NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 M 4.4413 8.3044 118.1935 55.2307 33.8986 174.8556 5 S 4.1610 7.6142 114.1676 56.2891 64.2088 171.2611 6 L 4.7551 9.4497 130.1656 55.5000 43.6621 174.6378 7 Y 5.1351 9.5107 122.9489 56.3210 43.1494 174.0771 8 R 5.2344 8.8008 120.5800 54.6042 34.0440 173.6775 9 L 5.2207 9.2806 127.3697 53.4207 45.3863 174.8232 10 I 5.1315 8.8966 127.6209 59.8094 39.9422 174.3306 11 Y 5.4106 8.5000 123.4038 55.7178 41.9382 173.7657 12 S 5.3253 9.3676 114.5436 56.9340 67.1584 172.7155 13 S 4.9410 8.9686 114.5662 57.5745 67.4397 172.3689 14 Q 4.7152 8.9983 119.4604 54.0125 29.8515 176.3234 15 G 4.3011 9.0932 113.0325 45.8877 0.0000 173.1068 16 I 4.3209 8.7524 116.1448 59.9786 38.6366 175.2667 17 P 4.5427 0.0000 0.0000 64.4352 31.6257 177.1714 18 N 4.4037 8.0229 116.3733 55.5920 38.8231 174.9337 19 L 3.9020 7.1926 116.8525 55.5478 41.8233 177.0994 20 Q 4.4640 9.2161 123.1866 53.6737 30.7561 175.1909 21 P 3.9161 0.0000 0.0000 65.8360 31.0621 179.0689 22 Q 3.9372 7.8786 116.5075 58.8014 28.5251 178.2714 23 D 4.2706 7.7306 120.0514 57.3535 40.7916 178.8031 24 L 3.7785 7.4436 118.9198 57.4066 41.4591 179.3440 25 K 4.0725 7.6949 119.5265 59.6017 32.1649 178.5676 26 D 4.3524 8.4323 119.5397 57.3906 40.7627 178.5967 27 I 3.6039 7.9257 120.5838 64.5360 37.1105 178.1713 28 L 3.9934 8.2041 120.9610 58.0302 41.9121 178.4000 29 E 3.9617 8.6129 119.6889 59.5347 29.5781 179.1194 30 S 4.1192 8.0950 115.1879 61.5094 62.9146 176.6559 31 S 4.1165 8.0439 116.9223 61.9158 62.4307 176.7344 32 Q 4.1961 8.3168 120.6731 57.8101 28.4203 178.2643 33 R 4.1523 7.5066 118.9908 59.0785 30.4969 177.8452 34 N 4.5219 8.7182 116.5557 56.2429 38.6986 177.1283 35 N 4.3262 8.7818 118.1804 56.0907 38.6048 175.1140 36 P 4.2032 0.0000 0.0000 65.9125 31.2153 178.1130 37 A 3.9515 8.0540 119.1260 55.2171 18.3178 177.9306 38 N 4.5870 7.6517 110.0681 52.8485 39.0035 175.6247 39 G 3.9496 8.0650 106.3663 46.4382 0.0000 173.5986 40 I 4.6134 7.6993 120.4768 59.8797 38.6210 175.2960 41 T 5.1065 8.6082 112.7618 58.1606 71.8980 173.9202 42 G 4.0281 7.3201 105.9961 46.0445 0.0000 170.5791 43 L 4.8734 7.3223 120.1218 53.6026 45.9023 175.3807 44 L 5.0766 9.3076 128.3222 53.5181 44.5738 174.5655 45 C 5.3474 9.4994 124.0416 58.1643 31.4807 172.3431 46 Y 4.9094 9.0121 124.0233 56.2047 40.9270 174.3239 47 S 5.0637 9.0233 126.1090 55.3326 63.8337 173.3686 48 K 3.1826 7.5852 126.8946 54.5801 31.8003 172.7390 49 P 4.7292 0.0000 0.0000 61.7885 32.7792 174.6390 50 A 5.1128 8.1956 123.3210 50.8192 21.4474 176.4415 51 F 5.4798 8.8329 119.8312 55.9685 41.9881 174.8651 52 L 4.9520 9.0842 123.8126 53.4171 45.1833 174.8838 53 Q 5.0400 8.4051 127.1305 54.0543 32.8447 173.9806 54 V 4.8984 8.3375 124.5384 59.8199 34.2551 174.3726 55 L 5.3324 9.0364 123.8025 53.0182 45.0852 175.3048 56 E 5.1753 10.3309 122.1512 54.0015 33.8283 176.5121 57 G 4.1494 8.1973 108.8448 44.8599 0.0000 171.0017 58 E 4.3506 8.1743 119.0980 56.5676 31.0516 177.2560 59 C 3.5304 9.0836 129.3574 63.4414 31.5131 176.7506 60 E 3.9319 8.0325 118.8102 61.4163 29.2829 180.8327 61 Q 4.2260 7.9708 118.9678 58.4269 28.8059 178.6442 62 V 3.6316 8.2956 119.7351 66.2178 31.5997 177.8301 63 N 4.4517 8.2551 116.1345 56.2599 38.4954 177.0138 64 E 3.9429 8.3261 120.6064 59.5797 29.6905 178.9815 65 T 3.8449 8.1887 115.9541 66.7738 68.5460 175.8195 66 Y 4.0032 8.3073 121.6715 61.3127 38.6090 178.1654 67 H 3.8369 8.1189 115.1456 58.1428 29.0866 177.6662 68 R 3.9495 7.7882 120.6976 59.3982 29.8794 178.3923 69 I 3.5783 7.7531 119.8992 64.5042 36.8727 178.4425 70 V 3.2607 7.0847 117.6543 65.7697 31.2029 177.1249 71 Q 4.2774 7.4106 114.5461 