NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.4288 8.1749 117.4052 63.3543 70.2812 173.8513 4 T 3.8187 8.2193 117.8605 63.0145 68.9915 172.3192 5 N 4.7281 10.1654 124.8150 51.8276 40.4631 174.5764 6 H 4.2475 8.6653 123.3559 57.9976 28.9658 176.6140 7 D 4.5386 8.3095 118.4375 55.9162 41.0888 175.9896 8 H 5.1815 7.9596 116.1882 54.8634 31.0167 173.8823 9 H 4.8266 8.9934 118.6879 54.9596 33.8574 172.0124 10 I 4.7782 8.1016 124.5331 59.6231 40.3420 173.9210 11 Y 4.9993 9.1887 125.0700 56.2350 40.4846 174.7980 12 V 4.7371 8.7916 125.5700 61.3163 33.2591 175.2097 13 L 5.0819 8.5156 128.7505 53.5994 43.3480 176.6384 *15 G 4.0399 8.3840 109.4281 45.3981 0.0000 172.6698 16 V 3.8660 7.7434 111.9109 60.1003 32.3989 176.1354 17 S 4.2198 8.6208 117.4408 60.5241 62.3940 174.9929 18 G 4.0114 9.0954 115.6503 45.3588 0.0000 173.7958 19 S 4.3421 7.7246 112.8783 58.3094 63.5225 175.2327 20 G 3.9085 8.0975 109.7562 46.2170 0.0000 175.7485 21 K 3.9997 7.4957 117.7379 59.8103 32.0936 178.2345 22 S 4.2587 8.1399 114.2588 61.9758 62.5202 176.8362 23 A 4.0642 7.9485 122.7184 54.6775 18.1607 179.8581 24 V 3.4411 7.7839 116.8593 66.1715 31.7383 177.9011 25 A 3.7420 8.1767 120.9084 55.3613 18.0043 179.8788 26 S 3.5539 7.6134 113.2983 61.3989 62.9339 176.5024 27 E 3.8412 7.6245 120.8937 59.2423 29.3518 178.9395 28 V 3.4783 7.6200 118.0226 65.9651 31.5809 177.8058 29 A 3.9326 8.2487 120.8021 55.2773 18.1861 179.1774 30 H 4.0405 8.2919 116.6545 59.6964 29.8597 177.3961 31 Q 3.9773 8.3229 118.6639 58.3938 28.5617 178.2719 32 L 4.5206 7.8604 117.1872 53.5143 42.0888 175.8366 33 H 3.9631 7.6616 114.3308 56.5789 26.9917 174.7285 34 A 4.5555 7.8164 119.4365 51.2304 19.9828 177.8529 35 A 4.5491 8.8179 121.2283 51.4719 20.6388 176.7070 36 F 5.5149 8.5753 121.7486 56.6764 42.7834 173.4846 37 L 4.2060 9.2029 128.1858 52.9223 45.0233 175.1901 38 D 4.4536 7.8138 127.4077 53.2180 40.9972 176.6851 39 G 3.7606 8.5617 115.4662 48.1727 0.0000 173.9040 40 D 4.5343 8.2625 120.8130 57.5711 40.6442 178.4551 41 F 4.8629 7.6637 115.5098 58.7060 39.0793 175.8389 42 L 4.7086 7.8530 117.9938 54.4744 42.0805 176.4631 43 H 4.3434 7.8007 115.9874 55.3848 29.4493 173.8124 44 P 4.5536 0.0000 0.0000 62.2314 32.3365 177.6821 45 R 3.8993 8.9584 120.1315 60.9169 30.0625 179.1297 46 R 3.6457 7.9035 115.1090 59.8973 29.9896 178.2182 47 N 4.2973 8.1771 117.5867 56.4265 38.7702 177.5236 48 I 3.8262 7.4379 120.2011 64.1992 37.3389 177.7928 49 E 4.1565 8.3879 119.3538 58.9176 29.4307 179.6365 50 K 4.2463 8.0016 117.4406 56.5790 31.8346 178.0445 *52 A 4.2396 7.9825 121.2554 51.0382 20.3013 178.0257 53 S 4.7205 8.1055 111.6742 59.1424 63.5345 174.5405 54 G 3.7731 7.9624 105.2312 47.6849 0.0000 173.5944 55 E 4.5119 7.5714 117.9362 53.3638 30.8187 174.3167 56 P 4.5040 0.0000 0.0000 61.4807 32.3642 176.2859 57 L 4.3093 8.3391 123.1471 54.6485 42.0857 175.6117 58 N 5.0518 8.4854 117.7011 50.7471 39.9018 175.2991 59 D 4.6132 8.8347 117.4211 58.1261 40.4121 179.1381 60 D 4.4566 8.1711 117.8827 57.3362 41.5118 178.0135 61 D 4.5129 8.6391 119.7095 57.3211 40.8334 178.8240 62 R 4.3114 7.7864 118.0002 58.3182 30.0558 178.7702 63 K 3.9245 7.8777 120.4201 59.1163 32.1316 176.9472 64 P 4.3798 0.0000 0.0000 65.1119 31.4907 178.1739 65 W 4.1933 7.6979 127.6737 60.5911 30.7086 178.0691 66 L 3.5364 8.4406 119.1685 57.3478 40.8151 179.4123 67 Q 3.8600 7.9858 119.6498 59.0490 29.0316 177.8581 68 A 3.9598 8.2192 122.1129 55.1459 18.3139 179.6283 69 L 3.7459 7.7212 117.2402 57.8591 41.6953 178.9018 70 N 4.1703 8.0259 116.9664 57.0229 38.7683 176.3443 71 D 4.3574 8.3144 119.8555 57.4476 40.7314 178.6714 72 A 3.9744 7.8967 119.5459 55.0511 18.4188 179.0285 73 A 4.0376 8.1047 118.6104 55.3510 18.5119 179.4158 74 F 4.1150 7.9400 117.3278 61.1661 39.9319 178.7236 75 A 4.0319 8.6205 119.9880 52.2231 18.2504 178.6759 *77 Q 