NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2305 8.3144 121.7897 55.9239 33.3933 174.8098 2 E 4.0436 8.4192 123.7757 53.8942 30.4874 175.7066 3 T 4.1990 8.6386 117.7979 61.2333 72.0465 175.0482 4 A 4.0052 8.5007 123.2033 55.3185 18.4928 179.8994 5 A 3.9523 8.0032 118.5812 55.3192 18.4958 179.6062 6 A 4.2902 8.0889 120.7000 54.5897 18.3538 179.7842 7 K 4.0216 8.3340 118.3654 59.5641 32.2166 178.8093 8 F 4.0466 8.3644 121.0406 61.2533 39.2127 176.9713 9 E 4.0666 8.3994 118.1105 59.4907 29.1025 179.3010 10 R 3.9770 7.9215 117.4150 59.6551 30.2442 178.2568 11 Q 3.9320 7.9876 116.6216 57.9500 29.0481 176.3246 12 H 4.5814 7.8266 114.3979 54.3781 31.5177 173.6819 13 M 4.6370 8.0227 118.6692 54.2656 33.3653 176.5936 14 D 4.7764 8.9710 122.4753 53.1304 41.6117 175.5751 15 S 4.5395 8.4628 115.5973 58.9528 63.7046 175.3578 16 S 4.4364 7.9978 114.6175 59.3486 63.4008 174.2574 17 T 4.7424 7.5445 110.5524 59.6830 71.3521 174.1289 18 S 4.1952 8.6355 117.2504 60.6750 63.6925 173.6486 19 A 3.7003 6.9799 120.3415 50.7961 21.2784 175.3780 20 A 3.4266 8.7777 124.2380 52.2017 18.5708 178.1960 21 S 4.6329 8.5365 116.0532 58.0490 64.6654 173.8692 22 S 4.7423 7.5145 115.1548 56.4634 65.8267 174.8330 23 S 4.3405 8.6608 115.0903 60.3968 63.1315 174.4970 24 N 4.7590 8.2438 118.4878 53.4482 39.1087 175.8976 25 Y 3.9950 8.1326 121.0488 61.1970 38.6539 177.6915 26 C 4.1862 8.3059 116.8826 60.0865 39.6680 175.7917 27 N 4.3747 8.1960 117.5411 56.4237 38.1173 177.1386 28 Q 3.9011 7.9351 120.7650 59.4917 29.2275 178.0962 29 M 3.6780 7.8303 120.1130 58.3890 31.6945 178.6747 30 M 4.0636 8.1164 119.2820 57.9401 31.9299 178.8405 31 K 3.9134 7.6012 118.5838 59.6704 32.2705 179.0521 32 S 4.1044 7.8787 114.0930 61.3063 62.7479 175.9983 33 R 4.3442 7.7464 117.8706 55.2929 30.0526 176.0034 34 N 4.2757 7.9813 114.9876 54.6872 36.3511 174.7950 35 L 4.5196 8.2329 116.7156 55.0722 41.9400 177.8535 36 T 5.5734 7.5547 106.5075 60.2724 69.1480 175.0036 37 K 4.1253 8.0763 123.0685 59.9644 32.5128 177.5809 38 D 4.5463 7.9993 118.2528 56.1573 41.6644 176.2410 39 R 3.9377 7.4054 113.3923 55.0754 32.1518 174.1261 40 C 4.8310 8.6185 115.9386 55.3700 40.2666 173.9838 41 K 4.2269 8.4091 127.8858 55.6862 32.5596 174.9327 42 P 4.7298 0.0000 0.0000 65.5694 32.3777 176.3998 43 V 5.1340 7.5735 117.5621 61.1998 34.8571 173.9643 44 N 4.7700 9.1625 123.7778 52.8239 42.4997 172.9603 45 T 4.8592 7.9495 121.1228 61.6623 71.7708 172.8733 46 F 4.7588 8.9216 124.1814 55.6341 42.2034 174.6178 47 V 4.4470 8.9919 122.5722 61.2234 33.6343 175.4347 48 H 5.7885 8.7861 127.9386 53.6223 26.3300 173.3103 49 E 4.7735 7.7168 118.6772 53.4037 34.6165 176.1521 50 S 4.4115 8.3563 114.8873 58.0812 65.0590 174.8886 51 L 3.9908 8.5065 124.1187 58.4254 41.8945 179.1187 52 A 3.9999 7.9988 120.1687 55.3809 18.1417 179.2102 53 D 4.3583 8.0652 116.4508 57.3249 41.1379 178.9202 54 V 3.7954 7.8243 118.7745 66.0867 31.6406 178.1702 55 Q 3.8916 8.4915 117.9510 58.7687 28.4998 178.5403 56 A 4.0427 8.1078 121.5221 54.6060 18.2229 179.6491 57 V 3.4412 7.7009 117.0480 65.9753 31.3034 176.9231 58 C 3.6998 7.7426 114.4933 58.1283 39.9188 174.1813 59 S 4.5933 7.4713 115.5432 58.2393 63.9728 174.8056 60 Q 4.0200 7.3955 123.3528 55.5644 27.3137 177.0754 61 K 4.3059 8.0690 129.7381 56.9689 33.1080 175.4712 62 N 4.4809 8.8217 127.3341 53.4119 39.3980 174.3035 63 V 4.6001 8.4273 118.3174 59.2314 36.6868 174.9459 64 A 4.4326 8.4140 124.5143 52.2186 19.2123 178.1454 65 C 4.6750 8.8833 118.4114 55.5868 41.5213 175.4318 66 K 3.6983 8.6732 122.1384 59.5859 31.6919 177.6269 67 N 4.5624 8.1018 113.3056 52.7634 37.5126 175.9314 68 G 3.9482 8.3362 108.4333 45.5670 0.0000 174.3486 69 Q 4.1851 9.6839 119.8854 56.2795 29.2347 176.5236 70 T 4.5230 8.3683 109.5375 61.5886 69.2013 174.0603 71 N 5.0326 7.9427 118.5988 53.5927 38.5013 174.6447 72 C 5.2873 7.3752 116.5212 56.9081 43.6189 172.7186 73 Y 5.0850 9.0693 118.9102 56.3597 42.2356 173.8178 74 Q 5.0719 9.0583 124.9556 53.9649 31.4739 174.9449 75 S 4.3271 8.7597 121.8867 58.7187 63.1325 174.3336 76 Y 4.4753 9.2211 121.7925 60.3258 37.8344 176.1701 77 S 4.8542 7.8439 112.4716 56.1600 65.7401 173.1775 78 T 4.2605 7.9957 110.4681 61.7708 69.7109 173.7753 79 M 5.0318 9.0419 121.6472 53.3864 37.0773 174.5624 80 S 4.9161 9.4473 117.0226 58.3007 63.5027 173.1174 81 I 5.2470 9.2029 120.3556 59.5610 41.7046 174.2384 82 T 4.9663 8.9305 119.2616 62.0736 