NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1D H 4.7448 8.4449 117.8664 55.7194 30.3609 172.4866 1E H 4.8523 8.0080 114.0650 52.1919 32.9617 171.6414 1F H 4.5964 9.1193 117.1977 56.0149 29.9223 174.0803 1 F 4.8634 8.3909 119.6501 57.7565 39.8314 174.6686 2 N 4.6602 8.3482 117.8823 52.3337 38.9703 174.7079 3 L 4.7563 8.0258 123.5156 52.0793 43.8231 174.8080 4 P 4.5524 0.0000 0.0000 61.6738 32.6103 175.2462 5 P 4.4083 0.0000 0.0000 63.0901 33.1848 175.9178 6 G 3.9439 8.6267 107.8694 45.4467 0.0000 171.9636 7 N 4.6209 8.0361 115.4029 51.2893 39.8463 174.4554 8 Y 4.8469 8.0488 117.6645 58.3292 38.6792 177.0150 9 K 4.1443 9.0459 122.4525 58.9260 32.2046 177.5120 10 K 4.6774 7.5932 115.3846 53.3414 34.8512 173.8224 11 P 4.7198 0.0000 0.0000 63.2392 32.3837 174.9203 12 K 4.8851 9.4619 119.2260 55.2144 37.5165 174.9868 13 L 5.0297 9.0812 121.3246 53.3575 44.4128 176.3682 14 L 4.8813 8.6041 123.6555 53.5206 42.4142 173.9991 15 Y 4.6832 9.1835 126.1613 57.2235 40.3832 173.3488 16 C 4.0983 8.5080 127.9187 57.6042 32.4022 173.9994 17 S 3.4854 8.0801 122.3137 61.8587 62.0004 174.3634 18 N 3.8700 8.2053 116.2944 55.3505 38.7389 174.4758 19 G 3.7505 7.8927 109.7108 45.1548 0.0000 174.1138 20 G 3.3336 7.8153 107.8642 45.7227 0.0000 173.3636 21 H 4.5880 7.3999 115.9751 54.7039 30.8939 174.2000 22 F 5.2346 8.8938 120.0405 56.0196 40.9608 175.2993 23 L 4.5206 8.9452 125.3778 55.2874 43.3737 175.6193 24 R 4.8462 9.5026 126.0386 54.6347 33.4899 173.8099 25 I 4.8171 8.2220 126.9426 59.4446 38.5979 175.7072 26 L 4.0973 8.6444 127.8745 53.4069 42.3471 176.7599 27 P 4.1661 0.0000 0.0000 65.9631 31.2679 177.2001 28 D 4.5362 7.9550 114.1073 53.6439 39.6848 177.0047 29 G 4.0819 8.4690 110.2796 45.3864 0.0000 174.1989 30 T 4.2971 8.2807 117.1630 63.4469 69.0768 173.5777 31 V 4.9377 7.9630 123.4342 61.3103 34.8980 174.5553 32 D 4.5835 8.5844 125.0908 53.0198 42.6970 174.1293 33 G 4.5696 8.6660 104.7800 45.4386 0.0000 172.3725 34 T 4.9880 8.7955 114.7004 60.6080 70.9608 174.7027 35 R 4.2297 8.8151 124.7435 56.7906 31.0436 176.4236 36 D 4.6002 8.0900 118.5964 53.5862 40.0038 176.7478 37 R 3.7667 8.6576 126.7038 58.4005 30.2163 178.0105 38 S 4.4395 8.3036 111.1493 58.0580 63.5453 174.0422 39 D 4.3979 7.8309 121.7557 55.0029 41.3038 175.7974 40 Q 4.4067 8.5306 123.4335 56.5954 29.3524 175.7469 41 H 4.8967 9.3795 115.7657 55.4584 29.3479 174.9610 42 I 4.5757 7.1144 109.7557 59.9029 38.4671 175.3546 43 Q 4.2729 7.7622 122.0568 55.6468 29.7523 174.7101 44 L 5.2403 9.0089 124.4664 52.8144 45.6682 175.2181 45 Q 4.7839 9.3072 124.8557 54.4712 30.9451 174.2405 46 L 5.2891 8.6345 126.3276 53.4555 44.1234 176.0286 47 S 4.5016 8.3521 115.1039 56.5527 66.8167 172.8659 48 A 4.5289 8.0994 125.4546 51.3761 19.5150 176.7309 49 E 4.1552 8.6651 124.3332 57.8273 30.4814 175.9867 50 S 4.6231 7.3319 112.2105 56.4209 67.2048 172.5040 51 N 4.4713 8.6494 120.5838 55.4238 38.9018 175.2165 52 G 3.9751 9.1972 113.7139 45.1873 0.0000 171.8715 53 E 5.1742 8.2681 120.0508 54.7585 32.1352 175.6362 54 V 5.4496 8.8180 115.9715 59.0137 36.8511 173.7608 55 Y 5.5867 7.9184 119.9765 56.5854 41.3390 175.3589 56 I 4.6500 8.5518 122.0068 59.5568 40.5362 174.1788 57 K 4.7903 8.7030 128.7148 54.0557 35.5103 175.0905 58 S 4.6119 8.7069 122.7142 58.6162 62.7112 174.9679 59 T 3.9281 8.5908 118.0674 64.3566 68.8544 175.9298 60 E 4.0588 8.3460 122.7660 58.3843 29.8693 177.0028 61 T 4.3424 8.2124 106.3829 60.7022 70.2689 175.3512 62 G 3.8317 8.1549 110.0151 45.1755 0.0000 173.7766 63 Q 4.3841 7.5859 119.0513 56.1424 30.1552 174.7259 64 Y 4.6555 9.1768 120.8354 56.2275 40.1600 175.0508 65 L 4.3908 9.2358 126.3730 55.3453 43.5346 175.5315 66 A 5.0164 8.7270 125.8561 50.8910 23.2071 174.3853 67 M 5.3883 8.5889 120.0116 53.8207 34.5402 175.8288 68 D 5.2683 9.4328 126.6241 52.5354 41.0800 176.9185 69 T 4.0174 8.5841 112.9241 64.8311 67.2193 174.0055 70 D 4.8417 8.6735 119.7909 53.9876 41.1239 177.1875 71 G 3.3690 8.5749 107.2039 45.3509 0.0000 173.1696 72 L 