NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0580 8.0544 120.3141 61.7007 32.7474 174.2018 2 H 4.4793 8.6337 121.6602 54.5258 30.8386 172.7714 3 L 4.6176 8.0077 126.3789 52.6108 44.8708 175.8227 4 T 3.9249 8.2381 117.9461 61.1977 68.0999 173.0560 5 P 4.2636 0.0000 0.0000 66.0440 30.7546 178.8660 6 K 3.9418 7.9970 117.8375 59.4126 31.9366 178.9146 7 E 3.9171 8.0794 118.7623 59.3059 28.9579 179.3594 8 K 3.8336 7.9321 119.0827 59.2930 32.0872 178.9861 9 S 4.1129 8.0641 115.5235 61.4375 62.8032 176.4479 10 A 3.9884 7.7204 123.3758 55.3266 18.0295 180.1088 11 V 3.6078 8.0311 111.5336 64.6662 31.3923 178.9766 12 T 4.0041 7.6859 108.2677 64.6117 68.2575 176.7101 13 A 4.0245 7.8721 123.5324 55.0038 18.1971 179.6647 14 L 3.7121 7.9665 116.4552 57.4966 41.5724 179.1721 15 W 4.5289 8.5210 127.8651 59.6024 30.4329 178.3919 16 G 3.7423 7.8015 105.2268 47.5441 0.0000 174.5131 17 K 4.4399 7.5209 117.2972 56.2662 32.1533 176.9303 18 V 3.9433 7.0611 119.2043 60.3660 32.6261 175.9917 19 N 4.4588 8.2681 121.9728 53.0214 37.6911 175.5838 20 V 3.9980 7.8674 129.7201 62.5960 31.3924 176.4389 21 D 4.7991 7.6650 116.2214 53.8193 45.8814 176.0599 22 E 4.4648 8.3371 116.4460 57.7911 31.8197 178.5008 23 V 3.5128 7.7886 111.6280 64.4633 31.2952 178.8559 24 G 3.6646 7.9451 105.0813 47.6033 0.0000 175.5283 25 G 3.8058 8.0165 106.5925 46.0874 0.0000 175.3719 26 E 4.0458 7.8236 120.3999 58.6102 29.7451 178.4427 27 A 3.8684 7.8295 120.8497 55.2406 18.7003 179.5980 28 L 4.0336 7.9697 118.9037 57.9987 41.6765 179.3855 29 G 3.6008 7.7256 106.1038 47.5927 0.0000 175.8488 30 R 4.0368 8.1820 119.8219 58.1195 30.0549 178.7399 31 L 4.1131 7.6504 120.9874 57.8739 41.6705 178.2325 32 L 4.2223 7.5602 116.4832 55.7576 41.5280 178.5887 33 V 3.8403 6.6540 118.0645 64.8895 32.3262 177.5419 34 V 3.5082 7.3729 116.5487 64.3666 32.7354 175.6254 35 Y 3.9151 6.8123 116.2343 54.8149 37.5542 174.2981 36 P 4.6634 0.0000 0.0000 63.0078 32.2202 178.5215 37 W 4.4637 7.8207 116.6280 59.4132 28.1248 178.0601 38 T 4.3191 7.5497 116.4916 65.9934 67.7946 176.3194 39 Q 4.2522 7.9736 120.3416 58.5608 28.3900 178.4810 40 R 3.8870 7.8952 120.0490 59.4273 30.1420 177.3563 41 F 4.0900 8.0988 113.4087 58.4192 39.2788 175.5621 42 F 4.8044 7.6253 118.5686 55.9804 38.8342 174.5587 43 E 4.2939 8.0056 122.6506 58.6241 30.3697 178.4606 44 S 5.1679 8.2155 111.9268 58.6683 63.1510 174.4237 45 F 4.7833 8.3899 117.2633 57.0749 41.1385 177.4751 46 G 3.8108 7.6678 109.0026 45.7936 0.0000 175.1987 47 D 4.4011 8.8214 125.8612 54.9022 41.1159 176.0456 48 L 4.8214 8.3523 124.5741 54.8529 44.0999 177.6053 49 S 4.2417 8.4737 115.5813 61.1771 63.2844 175.1373 50 T 4.6380 7.4644 111.7964 58.4252 72.3305 173.2715 51 P 4.2891 0.0000 0.0000 65.9515 31.2150 178.4222 52 D 4.3211 8.0428 118.5024 56.9889 40.9549 178.2585 53 A 3.9691 7.7794 121.4512 55.0474 18.2037 179.7766 54 V 3.5276 7.3702 115.0610 66.5338 31.7177 177.9057 55 M 4.2795 7.7826 116.9959 58.3501 31.9655 178.7524 56 G 3.7952 7.9966 103.6748 45.2792 0.0000 173.4133 57 N 4.3388 7.6532 120.9865 53.0972 39.5477 173.7158 58 P 4.2925 0.0000 0.0000 66.0310 31.3712 178.7386 59 K 3.7463 7.8019 117.6977 58.8354 31.8338 179.3688 60 V 3.7594 7.6342 118.3559 65.9740 31.4790 178.1342 61 K 4.0230 7.8138 116.9717 59.0724 31.9574 179.2799 62 A 3.9351 8.0726 121.1341 55.6161 18.4487 179.2627 63 H 4.4934 9.0356 117.0633 59.3335 29.9799 177.6940 64 G 3.6864 8.2819 107.7530 47.5719 0.0000 175.6177 65 K 4.0883 8.0142 121.6186 59.2391 32.2156 179.1975 66 K 4.0668 7.8229 118.2759 59.4104 31.6013 179.5532 67 V 3.7127 8.0265 118.6843 65.8936 31.5590 177.8801 68 L 4.6368 8.4231 120.3099 57.9531 42.0051 179.0801 69 G 3.7957 8.6007 105.8946 47.3232 0.0000 175.7242 70 A 4.1018 7.9458 122.8724 55.1409 18.3384 179.7770 71 F 4.1499 8.1318 115.9444 60.7445 38.8053 177.9824 72 S 4.0315 8.1710 113.6063 61.6379 62.9840 176.0444 73 D 4.5692 8.1101 120.1302 57.5204 39.7026 178.7066 74 G 3.7986 8.0405 105.2750 47.4065 0.0000 175.6077 75 L 4.0954 7.8933 120.5413 57.1230 41.5441 179.0450 76 A 4.0810 7.6085 119.9050 54.5147 20.0109 178.8185 77 H 4.6852 7.3707 113.6157 54.5737 25.3692 175.5615 78 L 4.3967 7.2920 