72.1227 172.6882 83 D 5.0652 9.2747 127.0736 53.1237 43.1914 174.8384 84 C 5.6866 9.2358 120.5848 55.3301 39.3909 173.3387 85 R 5.4074 8.8857 121.4298 54.2713 34.2771 174.7739 86 E 4.7148 9.2213 122.8785 56.3765 30.2306 176.9738 87 T 4.3835 8.1223 113.3287 60.2365 71.3092 175.5598 88 G 3.7445 8.6788 109.3721 47.8346 0.0000 174.1935 89 S 4.6126 7.4044 114.5272 58.5129 63.0906 173.4956 90 S 4.6223 7.4416 114.3195 56.2840 63.6013 173.5886 91 K 4.5348 8.3580 126.2902 54.4629 35.3658 175.3470 92 Y 4.2792 8.7547 125.5370 57.4905 39.1596 173.7320 93 P 3.3394 0.0000 0.0000 62.6607 31.5801 176.8661 94 N 4.6233 8.5905 120.9361 52.2505 36.9774 173.1432 95 C 4.3930 7.8884 117.4789 56.5466 38.4840 173.2202 96 A 5.0291 8.4442 124.5477 50.4712 21.9703 174.6031 97 Y 5.0986 9.6104 119.3986 55.9652 42.1481 174.9758 98 K 4.4889 9.3827 124.1323 55.8233 34.0577 175.2616 99 T 5.0657 8.5637 123.8487 62.4700 70.3462 174.1568 100 T 4.5381 8.8098 122.6978 61.8039 71.8228 172.9161 101 Q 4.8307 8.7254 127.8832 55.5618 30.5280 174.2889 102 A 4.5594 8.7994 125.6590 51.4402 23.7050 174.7563 103 N 5.5118 8.6934 116.5781 51.7516 40.6242 174.3576 104 K 4.6764 8.9658 122.6108 55.6139 36.9947 175.0413 105 H 4.9714 9.2921 118.1978 55.7473 29.9095 174.9805 106 I 4.8988 8.6744 115.0347 59.2938 40.9629 174.2903 107 I 4.8823 8.1934 124.1317 59.7205 40.1431 175.1914 108 V 4.8036 8.7742 119.0338 59.4326 36.4189 174.0869 109 A 5.1882 8.6561 123.9460 50.6848 20.9869 175.4916 110 C 5.1268 8.5164 119.3434 55.4644 38.1261 173.0784 111 E 4.6627 8.6024 118.8380 56.7634 34.3681 176.0346 112 G 4.1285 9.9779 107.9225 44.8581 0.0000 171.7933 113 N 4.7766 8.1538 117.2602 51.2775 40.4440 172.6989 114 P 4.3892 0.0000 0.0000 62.5753 32.1359 175.6893 115 Y 4.7482 8.2513 120.7141 56.7357 38.7721 174.3864 116 V 4.4223 8.0863 119.2139 58.3339 36.7530 173.3351 117 P 4.3955 0.0000 0.0000 62.8871 30.8738 177.1542 118 V 4.4400 8.8757 116.0372 61.3906 34.4007 175.4633 119 H 5.1248 7.9277 119.5621 54.5355 33.6048 171.8407 120 F 4.6265 8.8339 127.7261 57.5099 39.2238 174.8542 121 A 4.2461 8.0922 128.6733 53.6827 19.3495 176.4797 122 A 4.5569 6.6045 114.1598 51.7358 22.6996 174.5864 123 S 5.1223 8.7096 111.7601 56.9754 66.5134 174.8083 124 V 4.1542 8.8155 114.2338 61.7244 32.4892 175.4624 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 K 8.31 4.23 0.00 1.74 1.78 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.42 4.04 0.00 2.06 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 3 T 8.64 4.20 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 4 A 8.50 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 5 A 8.00 3.95 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 6 A 8.09 4.29 1.40 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 0.00 0.00 0.00 7 K 8.33 4.02 0.00 1.87 2.02 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.56 7.81 8 F 8.36 4.05 0.00 3.38 3.22 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 0.00 9 E 8.40 4.07 0.00 2.32 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 2.49 2.69 0.00 10 R 7.92 3.98 0.00 1.80 2.06 0.00 3.38 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 7.99 3.93 0.00 1.43 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.48 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 12 H 7.83 4.58 0.00 2.19 2.70 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.02 4.64 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.72 0.00 14 D 8.97 4.78 0.00 2.70 2.44 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 15 S 8.46 4.54 0.00 3.93 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 16 S 8.00 4.44 0.00 3.98 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 17 T 7.54 4.74 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 1.27 0.00 0.00 18 S 8.64 4.20 0.00 3.97 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 19 A 6.98 3.70 1.09 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 0.00 0.00 20 A 8.78 3.