4.2102 8.0207 117.7986 57.1515 30.5970 176.4160 78 R 3.9515 7.6468 118.3912 59.0570 30.1772 177.7300 79 T 4.7335 7.3889 106.3410 60.3903 69.1680 173.7686 80 N 4.7441 7.7921 118.1919 53.1182 42.8689 174.9186 81 K 3.9522 8.8349 123.4017 58.6752 33.5477 177.0410 82 V 4.8450 7.7593 119.6781 61.1132 34.4991 174.4486 83 S 5.2878 9.2042 123.9599 56.6990 66.2089 172.9926 84 L 5.3927 9.2342 123.5274 53.0907 44.8782 175.5585 85 I 5.1041 9.0445 123.7554 59.5512 41.2864 174.4306 86 V 4.5091 8.5839 127.1144 61.9055 32.9274 174.4326 87 C 5.0243 8.7776 128.4463 58.2297 34.0726 173.8280 88 S 4.3712 9.7372 120.8170 59.7128 63.2825 174.4101 89 A 4.0013 8.1255 121.2588 53.0991 15.8117 176.4424 90 L 4.0787 7.7816 123.1664 56.5965 43.1262 178.4391 91 K 4.4640 7.4532 117.4480 54.8823 34.4129 177.5659 92 K 3.7736 10.1562 124.5306 59.8990 32.2664 179.0817 93 H 4.2652 7.9555 114.7904 58.7081 28.3931 177.0746 94 Y 4.3015 7.5031 119.1677 60.7087 37.9139 177.7155 95 R 3.9909 7.8358 118.6477 59.5804 30.1823 178.7218 96 D 4.4402 8.1657 118.4316 57.5710 40.6018 179.0379 97 L 4.1067 7.6871 117.8517 57.4493 41.6048 179.0235 98 L 4.2310 7.6541 118.1183 57.2433 41.9907 179.0654 99 R 4.3165 8.2128 118.2046 57.9275 29.8183 174.9609 100 E 3.8507 7.5381 117.9004 58.4104 29.1014 177.4222 101 G 3.9459 9.0108 112.0291 45.4346 0.0000 171.8332 102 N 5.1002 8.5871 117.2605 51.2728 38.7126 174.0169 103 P 4.3547 0.0000 0.0000 65.1167 32.1105 176.8978 104 N 4.7376 7.8943 116.4942 52.5235 38.6275 173.6578 105 L 5.0219 7.7989 121.1993 53.9146 44.7552 175.4027 106 S 4.7575 8.7915 119.7322 56.7935 67.3888 172.1968 107 F 5.4315 9.5815 117.7582 55.8262 42.1609 175.2813 108 I 4.8068 8.8724 123.2680 59.9152 39.5323 174.4759 109 Y 4.8408 9.2378 131.0858 56.3529 39.5478 174.8148 110 L 4.5582 8.6955 128.2749 54.3783 42.1666 176.3486 111 K 4.1260 8.5360 126.5208 54.3311 34.6203 175.1189 112 G 4.4657 8.2817 111.9437 45.3649 0.0000 172.3588 113 D 4.9014 8.6174 121.1271 53.3251 42.2395 177.6099 114 F 3.6874 8.6243 121.3131 61.5124 38.6924 176.0446 115 D 4.5048 8.4315 117.2874 57.9007 40.9655 178.8548 116 V 3.6270 7.5757 118.2616 65.8686 31.4717 177.9201 117 I 3.9584 7.6211 119.0350 63.5352 37.1899 177.6052 118 E 3.6237 7.8293 120.7349 59.2966 29.1914 179.1242 119 S 4.1882 7.4474 112.1657 61.1353 63.3600 176.0306 120 R 4.0069 7.5351 121.2006 59.1359 29.7259 178.4844 121 L 3.9849 8.0837 118.9913 57.7811 41.4492 179.6204 122 K 4.0136 7.8950 116.7017 58.7100 32.0067 178.2495 123 A 4.4425 7.5192 118.9457 53.3893 19.3728 178.2679 124 R 3.5948 7.6684 114.8376 60.0667 30.3558 176.8027 *132 Q 4.1087 7.6001 116.2570 56.1466 31.1567 177.2959 *134 L 4.3184 7.9553 118.3703 54.7355 43.9651 178.6393 135 V 3.8263 8.1390 117.0708 66.5232 31.4126 177.5344 136 T 4.1002 7.8726 115.2166 67.3244 68.2897 175.8813 137 Q 4.0296 8.2564 118.8435 59.3889 28.5479 178.8180 138 F 3.9198 8.6002 118.6394 60.7838 39.1076 177.4744 139 E 4.1558 8.3801 118.3399 59.8028 29.6291 178.8531 140 T 4.1842 8.3429 114.6061 65.0397 68.5150 174.2371 141 L 3.8271 7.6464 123.1159 55.8896 42.6288 176.8582 142 Q 4.4491 8.7609 127.0129 54.2285 29.5835 175.7668 143 E 3.8931 8.6016 124.6253 55.2636 30.4469 175.4338 144 P 4.4476 0.0000 0.0000 61.8767 32.2439 177.2174 145 G 3.8909 8.3384 113.3230 44.7471 0.0000 173.2832 146 A 4.0641 8.5158 121.2975 54.9362 18.4656 178.6394 147 D 4.4637 8.0340 113.1405 54.4120 39.9968 175.8252 148 E 4.4902 8.0616 121.3130 55.2970 29.8859 176.4408 149 T 4.3029 8.5192 114.5399 62.3186 70.2190 174.6648 150 D 5.0770 7.8772 123.0793 53.4938 39.9580 176.4254 151 V 5.0501 7.8986 118.2197 62.4558 34.2740 174.4092 152 L 4.8891 9.5981 128.4159 53.1486 44.2669 175.7749 153 V 4.8951 8.3466 121.4805 61.3854 34.2862 175.0357 154 V 4.3785 8.3680 124.9395 61.1761 34.9776 173.5064 155 D 4.8689 8.8207 128.4877 54.0472 41.4500 175.4698 156 