118.4023 55.4186 42.4456 176.1950 79 D 4.6821 7.6585 118.0308 55.4727 42.5784 176.5842 80 N 5.0519 7.5136 116.6394 51.1215 39.5794 174.1192 81 L 4.3309 7.9719 123.9728 56.6368 41.9652 178.6460 82 K 4.0572 8.1628 117.6584 59.4756 32.2988 179.0724 83 G 3.6716 8.0616 105.8749 47.9482 0.0000 175.9418 84 T 3.6798 7.3996 111.4350 63.6969 68.4194 175.3353 85 F 4.7469 7.6405 117.7891 57.0877 39.0216 177.2732 86 A 3.9764 7.8633 122.3022 55.0001 17.7980 179.6446 87 T 3.9910 7.7070 111.1267 64.8419 67.8296 176.6487 88 L 4.1550 7.7786 120.7138 57.8088 41.6936 179.4876 89 S 4.3073 8.5232 114.6280 61.4244 62.3030 176.4719 90 E 3.9402 7.6894 119.0734 58.9580 29.1490 179.0348 91 L 3.8608 7.5278 118.9036 58.6244 42.1948 178.8500 92 H 4.3431 8.2604 116.0926 59.2731 28.7743 176.4542 93 C 4.2141 8.9195 119.3725 61.4352 27.4391 174.4646 94 D 4.3691 6.5363 122.3782 55.9542 40.8091 176.4112 95 K 4.2283 7.5526 118.5134 57.7663 34.0486 177.4678 96 L 3.9427 8.5765 120.5932 55.8100 42.8656 176.2577 97 H 4.2776 7.2044 114.9600 57.2857 26.5539 175.3113 98 V 4.1369 8.2864 118.0558 61.1067 32.6405 174.9176 99 D 4.3786 8.6332 127.4347 53.6416 41.7494 175.0010 100 P 3.5980 0.0000 0.0000 65.4274 31.2193 178.1461 101 E 3.9515 7.9934 118.1507 59.0285 29.4357 178.3763 102 N 4.3895 7.8845 116.4289 55.7160 38.1561 177.2443 103 F 4.6220 7.6361 119.5756 60.3402 39.1707 178.0115 104 R 4.1269 7.9835 117.5407 59.0159 29.9986 178.8279 105 L 3.9915 7.9240 118.9234 57.6133 41.5982 179.2748 106 L 4.1188 8.2272 120.5289 58.1429 41.9510 179.1167 107 G 3.7969 8.0653 103.6360 46.8944 0.0000 174.7124 108 N 4.7455 7.6763 117.0972 55.0651 39.1521 177.6616 109 V 3.7462 7.8494 114.0443 63.7798 31.5433 178.3471 110 L 3.7824 7.8954 120.4497 58.1449 41.9811 179.1830 111 V 3.4805 7.3762 116.7318 66.1330 31.2907 177.8331 112 C 4.1030 7.8722 116.5766 62.6201 27.9222 176.1930 113 V 3.4385 7.8825 120.3070 65.7577 30.9805 178.1117 114 L 3.4880 7.8421 119.0073 57.3761 41.2944 179.3944 115 A 3.6860 6.9847 120.2254 55.2058 18.0875 179.1011 116 H 4.0469 7.9342 115.9571 59.7303 29.9630 176.8867 117 H 4.0479 7.8934 116.9464 58.2450 28.9627 177.0832 118 F 4.8567 8.2947 118.3797 55.3900 39.6174 178.3152 119 G 3.8559 8.7003 108.0056 46.2819 0.0000 176.8225 120 K 4.1442 9.1882 124.7209 58.9504 32.4291 176.9779 121 E 4.0909 8.2072 118.2051 59.3439 29.4089 177.5669 122 F 4.5418 7.7516 120.9504 57.7620 37.7606 175.1813 123 T 4.3875 7.7083 116.8419 59.5109 71.6570 173.4481 124 P 4.1340 0.0000 0.0000 65.8032 31.0326 177.1329 125 P 4.2347 0.0000 0.0000 65.0393 31.3436 178.8296 126 V 3.5886 7.1342 117.0884 65.6140 31.2991 177.9494 127 Q 3.4203 7.8176 119.2819 58.9997 27.5649 177.7761 128 A 3.9410 8.1197 121.6692 54.9595 18.0915 179.2794 129 A 4.2074 7.6712 118.5435 55.0568 19.2803 179.3279 130 Y 4.0010 8.0136 114.8035 60.7885 37.8633 178.9175 131 Q 4.0825 8.4439 119.7721 58.9796 29.0322 178.5940 132 K 4.0213 7.5589 117.1942 59.5663 31.9993 179.2637 133 V 3.6009 7.6385 118.9973 65.9794 31.4571 178.5025 134 V 3.8765 8.2016 112.0139 64.1878 31.4433 178.5847 135 A 4.2056 8.2984 121.0607 54.8962 18.2393 179.8911 136 G 3.6681 7.9717 103.9820 47.7291 0.0000 176.2410 137 V 3.0873 7.8934 120.3607 65.4738 31.6033 178.0959 138 A 3.8505 7.6188 120.2419 55.3067 18.1291 179.4131 139 N 4.4158 8.5296 113.3460 55.5645 38.5965 176.6645 140 A 4.4363 7.5787 122.1399 53.7409 19.3887 178.6890 141 L 3.8373 7.6789 117.2814 56.5365 42.3329 177.7471 142 A 4.9987 7.5928 119.0581 52.4384 19.1854 177.6322 143 H 4.1552 7.9053 120.7575 59.3400 30.2554 175.8782 144 K 4.6639 7.8087 118.5774 55.6816 32.3406 175.4382 145 Y 5.2387 7.7768 119.2086 59.1907 46.0090 173.1974 146 H 4.3492 8.3986 123.3631 56.3634 29.8689 174.4873 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 V 8.05 4.06 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 0.93 0.00 0.00 0.94 0.00 0.00 2 H 8.63 4.48 0.00 3.16 3.24 0.00 5.89 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.01 4.62 0.00 1.51 1.44 0.77 0.85 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 4 T 8.24 3.92 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 1.22 0.00 0.00 5 P 0.00 4.26 0.00 2.28 2.30 0.00 