NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.9423 8.3093 119.4221 56.9797 39.5640 174.7756 4 S 3.9538 8.6230 121.2776 58.0485 64.0533 171.6003 5 E 3.9157 9.1289 124.9762 59.4442 29.7047 179.8311 6 E 4.1718 8.2469 119.1529 59.4162 29.4337 178.8260 7 Q 3.9319 7.6468 117.1963 59.4964 28.8432 177.9218 8 T 2.9953 7.7507 118.1532 66.1817 68.2167 176.1780 9 A 3.9002 8.6426 122.5186 55.1824 18.5924 179.2330 10 E 4.3036 7.7324 116.2406 59.2197 29.6172 179.0621 11 F 4.4911 9.2397 119.3545 61.0488 39.0653 177.8252 12 K 4.0925 8.0275 117.6544 59.8888 31.7111 179.0334 13 E 4.0133 8.5521 118.5802 59.3100 29.0855 179.5079 14 A 4.0767 7.9421 119.4533 55.0391 19.2226 178.7184 15 F 3.9562 8.9992 119.5023 61.7934 39.2399 177.1684 16 Q 4.3198 8.8580 116.3344 58.8097 28.9398 179.2450 17 L 4.4115 7.5636 121.2460 54.4309 42.0152 177.6232 18 F 4.5659 7.5099 110.4897 57.3233 41.5575 173.9560 19 D 4.8055 7.9331 120.4554 52.1380 42.6780 175.3853 20 R 4.0490 8.9019 127.7841 59.3693 30.9766 176.8584 21 T 3.8714 8.0880 106.5522 61.7942 68.2892 174.3474 22 G 4.5704 8.6306 120.9402 44.8490 0.0000 174.4512 23 D 4.4130 8.3872 119.7372 55.0708 39.1413 177.2903 24 G 4.1118 8.3815 106.0023 45.6920 0.0000 173.1238 25 K 5.7557 8.6448 117.3368 53.3874 35.6349 176.6230 26 I 4.2109 8.2832 124.5422 59.2507 39.0490 174.9832 27 L 4.2570 8.6515 127.1586 55.5930 42.0343 178.0986 28 Y 4.2447 9.0599 121.0407 61.7617 38.0014 179.1881 29 S 4.2175 8.4579 114.5731 61.4538 63.2912 176.2505 30 Q 3.8004 8.2497 122.2997 58.3324 28.3377 179.1627 31 C 3.7369 7.9228 119.4527 62.5492 31.6382 175.5537 32 G 3.7869 7.6989 106.8428 48.5234 0.0000 175.0921 33 D 4.3402 7.9049 121.1261 56.7022 40.8157 179.1121 34 V 2.7889 7.3959 118.6691 65.8355 31.3143 178.1310 35 M 4.0963 8.1650 118.6516 58.2883 31.7336 178.7780 36 R 4.6651 8.3711 119.4311 59.0595 30.1229 178.7463 37 A 3.8493 8.6493 120.2298 55.3324 18.2595 178.6138 38 L 4.4057 7.3667 115.0278 54.6621 41.7451 177.2057 39 G 3.8558 8.6961 106.9107 46.6049 0.0000 173.6588 40 Q 4.6830 7.8332 119.9101 54.0867 31.1803 175.3229 41 N 5.1748 8.3121 120.5774 51.8455 39.3426 173.5248 42 P 4.5363 0.0000 0.0000 62.6518 32.5249 177.0917 43 T 4.1679 9.4013 113.5380 61.4451 70.5184 175.2509 44 N 4.3537 8.6570 117.7152 56.1181 38.3297 177.6174 45 A 4.0604 7.9447 122.1623 55.1457 18.4911 179.3989 46 E 3.9106 8.2212 115.1118 59.1379 29.5673 179.1404 47 V 3.8371 7.2906 117.5946 65.5149 31.8679 177.6673 48 M 3.9410 7.6483 116.7110 58.3608 31.8757 177.8012 49 K 3.8175 8.1116 119.7607 59.3051 32.3294 177.0942 50 V 4.2515 7.1044 115.8103 62.8918 31.3896 175.8257 51 L 4.4526 7.9719 115.0223 52.9000 43.4544 177.1539 52 G 3.8201 8.3386 105.9346 45.9374 0.0000 174.1434 53 N 4.1479 8.2415 113.0283 53.6494 35.9350 173.2454 54 P 4.7089 0.0000 0.0000 61.9214 33.4493 175.7706 55 K 4.5652 8.1307 117.4062 56.7347 35.6969 178.8908 56 S 3.6221 7.7647 117.8157 59.9978 65.4651 175.1470 57 D 4.3605 8.1022 121.3146 56.1370 38.9201 178.3048 58 E 4.1121 8.4869 118.9411 57.5707 29.5173 177.9712 59 M 4.4230 7.8294 118.7968 56.4589 32.3704 175.9003 60 N 4.9064 7.9542 116.0602 53.1945 40.2078 174.1161 61 L 4.5094 7.6261 115.0933 56.9596 43.7349 177.1646 62 K 3.9617 7.7243 118.0920 57.0902 33.0440 175.9668 63 T 5.3975 8.2132 111.9213 60.0755 72.4898 172.5266 64 L 5.3975 8.5647 118.7621 52.2512 46.5507 175.9068 65 K 4.8797 8.6546 120.2338 54.4782 35.1689 176.7552 66 F 2.8215 8.4835 126.7522 61.3652 39.0786 177.2368 67 E 3.9722 8.4486 116.9591 59.3199 29.3497 178.0126 68 Q 4.2665 8.4241 116.7575 57.5243 29.1619 177.8015 69 F 4.1056 7.6948 122.8199 60.8618 39.6068 176.4515 70 L 3.4144 8.3181 121.3902 57.7873 41.9122 177.2186 71 P 4.9860 0.0000 0.0000 65.2411 30.7344 177.8720 72 M 4.5262 7.9194 119.9966 57.0641 32.2529 177.6745 73 M 3.5771 7.1959 117.8848 59.0664 32.1454 178.1013 74 Q 4.0924 8.1667 117.6518 59.2326 28.9767 178.7139 75 T 3.8311 7.4781 109.3385 65.5788 68.4835 175.4370 76 I 3.7506 8.2819 121.7970 63.4939 37.2219 178.4998 77 A 3.8846 7.9646 123.5172 54.6094 19.0003 177.7426 78 K 4.2861 7.8060 117.7983 55.2095 31.6399 175.4645 79 N 5.1418 8.1665 120.1077 51.0020 42.6135 175.1180 80 K 4.2258 8.5927 117.8823 58.8981 32.8532 176.6875 81 D 4.8349 