I 4.1229 8.5234 119.5660 60.4197 38.3117 176.5214 157 D 4.6447 8.5996 125.3468 52.8365 39.4442 174.4937 158 Q 4.6161 7.2206 117.9689 53.4369 32.5876 173.6822 159 P 4.3412 0.0000 0.0000 62.2691 32.2978 177.2462 160 L 3.8941 8.8302 124.0681 58.4956 41.7434 179.1205 161 E 4.0380 8.3354 116.9081 59.5304 29.2195 179.1862 162 G 3.5881 8.1608 106.6936 47.6295 0.0000 175.6904 163 V 3.5833 7.7703 120.9027 65.4008 31.4623 178.1352 164 V 3.4708 8.3460 118.0437 66.0082 31.4453 177.7650 165 A 3.9819 8.2845 120.8766 55.4919 17.9979 179.7246 166 S 4.1688 8.0070 113.2739 61.5091 63.0051 176.8501 167 T 3.9667 7.5398 118.6281 66.1036 68.2810 177.1849 168 I 3.5636 7.6237 121.8151 64.1719 37.0590 177.6554 169 E 3.8320 7.9800 120.3014 59.7025 29.1343 179.3086 170 V 3.5828 7.2463 116.2184 66.0321 31.6314 177.7814 171 I 3.5071 7.3340 118.4042 63.4936 36.9399 177.7740 172 K 4.2041 7.6987 117.7494 57.2846 32.2663 177.2588 173 K 4.1000 7.5677 124.3081 56.9970 32.2583 175.6968 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 3 T 8.17 4.43 4.80 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 1.29 0.00 0.00 4 T 8.22 3.82 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 1.09 0.00 0.00 5 N 10.17 4.73 0.00 2.48 2.47 0.00 0.00 7.27 8.42 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 6 H 8.67 4.25 0.00 3.15 3.36 0.00 5.94 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.31 4.54 0.00 2.73 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 H 7.96 5.18 0.00 3.06 3.23 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 H 8.99 4.83 0.00 3.14 2.90 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.10 4.78 1.64 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.55 0.78 0.00 0.00 11 Y 9.19 5.00 0.00 2.89 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 12 V 8.79 4.74 1.60 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 1.17 0.00 0.00 0.69 0.00 0.00 13 L 8.52 5.08 0.00 1.65 1.63 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 *15 G 8.38 4.04 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 0.00 0.00 0.00 16 V 7.74 3.87 2.07 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 0.37 0.00 0.00 0.66 0.00 0.00 17 S 8.62 4.22 0.00 3.84 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 18 G 9.10 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 0.00 0.00 0.00 19 S 7.72 4.34 0.00 4.03 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 20 G 8.10 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 21 K 7.50 4.00 0.00 1.86 1.87 0.00 1.97 0.00 0.00 1.98 0.00 0.00 3.05 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.59 1.63 7.81 22 S 8.14 4.26 0.00 3.93 4.06 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 23 A 7.95 4.06 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.78 3.44 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 0.94 0.00 0.00 0.95 0.00 0.00 25 A 8.18 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.61 3.55 0.00 3.81 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 27 E 7.62 3.84 0.00 2.05 1.87 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 2.27 2.32 0.00 28 V 7.62 3.48 2.07 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 0.93 0.00 0.00 0.89 0.00 0.00 29 A 8.25 3.93 1.28 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 30 H 8.29 4.04 0.00 3.19 3.37 0.00 5.61 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 31 Q 8.32 3.98 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.62 0.00 32 L 7.86 4.52 0.00 1.64 1.67 0.85 0.98 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 33 H 7.66 3.96 0.00 3.24 3.36 0.00 5.84 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.82 4.56 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 35 A 8.82 4.55 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 36 F 8.58 5.51 0.00 2.88 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 