3.75 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 6 K 8.00 3.94 0.00 1.84 1.88 0.00 1.54 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.58 7.81 7 E 8.08 3.92 0.00 2.19 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 8 K 7.93 3.83 0.00 1.77 1.87 0.00 1.50 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.54 7.81 9 S 8.06 4.11 0.00 4.08 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.72 3.99 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 11 V 8.03 3.61 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 0.75 0.00 0.00 0.79 0.00 0.00 12 T 7.69 4.00 4.27 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 1.18 0.00 0.00 13 A 7.87 4.02 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 14 L 7.97 3.71 0.00 2.20 1.92 0.74 0.78 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 15 W 8.52 4.53 0.00 3.70 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 G 7.80 3.74 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 0.00 0.00 0.00 17 K 7.52 4.44 0.00 1.85 2.02 0.00 1.54 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.51 7.81 18 V 7.06 3.94 1.78 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 -0.13 0.00 0.00 0.56 0.00 0.00 19 N 8.27 4.46 0.00 2.67 2.67 0.00 0.00 6.85 7.71 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 20 V 7.87 4.00 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 0.88 0.00 0.00 0.90 0.00 0.00 21 D 7.66 4.80 0.00 2.61 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 22 E 8.34 4.46 0.00 2.10 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 2.16 2.33 0.00 23 V 7.79 3.51 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 0.29 0.00 0.00 0.66 0.00 0.00 24 G 7.95 3.66 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 0.00 0.00 0.00 25 G 8.02 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 26 E 7.82 4.05 0.00 2.08 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 2.32 2.41 0.00 27 A 7.83 3.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.97 4.03 0.00 1.79 1.71 0.91 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.73 3.60 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 0.00 0.00 0.00 30 R 8.18 4.04 0.00 1.89 1.90 0.00 3.11 0.00 0.00 2.98 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 31 L 7.65 4.11 0.00 1.88 1.89 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.56 4.22 0.00 1.80 1.66 0.67 0.67 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 33 V 6.65 3.84 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.91 0.00 0.00 34 V 7.37 3.51 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 0.05 0.00 0.00 0.78 0.00 0.00 35 Y 6.81 3.92 0.00 2.46 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.66 0.00 2.26 2.10 0.00 3.91 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 2.12 2.14 0.00 37 W 7.82 4.46 0.00 3.65 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.55 4.32 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 1.28 0.00 0.00 39 Q 7.97 4.25 0.00 2.39 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 40 R 7.90 3.89 0.00 2.04 1.81 0.00 3.26 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 41 F 8.10 4.09 0.00 2.46 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 42 F 7.63 4.80 0.00 2.98 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 0.00 0.00 0.00 43 E 8.01 4.29 0.00 2.07 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 2.41 2.45 0.00 44 S 8.22 5.17 0.00 4.13 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 45 F 8.39 4.78 0.00 3.16 3.14 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 46 G 7.67 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 47 D 8.82 4.40 0.00 2.67 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 48 L 8.35 4.82 0.00 1.66 1.61 1.06 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.47 4.24 0.00 3.95 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 50 T 7.46 4.64 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 1.21 0.00 0.00 51 P 0.00 4.29 0.00 2.24 2.31 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 52 D 8.04 4.32 0.00 2.77 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 53 A 7.78 3.97 