4.7597 7.7739 119.9488 53.3928 43.2706 176.1702 73 L 4.9720 8.5866 123.9392 55.1648 42.6956 175.6340 74 Y 4.9946 9.2450 120.2324 55.9479 42.2637 173.5702 75 G 4.3019 8.9020 107.9355 44.9165 0.0000 173.1792 76 S 5.0299 9.0523 121.5613 56.8865 63.8511 175.3647 77 Q 3.9625 9.0160 125.6686 58.1863 28.9733 176.4266 78 T 4.7184 7.4936 105.8653 58.5122 71.8268 171.5711 79 P 3.4635 0.0000 0.0000 62.2937 31.9356 175.1925 80 N 4.9629 7.9934 118.1775 51.0541 40.7815 174.6024 81 E 3.9222 8.6669 114.8590 59.0842 29.7639 178.3209 82 E 4.1753 8.6678 118.5959 57.8755 29.7436 177.5136 83 C 4.8787 7.9035 115.1774 59.1684 29.1018 173.3911 84 L 4.6877 7.1537 120.4810 53.7906 42.8488 175.8513 85 F 5.3064 8.9373 121.1743 55.6493 43.6603 174.2253 86 L 4.7973 9.2977 123.1414 53.7737 42.6316 175.5291 87 E 4.5281 8.9637 127.0574 55.3529 30.1205 175.7664 88 R 4.8416 8.5406 125.4390 54.0280 34.6109 174.8588 89 L 4.7443 8.7694 123.8767 55.2602 43.1917 175.7848 90 E 4.7017 8.9649 123.8495 55.3341 33.6132 174.8701 91 E 3.9917 9.7473 123.7279 57.6840 27.3246 174.2440 92 N 4.3193 8.5071 110.7100 54.1265 36.5501 174.0399 93 H 4.8210 8.4944 116.5443 57.5938 37.1389 173.4052 94 Y 4.6983 7.7480 116.0693 57.3552 40.2182 173.7191 95 N 5.6123 9.5411 118.3554 51.9359 41.2995 174.5456 96 T 5.2723 8.7815 112.6259 60.1559 72.9437 172.6158 97 Y 5.0836 8.6891 119.3147 56.6391 41.5658 174.1570 98 I 4.6294 8.5355 126.1143 59.2721 39.4381 175.4276 99 S 4.0450 9.0171 122.7709 58.5416 62.4304 173.8728 100 K 3.9644 8.7193 129.4238 59.4004 32.2332 178.6620 101 K 3.7816 7.9335 118.0906 59.0014 32.3254 176.5959 102 H 4.5138 7.8362 115.3256 54.9616 29.5833 176.0325 103 A 3.9252 7.6739 125.5037 55.1528 18.3996 180.6410 104 E 3.8946 8.0378 115.5151 58.6824 29.7609 177.3904 105 K 4.3045 7.6201 115.6908 55.1869 32.6681 175.9175 106 N 3.8377 7.7050 115.4523 53.9621 36.4977 174.9920 107 W 4.8925 7.6861 117.5657 56.0317 30.8223 177.5542 108 F 5.4277 9.2423 124.3249 55.6585 40.7867 175.8466 109 V 4.0228 9.0619 121.5533 63.0658 32.6759 175.1980 110 G 4.4123 8.5452 112.0631 45.3347 0.0000 171.6159 111 L 5.2840 8.5102 122.6165 52.5377 44.9442 176.9701 112 K 4.1750 8.8362 123.1260 55.2526 33.0707 178.2583 113 K 3.8237 8.4727 119.9088 59.4688 31.9418 177.8751 114 N 4.5455 8.0443 113.6010 52.7785 37.6897 175.9016 115 G 3.5786 8.3212 109.0464 45.2378 0.0000 173.5292 116 S 4.7707 7.9426 114.7718 56.9254 64.6056 173.6496 117 C 4.7864 8.2944 119.6914 59.9381 28.7172 173.3612 118 K 4.3914 8.8100 121.4224 55.6578 33.1752 176.6851 119 R 4.0717 8.4971 123.2176 55.7895 31.3769 177.1436 120 G 3.2406 8.6483 115.4521 48.2993 0.0000 174.1710 121 P 4.1578 0.0000 0.0000 64.4597 31.4119 177.6399 122 R 4.2507 7.7651 115.4991 56.6781 30.3820 176.4171 123 T 5.1437 7.7175 108.2780 60.0323 70.7272 173.5943 124 H 4.7775 8.0004 114.7696 54.9118 30.5332 173.0781 125 Y 4.0268 8.8317 118.7608 60.1405 38.0725 177.0968 126 G 4.0909 9.0593 111.3672 45.4311 0.0000 173.7623 127 Q 4.3461 7.5310 118.7632 54.7790 30.1206 177.0190 128 K 3.8206 8.2661 119.2234 58.5737 32.8841 179.3137 129 A 4.0122 8.0964 121.3754 53.9901 18.2683 178.5351 130 I 4.4217 7.1620 105.6785 60.4973 38.5399 175.2686 131 L 4.3829 7.2840 123.3647 53.9635 42.6882 175.8130 132 F 5.5115 9.3839 122.2716 55.6094 43.5287 174.2764 133 L 5.2980 9.2611 120.7806 52.3979 44.9423 174.1023 134 P 5.0960 0.0000 0.0000 62.5918 32.0897 175.6490 135 L 4.8505 9.0955 125.3416 52.0592 44.4209 174.7008 136 P 4.6412 0.0000 0.0000 62.6367 32.3789 177.0716 137 V 3.7848 8.1505 114.0400 61.7621 31.6562 176.3570 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 1D H 8.44 4.74 0.00 3.08 3.39 0.00 5.82 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 8.01 4.85 0.00 3.26 3.27 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 9.12 4.60 0.00 3.33 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 F 8.39 4.86 0.00 2.86 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 N 8.35 4.66 0.00 2.97 2.80 0.00 0.00 6.89 6.74 