54.9877 29.1132 175.2719 72 D 4.4095 8.0088 125.0662 54.4669 41.6603 177.2963 73 E 4.3483 8.7453 121.5947 57.4848 30.0145 174.3860 74 R 4.4354 8.4758 117.1915 57.7006 30.5138 175.2360 75 H 5.2382 7.8010 111.6225 55.4650 31.6571 171.3716 76 H 4.6398 9.1120 114.3564 55.1860 31.4893 172.9592 77 S 3.8566 8.6881 112.8261 58.9299 60.0077 171.5716 78 P 4.6862 0.0000 0.0000 62.8934 32.2588 175.6979 79 Q 4.6797 9.6053 120.1994 54.0847 31.8480 174.7764 80 I 4.1109 8.5892 125.8191 61.6413 37.2322 175.8303 81 I 4.2516 8.8779 128.3997 63.0348 38.5696 176.0245 82 E 4.7428 7.7714 120.4376 55.2007 33.1817 173.7966 83 C 5.3048 8.5096 126.2147 58.4988 34.4155 172.5600 84 M 4.6447 8.6007 122.3196 53.0733 34.4798 172.5067 85 P 4.2027 0.0000 0.0000 62.7891 32.1064 175.3112 86 I 4.6210 8.2711 114.5124 59.3336 40.1877 175.7186 87 R 4.1601 8.7153 122.1660 58.7602 30.4741 176.9787 88 R 4.5858 7.2731 110.6589 54.8686 31.7636 174.7179 89 R 4.3855 8.3851 118.0863 56.5652 30.6651 176.3806 90 N 4.8084 9.2044 115.7589 53.0130 40.9649 175.5021 91 F 4.8949 8.4696 118.0205 56.9620 39.6447 176.7779 92 E 4.2235 8.2408 118.5524 57.7926 30.1127 177.7968 93 V 3.5021 7.3216 119.1969 64.5013 31.9370 176.0773 94 W 5.0602 7.8464 119.0766 54.3058 32.1309 175.9183 95 S 4.4218 8.9940 117.5371 61.1897 63.3623 173.9729 96 M 4.9623 7.9589 117.1113 54.1062 35.1898 173.5757 97 Q 4.6661 8.6692 125.4983 54.1342 32.6551 173.8750 98 A 5.1846 8.5416 126.4441 50.2527 22.8000 174.8981 99 I 4.7708 8.7600 122.8869 59.4020 41.0238 174.8289 100 T 4.7125 9.5042 118.6923 61.3967 70.1313 174.4444 101 V 4.4677 8.8246 125.8123 61.5247 34.3294 173.7986 102 N 5.1498 8.7368 125.8364 52.0002 39.7916 174.3396 103 D 4.4436 8.5995 116.3060 56.6004 41.3359 177.0667 104 L 4.4113 7.6814 116.6415 55.3378 42.3111 177.0195 105 S 4.3661 7.7007 115.3075 58.4619 63.5801 174.9462 106 T 4.0470 8.4427 118.9134 64.0720 70.1945 175.3623 107 E 4.0190 8.7707 122.8474 59.5159 29.5594 179.4275 108 Q 3.9693 8.0985 119.2179 59.3590 29.1317 178.6665 109 V 3.7281 7.7649 118.5872 66.0399 31.7193 178.0162 110 K 4.1340 8.2408 118.2529 59.6146 31.7553 179.5667 111 T 3.9361 8.1126 116.3390 66.4908 68.1278 176.7340 112 L 4.0944 7.6968 119.5532 57.7143 41.9779 179.3265 113 V 3.8299 8.2052 118.1974 66.2300 31.3917 177.9246 114 L 4.1040 8.1487 119.8817 57.9458 41.6439 178.6654 115 K 3.7654 8.1193 119.0931 58.6151 32.0096 176.7693 116 Y 4.7640 7.2852 113.4157 57.3061 38.5049 174.6163 117 S 4.5687 7.6053 114.3327 57.3788 65.9564 175.1031 118 G 3.3937 8.5921 108.8162 47.9229 0.0000 172.9191 119 F 4.8104 7.5311 116.1428 56.3114 43.0733 174.2540 120 T 4.1587 8.6832 117.0708 65.4293 68.5314 174.9953 121 T 4.3496 7.6655 112.2145 59.4738 70.1499 174.0981 122 L 3.8116 8.3896 128.2148 54.9607 42.3068 176.4457 123 R 4.4206 8.1456 125.1029 53.3942 31.5783 174.0201 124 P 4.1344 0.0000 0.0000 65.3478 31.5228 178.5686 125 S 4.4393 8.0252 109.5360 59.2256 63.3098 173.9991 126 A 4.6966 7.9940 123.9938 52.1658 18.8758 176.6436 127 M 5.0048 7.4936 115.9356 54.1985 36.0348 175.6647 128 D 4.7811 8.8634 122.8573 51.6316 42.5351 175.9184 129 P 4.2128 0.0000 0.0000 65.9172 31.1545 178.5633 130 E 3.9203 8.2188 117.4389 59.1940 29.5313 178.7153 131 Q 3.8717 8.7507 118.4692 59.0681 28.8482 178.3163 132 C 4.0615 8.1358 117.7182 62.8624 28.2218 175.8596 133 L 4.0227 8.0619 121.7693 58.5527 41.5809 178.9138 134 N 4.2521 8.2129 116.3921 55.8673 38.3218 177.0345 135 F 3.9385 7.6605 122.2566 61.4090 39.3755 177.2419 136 L 3.9113 8.0970 118.2500 57.7840 41.5078 179.5535 137 L 3.9401 8.1984 118.9232 57.8734 41.3231 179.3672 138 D 4.3428 8.1203 118.0090 57.3576 41.1300 178.3706 139 I 3.8358 