.2094 58.1169 41.9671 178.9090 45 A 3.9768 7.8350 119.7402 55.1339 18.5440 179.0032 46 E 4.0018 8.2164 117.5616 59.6141 29.9658 178.9815 47 L 3.9003 8.4000 119.2565 57.8919 41.4502 179.3307 48 S 4.5306 8.3001 113.5184 60.1354 62.8275 175.7590 49 G 3.8720 8.0950 107.8375 44.6584 0.0000 173.6566 50 Q 4.7901 7.4183 119.2400 53.1962 31.7679 173.7278 51 P 4.4157 0.0000 0.0000 63.4318 32.3464 176.2913 52 G 3.6136 8.9177 106.3007 45.8046 0.0000 173.8641 53 F 5.2190 7.5496 116.4034 56.3489 40.8581 176.9907 54 E 4.0763 8.5996 123.7681 59.4485 29.2869 178.6773 55 D 4.4444 8.1446 118.7190 56.6957 39.6627 178.4653 56 L 4.2588 8.1438 120.5593 57.5192 41.7676 179.4669 57 T 3.9218 8.4651 115.7366 66.8073 68.5349 176.5479 58 A 4.1154 8.1105 122.5211 55.0817 18.2490 179.6207 59 E 4.0154 8.3321 116.7452 59.8100 29.6717 179.3564 60 L 3.9731 8.3135 119.1044 57.9970 41.5527 179.5171 61 L 4.0375 7.9901 119.7084 58.4327 41.9989 179.2355 62 T 3.9335 7.9206 115.7441 66.6335 68.3535 176.8232 63 I 4.1008 8.5923 123.8406 63.9577 37.1119 178.4234 64 Q 4.7427 8.3057 120.3021 58.8291 28.5253 178.7018 65 H 4.1266 8.0519 117.2368 59.0320 28.8094 177.8018 66 E 3.9034 8.4056 120.3898 59.3085 29.1138 179.4651 67 L 4.1427 8.4759 119.6331 57.4363 41.6477 179.2394 68 F 4.0191 8.2488 120.7807 61.4383 39.3959 176.9041 69 D 4.4781 8.3775 118.4992 57.5140 40.5979 178.3685 70 C 4.0466 8.4886 117.6746 62.8607 28.1205 176.2446 71 G 3.3705 8.0698 107.1766 47.8892 0.0000 175.5544 72 G 3.8130 8.0144 108.8280 47.6780 0.0000 175.3204 73 D 4.6955 8.4577 120.3631 57.0329 40.8578 178.4222 74 L 4.2735 7.7803 118.4495 57.1409 41.8739 178.8067 75 A 4.1610 8.3196 120.6276 53.8573 18.6433 178.3212 76 I 3.8499 7.2463 118.2750 62.2088 37.5487 176.9114 77 V 4.5367 8.0985 117.9208 61.4682 32.3030 175.1986 78 T 4.1727 7.2675 111.2856 63.0844 70.0630 173.5280 *82 D 4.0858 7.5904 121.0847 53.9432 42.5713 174.7433 83 Y 4.6926 7.8784 118.9143 57.5645 38.9321 175.8711 84 K 4.3243 9.6204 121.1422 58.1700 33.2254 177.9484 85 L 3.9739 8.3976 119.7988 55.5045 42.4418 175.8634 86 T 4.7556 7.9942 118.0028 59.7620 70.4511 174.6602 87 E 4.0567 8.6366 124.8833 59.2042 29.4302 179.4019 88 E 4.0585 8.2170 118.6796 59.5011 29.6417 179.1712 89 S 4.3115 7.9080 115.1471 61.7075 62.4860 176.9660 90 V 3.7855 7.8979 120.4789 65.9307 31.3235 178.2642 91 S 4.1396 7.9577 114.6761 61.4515 62.7859 176.0015 92 F 4.0999 8.8083 123.7274 61.4741 39.0262 176.9371 93 L 3.8442 7.8610 117.7191 58.0311 41.4097 179.1711 94 E 3.8960 7.7404 117.6644 59.8939 29.3823 179.6132 95 T 3.7280 7.6975 115.2842 66.9430 68.5011 176.9318 96 R 3.3998 7.5159 119.5178 58.9146 29.8534 179.2661 97 I 3.6877 8.0973 120.1481 64.2841 37.0734 178.2544 98 D 4.2257 8.1635 119.5880 57.3188 40.7892 178.2593 99 A 3.9034 7.9914 121.6793 55.7923 18.2595 179.4140 100 Y 4.3656 7.8294 114.9103 61.5745 37.7640 178.4786 101 T 3.9376 8.2032 115.8836 66.4364 68.5626 176.3880 102 A 4.1011 8.3436 122.1859 55.2805 18.6244 178.7517 103 E 3.9645 8.0570 116.1447 58.5419 29.9376 177.5128 104 A 4.3049 7.3855 120.3595 50.4354 19.3802 175.1777 105 P 4.3455 0.0000 0.0000 62.0675 31.9115 176.2841 106 E 3.8982 8.8699 120.5735 56.8354 29.6064 176.5621 107 L 4.5389 8.3049 122.7963 54.8676 42.0414 176.2730 108 K 4.5712 8.2835 117.7643 55.5925 33.6652 175.5885 109 K 4.4504 7.5088 117.9924 54.9203 35.2592 174.9341 110 F 4.3252 8.7330 121.5997 57.7993 39.8216 174.4557 111 I 4.8603 8.6758 123.7183 59.9336 39.0955 174.9496 112 L 4.8064 8.8248 125.4959 52.2504 43.7565 175.0160 113 P 4.1263 0.0000 0.0000 61.6209 32.0907 177.3729 114 G 3.7947 9.5734 110.3342 45.3717 0.0000 171.2292 115 G 4.0450 8.1213 107.7041 44.1981 0.0000 176.5452 116 S 4.4230 9.8085 122.7658 57.4170 64.9516 174.9862 117 K 3.9760 8.4232 121.0731 59.6170 31.7268 179.3631 118 C 3.9646 7.9758 116.2568 62.9163 28.2718 175.9193 119 A 3.8569 7.7748 121.9871 55.2130 17.3558 179.8980 120 S 4.1288 7.9897 113.8792 61.6127 62.7761 176.8606 121 L 4.0297 7.7919 121.7930 57.7460 41.3858 179.4911 122 L 3.8039 7.9908 118.9520 57.9872 41.4737 179.3308 123 H 4.3978 8.1059 116.1002 58.6709 28.5394 177.9155 124 I 3.5493 7.6031 121.3759 64.2861 36.8578 178.1295 125 A 3.6636 7.9225 121.8008 54.9754 17.9225 179.6805 126 R 4.0557 7.7199 