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 3 L 8.03 4.76 0.00 1.47 1.41 0.62 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.55 0.00 2.18 2.10 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 5 P 0.00 4.41 0.00 2.16 2.10 0.00 3.84 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 6 G 8.63 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 7 N 8.04 4.62 0.00 2.64 2.68 0.00 0.00 5.87 7.55 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 8 Y 8.05 4.85 0.00 3.03 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.05 4.14 0.00 1.79 1.89 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.57 7.81 10 K 7.59 4.68 0.00 1.72 1.70 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.39 7.81 11 P 0.00 4.72 0.00 2.06 2.05 0.00 3.73 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 1.98 1.99 0.00 12 K 9.46 4.89 0.00 1.64 1.82 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.62 7.81 13 L 9.08 5.03 0.00 1.66 1.66 0.44 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.60 4.88 0.00 1.60 1.62 0.34 0.85 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 15 Y 9.18 4.68 0.00 3.32 3.17 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 16 C 8.51 4.10 0.00 2.54 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 17 S 8.08 3.49 0.00 3.81 3.49 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 18 N 8.21 3.87 0.00 2.52 2.43 0.00 0.00 6.85 7.98 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 19 G 7.89 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 20 G 7.82 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 H 7.40 4.59 0.00 3.02 3.19 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.89 5.23 0.00 3.04 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 23 L 8.95 4.52 0.00 1.82 1.52 0.95 0.29 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 24 R 9.50 4.85 0.00 1.90 2.06 0.00 3.25 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.79 0.00 25 I 8.22 4.82 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 0.89 0.00 0.00 26 L 8.64 4.10 0.00 1.89 1.51 0.91 0.75 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 27 P 0.00 4.17 0.00 2.00 2.13 0.00 3.50 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 28 D 7.96 4.54 0.00 2.79 2.77 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 29 G 8.47 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.28 4.30 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 1.22 0.00 0.00 31 V 7.96 4.94 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.95 0.00 0.00 32 D 8.58 4.58 0.00 2.98 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 33 G 8.67 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 34 T 8.80 4.99 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 1.36 0.00 0.00 35 R 8.82 4.23 0.00 1.85 1.96 0.00 3.18 0.00 0.00 3.06 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.35 0.00 36 D 8.09 4.60 0.00 2.85 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 37 R 8.66 3.77 0.00 1.86 1.89 0.00 3.48 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.86 0.00 38 S 8.30 4.44 0.00 3.95 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 39 D 7.83 4.40 0.00 2.82 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 40 Q 8.53 4.41 0.00 1.88 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.12 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 9.38 4.90 0.00 3.29 3.45 0.00 5.77 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.11 4.58 1.89 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.91 1.02 0.00 0.00 43 Q 7.76 4.27 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 44 L 9.01 5.24 0.00 1.57 1.43 0.82 0.68 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 Q 9.31 4.78 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 46 L 8.63 5.29 0.00 1.78 1.62 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.35 4.50 0.00 3.81 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.10 4.53 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 49 E 8.67 4.16 0.00 