7.6425 120.3813 64.5969 36.7834 178.3690 140 A 4.2071 8.3426 121.3698 54.9215 17.9075 179.5686 141 K 4.1103 7.7447 117.6087 59.1527 32.3687 178.2732 142 I 4.3197 7.5459 111.1306 60.6373 38.2803 175.0356 143 Y 4.3324 7.1657 118.9451 56.2291 37.7810 175.1020 144 E 4.4404 8.4858 125.7284 56.2764 30.7531 174.8616 145 L 4.0782 12.0000 122.8961 54.9736 41.9496 175.5027 146 S 3.0912 7.5503 115.1523 58.7755 63.8559 172.7357 147 D 5.1738 7.3700 118.6372 53.0136 42.2687 174.6437 148 N 5.4170 7.5423 114.6124 52.1277 37.5518 175.7322 149 F 4.5330 7.6640 121.1223 60.5246 39.3835 176.8349 150 F 4.6188 8.3513 117.7620 58.6234 39.8603 176.0017 151 L 4.7369 7.6852 121.1194 53.5168 45.2514 175.6499 152 D 5.0029 8.7171 127.7131 52.3858 39.8377 175.9359 153 L 4.0978 7.8374 122.9311 54.9129 40.9961 174.7915 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 4 M 8.30 4.44 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 5 S 7.61 4.16 0.00 4.15 4.12 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 6 L 9.45 4.76 0.00 1.87 1.57 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 9.51 5.14 0.00 3.00 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 8 R 8.80 5.23 0.00 1.90 1.71 0.00 3.17 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 1.54 1.60 0.00 9 L 9.28 5.22 0.00 1.70 1.48 0.53 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.90 5.13 1.86 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 1.22 0.47 0.92 0.00 0.00 11 Y 8.50 5.41 0.00 3.19 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 12 S 9.37 5.33 0.00 3.98 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 13 S 8.97 4.94 0.00 4.17 4.30 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 14 Q 9.00 4.72 0.00 1.64 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 15 G 9.09 4.30 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 0.00 16 I 8.75 4.32 1.91 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 1.48 0.82 1.04 0.00 0.00 17 P 0.00 4.54 0.00 2.21 2.23 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 18 N 8.02 4.40 0.00 2.71 2.91 0.00 0.00 6.96 7.85 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 19 L 7.19 3.90 0.00 1.50 1.38 0.66 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 9.22 4.46 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.23 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 21 P 0.00 3.92 0.00 1.98 1.87 0.00 3.51 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 2.03 2.07 0.00 22 Q 7.88 3.94 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 23 D 7.73 4.27 0.00 2.66 2.61 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 24 L 7.44 3.78 0.00 0.93 0.69 0.68 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.69 4.07 0.00 1.80 1.94 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.24 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.55 1.71 7.81 26 D 8.43 4.35 0.00 2.84 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 27 I 7.93 3.60 1.97 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.86 0.79 0.00 0.00 28 L 8.20 3.99 0.00 2.14 1.92 0.85 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.61 3.96 0.00 2.36 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 2.34 2.41 0.00 30 S 8.10 4.12 0.00 3.91 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 31 S 8.04 4.12 0.00 4.08 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 0.00 32 Q 8.32 4.20 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.98 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 33 R 7.51 4.15 0.00 1.88 2.10 0.00 3.27 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 34 N 8.72 4.52 0.00 2.78 2.85 0.00 0.00 7.05 