NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4724 8.3049 118.7929 53.6866 33.1503 174.9054 2 N 4.0854 8.7756 118.5578 53.0081 39.2769 173.4896 3 K 4.4612 8.8435 121.6895 56.3827 34.8665 175.2135 4 K 5.0129 9.5698 124.7727 54.8227 34.6720 174.7011 5 I 4.7796 8.9046 128.4773 59.4007 40.0306 174.2301 6 L 4.7797 8.6474 129.6059 53.9006 43.4650 175.0567 7 V 4.6539 8.7421 127.3829 61.1494 34.0336 174.5421 8 V 5.1521 8.6215 127.1076 60.4408 34.3011 173.4824 9 D 5.1192 8.3885 126.4037 53.2537 44.3232 175.3719 10 D 4.6932 8.9723 124.8597 54.1644 40.5768 177.0422 11 E 4.5156 8.9019 124.4160 57.4584 30.8112 182.6164 12 E 4.2411 8.7669 125.1225 60.2249 29.9055 175.6230 13 S 4.3097 8.0588 114.8133 61.5089 62.9108 176.6940 14 I 3.7279 7.6587 122.8402 64.0126 36.8738 178.3847 15 V 3.6258 7.7317 118.7851 66.2855 31.3292 178.1616 16 T 3.9492 8.3907 118.2770 67.1580 68.3064 177.0603 17 L 4.0805 7.9235 124.1221 59.6546 40.8775 181.2331 18 L 4.3170 8.1523 120.2404 57.5641 41.5557 179.4772 19 Q 3.9596 8.4410 119.7887 59.2634 29.0263 177.5042 20 Y 4.1155 8.2389 120.5723 61.0379 38.8572 178.0272 21 N 4.2190 8.3896 117.2744 56.2657 38.6896 177.5754 22 L 4.2346 8.2949 120.6599 57.7279 41.6970 179.3588 23 E 4.5156 8.3695 120.1462 58.9356 29.1634 179.2975 24 R 3.7671 7.5467 117.8189 59.2676 30.1753 177.9581 25 S 4.3900 7.6994 112.1864 58.7614 62.9411 174.7504 26 G 3.7336 7.9816 110.2283 45.4795 0.0000 172.9096 27 Y 4.9163 7.7528 116.4783 56.1475 40.8907 174.7211 28 D 4.9563 8.9317 121.8094 53.7373 42.7356 175.7883 29 V 5.0421 8.3616 121.6000 61.0575 34.4112 174.4569 30 I 4.8648 8.7486 120.5362 59.3168 40.9165 174.3080 31 T 5.3236 8.3624 111.7727 60.2514 72.1825 172.6783 32 A 5.1400 9.0137 123.4101 50.6491 23.2197 176.8889 33 S 4.9645 9.6965 112.9661 57.1736 64.1929 173.2306 34 D 4.8654 7.4750 120.4569 51.4603 43.3090 176.0447 35 G 3.9974 8.9126 110.5364 47.5165 0.0000 176.8371 36 E 3.9712 8.1851 120.3330 61.0982 29.8314 182.7017 37 E 4.0850 8.8933 121.0282 58.9363 29.6845 178.7230 38 A 3.8939 8.0052 120.7167 55.1770 18.4903 179.3979 39 L 3.8465 8.0221 118.8822 57.9542 42.1291 179.1476 40 K 3.9212 7.9704 119.4744 59.5524 32.1870 179.0385 41 K 4.0522 8.5302 120.0920 58.6461 31.3905 179.2998 42 A 3.6895 8.0034 121.0720 55.2276 18.0915 179.5827 43 E 4.0625 8.0345 115.9729 59.2854 29.2394 179.1087 44 T 4.2630 8.0135 109.3295 63.9318 69.4701 176.3356 45 E 4.2933 8.5124 118.8913 54.9032 31.3297 176.4085 46 K 4.1013 7.5785 116.0431 56.7828 29.8606 172.5494 47 P 4.5509 0.0000 0.0000 62.7375 32.4451 177.2239 48 D 4.6780 8.7446 119.5332 56.7485 41.5027 176.5478 49 L 4.7336 7.6713 118.6475 53.8668 45.9230 173.6951 50 I 4.7455 8.7524 126.0526 59.4746 40.2082 174.5533 51 V 4.5151 8.6489 127.9657 61.2706 33.0975 174.2568 52 L 4.8311 8.7258 130.7693 52.8701 44.7975 175.0523 53 D 4.7282 8.6552 127.1812 54.5519 41.5200 176.2616 54 V 3.5874 8.7233 126.6519 66.2268 32.5644 175.9715 55 M 4.6509 7.9914 123.7353 54.0370 31.3968 175.3351 56 L 4.8397 7.9774 123.5142 51.7340 45.6517 175.1635 57 P 4.4638 0.0000 0.0000 63.7901 32.1984 176.4037 58 K 4.2073 8.9557 122.8300 56.3727 30.4273 176.6192 59 L 4.6744 7.2710 116.5917 52.1388 45.1314 176.5865 60 D 5.3781 8.0104 125.2769 51.6518 42.2630 177.3887 61 G 3.5723 8.6896 105.8067 48.0454 0.0000 175.8687 62 I 3.8181 7.7914 121.7242 64.2081 37.1304 178.0245 63 E 3.9342 8.5134 120.1395 59.0375 29.4826 178.7811 64 V 3.5597 8.0198 118.6002 66.4027 31.5130 177.7820 65 C 4.1436 8.1542 116.2294 62.6813 27.9576 176.0379 