1.38 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 0.00 1.94 2.16 0.00 50 S 7.33 4.62 0.00 3.85 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 N 8.65 4.47 0.00 2.78 2.98 0.00 0.00 7.08 7.98 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 52 G 9.20 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 53 E 8.27 5.17 0.00 2.06 1.74 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 2.22 2.28 0.00 54 V 8.82 5.45 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 0.70 0.00 0.00 1.22 0.00 0.00 55 Y 7.92 5.59 0.00 3.01 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.55 4.65 1.70 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.82 0.67 0.00 0.00 57 K 8.70 4.79 0.00 1.31 1.37 0.00 1.38 0.00 0.00 1.20 0.00 0.00 2.13 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.00 0.87 7.81 58 S 8.71 4.61 0.00 3.88 3.64 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 59 T 8.59 3.93 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 1.21 0.00 0.00 60 E 8.35 4.06 0.00 1.95 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 2.17 2.32 0.00 61 T 8.21 4.34 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 1.26 0.00 0.00 62 G 8.15 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 0.00 0.00 0.00 63 Q 7.59 4.38 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 64 Y 9.18 4.66 0.00 2.80 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 65 L 9.24 4.39 0.00 1.60 1.48 0.81 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.73 5.02 0.57 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 67 M 8.59 5.39 0.00 2.27 2.27 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.74 0.00 68 D 9.43 5.27 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 69 T 8.58 4.02 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 1.27 0.00 0.00 70 D 8.67 4.84 0.00 2.69 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 71 G 8.57 3.37 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 0.00 72 L 7.77 4.76 0.00 1.87 1.64 0.91 0.61 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 73 L 8.59 4.97 0.00 1.58 1.63 0.92 0.97 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 74 Y 9.25 4.99 0.00 2.95 3.02 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 75 G 8.90 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 76 S 9.05 5.03 0.00 3.82 3.72 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 77 Q 9.02 3.96 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 78 T 7.49 4.72 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 1.22 0.00 0.00 79 P 0.00 3.46 0.00 1.51 0.49 0.00 3.50 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 80 N 7.99 4.96 0.00 2.89 2.89 0.00 0.00 6.02 7.66 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 81 E 8.67 3.92 0.00 2.07 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 0.00 2.33 2.24 0.00 82 E 8.67 4.18 0.00 2.32 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 0.00 2.39 2.34 0.00 83 C 7.90 4.88 0.00 3.12 3.12 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 84 L 7.15 4.69 0.00 1.55 1.43 0.82 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.94 5.31 0.00 3.09 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 L 9.30 4.80 0.00 1.56 1.63 0.89 1.03 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 87 E 8.96 4.53 0.00 2.17 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 2.21 1.93 0.00 88 R 8.54 4.84 0.00 1.83 1.85 0.00 3.14 0.00 0.00 2.90 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 89 L 8.77 4.74 0.00 1.50 1.61 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.96 4.70 0.00 2.25 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 91 E 9.75 3.99 0.00 2.40 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 92 N 8.51 4.32 0.00 2.83 2.88 0.00 0.00 6.86 8.16 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 93 H 8.49 4.82 0.00 2.83 2.90 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.75 4.70 0.00 3.00 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 95 N 