8.1523 118.0065 55.0817 43.3977 174.3628 82 Q 4.8448 8.0712 126.2202 56.8775 31.1620 174.7265 83 G 3.1050 7.9186 111.4545 44.6572 0.0000 173.1522 84 C 4.9478 7.0664 110.5122 57.3153 32.3676 174.5071 85 F 3.6035 8.7430 124.5373 61.2218 39.6910 178.7429 86 E 3.8654 7.3182 118.4148 58.7109 30.1675 178.4630 87 D 4.7225 7.7831 118.9014 55.7496 41.9186 177.8586 88 Y 4.4408 8.1321 117.0069 62.1384 37.9025 179.5967 89 V 3.3626 7.9576 112.6645 64.1992 31.6974 178.1112 90 E 4.0389 7.9078 118.8510 59.2206 29.0623 179.2635 91 G 3.6663 7.8274 105.0274 47.3659 0.0000 175.9805 92 L 4.2254 7.5092 120.9664 57.3019 41.8639 178.8936 93 R 3.5685 7.7428 118.1647 58.0256 29.7211 177.5231 94 V 3.8657 7.0119 115.8453 64.1344 31.7152 175.7539 95 F 4.8835 8.1048 115.4015 58.0159 39.8241 176.4351 96 D 4.7775 8.1648 121.9169 54.2406 39.1174 177.8126 97 K 4.7317 7.3734 124.0252 58.5426 34.7327 176.3648 98 E 4.6493 8.5546 117.1534 57.3042 31.0378 174.8699 99 G 4.1994 8.2734 102.8330 46.1637 0.0000 172.2270 100 N 4.3186 8.2036 119.5211 54.7127 38.5049 176.4783 101 G 4.0527 9.4772 105.3872 44.5213 0.0000 173.0387 102 T 4.5772 7.2509 108.1887 59.6444 72.0985 173.3713 103 V 4.6279 8.3561 122.2191 61.0428 35.4733 174.5347 104 M 4.4536 8.6523 125.6748 54.9975 32.4860 177.6051 105 G 4.2254 9.4197 110.6792 45.7047 0.0000 174.2632 106 A 4.2449 8.0799 123.0562 53.4523 20.7256 178.9944 107 E 4.0210 7.8388 116.6066 59.4818 29.7203 179.3386 108 I 3.5557 7.6050 119.3972 64.3653 37.0504 178.3252 109 R 3.9351 7.3002 117.8910 60.0480 29.8553 176.7732 110 H 4.3730 8.4888 119.2493 56.7731 29.6083 177.5618 111 V 3.2977 7.0796 118.7600 65.9562 32.3076 178.4332 112 L 4.0735 7.7572 118.1076 56.5052 41.3467 178.0241 113 V 4.8008 8.9986 118.8053 61.9112 31.8402 176.2935 114 T 4.5327 7.7412 104.0618 62.0364 72.1887 172.9913 115 L 4.7940 7.4438 121.2267 53.8615 46.4092 178.3609 116 G 3.7134 8.6697 109.5908 46.6949 0.0000 176.1603 117 E 4.2938 8.6308 114.6275 55.7934 26.9805 175.9458 118 K 3.7780 7.8064 117.0016 57.4617 33.0786 177.6652 119 M 4.6634 8.2319 125.1680 54.8565 34.5123 175.2928 120 T 4.6747 8.7510 109.4711 60.1596 71.7989 175.4862 121 E 3.9478 8.8878 120.9778 59.9219 29.2020 179.3435 122 E 3.9093 8.0642 118.7686 59.2235 29.6444 178.3319 123 E 3.9056 8.2575 118.4990 60.1485 29.5866 180.0309 124 V 3.5922 7.9338 111.6585 64.5004 31.6748 177.8683 125 E 3.8346 7.9957 118.6610 59.9153 29.1933 178.9353 126 Q 4.0208 8.2904 117.5880 59.5057 28.8342 178.2393 127 L 4.1106 7.5191 121.0119 57.5881 42.3861 178.7670 128 V 3.7736 8.4018 111.7403 63.2408 31.5769 176.0184 129 A 3.8314 7.4302 120.9975 54.3013 17.7207 177.2056 130 G 4.0622 9.4355 111.1802 46.0876 0.0000 172.9079 131 H 4.7935 8.4423 114.4750 54.8769 30.7825 173.2274 132 E 4.5740 7.9810 120.5443 55.5500 30.8853 176.0622 133 D 5.0513 8.3651 124.6139 52.6271 41.4523 177.0893 134 S 4.0639 8.8186 111.5809 61.8806 62.9784 174.6423 135 N 4.7353 8.3735 116.0037 52.3712 38.5199 174.7692 136 G 3.9840 8.1000 106.0167 46.8592 0.0000 173.0756 137 C 4.9193 8.9952 117.1637 57.8317 30.4366 173.4020 138 I 5.1440 8.3855 124.2470 59.0252 39.8868 174.5681 139 N 4.7397 8.4886 124.5951 52.0462 39.1900 174.5792 140 Y 4.2099 8.4992 124.8286 60.9946 38.2806 179.6979 141 E 3.9573 8.2851 120.5004 58.4973 30.1369 179.4526 142 E 4.0947 8.1375 117.8673 59.1150 29.7447 178.7032 143 L 3.9565 8.1084 120.1833 58.8021 42.0487 179.0920 144 V 3.5014 8.8136 118.9114 66.2481 31.4345 177.9430 145 R 4.1026 8.2605 117.2226 59.8200 30.0633 178.2933 146 M 4.0031 8.7398 117.8980 59.3306 31.9542 178.7694 147 V 3.6913 7.6357 111.5053 63.9377 31.9050 178.0034 148 L 4.0454 8.2718 118.4379 55.9440 41.1312 177.8345 149 S 4.2000 6.7189 125.3946 61.7747 64.1209 175.3012 150 G 3.7671 7.9115 113.2489 45.7034 0.0000 173.3332 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 F 8.31 4.94 0.00 3.08 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 4 S 8.62 3.95 0.00 4.13 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 5 E 9.13 3.92 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 6 E 8.25 4.17 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 7 Q 7.65 3.93 0.00 1.85 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.49 0.00 0.00 0.00 0.00 0.00 2.41 1.85 0.00 8 T 7.75 3.