37 L 9.20 4.21 0.00 1.59 1.38 0.88 0.80 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 38 D 7.81 4.45 0.00 2.19 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 8.56 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 40 D 8.26 4.53 0.00 2.66 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 41 F 7.66 4.86 0.00 3.02 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 42 L 7.85 4.71 0.00 1.72 1.77 0.93 1.39 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 43 H 7.80 4.34 0.00 3.08 3.10 0.00 5.85 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 44 P 0.00 4.55 0.00 2.20 2.00 0.00 3.68 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 45 R 8.96 3.90 0.00 1.85 2.01 0.00 3.16 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 46 R 7.90 3.65 0.00 1.86 1.88 0.00 3.14 0.00 0.00 3.34 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 47 N 8.18 4.30 0.00 2.51 2.58 0.00 0.00 7.23 6.85 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 48 I 7.44 3.83 1.98 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 1.63 0.39 0.89 0.00 0.00 49 E 8.39 4.16 0.00 2.03 1.99 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 2.46 2.44 0.00 50 K 8.00 4.25 0.00 1.96 1.70 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.29 7.81 *52 A 7.98 4.24 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 53 S 8.11 4.72 0.00 3.97 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 54 G 7.96 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 55 E 7.57 4.51 0.00 2.08 1.87 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 2.44 2.34 0.00 56 P 0.00 4.50 0.00 2.17 2.05 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 57 L 8.34 4.31 0.00 1.55 1.69 0.58 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.49 5.05 0.00 3.00 2.96 0.00 0.00 7.28 7.79 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 59 D 8.83 4.61 0.00 2.84 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 60 D 8.17 4.46 0.00 2.83 2.76 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 61 D 8.64 4.51 0.00 2.65 2.82 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 R 7.79 4.31 0.00 1.98 1.89 0.00 2.98 0.00 0.00 3.11 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 63 K 7.88 3.92 0.00 1.85 1.87 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.50 7.81 64 P 0.00 4.38 0.00 2.37 2.33 0.00 3.86 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.06 0.00 65 W 7.70 4.19 0.00 3.40 3.47 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 66 L 8.44 3.54 0.00 1.75 1.53 0.52 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 7.99 3.86 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 68 A 8.22 3.96 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 L 7.72 3.75 0.00 1.45 1.46 0.02 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 70 N 8.03 4.17 0.00 2.77 2.96 0.00 0.00 7.30 8.05 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 71 D 8.31 4.36 0.00 2.90 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.90 3.97 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.10 4.04 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 74 F 7.94 4.11 0.00 3.06 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 75 A 8.62 4.03 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 *77 Q 8.02 4.21 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.82 7.01 0.00 0.00 0.00 0.00 0.00 2.04 2.37 0.00 78 R 7.65 3.95 0.00 1.86 1.94 0.00 3.13 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.28 0.00 79 T 7.39 4.73 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 1.18 0.00 0.00 80 N 7.79 4.74 0.00 2.62 2.68 0.00 0.00 7.19 7.61 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 81 K 8.83 3.95 0.00 1.70 1.85 0.00 1.60 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.40 7.81 82 V 7.76 4.85 2.13 