NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4444 8.1927 115.4123 57.8016 64.5995 174.2221 3 S 3.8940 8.4973 115.2178 60.7167 62.0747 174.7073 4 S 4.0847 8.7829 116.7724 61.3660 62.6051 175.6400 5 I 3.7006 7.6894 122.3016 64.5017 36.8743 178.6389 6 R 3.8883 8.3392 119.2797 59.2229 29.8333 178.9434 7 E 4.0062 8.5410 118.8022 59.5082 29.4126 179.0961 8 E 3.9770 8.2503 119.3507 58.9414 29.6278 178.9757 9 V 3.5255 7.8615 118.5541 66.4944 31.6086 177.8958 10 H 4.2669 8.2379 115.8120 58.6600 28.4351 177.8613 11 R 3.9403 8.0966 120.9225 59.3825 29.8660 178.0894 12 H 4.1019 8.3970 118.2925 59.3977 29.7472 177.2559 13 L 4.0850 7.9694 119.4625 57.7290 41.2340 179.4767 14 G 3.7526 7.9867 105.2885 47.7607 0.0000 176.1644 15 T 3.9588 7.9921 118.1272 66.5148 68.5015 177.2866 16 V 3.6339 7.9356 113.8610 63.9341 31.4592 178.3543 17 A 4.0168 7.6535 119.7014 55.0367 17.9118 179.5729 18 L 4.0453 7.8309 116.7282 57.3859 41.7025 178.4591 19 M 4.4945 7.5940 116.3060 53.6378 32.3315 175.7584 20 Q 3.9260 7.2327 121.0548 55.7410 29.4412 174.8462 21 P 4.3636 0.0000 0.0000 63.0740 32.0182 175.2887 22 A 4.4319 8.0262 122.0156 51.5519 21.7413 176.4132 23 L 4.3035 8.3035 120.2568 53.6910 41.1733 176.4792 24 H 4.4531 8.5717 124.7485 54.6888 29.2373 174.5992 25 Q 4.3876 8.1504 129.2989 54.0017 28.5871 175.1311 26 Q 4.1046 8.4706 124.7628 55.9324 29.4293 176.2559 27 T 4.5920 8.4593 111.8043 60.3039 70.5452 174.4065 28 H 4.6947 8.3606 122.6366 54.5774 28.4946 173.3859 29 A 3.6584 7.9758 129.9018 53.1694 16.0290 175.6053 30 P 4.3013 0.0000 0.0000 61.6759 32.7945 177.2171 31 A 4.2187 8.2309 122.2610 51.3588 19.2400 176.9094 32 P 4.3725 0.0000 0.0000 65.8679 31.4892 178.9179 33 T 4.0631 7.8903 106.3882 63.5076 68.8214 174.5468 34 E 4.3717 8.3248 121.0190 56.2259 30.0128 175.5852 35 I 4.3625 7.4943 121.4282 59.9292 37.9326 176.3470 36 T 4.4253 8.2117 116.6249 60.7874 71.4447 175.0139 37 H 4.1975 8.6511 120.1167 59.7305 29.8420 177.1123 38 T 3.8204 7.9667 117.0378 66.7626 68.3301 176.3980 39 L 3.8986 7.9571 120.6645 57.5119 41.6572 179.1513 40 F 4.1041 8.6648 121.1088 61.4538 39.1109 177.2134 41 R 3.9050 8.1971 116.9892 59.2714 29.6287 178.0163 42 A 4.0278 7.8078 120.6140 55.4233 18.1464 179.3097 43 Y 4.2190 8.0898 114.7594 60.8240 37.9825 177.5916 44 T 4.2762 7.4550 108.3053 60.5791 69.3552 175.1124 45 R 3.9257 6.7402 117.3202 56.5091 30.1572 176.3019 46 V 3.9381 8.0343 118.7308 60.9957 31.7944 174.5529 47 P 4.0634 0.0000 0.0000 66.0066 31.1502 177.4655 48 H 4.4404 6.9800 111.4402 56.8842 28.7280 175.7969 49 D 4.5415 7.7031 121.4150 53.1971 39.3335 175.7562 50 V 4.7721 7.1254 113.1297 59.4624 33.1489 176.2569 51 G 3.8745 7.9852 109.8251 47.3837 0.0000 173.7989 52 G 4.0138 8.9548 113.3115 45.1892 0.0000 173.6425 53 E 4.0529 8.0555 120.0216 55.8552 30.0434 176.3821 54 A 4.3167 8.3453 126.0457 52.4679 19.0839 176.0928 55 D 4.6181 8.1767 119.5900 53.3980 44.3584 174.6308 56 V 4.2259 7.8730 115.5857 59.0805 33.3680 174.1532 57 P 4.4645 0.0000 0.0000 62.1553 31.8984 176.2408 58 I 4.4000 7.3179 114.3250 58.6470 40.4602 175.2070 59 E 3.9736 8.4195 123.1140 55.4387 28.4036 175.7536 60 Y 4.3159 8.0115 123.8599 58.5236 38.4983 175.8757 61 H 5.0551 8.2803 117.7481 53.7989 31.9013 172.4946 62 E 4.5528 8.4892 119.3007 55.0376 31.0721 175.7496 63 K 4.5730 8.0402 120.3491 54.4432 35.2217 176.0269 64 E 4.0784 8.6455 125.3256 56.2254 30.1064 176.0360 65 E 4.2301 8.3633 122.7517 55.6315 30.8412 176.2991 66 E 4.2765 8.7894 125.8432 55.6759 30.7649 177.8448 67 I 3.7308 8.5275 122.9912 64.4361 37.2531 178.8664 68 W 5.0232 8.3000 118.1368 58.9574 27.8752 178.1744 69 E 2.9044 6.9908 119.4810 58.6126 28.7212 178.7995 70 L 3.8262 7.3910 119.8566 58.2397 42.1835 178.6578 71 N 4.4418 8.2282 116.4431 56.4743 38.3637 