NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8597 8.0549 120.2896 61.4974 32.6148 174.6393 2 Q 4.3728 8.1119 121.0576 53.5798 31.0911 173.3348 3 W 4.9413 8.2018 119.0261 54.8369 32.2292 175.6989 4 S 4.3689 12.0000 118.2383 57.5884 62.9248 175.1757 5 A 4.3824 8.7609 124.7307 55.4934 17.8595 179.8362 6 E 4.1208 7.8894 116.0662 59.0371 29.3196 179.1553 7 E 4.0168 9.4716 119.3031 59.3895 28.1882 179.3635 8 K 3.8383 8.0462 116.8614 58.0018 32.1718 178.7175 9 Q 3.9752 7.2276 117.2845 58.6465 29.3855 176.9557 10 L 3.9287 8.3870 120.1461 58.0510 41.4808 179.3043 11 I 3.1960 7.0606 118.7478 65.0846 37.3086 178.0791 12 S 4.4273 7.7460 113.6347 60.6517 61.4664 176.4251 13 G 3.9733 8.3375 109.5413 47.1178 0.0000 175.1804 14 L 4.3142 8.1753 122.7602 57.5776 42.1000 178.8031 15 W 4.5246 9.3605 129.2841 60.3157 30.4804 177.7965 16 G 3.8261 7.7709 103.8617 46.1991 0.0000 173.9515 17 K 4.4733 7.5045 118.2315 55.7801 33.1289 176.3920 18 V 3.5482 7.4269 120.7799 62.6143 31.1749 175.8647 19 N 4.4558 8.4688 126.0417 52.4936 38.5146 175.1491 20 V 3.4739 8.0816 128.1299 65.9388 31.6097 177.4159 21 A 4.0876 7.9901 119.8471 54.5215 18.1854 178.2207 22 D 4.4261 7.6043 115.6806 56.6810 41.8634 178.4319 23 C 4.0133 8.0102 116.6015 63.1882 28.2188 176.6895 24 G 3.5713 7.7993 105.4041 47.5719 0.0000 175.7020 25 A 3.9829 7.2903 120.3968 54.8385 18.4043 179.4957 26 E 3.8255 8.6809 117.1171 59.6429 29.3803 179.2284 27 A 3.8587 7.8140 119.5021 55.2650 18.5930 179.0636 28 L 4.1275 7.8683 117.4569 57.8616 42.3202 178.3604 29 A 3.9455 8.1359 121.1257 55.7356 18.2296 179.9139 30 R 3.7996 8.7842 116.7681 59.1088 30.0304 178.9856 31 L 3.9711 8.2453 120.7915 58.1765 42.1461 178.9372 32 L 4.3149 7.8278 119.6274 56.5904 41.2870 178.9777 33 I 3.9464 7.0314 118.5526 62.4372 38.0803 177.2379 34 V 3.8847 7.7200 116.9754 62.6050 33.0315 175.7906 35 Y 4.1400 7.2354 115.5656 54.4114 38.7729 173.5706 36 P 4.5326 0.0000 0.0000 64.4333 31.9576 177.5555 37 W 4.1807 8.4859 114.7962 59.3258 27.1441 178.0295 38 T 4.0428 7.6475 111.2839 64.9400 68.2106 176.4199 39 Q 4.2436 8.8466 121.4574 58.3025 28.3885 178.7445 40 R 3.6684 6.9640 118.4778 59.3638 30.0038 177.0688 41 F 4.6677 6.5092 112.4238 57.6816 38.5657 175.7994 42 F 4.7862 8.0824 117.4975 56.9384 40.0567 175.7130 43 A 4.1871 8.3966 127.0472 55.6292 18.0014 180.3323 44 S 4.3893 8.3810 106.1163 60.0503 62.7635 174.5003 45 F 4.7339 9.1016 119.0953 57.4046 40.2821 176.0287 46 G 3.9652 8.1087 109.2477 45.1710 0.0000 176.0485 47 N 4.7641 8.7005 127.7108 52.1129 38.4168 174.5048 48 L 4.8603 8.1334 129.3010 54.4108 42.6443 178.4158 49 S 4.1456 9.4346 114.6000 59.7861 63.0448 173.6024 50 S 4.6113 7.5527 114.8560 55.4990 65.9994 173.4318 51 P 4.6762 0.0000 0.0000 66.1588 30.7914 179.1224 52 T 3.8218 7.8075 113.7116 66.4371 68.6465 176.3033 53 A 3.9909 8.1903 122.7707 55.6832 18.2120 179.8704 54 I 3.7337 8.8640 116.8583 64.2884 37.2252 178.2115 55 L 4.2743 7.7423 118.3595 56.3820 41.6072 178.6092 56 G 3.7938 7.8984 105.1119 45.0769 0.0000 173.9788 57 N 4.1810 7.5461 118.6429 53.9704 39.7259 173.0481 58 P 4.4487 0.0000 0.0000 66.1324 32.2021 178.2599 59 M 3.8475 7.8849 118.7711 57.7173 31.5510 178.4303 60 V 3.7766 8.0203 117.7520 