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 1.27 0.00 0.00 1.02 0.00 0.00 83 S 9.20 5.29 0.00 3.85 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 84 L 9.23 5.39 0.00 1.64 1.60 0.84 0.82 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 85 I 9.04 5.10 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.72 0.84 0.00 0.00 86 V 8.58 4.51 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.15 0.00 0.00 87 C 8.78 5.02 0.00 2.85 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 88 S 9.74 4.37 0.00 4.23 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 89 A 8.13 4.00 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 90 L 7.78 4.08 0.00 1.78 1.68 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.45 4.46 0.00 0.79 0.90 0.00 1.45 0.00 0.00 1.28 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.26 1.22 7.81 92 K 10.16 3.77 0.00 1.70 1.78 0.00 1.57 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.37 7.81 93 H 7.96 4.27 0.00 3.32 3.46 0.00 5.50 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 94 Y 7.50 4.30 0.00 3.04 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 95 R 7.84 3.99 0.00 1.85 1.67 0.00 2.21 0.00 0.00 2.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.39 0.00 96 D 8.17 4.44 0.00 2.89 2.76 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 97 L 7.69 4.11 0.00 1.83 1.75 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.65 4.23 0.00 2.01 1.71 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 99 R 8.21 4.32 0.00 2.10 2.02 0.00 3.39 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.98 0.00 100 E 7.54 3.85 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 2.36 2.30 0.00 101 G 9.01 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 0.00 0.00 0.00 102 N 8.59 5.10 0.00 2.86 2.67 0.00 0.00 6.69 5.32 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 0.00 103 P 0.00 4.35 0.00 2.21 2.22 0.00 3.86 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 1.97 2.02 0.00 104 N 7.89 4.74 0.00 2.56 2.88 0.00 0.00 5.66 6.67 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 0.00 105 L 7.80 5.02 0.00 1.45 1.59 0.74 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 106 S 8.79 4.76 0.00 4.13 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 0.00 107 F 9.58 5.43 0.00 3.02 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 0.00 108 I 8.87 4.81 1.95 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.16 0.92 0.00 0.00 109 Y 9.24 4.84 0.00 2.97 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 0.00 110 L 8.70 4.56 0.00 1.59 1.61 0.92 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 0.00 111 K 8.54 4.13 0.00 0.79 1.22 0.00 1.56 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.17 0.97 7.81 112 G 8.28 4.47 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 0.00 113 D 8.62 4.90 0.00 2.80 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 0.00 114 F 8.62 3.69 0.00 2.30 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 0.00 115 D 8.43 4.50 0.00 2.82 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 0.00 116 V 7.58 3.63 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.98 0.00 0.00 117 I 7.62 3.96 1.94 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 1.64 0.44 0.91 0.00 0.00 118 E 7.83 3.62 0.00 1.16 1.87 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 2.26 2.22 0.00 119 S 7.45 4.19 0.00 4.07 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 0.00 120 R 7.54 4.01 0.00 1.95 1.95 0.00 3.33 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 121 L 8.08 3.98 0.00 1.91 1.69 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 122 K 7.89 4.01 0.00 1.75 1.88 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.64 7.81 123 A 7.52 4.44 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 0.00 124 R 7.67 3.59 0.00 1.92 1.93 0.00 3.21 