177.6409 72 T 4.0116 8.0471 117.2380 66.5580 68.6324 176.3508 73 F 4.1791 8.1721 122.5038 61.3917 39.2953 176.9297 74 A 3.9456 8.1040 120.2281 55.5034 18.1178 179.7098 75 T 3.8805 8.2163 114.2427 67.0685 68.4425 176.6982 76 C 4.6008 8.5938 118.7919 63.1564 28.2803 176.1176 77 E 4.1171 8.3467 120.1626 59.5045 28.9416 179.2030 78 C 4.6497 8.6354 117.3313 62.8104 28.1108 176.0731 79 L 3.9131 8.4257 120.6673 57.5601 41.1384 179.4662 80 A 5.1901 8.2885 122.0505 54.4263 18.2357 179.1840 81 W 4.4760 8.6736 126.2107 60.7629 30.7350 177.5666 82 R 4.3905 8.0281 115.4132 55.8765 30.0767 177.2532 83 G 3.9895 8.0267 105.4087 46.1991 0.0000 175.8277 84 V 3.6526 8.2300 121.8485 65.0674 31.8315 175.7132 85 W 4.9055 7.8807 114.5497 55.0565 30.4021 173.0596 86 T 4.7598 8.8582 110.3508 60.1184 71.4480 175.5736 87 A 3.5984 8.2010 122.9374 55.2195 18.3220 179.8496 88 E 3.7997 7.9515 116.6954 59.4823 29.5886 179.2164 89 E 3.9287 7.8096 118.8995 59.1200 29.4360 179.3258 90 R 3.0076 7.0195 118.4207 59.1036 29.9585 178.6096 91 R 3.6063 7.7107 118.1012 59.2405 29.9807 178.9415 92 R 3.7436 7.7422 118.1903 59.4671 29.6771 178.7695 93 K 4.2298 7.8383 119.4692 58.7940 31.8726 179.2717 94 Q 4.1523 8.6345 121.5943 57.9863 28.2778 176.8810 95 N 4.9770 8.5394 115.4608 53.2973 39.2975 175.3240 96 C 4.1652 7.4718 115.6982 61.3602 30.4727 176.0187 97 D 4.4275 8.2447 119.2434 57.2466 40.5245 179.3814 98 V 3.6879 7.1033 111.4760 62.4124 31.8605 177.3757 99 G 4.1363 8.1284 105.4009 45.8210 0.0000 173.9823 100 Q 4.0468 8.8536 121.2032 59.6743 28.7644 179.4941 101 T 3.9092 7.9372 115.6665 66.9254 68.7657 176.7336 102 V 3.6293 7.8158 119.5015 65.9754 31.5395 177.0180 103 Y 4.2408 8.4589 119.7905 60.2216 38.3953 177.4878 104 L 4.5341 7.7230 116.9048 54.9437 43.1704 178.3623 105 G 3.8092 8.3705 105.4442 45.7123 0.0000 173.7514 106 M 4.6431 7.0804 118.8863 52.7698 34.3462 174.0757 107 P 4.5578 0.0000 0.0000 62.3424 32.1199 176.4579 108 Y 4.1720 8.7158 120.8092 62.1937 38.5041 178.5125 109 Y 4.4445 8.2753 116.5366 60.2208 38.1173 178.4339 110 G 3.9354 8.5345 107.6955 47.9532 0.0000 176.1130 111 R 4.1288 8.1770 120.4508 58.6167 30.1085 179.1115 112 W 4.4878 8.3828 119.8261 59.1800 29.2000 178.0989 113 L 4.2003 8.6352 120.1916 58.3771 41.6054 178.8461 114 L 4.0718 8.2759 118.9867 58.3992 41.6309 179.8008 115 T 4.0565 8.3453 115.1717 66.2199 67.9859 176.8649 116 A 3.9867 8.2162 122.9654 55.0394 18.2161 179.5269 117 A 4.0129 8.1334 119.4306 55.0954 18.4421 179.8136 118 R 3.8595 8.1570 117.4174 59.7271 30.2810 178.6588 119 I 3.8545 7.8625 118.3151 63.9389 37.7239 177.8210 120 L 4.1310 7.4887 118.8229 57.6032 41.4205 179.6490 121 V 3.9248 7.4230 119.3106 65.4839 31.3883 177.8802 122 D 4.3982 8.4038 117.6515 56.7474 40.6406 177.9383 123 K 4.1946 7.6068 116.2511 55.0035 32.3584 176.3409 124 Q 3.3992 7.6312 116.5583 56.9572 26.7613 175.1928 125 F 4.5053 8.0791 117.9984 59.5400 39.5468 176.7272 126 V 4.6856 7.3376 112.7119 58.8041 35.6366 174.6695 127 T 4.2244 8.9096 114.2220 61.0104 71.1061 175.9002 128 L 3.9116 8.2886 123.0381 58.4566 42.0033 179.3250 129 T 3.8312 7.7836 115.4529 66.6909 68.4657 176.2220 130 E 3.9897 8.2547 120.4966 59.0475 29.4205 179.3031 131 L 3.9427 7.6488 120.1369 58.4582 42.2390 178.6124 132 H 4.2517 8.4543 116.5411 59.1279 28.6788 177.5456 133 N 4.3607 8.5634 118.5877 56.2033 38.2704 177.4342 134 K 3.9904 8.2057 121.0537 59.4216 32.2613 179.0020 135 I 3.6708 7.8897 120.1840 64.3211 37.1012 178.4986 136 V 3.5646 7.7762 119.0928 66.0402 31.3686 177.7212 137 E 3.9320 8.2535 119.0423 59.3229 29.5448 178.3809 138 M 4.0279 8.2836 118.4718 58.7873 32.2460 178.3720 139 R 3.9246 8.1163 118.1714 59.3609 30.1477 178.8928 140 E 3.9440 8.1480 118.2097 59.2570 29.2052 179.2026 141 R 3.8648 7.7304 117.8087 