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 9 A 8.64 3.90 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 10 E 7.73 4.30 0.00 2.28 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 0.00 2.40 2.77 0.00 11 F 9.24 4.49 0.00 3.51 3.57 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 12 K 8.03 4.09 0.00 1.67 1.54 0.00 1.64 0.00 0.00 1.37 0.00 0.00 2.64 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.34 1.50 7.81 13 E 8.55 4.01 0.00 2.14 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 2.36 2.58 0.00 14 A 7.94 4.08 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.00 3.96 0.00 3.15 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 16 Q 8.86 4.32 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.44 0.00 0.00 0.00 0.00 0.00 2.60 2.65 0.00 17 L 7.56 4.41 0.00 1.72 1.84 0.82 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 18 F 7.51 4.57 0.00 3.10 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 19 D 7.93 4.81 0.00 2.59 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.90 4.05 0.00 1.81 1.95 0.00 3.28 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 21 T 8.09 3.87 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 22 G 8.63 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.39 4.41 0.00 2.84 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 24 G 8.38 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 8.64 5.76 0.00 1.81 1.75 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.50 7.81 26 I 8.28 4.21 1.55 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 0.32 0.66 0.00 0.00 27 L 8.65 4.26 0.00 1.61 1.66 0.96 0.90 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 28 Y 9.06 4.24 0.00 2.75 3.09 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 29 S 8.46 4.22 0.00 4.04 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 8.25 3.80 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 31 C 7.92 3.74 0.00 2.93 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 32 G 7.70 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.90 4.34 0.00 2.60 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 34 V 7.40 2.79 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 0.48 0.00 0.00 -0.81 0.00 0.00 35 M 8.17 4.10 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.72 0.00 36 R 8.37 4.67 0.00 2.00 1.99 0.00 3.26 0.00 0.00 3.27 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 37 A 8.65 3.85 1.52 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 0.00 0.00 38 L 7.37 4.41 0.00 1.66 1.38 0.02 1.37 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 39 G 8.70 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 0.00 0.00 0.00 40 Q 7.83 4.68 0.00 2.36 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.41 6.90 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 41 N 8.31 5.17 0.00 2.75 2.78 0.00 0.00 7.00 8.02 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 42 P 0.00 4.54 0.00 2.16 2.05 0.00 3.84 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 43 T 9.40 4.17 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 1.37 0.00 0.00 44 N 8.66 4.35 0.00 3.08 2.91 0.00 0.00 6.70 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 45 A 7.94 4.06 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 46 E 8.22 3.91 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 47 V 7.29 3.84 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 0.96 0.00 0.00 1.01 0.00 0.00 48 M 7.65 3.94 0.00 2.21 2.03 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 2.61 2.59 0.00 49 K 8.11 3.82 0.00 1.71 1.94 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.38 7.81 50 V 7.10 4.25 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 0.77 0.00 0.00 0.87 0.00 0.00 51 L 7.97 4.45 0.00 1.65 1.54 0.56 0.35 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 52 G 8.34 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 0.00 0.00 0.00 53 N 8.24 4.15 0.00 2.83 2.83 0.00 0.00 7.14 8.02 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 54 P 0.00 4.71 0.00 2.17 2.14 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.60 0.00 55 K 8.13 4.57 0.00 2.24 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.50 