117.2821 59.9644 30.2982 178.9520 127 T 3.8937 7.8621 109.6108 64.9216 68.6988 176.5772 128 I 3.6816 7.8714 122.7777 64.1595 36.9481 178.4836 129 T 3.9460 8.1299 117.0375 66.8026 68.2880 176.8029 130 R 3.9213 8.1008 119.9405 59.1194 30.0259 179.1656 131 R 3.8334 8.0289 118.2901 59.4452 30.1469 178.4276 132 A 4.0236 8.4097 121.0201 54.9926 18.2908 179.2646 133 E 3.8624 8.4004 118.0668 59.6308 29.7497 179.0911 134 R 3.9495 8.1068 118.1235 59.5312 30.1253 179.3285 135 R 3.9176 8.0030 117.6674 59.2110 29.8593 179.2927 136 V 3.5985 7.7386 117.0621 65.7561 31.5820 177.7744 137 V 3.7155 8.1813 117.1689 66.2587 31.4575 177.6615 138 A 4.1833 7.9612 118.8144 54.7744 18.3001 179.4831 139 L 4.0519 7.7527 116.4336 55.9589 41.7376 178.7395 *141 K 4.2264 8.0349 118.7109 55.5882 33.9507 177.1693 142 S 4.4266 8.1099 112.6007 59.8970 63.6635 173.4796 143 E 4.6895 7.4689 115.9592 55.0410 31.6019 174.5569 144 E 4.1626 8.6259 119.6112 56.4982 29.9864 176.5908 145 I 4.6088 7.7944 114.7798 58.3115 40.9955 175.3521 146 H 4.0174 8.1640 119.9242 55.8605 29.1270 175.1228 147 E 3.9283 8.6145 128.7904 59.5350 29.3031 179.0486 148 T 3.8280 7.6233 115.3403 66.5191 68.3936 176.4158 149 V 3.5771 7.6567 120.2260 65.9149 31.4362 177.9231 150 L 4.0301 7.7213 119.5379 57.8906 41.9510 179.0862 151 R 3.9161 7.8923 117.8508 59.1124 29.8780 177.8234 152 Y 4.0680 8.3322 119.8062 61.0609 38.5948 178.4513 153 L 3.9659 8.1255 119.4971 57.8398 41.4733 179.0782 154 N 4.2991 7.6699 116.0289 56.6482 39.0965 176.8223 155 R 4.0518 8.0326 119.4714 58.6316 30.2013 178.2399 156 L 3.5399 7.8222 120.9258 58.3769 42.0134 179.3081 157 S 4.3745 7.8720 113.7951 61.7488 62.6374 176.3081 158 D 4.4418 7.9445 121.9702 57.1521 40.7269 177.6503 159 Y 4.0028 8.2760 120.5256 60.9756 38.7731 178.4761 160 F 4.5533 8.4443 118.7177 60.3779 38.9434 177.4885 161 F 4.0957 8.2804 119.8698 61.3176 39.3270 177.1143 162 A 4.1266 8.5570 120.7532 54.8216 18.1907 179.8659 163 G 3.0287 8.3640 104.6128 47.5057 0.0000 175.9832 164 A 3.8346 8.2204 123.3997 54.7106 18.1698 180.0905 165 R 3.8129 7.3978 116.2959 59.2122 30.0471 179.1526 166 V 3.4699 7.3251 117.8268 66.0659 31.3703 177.9177 167 V 3.7543 7.4774 117.7606 66.3709 31.2169 177.7876 168 N 4.3686 8.0477 116.4709 55.5813 38.3371 177.0835 169 A 3.9344 8.1441 122.4419 55.3465 18.2869 179.5956 170 R 3.9171 8.6747 116.4037 59.5255 29.9955 178.8870 171 S 4.6055 8.5102 111.7822 57.6403 62.6947 174.3807 172 G 3.9878 8.0828 108.9371 46.9762 0.0000 175.5787 173 I 3.8197 7.7308 120.3880 61.5459 37.6864 176.1662 174 G 4.1141 8.0140 109.0702 44.6700 0.0000 173.1865 175 D 4.3510 8.4712 123.8108 53.9399 41.7296 176.1911 176 V 3.8687 8.3183 123.7722 62.8535 32.3725 175.4305 177 E 4.6523 8.7078 127.8075 55.6689 31.4218 176.7142 178 Y 4.5018 8.1742 122.2397 56.6877 37.4970 172.5785 179 E 4.4122 8.2690 121.6363 55.2209 32.1788 176.6523 180 R 2.8095 8.3925 117.2756 55.4854 32.4919 178.4018 181 S 3.5421 8.8486 100.5000 59.1458 61.7741 172.1115 182 A 4.2834 7.6136 128.9626 52.9822 19.0007 176.4425 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 22 K 8.31 4.08 0.00 1.75 1.87 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.41 7.81 23 D 8.65 4.07 0.00 3.00 2.62 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 24 S 9.49 4.09 0.00 3.93 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 25 L 8.09 3.90 0.00 1.91 1.73 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.86 3.91 0.00 2.06 1.92 0.00 3.12 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 27 V 7.74 3.65 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 1.03 0.00 0.00 0.97 0.00 0.00 28 E 9.00 3.97 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 29 S 7.98 4.15 0.00 4.05 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 30 Y 8.23 3.91 0.00 3.06 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 31 G 8.55 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.02 4.12 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 1.25 0.00 0.00 33 I 7.66 3.82 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.79 0.78 0.00 0.00 34 D 7.95 4.23 0.00 2.75 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 35 E 8.57 3.98 0.00 2.24 2.19 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 