59.5289 30.2353 178.5024 142 V 3.7163 7.7591 117.3940 66.0632 31.3926 177.9110 143 A 4.0136 8.1181 119.7075 55.0100 18.2261 179.3562 144 S 4.2861 8.1712 112.3134 59.7361 63.6289 175.4835 145 G 4.0571 7.9133 110.2066 45.0705 0.0000 175.2203 146 Q 3.8928 7.5667 118.7815 57.1614 28.8636 177.6701 147 G 4.0434 8.7653 101.9175 45.3233 0.0000 173.2177 148 L 4.6532 8.7004 120.6105 53.7300 43.1446 178.0166 149 G 3.8669 8.0975 118.0509 46.3888 0.0000 172.2703 150 E 4.1697 8.4216 121.4630 56.9112 30.2341 176.9194 151 Y 4.5086 8.0032 118.6923 60.2785 38.7762 175.2029 152 L 4.8729 7.5465 121.4515 53.1934 45.3987 173.2440 153 P 4.7767 0.0000 0.0000 61.8948 32.5394 174.0543 154 P 4.7158 0.0000 0.0000 62.2126 32.4750 175.9877 155 K 4.3081 8.5247 120.6173 55.3544 32.5268 176.6910 156 A 4.7371 8.6204 126.0502 52.0020 17.9376 177.0991 157 K 4.1935 8.7241 119.4988 59.3519 32.8042 175.8247 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 2 S 8.19 4.44 0.00 4.02 4.07 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 3 S 8.50 3.89 0.00 3.99 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 4 S 8.78 4.08 0.00 3.93 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 5 I 7.69 3.70 1.99 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 1.51 0.40 0.89 0.00 0.00 6 R 8.34 3.89 0.00 1.95 2.02 0.00 3.27 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.83 0.00 7 E 8.54 4.01 0.00 2.26 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 2.35 2.43 0.00 8 E 8.25 3.98 0.00 2.05 2.08 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 2.29 2.32 0.00 9 V 7.86 3.53 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 0.91 0.00 0.00 10 H 8.24 4.27 0.00 3.23 3.33 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 11 R 8.10 3.94 0.00 2.06 2.10 0.00 3.11 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 12 H 8.40 4.10 0.00 3.37 3.50 0.00 5.85 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 13 L 7.97 4.09 0.00 1.83 1.74 0.94 0.83 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 14 G 7.99 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 7.99 3.96 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 1.19 0.00 0.00 16 V 7.94 3.63 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 0.61 0.00 0.00 0.92 0.00 0.00 17 A 7.65 4.02 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 18 L 7.83 4.05 0.00 1.73 1.74 0.91 0.73 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 19 M 7.59 4.49 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 20 Q 7.23 3.93 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 21 P 0.00 4.36 0.00 2.08 1.97 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 22 A 8.03 4.43 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 23 L 8.30 4.30 0.00 1.65 1.67 0.93 1.04 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 24 H 8.57 4.45 0.00 3.08 3.27 0.00 5.90 0.00 0.00 0.00 0.00 6.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.15 4.39 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.73 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 26 Q 8.47 4.10 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.51 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 27 T 8.46 4.59 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 1.35 0.00 0.00 28 H 8.36 4.69 0.00 3.25 3.30 0.00 5.68 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 29 A 7.98 3.66 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 30 P 0.00 4.30 0.00 2.17 2.01 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 31 A 8.23 4.22 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.37 0.00 2.19 2.15 0.00 3.60 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 2.12 2.10 0.00 33 T 7.89 4.06 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 