7.81 56 S 7.76 3.62 0.00 4.04 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 D 8.10 4.36 0.00 2.88 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 58 E 8.49 4.11 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 59 M 7.83 4.42 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.79 0.00 60 N 7.95 4.91 0.00 2.67 2.77 0.00 0.00 7.00 7.07 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 61 L 7.63 4.51 0.00 1.57 1.62 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.72 3.96 0.00 1.07 0.74 0.00 1.07 0.00 0.00 1.44 0.00 0.00 2.66 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.16 0.96 7.81 63 T 8.21 5.40 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 1.30 0.00 0.00 64 L 8.56 5.40 0.00 2.08 1.88 0.95 1.01 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 65 K 8.65 4.88 0.00 1.72 1.71 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.49 7.81 66 F 8.48 2.82 0.00 2.56 2.83 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 67 E 8.45 3.97 0.00 2.08 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 0.00 2.36 2.38 0.00 68 Q 8.42 4.27 0.00 2.35 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.71 0.00 69 F 7.69 4.11 0.00 3.08 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.32 3.41 0.00 1.26 1.65 1.30 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.99 0.00 2.25 2.29 0.00 3.67 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.99 0.00 72 M 7.92 4.53 0.00 1.81 1.88 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.27 0.00 73 M 7.20 3.58 0.00 1.95 1.52 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.07 0.00 74 Q 8.17 4.09 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.36 0.00 0.00 0.00 0.00 0.00 2.64 2.75 0.00 75 T 7.48 3.83 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 1.20 0.00 0.00 76 I 8.28 3.75 1.99 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 1.39 0.66 0.90 0.00 0.00 77 A 7.96 3.88 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 78 K 7.81 4.29 0.00 1.70 1.73 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.40 7.81 79 N 8.17 5.14 0.00 2.65 2.69 0.00 0.00 7.21 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 80 K 8.59 4.23 0.00 1.71 1.85 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.50 7.81 81 D 8.15 4.83 0.00 2.58 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.07 4.84 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 83 G 7.92 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 0.00 0.00 0.00 84 C 7.07 4.95 0.00 3.32 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 85 F 8.74 3.60 0.00 3.30 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 86 E 7.32 3.87 0.00 2.00 1.97 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 2.35 2.59 0.00 87 D 7.78 4.72 0.00 2.49 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 88 Y 8.13 4.44 0.00 3.01 2.83 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 89 V 7.96 3.36 1.71 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 -0.32 0.00 0.00 0.70 0.00 0.00 90 E 7.91 4.04 0.00 1.98 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 2.23 2.30 0.00 91 G 7.83 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.51 4.23 0.00 1.35 1.71 0.93 0.92 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 93 R 7.74 3.57 0.00 1.24 1.71 0.00 3.20 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 94 V 7.01 3.87 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.75 0.00 0.00 95 F 8.10 4.88 0.00 3.20 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.16 4.78 0.00 3.08 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 97 K 7.37 4.73 0.00 1.83 1.82 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.56 7.81 98 E 8.55 4.65 0.00 2.17 1.82 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 2.25 2.28 0.00 99 G 8.27 4.20 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 0.00 100 N 8.20 4.32 0.00 2.73 2.90 0.00 0.00 7.15 7.03 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 0.00 101 G 9.48 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 7.25 4.58 4.33 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 1.09 0.00 0.00 103 V 8.36 4.63 2.20 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 1.13 0.00 