2.65 2.50 0.00 36 L 8.08 4.02 0.00 1.95 1.84 1.07 0.51 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 37 N 8.60 4.36 0.00 3.04 2.98 0.00 0.00 7.31 6.90 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 38 S 8.22 4.06 0.00 4.04 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 F 8.17 3.90 0.00 3.27 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 40 I 8.02 3.84 2.18 0.00 0.00 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 1.49 0.78 1.07 0.00 0.00 41 G 8.21 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 0.00 0.00 0.00 42 L 7.73 3.96 0.00 1.66 1.81 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.29 4.01 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 44 L 8.46 3.94 0.00 1.99 1.81 0.98 0.95 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 45 A 7.84 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.22 4.00 0.00 2.19 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 2.28 2.37 0.00 47 L 8.40 3.90 0.00 1.71 1.68 0.83 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.30 4.53 0.00 4.02 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 49 G 8.10 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.42 4.79 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 51 P 0.00 4.42 0.00 2.10 2.03 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.93 0.00 52 G 8.92 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 53 F 7.55 5.22 0.00 3.11 2.87 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.60 4.08 0.00 2.11 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 2.48 0.00 55 D 8.14 4.44 0.00 3.11 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 56 L 8.14 4.26 0.00 1.96 1.81 0.74 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.47 3.92 4.49 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 1.28 0.00 0.00 58 A 8.11 4.12 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.33 4.02 0.00 2.57 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 0.00 2.81 2.77 0.00 60 L 8.31 3.97 0.00 1.81 1.89 1.05 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.99 4.04 0.00 1.85 1.90 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 62 T 7.92 3.93 4.40 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 1.08 0.00 0.00 63 I 8.59 4.10 2.13 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 1.09 0.00 0.00 64 Q 8.31 4.74 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.59 0.00 65 H 8.05 4.13 0.00 3.28 3.30 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.41 3.90 0.00 1.99 1.42 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 2.19 2.44 0.00 67 L 8.48 4.14 0.00 1.95 1.75 1.11 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 68 F 8.25 4.02 0.00 3.27 3.28 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 69 D 8.38 4.48 0.00 2.97 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 70 C 8.49 4.05 0.00 3.06 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.07 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.01 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 73 D 8.46 4.70 0.00 2.78 2.65 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 74 L 7.78 4.27 0.00 1.84 1.78 0.93 0.81 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 75 A 8.32 4.16 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 76 I 7.25 3.85 2.22 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 1.30 0.91 0.85 0.00 0.00 77 V 8.10 4.54 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 0.74 0.00 0.00 0.99 0.00 0.00 78 T 7.27 4.17 4.22 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 0.00 0.00 0.00 1.16 0.00 0.00 *82 D 7.59 4.09 0.00 2.60 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 7.88 4.69 0.00 2.77 2.51 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 84 K 9.62 4.32 0.00 1.87 1.90 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.42 7.81 85 L 8.40 3.97 0.00 1.65 1.61 0.49 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 86 T 7.99 4.76 4.25 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 1.31 0.00 0.00 87 E 8.64 4.06 0.00 2.04 2.01 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 2.42 2.36 0.00 88 E 8.22 4.06 0.00 2.07 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 2.42 2.50 0.00 89 S 7.91 4.31 