66 K 3.9388 8.4087 121.5043 59.7489 31.8761 178.9323 67 Q 4.0373 8.3721 118.4417 58.7730 28.5807 178.6067 68 L 4.0569 8.1037 120.1560 57.8471 41.6609 179.5083 69 R 3.9057 8.2740 118.8009 59.5157 29.7928 178.3127 70 Q 3.9957 8.0825 118.3906 59.0239 29.1229 177.4394 71 Q 4.2559 7.6977 115.7618 55.4224 28.9408 176.2766 72 K 3.9828 7.8105 118.4037 57.1120 30.1199 175.4221 73 L 4.3042 7.9084 118.9197 53.8284 42.5160 176.0179 74 M 4.6391 8.1787 122.0430 53.6678 34.0988 174.5667 75 F 4.8554 8.4855 123.9941 54.6648 42.7338 173.0599 76 P 4.6903 0.0000 0.0000 62.8175 32.4610 175.3235 77 I 4.8565 9.0824 125.0369 59.3687 41.0186 174.0272 78 L 4.6966 8.8808 130.0771 53.5989 43.5807 175.0861 79 M 4.6639 8.3536 127.1895 54.6509 33.8360 175.3270 80 L 5.1858 8.6741 123.5008 53.2125 44.2109 175.6877 81 T 5.0316 8.7942 113.4938 59.6955 72.3487 173.6099 82 A 4.7786 8.5599 126.9894 51.3094 20.7531 177.6302 83 K 4.1101 8.7445 123.2474 56.8522 32.0971 177.1061 84 D 4.5415 8.9499 123.3463 54.2007 37.1935 172.6408 85 E 4.6752 7.8189 118.8050 54.7907 30.1862 178.3064 86 E 4.2719 8.3606 120.2268 55.2644 30.7984 176.0556 87 F 4.6887 8.4205 123.8538 55.5986 41.9691 175.3344 88 D 4.3386 7.1163 125.8876 53.4325 41.3951 177.1891 89 K 4.0613 8.2954 127.6527 58.6539 32.1512 179.4656 90 V 3.6356 7.9193 119.4302 65.6236 31.4414 177.6752 91 L 4.0352 8.0934 119.8508 58.1011 41.9762 178.7788 92 G 4.7184 8.3192 107.1553 47.4693 0.0000 175.2985 93 L 4.0686 8.2409 122.5604 57.9456 41.8944 178.7212 94 E 4.0236 7.8975 117.2488 59.3072 29.5343 178.6041 95 L 4.4218 7.7806 116.0747 54.8147 42.0967 177.7826 96 G 3.9113 7.8723 107.2997 45.0242 0.0000 173.7890 97 A 4.0634 7.9020 122.4983 52.2438 18.8193 177.5576 98 D 4.7928 8.3614 120.8892 55.3781 42.9030 175.7060 99 D 4.5480 7.0617 115.8661 53.7779 45.1009 173.4979 100 Y 5.0794 8.2253 117.2129 56.4261 42.5422 174.2718 101 M 5.1937 9.1229 122.4291 54.1240 35.9353 174.1555 102 T 5.0187 8.6599 115.3751 60.6006 71.2338 173.7302 103 K 4.9946 8.6702 122.9195 54.0985 33.9450 174.9853 104 P 4.4565 0.0000 0.0000 62.4236 32.3088 175.3265 105 F 5.0111 7.3977 113.1795 54.3933 41.1904 174.7985 106 S 4.6821 8.4612 116.7512 56.7471 65.9640 173.3144 107 P 4.3800 0.0000 0.0000 66.2206 31.0772 179.2663 108 R 4.0445 8.0303 116.1571 58.8304 29.9787 178.6197 109 E 3.9525 8.2909 119.6748 59.2903 29.6724 179.2650 110 V 3.5014 7.8371 119.1602 64.8611 31.4164 177.9427 111 N 4.3321 8.3336 116.9810 56.0055 38.4112 177.2358 112 A 4.0277 8.2179 122.1454 55.2607 18.5037 179.9727 113 R 3.8641 8.1417 116.6980 59.3011 30.0366 179.5045 114 V 3.4816 7.9607 118.2804 65.6536 31.4854 177.9488 115 K 3.9536 8.2162 119.1912 59.5475 32.0766 178.5929 116 A 4.0060 8.0749 120.9419 55.2559 18.0681 179.7222 117 I 3.6585 7.5528 117.2363 64.5666 37.2756 178.5025 118 L 4.1276 7.9774 118.8400 57.5049 41.5249 179.2674 119 R 4.0791 7.9766 119.0829 59.2408 29.9106 178.3223 120 R 4.1405 7.9023 116.3152 57.8590 30.0869 176.8294 121 S 4.2471 7.5779 118.7638 58.3431 63.2112 173.6983 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.47 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.14 0.00 2 N 8.78 4.09 0.00 2.95 2.86 0.00 0.00 7.01 6.73 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 3 K 8.84 4.46 0.00 1.99 1.84 0.00 1.69 0.00 0.00 1.91 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.61 1.51 7.81 4 K 9.57 5.01 0.00 1.80 1.67 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.40 7.81 5 I 8.90 4.78 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 