0.00 0.00 3.16 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 *132 Q 7.60 4.11 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 *134 L 7.96 4.32 0.00 1.85 1.88 1.06 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.14 3.83 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.01 0.00 0.00 136 T 7.87 4.10 4.31 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 1.26 0.00 0.00 137 Q 8.26 4.03 0.00 2.40 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 138 F 8.60 3.92 0.00 3.26 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 0.00 139 E 8.38 4.16 0.00 2.24 2.13 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 2.36 2.40 0.00 140 T 8.34 4.18 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 1.24 0.00 0.00 141 L 7.65 3.83 0.00 1.51 1.80 0.67 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 142 Q 8.76 4.45 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 143 E 8.60 3.89 0.00 1.84 1.87 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 2.15 2.35 0.00 144 P 0.00 4.45 0.00 1.96 1.93 0.00 3.52 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 1.78 1.70 0.00 145 G 8.34 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 0.00 146 A 8.52 4.06 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 0.00 147 D 8.03 4.46 0.00 2.79 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 0.00 148 E 8.06 4.49 0.00 2.03 1.90 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 2.20 2.17 0.00 149 T 8.52 4.30 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 1.23 0.00 0.00 150 D 7.88 5.08 0.00 2.83 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 0.00 151 V 7.90 5.05 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 0.94 0.00 0.00 0.96 0.00 0.00 152 L 9.60 4.89 0.00 1.66 1.58 1.03 0.85 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 0.00 153 V 8.35 4.90 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 0.65 0.00 0.00 1.08 0.00 0.00 154 V 8.37 4.38 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 0.92 0.00 0.00 0.91 0.00 0.00 155 D 8.82 4.87 0.00 2.69 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 0.00 156 I 8.52 4.12 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.86 0.00 0.00 157 D 8.60 4.64 0.00 2.58 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 0.00 158 Q 7.22 4.62 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.99 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 159 P 0.00 4.34 0.00 2.18 2.00 0.00 3.61 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 160 L 8.83 3.89 0.00 1.73 1.67 0.90 0.87 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 0.00 161 E 8.34 4.04 0.00 2.18 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 2.35 2.33 0.00 162 G 8.16 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.77 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 0.90 0.00 0.00 164 V 8.35 3.47 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 0.90 0.00 0.00 0.90 0.00 0.00 165 A 8.28 3.98 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 0.00 166 S 8.01 4.17 0.00 4.03 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 T 7.54 3.97 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 1.11 0.00 0.00 168 I 7.62 3.56 1.95 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 1.32 0.81 0.85 0.00 0.00 169 E 7.98 3.83 0.00 2.16 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 2.29 2.32 0.00 170 V 7.25 3.58 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 0.88 0.00 0.00 0.96 0.00 0.00 171 I 7.33 3.51 1.71 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 -0.16 0.22 0.65 0.00 0.00 172 K 7.70 4.20 0.00 1.71 1.83 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.62 7.81 173 K 7.57 4.10 0.00 1.87 1.73 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.48 7.81 * Residues marked with a * may have inaccurate shift predictions.