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 54 V 7.37 3.53 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 0.87 0.00 0.00 0.97 0.00 0.00 55 M 7.78 4.28 0.00 2.02 2.08 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 2.59 2.93 0.00 56 G 8.00 3.80 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 0.00 0.00 0.00 57 N 7.65 4.34 0.00 3.10 2.91 0.00 0.00 6.77 7.02 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 58 P 0.00 4.29 0.00 2.24 2.25 0.00 3.72 0.00 0.00 3.83 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 59 K 7.80 3.75 0.00 1.20 0.74 0.00 0.76 0.00 0.00 1.20 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.21 1.18 7.81 60 V 7.63 3.76 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 1.10 0.00 0.00 1.03 0.00 0.00 61 K 7.81 4.02 0.00 1.99 1.82 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.14 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.61 7.81 62 A 8.07 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 9.04 4.49 0.00 3.55 3.59 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.28 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.01 4.09 0.00 1.98 1.86 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.59 7.81 66 K 7.82 4.07 0.00 2.27 1.95 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.69 7.81 67 V 8.03 3.71 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.92 0.00 0.00 68 L 8.42 4.64 0.00 2.11 1.93 0.91 0.73 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 69 G 8.60 3.80 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 0.00 0.00 0.00 70 A 7.95 4.10 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 71 F 8.13 4.15 0.00 3.50 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.17 4.03 0.00 4.30 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 0.00 73 D 8.11 4.57 0.00 2.88 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 74 G 8.04 3.80 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 0.00 0.00 0.00 75 L 7.89 4.10 0.00 1.62 1.51 -0.39 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.61 4.08 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 77 H 7.37 4.69 0.00 3.13 3.24 0.00 5.81 0.00 0.00 0.00 0.00 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.29 4.40 0.00 1.65 1.62 0.98 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.66 4.68 0.00 2.64 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 80 N 7.51 5.05 0.00 2.70 2.60 0.00 0.00 7.25 6.66 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 L 7.97 4.33 0.00 1.81 1.90 0.97 1.10 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 82 K 8.16 4.06 0.00 1.67 1.77 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.62 7.81 83 G 8.06 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 84 T 7.40 3.68 3.65 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 0.00 0.00 0.00 0.90 0.00 0.00 85 F 7.64 4.75 0.00 2.97 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 86 A 7.86 3.98 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 87 T 7.71 3.99 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 1.15 0.00 0.00 88 L 7.78 4.16 0.00 2.02 1.77 1.00 0.82 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 89 S 8.52 4.31 0.00 4.08 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 90 E 7.69 3.94 0.00 2.26 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 2.32 2.52 0.00 91 L 7.53 3.86 0.00 1.69 1.79 0.74 1.01 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 92 H 8.26 4.34 0.00 3.41 3.65 0.00 5.86 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 93 C 8.92 4.21 0.00 3.00 2.25 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 0.00 94 D 6.54 4.37 0.00 2.62 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 95 K 7.55 4.23 0.00 1.75 1.83 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.28 7.81 96 L 8.58 3.94 0.00 1.84 1.94 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.20 4.28 0.00 3.45 3.41 0.00 5.70 0.00 0.00 0.00 0.00 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.29 4.14 2.17 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 0.30 0.00 0.00 1.01 0.00 0.00 99 D 8.63 4.38 0.00 2.71 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.60 0.00 