0.84 0.33 0.80 0.00 0.00 6 L 8.65 4.78 0.00 1.67 1.40 0.92 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.74 4.65 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 0.95 0.00 0.00 0.88 0.00 0.00 8 V 8.62 5.15 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 0.93 0.00 0.00 0.85 0.00 0.00 9 D 8.39 5.12 0.00 2.73 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 10 D 8.97 4.69 0.00 2.80 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.90 4.52 0.00 1.97 1.88 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 2.19 2.18 0.00 12 E 8.77 4.24 0.00 1.97 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 2.31 1.94 0.00 13 S 8.06 4.31 0.00 4.01 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 14 I 7.66 3.73 2.05 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 1.52 0.94 1.07 0.00 0.00 15 V 7.73 3.63 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 1.14 0.00 0.00 0.97 0.00 0.00 16 T 8.39 3.95 4.38 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 0.00 0.00 1.21 0.00 0.00 17 L 7.92 4.08 0.00 1.67 1.68 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.15 4.32 0.00 1.96 1.79 0.99 0.87 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 19 Q 8.44 3.96 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 20 Y 8.24 4.12 0.00 3.15 3.18 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 21 N 8.39 4.22 0.00 3.01 2.91 0.00 0.00 7.13 6.37 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 22 L 8.29 4.23 0.00 1.80 1.82 0.84 1.02 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 23 E 8.37 4.52 0.00 2.08 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 2.50 2.31 0.00 24 R 7.55 3.77 0.00 1.43 1.89 0.00 2.94 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 25 S 7.70 4.39 0.00 4.11 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 26 G 7.98 3.73 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 0.00 0.00 0.00 27 Y 7.75 4.92 0.00 3.10 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 28 D 8.93 4.96 0.00 2.64 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 29 V 8.36 5.04 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 0.97 0.00 0.00 30 I 8.75 4.86 1.86 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 1.27 1.15 0.91 0.00 0.00 31 T 8.36 5.32 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 1.22 0.00 0.00 32 A 9.01 5.14 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 9.70 4.96 0.00 3.96 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 34 D 7.48 4.87 0.00 3.06 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 35 G 8.91 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.19 3.97 0.00 1.99 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 2.31 1.93 0.00 37 E 8.89 4.08 0.00 1.98 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 0.00 2.28 2.32 0.00 38 A 8.01 3.89 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 39 L 8.02 3.85 0.00 1.86 1.81 0.91 0.33 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 40 K 7.97 3.92 0.00 2.03 1.92 0.00 1.58 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.51 7.81 41 K 8.53 4.05 0.00 1.77 1.79 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.43 7.81 42 A 8.00 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.03 4.06 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 2.51 2.46 0.00 44 T 8.01 4.26 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 1.29 0.00 0.00 45 E 8.51 4.29 0.00 1.97 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 2.37 