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.54 4.63 0.00 3.94 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 22 S 7.51 4.74 0.00 3.98 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 23 S 8.66 4.34 0.00 4.03 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 24 N 8.24 4.76 0.00 2.81 2.88 0.00 0.00 6.46 6.75 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 25 Y 8.13 4.00 0.00 3.07 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.31 4.19 0.00 3.18 3.10 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 27 N 8.20 4.37 0.00 2.92 2.91 0.00 0.00 6.74 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 28 Q 7.94 3.90 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.22 2.43 0.00 29 M 7.83 3.68 0.00 0.84 1.12 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.70 0.00 30 M 8.12 4.06 0.00 1.74 1.87 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 2.42 0.00 31 K 7.60 3.91 0.00 1.94 1.90 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.46 7.81 32 S 7.88 4.10 0.00 3.84 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.75 4.34 0.00 1.85 1.97 0.00 3.59 0.00 0.00 3.21 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.99 0.00 34 N 7.98 4.28 0.00 2.88 2.94 0.00 0.00 6.86 7.37 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 35 L 8.23 4.52 0.00 1.81 1.65 0.81 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.55 5.57 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 1.43 0.00 0.00 37 K 8.08 4.13 0.00 1.78 1.90 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.50 7.81 38 D 8.00 4.55 0.00 2.68 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 39 R 7.41 3.94 0.00 1.86 1.78 0.00 2.90 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 40 C 8.62 4.83 0.00 3.11 3.16 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 41 K 8.41 4.23 0.00 1.80 1.78 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.40 7.81 42 P 0.00 4.73 0.00 2.20 2.32 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 43 V 7.57 5.13 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 0.81 0.00 0.00 0.98 0.00 0.00 44 N 9.16 4.77 0.00 2.65 2.30 0.00 0.00 6.92 7.97 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 45 T 7.95 4.86 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 0.83 0.00 0.00 46 F 8.92 4.76 0.00 3.02 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 47 V 8.99 4.45 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 1.07 0.00 0.00 1.00 0.00 0.00 48 H 8.79 5.79 0.00 3.15 3.42 0.00 5.64 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.72 4.77 0.00 1.95 1.85 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 2.27 2.29 0.00 50 S 8.36 4.41 0.00 4.07 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 51 L 8.51 3.99 0.00 1.83 1.74 1.01 1.20 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 52 A 8.00 4.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.07 4.36 0.00 2.83 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 54 V 7.82 3.80 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 1.24 0.00 0.00 1.05 0.00 0.00 55 Q 8.49 3.89 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 56 A 8.11 4.04 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 57 V 7.70 3.44 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 1.08 0.00 0.00 0.92 0.00 0.00 58 C 7.74 3.70 0.00 2.86 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 59 S 7.47 4.59 0.00 3.89 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 60 Q 7.40 4.02 0.00 1.75 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 1.93 2.23 0.00 61 K 8.07 4.31 0.00 1.99 1.84 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.46 7.81 62 N 8.82 4.48 0.00 2.76 2.66 0.00 0.00 7.00 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 63 V 8.43 4.60 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 0.68 0.00 0.00 0.82 0.00 0.00 64 A 8.41 4.43 1.19 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 0.00 0.00 65 C 8.88 4.68 0.00 3.16 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 66 K 8.67 3.70 0.00 1.74 1.89 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.44 7.81 67 N 8.10 4.56 0.00 2.80 2.91 0.00 0.00 6.18 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.34 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 69 Q 9.68 4.19 0.00 2.39 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 70 T 8.37 4.52 4.19 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 1.22 0.00 0.00 71 N 7.94 5.03 0.00 3.08 3.16 0.00 0.00 6.08 7.68 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 72 C 7.38 5.29 0.00 2.98 2.90 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 73 Y 9.07 5.08 0.00 2.79 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 74 Q 9.06 5.07 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 75 S 8.76 4.33 0.00 3.92 3.86 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 76 