1.21 0.00 0.00 34 E 8.32 4.37 0.00 2.11 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 2.28 2.40 0.00 35 I 7.49 4.36 2.09 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 1.42 0.52 1.15 0.00 0.00 36 T 8.21 4.43 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 1.25 0.00 0.00 37 H 8.65 4.20 0.00 3.27 3.38 0.00 5.88 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 38 T 7.97 3.82 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 1.19 0.00 0.00 39 L 7.96 3.90 0.00 1.94 1.88 0.81 1.03 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 40 F 8.66 4.10 0.00 3.28 3.24 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 41 R 8.20 3.91 0.00 1.79 2.04 0.00 3.36 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 42 A 7.81 4.03 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 43 Y 8.09 4.22 0.00 2.85 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 44 T 7.45 4.28 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 0.42 0.00 0.00 45 R 6.74 3.93 0.00 1.93 2.13 0.00 3.07 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.52 0.00 46 V 8.03 3.94 2.08 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 0.80 0.00 0.00 0.90 0.00 0.00 47 P 0.00 4.06 0.00 1.62 1.82 0.00 3.50 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 48 H 6.98 4.44 0.00 3.41 3.34 0.00 5.57 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.70 4.54 0.00 2.66 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 50 V 7.13 4.77 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 1.24 0.00 0.00 1.01 0.00 0.00 51 G 7.99 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 52 G 8.95 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 53 E 8.06 4.05 0.00 2.18 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 2.34 2.33 0.00 54 A 8.35 4.32 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 55 D 8.18 4.62 0.00 2.62 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.87 4.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.90 0.00 0.00 57 P 0.00 4.46 0.00 1.97 1.90 0.00 3.58 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 1.99 2.03 0.00 58 I 7.32 4.40 1.73 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.76 0.86 0.00 0.00 59 E 8.42 3.97 0.00 1.88 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 2.28 2.30 0.00 60 Y 8.01 4.32 0.00 3.01 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.28 5.06 0.00 3.17 3.27 0.00 5.71 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.49 4.55 0.00 1.97 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 2.25 2.21 0.00 63 K 8.04 4.57 0.00 1.67 1.59 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.43 7.81 64 E 8.65 4.08 0.00 1.97 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 2.29 2.28 0.00 65 E 8.36 4.23 0.00 1.82 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 2.09 2.08 0.00 66 E 8.79 4.28 0.00 1.22 1.61 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 2.20 2.28 0.00 67 I 8.53 3.73 2.17 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.72 0.90 0.00 0.00 68 W 8.30 5.02 0.00 3.52 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 69 E 6.99 2.90 0.00 1.49 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 1.47 1.47 0.00 70 L 7.39 3.83 0.00 1.90 1.75 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.23 4.44 0.00 2.97 2.98 0.00 0.00 7.06 6.97 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 72 T 8.05 4.01 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 1.60 0.00 0.00 73 F 8.17 4.18 0.00 2.84 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 74 A 8.10 3.95 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 75 T 8.22 3.88 4.54 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 1.28 0.00 0.00 76 C 8.59 4.60 0.00 3.59 3.44 