2.47 0.00 46 K 7.58 4.10 0.00 1.91 1.88 0.00 2.09 0.00 0.00 2.16 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.55 7.81 47 P 0.00 4.55 0.00 2.32 2.02 0.00 3.95 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 48 D 8.74 4.68 0.00 2.71 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 49 L 7.67 4.73 0.00 1.63 1.33 0.82 0.85 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 50 I 8.75 4.75 1.73 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.24 0.80 0.00 0.00 51 V 8.65 4.52 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 0.84 0.00 0.00 0.78 0.00 0.00 52 L 8.73 4.83 0.00 1.61 1.33 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.66 4.73 0.00 2.87 2.53 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 0.00 54 V 8.72 3.59 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 1.04 0.00 0.00 0.56 0.00 0.00 55 M 7.99 4.65 0.00 2.06 2.05 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 2.60 2.53 0.00 56 L 7.98 4.84 0.00 1.64 1.66 0.89 0.97 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 57 P 0.00 4.46 0.00 2.21 2.17 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 58 K 8.96 4.21 0.00 1.95 2.06 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.44 7.81 59 L 7.27 4.67 0.00 1.63 1.50 0.92 0.98 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 60 D 8.01 5.38 0.00 3.18 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 61 G 8.69 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 0.00 0.00 0.00 62 I 7.79 3.82 2.10 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.95 0.98 0.00 0.00 63 E 8.51 3.93 0.00 2.21 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 2.31 2.36 0.00 64 V 8.02 3.56 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 0.92 0.00 0.00 1.01 0.00 0.00 65 C 8.15 4.14 0.00 3.20 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.41 3.94 0.00 1.99 1.97 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 67 Q 8.37 4.04 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 68 L 8.10 4.06 0.00 1.92 1.86 0.89 0.72 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 69 R 8.27 3.91 0.00 1.99 2.14 0.00 3.12 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 70 Q 8.08 4.00 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 71 Q 7.70 4.26 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.28 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 72 K 7.81 3.98 0.00 1.91 1.93 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.54 7.81 73 L 7.91 4.30 0.00 1.89 1.66 1.07 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 74 M 8.18 4.64 0.00 1.80 1.85 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 2.43 2.45 0.00 75 F 8.49 4.86 0.00 2.96 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 76 P 0.00 4.69 0.00 2.07 1.97 0.00 3.76 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 2.27 2.12 0.00 77 I 9.08 4.86 1.80 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.06 0.78 0.00 0.00 78 L 8.88 4.70 0.00 1.55 1.37 0.76 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 79 M 8.35 4.66 0.00 1.64 1.58 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 80 L 8.67 5.19 0.00 1.52 1.56 0.96 0.09 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 81 T 8.79 5.03 4.46 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 1.23 0.00 0.00 82 A 8.56 4.78 1.29 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 0.00 0.00 0.00 83 K 8.74 4.11 0.00 1.79 1.62 0.00 1.96 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.01 7.81 84 