0.00 3.98 4.18 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 90 V 7.90 3.79 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.09 0.00 0.00 91 S 7.96 4.14 0.00 4.13 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 92 F 8.81 4.10 0.00 3.16 3.30 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 93 L 7.86 3.84 0.00 1.92 1.61 1.10 0.04 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 94 E 7.74 3.90 0.00 2.12 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 0.00 2.31 2.60 0.00 95 T 7.70 3.73 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 1.07 0.00 0.00 96 R 7.52 3.40 0.00 1.78 1.49 0.00 2.76 0.00 0.00 2.59 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 1.09 0.00 97 I 8.10 3.69 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.93 0.93 0.00 0.00 98 D 8.16 4.23 0.00 2.74 2.65 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 99 A 7.99 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 7.83 4.37 0.00 2.97 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 0.00 101 T 8.20 3.94 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 1.25 0.00 0.00 102 A 8.34 4.10 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 0.00 103 E 8.06 3.96 0.00 2.18 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 2.36 2.38 0.00 104 A 7.39 4.30 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.35 0.00 2.19 2.08 0.00 3.78 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 1.98 1.94 0.00 106 E 8.87 3.90 0.00 2.09 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 2.29 2.33 0.00 107 L 8.30 4.54 0.00 1.79 1.74 1.10 0.47 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 0.00 108 K 8.28 4.57 0.00 1.71 1.78 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.38 7.81 109 K 7.51 4.45 0.00 1.69 1.68 0.00 1.80 0.00 0.00 1.81 0.00 0.00 3.18 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.70 7.81 110 F 8.73 4.33 0.00 3.04 2.93 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 0.00 111 I 8.68 4.86 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 1.43 0.85 1.05 0.00 0.00 112 L 8.82 4.81 0.00 1.52 1.63 1.07 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.13 0.00 2.00 1.90 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 1.97 1.94 0.00 114 G 9.57 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 0.00 0.00 0.00 115 G 8.12 4.05 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 0.00 0.00 0.00 116 S 9.81 4.42 0.00 4.03 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.42 3.98 0.00 1.81 1.88 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.53 7.81 118 C 7.98 3.96 0.00 2.76 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 0.00 119 A 7.77 3.86 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 7.99 4.13 0.00 4.04 3.92 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 0.00 121 L 7.79 4.03 0.00 1.85 1.70 0.91 0.67 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 0.00 122 L 7.99 3.80 0.00 1.73 1.73 0.76 1.15 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 0.00 123 H 8.11 4.40 0.00 3.45 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.60 3.55 1.96 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.73 0.47 0.00 0.00 125 A 7.92 3.66 0.32 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 0.00 126 R 7.72 4.06 0.00 2.14 2.22 0.00 3.35 0.00 0.00 3.60 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.09 0.00 127 T 7.86 3.89 4.18 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 1.23 0.00 0.00 128 I 7.87 3.68 1.72 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.19 0.86 0.00 0.00 129 T 8.13 3.95 4.57 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 1.36 0.00 0.00 130 R 8.10 3.92 0.00 2.01 1.98 0.00 3.30 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.80 0.00 131 R 8.03 3.83 0.00 1.87 2.13 0.00 3.09 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 1.62 1.64 0.00 132 A 8.41 4.02 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 0.00 133 E 8.40 3.86 0.00 2.17 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 0.00 2.31 2.36 0.00 134 R 8.11 3.95 0.00 2.05 1.98 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 135 R 8.00 3.92 0.00 2.00 1.99 0.00 3.30 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.79 