9.54 5.61 0.00 3.00 2.58 0.00 0.00 6.94 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 96 T 8.78 5.27 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 97 Y 8.69 5.08 0.00 2.79 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 98 I 8.54 4.63 1.74 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.19 0.66 0.64 0.00 0.00 99 S 9.02 4.04 0.00 4.06 4.08 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 0.00 0.00 0.00 100 K 8.72 3.96 0.00 1.73 1.69 0.00 1.63 0.00 0.00 1.48 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.32 7.81 101 K 7.93 3.78 0.00 1.73 1.66 0.00 1.48 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.27 1.03 7.81 102 H 7.84 4.51 0.00 2.98 2.04 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.67 3.93 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 0.00 104 E 8.04 3.89 0.00 1.82 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 2.22 2.26 0.00 105 K 7.62 4.30 0.00 1.07 1.74 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.48 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.19 7.81 106 N 7.70 3.84 0.00 2.98 2.90 0.00 0.00 6.88 7.09 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 0.00 107 W 7.69 4.89 0.00 3.29 3.08 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 0.00 0.00 0.00 108 F 9.24 5.43 0.00 2.87 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 0.00 109 V 9.06 4.02 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 0.64 0.00 0.00 0.53 0.00 0.00 110 G 8.55 4.41 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 0.00 111 L 8.51 5.28 0.00 1.45 1.43 1.02 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.84 4.18 0.00 1.96 1.66 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.35 7.81 113 K 8.47 3.82 0.00 1.70 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.45 7.81 114 N 8.04 4.55 0.00 2.78 2.89 0.00 0.00 6.19 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 0.00 115 G 8.32 3.58 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 0.00 0.00 0.00 0.00 116 S 7.94 4.77 0.00 4.00 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 0.00 117 C 8.29 4.79 0.00 2.88 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 0.00 118 K 8.81 4.39 0.00 1.58 1.68 0.00 1.61 0.00 0.00 1.57 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.33 7.81 119 R 8.50 4.07 0.00 1.79 1.62 0.00 3.23 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.48 0.00 120 G 8.65 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 0.00 0.00 0.00 121 P 0.00 4.16 0.00 1.89 2.15 0.00 2.97 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 122 R 7.77 4.25 0.00 1.84 1.93 0.00 3.29 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 123 T 7.72 5.14 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 124 H 8.00 4.78 0.00 3.39 3.52 0.00 5.48 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.83 4.03 0.00 3.13 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 0.00 126 G 9.06 4.09 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 0.00 127 Q 7.53 4.35 0.00 1.84 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.76 0.00 0.00 0.00 0.00 0.00 2.16 2.09 0.00 128 K 8.27 3.82 0.00 1.77 1.63 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.32 7.81 129 A 8.10 4.01 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.16 4.42 1.58 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.89 0.58 0.00 0.00 131 L 7.28 4.38 0.00 0.97 0.65 0.24 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.38 5.51 0.00 3.35 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 0.00 133 L 9.26 5.30 0.00 1.94 1.71 0.90 1.60 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 0.00 134 P 0.00 5.10 0.00 2.16 2.22 0.00 3.84 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 135 L 9.10 4.85 0.00 1.68 1.64 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.64 0.00 1.93 1.98 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 137 V 8.15 3.78 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 0.68 0.00 0.00 0.91 0.00 0.00