6.80 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 35 N 8.78 4.33 0.00 2.85 3.14 0.00 0.00 7.04 8.31 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 36 P 0.00 4.20 0.00 2.18 2.14 0.00 3.74 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 2.28 2.24 0.00 37 A 8.05 3.95 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 38 N 7.65 4.59 0.00 2.98 2.89 0.00 0.00 7.01 7.53 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 39 G 8.06 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 40 I 7.70 4.61 2.04 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.37 0.97 0.00 0.00 41 T 8.61 5.11 4.68 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 1.35 0.00 0.00 42 G 7.32 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.32 4.87 0.00 1.75 1.13 1.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 44 L 9.31 5.08 0.00 1.72 1.64 0.89 0.79 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 45 C 9.50 5.35 0.00 2.96 2.91 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 46 Y 9.01 4.91 0.00 3.08 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 47 S 9.02 5.06 0.00 3.74 3.52 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 48 K 7.59 3.18 0.00 1.81 1.64 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.04 7.81 49 P 0.00 4.73 0.00 2.08 2.24 0.00 3.51 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 1.96 1.91 0.00 50 A 8.20 5.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 8.83 5.48 0.00 3.19 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 52 L 9.08 4.95 0.00 1.68 1.48 0.92 0.93 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 53 Q 8.41 5.04 0.00 1.87 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 54 V 8.34 4.90 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 -0.28 0.00 0.00 0.70 0.00 0.00 55 L 9.04 5.33 0.00 1.63 1.64 1.12 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 56 E 10.33 5.18 0.00 1.94 1.89 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 2.34 2.35 0.00 57 G 8.20 4.15 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 0.00 58 E 8.17 4.35 0.00 2.07 1.86 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 2.48 2.52 0.00 59 C 9.08 3.53 0.00 2.70 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 60 E 8.03 3.93 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.98 0.00 61 Q 7.97 4.23 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.87 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 62 V 8.30 3.63 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 1.18 0.00 0.00 1.07 0.00 0.00 63 N 8.26 4.45 0.00 2.96 2.91 0.00 0.00 6.73 7.28 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 64 E 8.33 3.94 0.00 2.09 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 0.00 2.31 2.50 0.00 65 T 8.19 3.84 4.30 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 1.25 0.00 0.00 66 Y 8.31 4.00 0.00 2.91 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 67 H 8.12 3.84 0.00 3.13 3.27 0.00 5.71 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.79 3.95 0.00 1.99 2.04 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 69 I 7.75 3.58 1.76 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 1.35 0.64 0.82 0.00 0.00 70 V 7.08 3.26 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 0.64 0.00 0.00 0.03 0.00 0.00 71 Q 7.41 4.28 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.61 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 72 D 8.01 4.41 0.00 2.71 2.50 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 0.00 0.00 0.00 73 E 8.75 4.35 0.00 2.03 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 2.23 1.90 0.00 74 R 8.48 4.44 0.00 1.93 