0.00 1.29 0.00 0.00 104 M 8.65 4.45 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.57 0.00 105 G 9.42 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 0.00 0.00 0.00 106 A 8.08 4.24 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 0.00 107 E 7.84 4.02 0.00 2.11 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 2.37 2.40 0.00 108 I 7.61 3.56 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.32 0.88 0.00 0.00 109 R 7.30 3.94 0.00 2.04 1.94 0.00 3.24 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 110 H 8.49 4.37 0.00 3.38 3.10 0.00 5.69 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.08 3.30 1.68 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 0.88 0.00 0.00 0.01 0.00 0.00 112 L 7.76 4.07 0.00 1.74 1.67 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 113 V 9.00 4.80 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 0.85 0.00 0.00 0.98 0.00 0.00 114 T 7.74 4.53 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 115 L 7.44 4.79 0.00 1.67 1.56 0.88 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.67 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 0.00 0.00 0.00 117 E 8.63 4.29 0.00 1.97 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 2.29 0.00 118 K 7.81 3.78 0.00 1.62 1.79 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.55 7.81 119 M 8.23 4.66 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.46 0.00 120 T 8.75 4.67 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 1.25 0.00 0.00 121 E 8.89 3.95 0.00 2.17 2.26 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 2.36 2.36 0.00 122 E 8.06 3.91 0.00 1.99 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 2.39 2.33 0.00 123 E 8.26 3.91 0.00 2.27 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 2.38 0.00 124 V 7.93 3.59 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 0.75 0.00 0.00 0.99 0.00 0.00 125 E 8.00 3.83 0.00 2.32 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 0.00 2.31 2.41 0.00 126 Q 8.29 4.02 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 127 L 7.52 4.11 0.00 1.56 1.71 0.87 1.40 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 0.00 128 V 8.40 3.77 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 0.66 0.00 0.00 1.05 0.00 0.00 129 A 7.43 3.83 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 0.00 130 G 9.44 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 0.00 131 H 8.44 4.79 0.00 3.33 3.30 0.00 5.81 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 0.00 132 E 7.98 4.57 0.00 2.03 1.93 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 2.39 2.30 0.00 133 D 8.37 5.05 0.00 2.90 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 0.00 134 S 8.82 4.06 0.00 3.99 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 0.00 135 N 8.37 4.74 0.00 2.73 2.86 0.00 0.00 6.87 7.65 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 0.00 136 G 8.10 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 0.00 0.00 0.00 137 C 9.00 4.92 0.00 3.06 2.83 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 0.00 138 I 8.39 5.14 2.00 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 1.24 2.06 0.93 0.00 0.00 139 N 8.49 4.74 0.00 2.68 2.65 0.00 0.00 6.82 7.56 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 0.00 140 Y 8.50 4.21 0.00 3.12 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 0.00 141 E 8.29 3.96 0.00 2.33 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.37 0.00 142 E 8.14 4.09 0.00 2.34 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 143 L 8.11 3.96 0.00 1.79 1.88 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.81 3.50 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.80 0.00 0.00 145 R 8.26 4.10 0.00 2.06 2.10 0.00 3.27 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 146 M 8.74 4.00 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.64 0.00 147 V 7.64 3.69 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 0.75 0.00 0.00 0.98 0.00 0.00 148 L 8.27 4.05 0.00 1.98 1.61 0.92 1.06 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 0.00 149 S 6.72 4.20 0.00 4.07 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 0.00 150 G 7.91 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