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 77 E 8.35 4.12 0.00 1.82 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 1.81 1.91 0.00 78 C 8.64 4.65 0.00 3.24 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 79 L 8.43 3.91 0.00 1.99 1.32 0.61 0.61 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 80 A 8.29 5.19 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 0.00 0.00 81 W 8.67 4.48 0.00 3.30 3.46 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 82 R 8.03 4.39 0.00 1.65 1.71 0.00 3.04 0.00 0.00 2.41 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.38 0.00 83 G 8.03 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 84 V 8.23 3.65 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 0.48 0.00 0.00 0.42 0.00 0.00 85 W 7.88 4.91 0.00 3.62 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 86 T 8.86 4.76 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 1.26 0.00 0.00 87 A 8.20 3.60 1.21 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 0.00 0.00 88 E 7.95 3.80 0.00 1.93 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 2.34 2.31 0.00 89 E 7.81 3.93 0.00 2.14 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 2.36 2.33 0.00 90 R 7.02 3.01 0.00 0.67 1.22 0.00 2.63 0.00 0.00 2.61 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.76 0.00 91 R 7.71 3.61 0.00 1.85 1.85 0.00 3.30 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.67 0.00 92 R 7.74 3.74 0.00 1.78 2.01 0.00 3.31 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 1.56 1.77 0.00 93 K 7.84 4.23 0.00 1.94 1.92 0.00 1.91 0.00 0.00 2.01 0.00 0.00 3.08 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.51 7.81 94 Q 8.63 4.15 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.66 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 95 N 8.54 4.98 0.00 2.70 2.87 0.00 0.00 6.81 7.58 0.00 0.00 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 C 7.47 4.17 0.00 2.99 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 97 D 8.24 4.43 0.00 2.81 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 98 V 7.10 3.69 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 0.79 0.00 0.00 1.13 0.00 0.00 99 G 8.13 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 8.85 4.05 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.85 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 101 T 7.94 3.91 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 1.25 0.00 0.00 102 V 7.82 3.63 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.98 0.00 0.00 103 Y 8.46 4.24 0.00 3.23 3.20 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 0.00 104 L 7.72 4.53 0.00 1.63 1.68 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.37 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 0.00 106 M 7.08 4.64 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 107 P 0.00 4.56 0.00 2.47 2.15 0.00 3.78 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 108 Y 8.72 4.17 0.00 2.98 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 0.00 109 Y 8.28 4.44 0.00 3.09 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 0.00 110 G 8.53 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 0.00 0.00 0.00 111 R 8.18 4.13 0.00 2.05 2.07 0.00 3.29 0.00 0.00 3.47 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.96 0.00 112 W 8.38 4.49 0.00 3.83 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 0.00 113 L 8.64 4.20 0.00 2.18 2.08 1.07 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.28 4.07 0.00 1.84 1.79 0.99 0.63 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 0.00 115 T 8.35 4.06 4.58 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 116 A 8.22 3.99 1.57 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 0.00 0.00 0.00 117 A 8.13 4.01 