0.00 136 V 7.74 3.60 2.21 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 0.79 0.00 0.00 1.02 0.00 0.00 137 V 8.18 3.72 2.27 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 0.87 0.00 0.00 0.96 0.00 0.00 138 A 7.96 4.18 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 0.00 139 L 7.75 4.05 0.00 1.88 1.79 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 *141 K 8.03 4.23 0.00 1.98 1.90 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.66 7.81 142 S 8.11 4.43 0.00 3.97 3.99 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 0.00 143 E 7.47 4.69 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.31 0.00 144 E 8.63 4.16 0.00 2.03 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 0.00 2.34 2.27 0.00 145 I 7.79 4.61 1.84 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 1.29 0.54 0.99 0.00 0.00 146 H 8.16 4.02 0.00 1.42 2.72 0.00 5.71 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.61 3.93 0.00 2.01 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 2.39 2.39 0.00 148 T 7.62 3.83 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 1.29 0.00 0.00 149 V 7.66 3.58 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 0.99 0.00 0.00 0.83 0.00 0.00 150 L 7.72 4.03 0.00 1.78 1.79 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 151 R 7.89 3.92 0.00 2.07 1.97 0.00 3.20 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 152 Y 8.33 4.07 0.00 3.11 3.15 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 0.00 153 L 8.13 3.97 0.00 1.78 1.74 0.96 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 154 N 7.67 4.30 0.00 2.86 3.02 0.00 0.00 7.29 8.73 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 0.00 155 R 8.03 4.05 0.00 1.92 1.82 0.00 3.22 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 156 L 7.82 3.54 0.00 1.38 1.71 0.24 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 157 S 7.87 4.37 0.00 4.14 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 D 7.94 4.44 0.00 2.96 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 0.00 159 Y 8.28 4.00 0.00 2.89 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 0.00 160 F 8.44 4.55 0.00 3.39 3.29 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 0.00 161 F 8.28 4.10 0.00 3.38 3.34 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 0.00 162 A 8.56 4.13 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 G 8.36 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 0.00 0.00 0.00 164 A 8.22 3.83 0.96 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 0.00 165 R 7.40 3.81 0.00 1.60 1.83 0.00 2.80 0.00 0.00 2.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.15 0.00 166 V 7.33 3.47 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 0.91 0.00 0.00 0.79 0.00 0.00 167 V 7.48 3.75 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 0.82 0.00 0.00 0.43 0.00 0.00 168 N 8.05 4.37 0.00 2.99 2.91 0.00 0.00 6.44 7.24 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 0.00 169 A 8.14 3.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 R 8.67 3.92 0.00 2.01 2.03 0.00 3.39 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 1.44 1.63 0.00 171 S 8.51 4.61 0.00 4.10 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 0.00 172 G 8.08 3.99 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 0.00 0.00 0.00 173 I 7.73 3.82 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.86 0.91 0.00 0.00 174 G 8.01 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 0.00 175 D 8.47 4.35 0.00 2.68 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 8.32 3.87 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 177 E 8.71 4.65 0.00 1.94 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 2.32 2.52 0.00 178 Y 8.17 4.50 0.00 3.09 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 0.00 179 E 8.27 4.41 0.00 1.92 1.81 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 2.20 2.26 0.00 180 R 8.39 2.81 0.00 1.68 1.24 0.00 3.48 0.00 0.00 3.21 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 181 S 8.85 3.54 0.00 4.05 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 0.00 182 A 7.61 4.28 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 * Residues marked with a * may have inaccurate shift predictions.