2.13 2.16 0.00 3.52 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.25 0.00 101 E 7.99 3.95 0.00 1.96 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 2.27 2.37 0.00 102 N 7.88 4.39 0.00 2.55 2.73 0.00 0.00 6.89 8.24 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 0.00 103 F 7.64 4.62 0.00 3.20 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.98 4.13 0.00 1.89 2.00 0.00 3.32 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.84 0.00 105 L 7.92 3.99 0.00 1.66 1.26 0.33 0.21 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 0.00 106 L 8.23 4.12 0.00 1.97 1.82 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.07 3.80 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 0.00 0.00 0.00 108 N 7.68 4.75 0.00 3.13 2.93 0.00 0.00 6.85 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 0.00 109 V 7.85 3.75 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 1.02 0.00 0.00 1.07 0.00 0.00 110 L 7.90 3.78 0.00 1.66 1.64 0.78 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.38 3.48 2.29 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 1.34 0.00 0.00 1.14 0.00 0.00 112 C 7.87 4.10 0.00 3.21 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 0.00 113 V 7.88 3.44 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 0.80 0.00 0.00 0.88 0.00 0.00 114 L 7.84 3.49 0.00 0.78 1.06 0.47 0.74 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 0.00 115 A 6.98 3.69 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 0.00 116 H 7.93 4.05 0.00 3.19 3.39 0.00 5.77 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.89 4.05 0.00 2.62 2.50 0.00 5.72 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.29 4.86 0.00 3.20 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 0.00 119 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 0.00 120 K 9.19 4.14 0.00 1.77 1.90 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 121 E 8.21 4.09 0.00 2.32 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 2.37 2.33 0.00 122 F 7.75 4.54 0.00 3.13 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 0.00 123 T 7.71 4.39 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 1.35 0.00 0.00 124 P 0.00 4.13 0.00 2.15 2.15 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.23 0.00 2.12 2.06 0.00 3.54 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 2.08 2.10 0.00 126 V 7.13 3.59 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 1.00 0.00 0.00 0.91 0.00 0.00 127 Q 7.82 3.42 0.00 1.71 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 128 A 8.12 3.94 1.38 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 0.00 0.00 0.00 129 A 7.67 4.21 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.01 4.00 0.00 3.42 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.44 4.08 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.72 2.60 0.00 132 K 7.56 4.02 0.00 1.90 1.86 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.66 7.81 133 V 7.64 3.60 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 0.97 0.00 0.00 0.75 0.00 0.00 134 V 8.20 3.88 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 1.13 0.00 0.00 1.21 0.00 0.00 135 A 8.30 4.21 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 7.97 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 0.00 137 V 7.89 3.09 2.15 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 -0.08 0.00 0.00 0.94 0.00 0.00 138 A 7.62 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.53 4.42 0.00 2.70 2.90 0.00 0.00 7.00 7.32 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 0.00 140 A 7.58 4.44 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 0.00 141 L 7.68 3.84 0.00 1.27 0.70 0.19 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.59 5.00 1.64 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 0.00 0.00 143 H 7.91 4.16 0.00 3.19 3.37 0.00 5.94 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.81 4.66 0.00 1.82 2.05 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.37 7.81 145 Y 7.78 5.24 0.00 2.94 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 0.00 146 H 8.40 4.35 0.00 3.32 3.20 0.00 6.03 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00