D 8.95 4.54 0.00 2.82 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 85 E 7.82 4.68 0.00 1.94 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 2.14 2.07 0.00 86 E 8.36 4.27 0.00 1.98 1.77 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 2.23 1.87 0.00 87 F 8.42 4.69 0.00 2.95 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 88 D 7.12 4.34 0.00 2.47 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 0.00 0.00 0.00 89 K 8.30 4.06 0.00 1.67 1.65 0.00 1.46 0.00 0.00 1.24 0.00 0.00 2.15 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 1.26 7.81 90 V 7.92 3.64 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 0.99 0.00 0.00 0.91 0.00 0.00 91 L 8.09 4.04 0.00 1.68 1.65 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 92 G 8.32 4.72 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 0.00 0.00 0.00 93 L 8.24 4.07 0.00 1.98 1.90 0.97 0.79 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 94 E 7.90 4.02 0.00 2.19 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 2.37 2.61 0.00 95 L 7.78 4.42 0.00 1.93 1.78 1.12 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 96 G 7.87 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 0.00 0.00 0.00 97 A 7.90 4.06 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 8.36 4.79 0.00 2.58 2.67 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 99 D 7.06 4.55 0.00 2.68 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 0.00 0.00 0.00 0.00 100 Y 8.23 5.08 0.00 2.97 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 0.00 101 M 9.12 5.19 0.00 1.80 1.68 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.28 0.00 102 T 8.66 5.02 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 1.26 0.00 0.00 103 K 8.67 4.99 0.00 1.71 1.82 0.00 1.79 0.00 0.00 1.95 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.80 1.54 7.81 104 P 0.00 4.46 0.00 2.09 1.96 0.00 3.73 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 1.98 1.93 0.00 105 F 7.40 5.01 0.00 3.16 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 S 8.46 4.68 0.00 4.11 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 0.00 107 P 0.00 4.38 0.00 2.25 2.44 0.00 3.64 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 2.18 2.27 0.00 108 R 8.03 4.04 0.00 1.89 2.01 0.00 3.16 0.00 0.00 3.29 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 109 E 8.29 3.95 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 110 V 7.84 3.50 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 0.94 0.00 0.00 0.74 0.00 0.00 111 N 8.33 4.33 0.00 2.99 2.97 0.00 0.00 6.91 6.92 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 0.00 112 A 8.22 4.03 1.39 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 0.00 113 R 8.14 3.86 0.00 1.79 1.92 0.00 3.04 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 114 V 7.96 3.48 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 0.67 0.00 0.00 0.78 0.00 0.00 115 K 8.22 3.95 0.00 2.02 2.02 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.51 7.81 116 A 8.07 4.01 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 I 7.55 3.66 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.62 0.87 0.00 0.00 118 L 7.98 4.13 0.00 1.77 1.78 0.96 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.98 4.08 0.00 2.07 2.07 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 120 R 7.90 4.14 0.00 1.99 1.98 0.00 3.16 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.97 0.00 121 S 7.58 4.25 0.00 3.86 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