1.99 0.00 3.06 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 75 H 7.80 5.24 0.00 3.51 3.51 0.00 5.60 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 H 9.11 4.64 0.00 3.34 3.45 0.00 5.61 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.69 3.86 0.00 4.06 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 78 P 0.00 4.69 0.00 2.22 1.94 0.00 3.70 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.83 0.00 79 Q 9.61 4.68 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.04 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 80 I 8.59 4.11 1.85 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 0.89 0.45 0.81 0.00 0.00 81 I 8.88 4.25 1.99 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 1.13 0.74 0.91 0.00 0.00 82 E 7.77 4.74 0.00 2.00 1.72 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 2.27 2.29 0.00 83 C 8.51 5.30 0.00 2.95 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 84 M 8.60 4.64 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 85 P 0.00 4.20 0.00 1.93 1.87 0.00 3.41 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.84 0.00 86 I 8.27 4.62 1.86 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.74 0.87 0.00 0.00 87 R 8.72 4.16 0.00 1.81 2.01 0.00 3.40 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 88 R 7.27 4.59 0.00 1.86 1.84 0.00 3.01 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 89 R 8.39 4.39 0.00 1.84 2.10 0.00 3.19 0.00 0.00 3.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 90 N 9.20 4.81 0.00 2.18 2.25 0.00 0.00 6.78 7.05 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 91 F 8.47 4.89 0.00 3.38 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 92 E 8.24 4.22 0.00 2.08 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 2.22 2.20 0.00 93 V 7.32 3.50 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 -0.04 0.00 0.00 0.79 0.00 0.00 94 W 7.85 5.06 0.00 3.47 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.99 4.42 0.00 3.98 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 0.00 96 M 7.96 4.96 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 97 Q 8.67 4.67 0.00 2.10 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 1.97 1.75 0.00 98 A 8.54 5.18 1.22 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 0.00 0.00 99 I 8.76 4.77 1.70 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 1.00 0.57 0.38 0.00 0.00 100 T 9.50 4.71 4.34 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 1.47 0.00 0.00 101 V 8.82 4.47 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 1.12 0.00 0.00 1.14 0.00 0.00 102 N 8.74 5.15 0.00 2.83 2.78 0.00 0.00 6.29 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 8.60 4.44 0.00 2.63 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 0.00 104 L 7.68 4.41 0.00 1.69 1.71 0.93 0.89 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 0.00 105 S 7.70 4.37 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 0.00 106 T 8.44 4.05 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 1.28 0.00 0.00 107 E 8.77 4.02 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 108 Q 8.10 3.97 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 109 V 7.76 3.73 2.32 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 1.22 0.00 0.00 1.09 0.00 0.00 110 K 8.24 4.13 0.00 2.04 1.89 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.64 7.81 111 T 8.11 3.94 4.42 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 1.21 0.00 0.00 112 L 7.70 4.09 0.00 2.03 2.00 0.90 1.09 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 0.00 113 V 8.21 3.83 2.33 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 1.00 0.00 0.00 1.13 