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 0.00 118 R 8.16 3.86 0.00 2.12 2.22 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 119 I 7.86 3.85 1.51 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.93 0.11 0.00 0.00 120 L 7.49 4.13 0.00 1.91 1.73 0.89 0.61 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 0.00 121 V 7.42 3.92 2.18 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 1.29 0.00 0.00 0.96 0.00 0.00 122 D 8.40 4.40 0.00 2.71 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 0.00 123 K 7.61 4.19 0.00 1.77 1.21 0.00 2.12 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.46 7.81 124 Q 7.63 3.40 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 7.02 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 125 F 8.08 4.51 0.00 3.13 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 0.00 126 V 7.34 4.69 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 0.84 0.00 0.00 0.95 0.00 0.00 127 T 8.91 4.22 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 1.19 0.00 0.00 128 L 8.29 3.91 0.00 1.70 1.61 0.84 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.78 3.83 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 1.21 0.00 0.00 130 E 8.25 3.99 0.00 2.16 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 2.32 2.30 0.00 131 L 7.65 3.94 0.00 1.73 1.80 0.93 1.44 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 0.00 132 H 8.45 4.25 0.00 3.32 3.30 0.00 5.69 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 0.00 133 N 8.56 4.36 0.00 2.91 2.87 0.00 0.00 6.71 6.81 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 0.00 134 K 8.21 3.99 0.00 1.95 2.01 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 135 I 7.89 3.67 2.02 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 1.68 0.74 0.89 0.00 0.00 136 V 7.78 3.56 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.01 0.00 0.00 137 E 8.25 3.93 0.00 2.16 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 0.00 2.31 2.46 0.00 138 M 8.28 4.03 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 139 R 8.12 3.92 0.00 2.06 1.95 0.00 3.16 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 140 E 8.15 3.94 0.00 2.25 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 141 R 7.73 3.86 0.00 2.01 2.10 0.00 3.29 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.78 0.00 142 V 7.76 3.72 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.94 0.00 0.00 143 A 8.12 4.01 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 0.00 144 S 8.17 4.29 0.00 4.03 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 0.00 145 G 7.91 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 0.00 0.00 0.00 146 Q 7.57 3.89 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.33 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 147 G 8.77 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 0.00 148 L 8.70 4.65 0.00 1.68 1.63 0.99 1.22 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 0.00 149 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 0.00 150 E 8.42 4.17 0.00 1.92 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 0.00 1.65 1.67 0.00 151 Y 8.00 4.51 0.00 3.23 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 0.00 152 L 7.55 4.87 0.00 1.80 1.61 0.95 0.97 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 0.00 153 P 0.00 4.78 0.00 2.12 2.04 0.00 3.85 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 2.00 2.01 0.00 154 P 0.00 4.72 0.00 1.96 2.13 0.00 3.68 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 2.03 2.26 0.00 155 K 8.52 4.31 0.00 1.66 1.74 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.55 7.81 156 A 8.62 4.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 8.72 4.19 0.00 1.84 1.76 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.39 7.81