Y 9.22 4.48 0.00 3.03 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 77 S 7.84 4.85 0.00 3.98 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 78 T 8.00 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 1.02 0.00 0.00 79 M 9.04 5.03 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 80 S 9.45 4.92 0.00 3.88 3.94 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 81 I 9.20 5.25 1.95 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 1.35 0.59 1.06 0.00 0.00 82 T 8.93 4.97 4.39 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 1.23 0.00 0.00 83 D 9.27 5.07 0.00 2.59 2.59 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 84 C 9.24 5.69 0.00 2.90 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 85 R 8.89 5.41 0.00 1.80 1.81 0.00 3.17 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 86 E 9.22 4.71 0.00 1.79 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.65 0.00 87 T 8.12 4.38 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 1.20 0.00 0.00 88 G 8.68 3.74 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 0.00 0.00 0.00 89 S 7.40 4.61 0.00 3.94 3.86 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 90 S 7.44 4.62 0.00 3.78 3.71 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 91 K 8.36 4.53 0.00 1.79 1.65 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.36 7.81 92 Y 8.75 4.28 0.00 2.95 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 93 P 0.00 3.34 0.00 1.77 1.31 0.00 3.72 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 1.77 1.80 0.00 94 N 8.59 4.62 0.00 2.74 2.75 0.00 0.00 7.03 7.54 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 95 C 7.89 4.39 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 96 A 8.44 5.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.61 5.10 0.00 2.94 2.90 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 98 K 9.38 4.49 0.00 1.83 1.84 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.45 7.81 99 T 8.56 5.07 4.32 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 1.28 0.00 0.00 100 T 8.81 4.54 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 1.23 0.00 0.00 101 Q 8.73 4.83 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.73 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 102 A 8.80 4.56 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 0.00 103 N 8.69 5.51 0.00 2.58 2.75 0.00 0.00 6.68 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 0.00 104 K 8.97 4.68 0.00 1.85 1.90 0.00 1.30 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.50 7.81 105 H 9.29 4.97 0.00 3.21 3.29 0.00 5.57 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.67 4.90 1.80 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.92 1.14 0.00 0.00 107 I 8.19 4.88 1.77 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 1.15 0.95 0.85 0.00 0.00 108 V 8.77 4.80 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 0.65 0.00 0.00 0.82 0.00 0.00 109 A 8.66 5.19 1.24 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 0.00 0.00 110 C 8.52 5.13 0.00 1.86 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 0.00 111 E 8.60 4.66 0.00 1.81 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 0.00 2.24 2.19 0.00 112 G 9.98 4.13 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 0.00 0.00 0.00 113 N 8.15 4.78 0.00 2.66 2.70 0.00 0.00 6.89 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 0.00 114 P 0.00 4.39 0.00 2.23 2.05 0.00 3.82 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 1.99 1.95 0.00 115 Y 8.25 4.75 0.00 2.83 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 0.00 116 V 8.09 4.42 1.91 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 0.67 0.00 0.00 0.88 0.00 0.00 117 P 0.00 4.40 0.00 0.49 1.18 0.00 3.31 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 118 V 8.88 4.44 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 0.63 0.00 0.00 0.95 0.00 0.00 119 H 7.93 5.12 0.00 3.26 3.13 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.83 4.63 0.00 2.59 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 0.00 121 A 8.09 4.25 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 0.00 122 A 6.60 4.56 1.17 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 0.00 0.00 123 S 8.71 5.12 0.00 4.04 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 0.00 124 V 8.82 4.15 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 0.70 0.00 0.00 1.01 0.00 0.00