0.00 0.00 114 L 8.15 4.10 0.00 1.98 1.81 0.84 0.27 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 0.00 115 K 8.12 3.77 0.00 1.80 1.70 0.00 1.65 0.00 0.00 1.26 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.55 1.18 7.81 116 Y 7.29 4.76 0.00 3.09 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.61 4.57 0.00 3.91 3.84 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 0.00 118 G 8.59 3.39 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 0.00 119 F 7.53 4.81 0.00 2.94 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 0.00 120 T 8.68 4.16 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 1.25 0.00 0.00 121 T 7.67 4.35 4.17 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 1.17 0.00 0.00 122 L 8.39 3.81 0.00 1.41 1.51 0.17 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.15 4.42 0.00 1.84 1.77 0.00 3.11 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.80 0.00 124 P 0.00 4.13 0.00 2.16 2.07 0.00 3.54 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 125 S 8.03 4.44 0.00 3.99 3.98 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 0.00 126 A 7.99 4.70 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 0.00 127 M 7.49 5.00 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.66 0.00 128 D 8.86 4.78 0.00 2.92 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 0.00 129 P 0.00 4.21 0.00 2.18 2.16 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.27 0.00 130 E 8.22 3.92 0.00 2.04 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 2.41 0.00 131 Q 8.75 3.87 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.54 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 132 C 8.14 4.06 0.00 3.13 2.99 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 0.00 133 L 8.06 4.02 0.00 1.84 1.83 1.13 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 134 N 8.21 4.25 0.00 2.25 2.48 0.00 0.00 6.70 8.62 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 0.00 135 F 7.66 3.94 0.00 2.99 3.23 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 0.00 136 L 8.10 3.91 0.00 2.11 1.82 0.85 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.20 3.94 0.00 1.82 1.63 0.87 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 138 D 8.12 4.34 0.00 2.75 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 0.00 139 I 7.64 3.84 1.71 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.44 0.94 0.00 0.00 140 A 8.34 4.21 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.74 4.11 0.00 2.04 1.88 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.48 7.81 142 I 7.55 4.32 1.69 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 1.71 0.40 0.92 0.00 0.00 143 Y 7.17 4.33 0.00 3.09 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 0.00 144 E 8.49 4.44 0.00 1.99 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 2.39 2.53 0.00 145 L 12.00 4.08 0.00 2.01 1.70 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 146 S 7.55 3.09 0.00 3.33 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 0.00 147 D 7.37 5.17 0.00 1.58 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 0.00 0.00 0.00 148 N 7.54 5.42 0.00 2.95 2.64 0.00 0.00 6.45 7.43 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 0.00 149 F 7.66 4.53 0.00 2.39 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 0.00 150 F 8.35 4.62 0.00 3.08 3.11 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 0.00 151 L 7.69 4.74 0.00 1.75 1.53 0.97 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.72 5.00 0.00 2.77 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 L 7.84 4.10 0.00 1.76 1.81 0.56 0.66 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