66.5716 30.9724 178.0765 61 R 4.0254 8.5942 117.2673 58.5027 30.1662 178.2818 62 A 4.2809 7.9263 119.3627 54.0477 18.8829 178.4690 63 H 4.6323 8.3570 116.9006 58.5456 29.9033 177.6518 64 G 3.5643 7.9546 107.8978 47.4601 0.0000 175.3202 65 K 3.8866 7.4629 120.3459 60.0784 32.4303 178.1055 66 K 3.9719 8.1605 117.0206 59.5481 31.7608 179.8899 67 V 3.2647 8.4916 115.8548 65.4905 32.2093 177.8786 68 L 4.5018 8.5739 119.7854 59.3772 42.3572 179.8417 69 T 4.0730 8.1425 115.4151 66.7559 68.4880 175.9143 70 S 3.9809 8.4533 115.0449 61.6353 62.4795 175.9812 71 F 4.1767 8.6982 120.0485 60.5660 38.5974 177.5922 72 G 3.5484 8.8709 105.5402 48.1790 0.0000 175.4781 73 D 4.3662 7.9870 120.5813 56.0524 40.4815 178.8202 74 A 3.9737 7.3689 120.9930 55.0155 18.5573 179.4729 75 V 3.1574 7.5705 115.9669 65.7634 31.4633 178.1529 76 K 4.2267 7.4636 117.5062 57.5090 32.1208 176.3218 77 N 4.6550 7.7804 117.5630 51.6848 39.7342 172.8885 78 L 4.0776 8.1526 127.4190 55.8351 42.9514 176.3541 79 D 5.0450 7.6404 117.0214 54.0021 41.0056 176.3174 80 N 4.6600 7.6989 113.9546 51.9992 39.7203 176.2950 81 I 3.9066 8.0012 120.5651 63.6941 36.8146 177.0066 82 K 3.9063 8.1754 119.4884 60.2453 32.0364 177.8811 83 N 4.5279 8.0244 115.6524 56.1704 38.7987 177.3055 84 T 3.7831 7.5004 116.0330 67.0455 68.7279 176.3115 85 F 4.0375 8.2509 117.9439 59.1832 38.8441 177.6189 86 A 3.9721 7.6366 121.3327 55.7626 17.8674 178.9316 87 Q 3.9533 7.4237 114.5313 59.6756 29.1826 178.7276 88 L 4.3034 8.0052 117.2330 55.8156 41.8184 179.2737 89 S 3.9890 7.8064 115.0074 61.3933 62.2204 175.5214 90 E 3.8049 8.0477 120.5878 59.3448 29.3950 178.6540 91 L 3.9127 7.9554 119.5895 58.9614 41.9426 178.6238 92 H 4.4287 8.4575 114.5193 57.6191 28.5103 176.7185 93 C 4.7592 7.6793 118.6063 59.2711 29.7260 174.2201 94 D 4.7165 10.6100 117.4669 53.8109 42.3326 176.6294 95 K 4.5240 7.9313 116.6779 55.6772 33.7848 175.8212 96 L 4.5442 7.6045 115.2684 54.0675 43.9300 175.7564 97 H 3.9552 7.8744 114.6131 56.6483 26.2385 174.8201 98 V 3.7559 7.1942 117.2907 60.5908 33.0986 174.7256 99 D 4.1242 8.3407 126.9255 53.3898 41.8838 174.3572 100 P 2.9700 0.0000 0.0000 66.2560 31.3197 178.8656 101 E 3.7749 8.1910 117.4575 59.3348 29.6520 178.8676 102 N 4.4823 8.1905 116.6805 55.7263 38.5686 177.4658 103 F 4.5662 9.3705 119.5703 60.6917 39.1833 177.2017 104 R 3.9929 8.2735 117.8450 59.9399 29.3836 178.2703 105 L 4.0652 7.9269 118.3374 57.4322 41.6010 179.1906 106 L 4.2264 8.6968 121.2225 57.9834 41.9864 179.0266 107 G 3.6985 8.3731 105.9295 48.0330 0.0000 175.2436 108 D 4.4994 8.2578 121.8216 56.8773 40.8389 179.5951 109 I 3.7720 7.5508 119.9010 64.2163 37.1226 177.7405 110 L 3.8136 8.3322 121.6278 58.6410 41.7727 179.2539 111 I 3.5759 7.8573 119.3202 64.3490 36.7665 178.4071 112 I 3.7473 7.2367 119.0863 63.8070 36.9173 178.2254 113 V 3.6747 7.6852 119.4518 65.5633 31.2810 178.2220 114 L 3.8548 7.7835 118.8400 57.5653 41.6662 178.8639 115 A 3.5044 7.2672 117.8341 53.0250 17.8584 178.1373 116 A 4.4326 7.3712 118.3325 52.3573 20.1816 177.3610 117 H 4.4379 8.1435 112.4691 55.5964 29.8549 175.2388 118 F 4.7592 7.5811 115.9431 55.8726 42.3704 176.0165 119 T 3.4434 7.3853 116.1792 64.4553 67.1957 176.2647 120 K 4.0943 8.9916 130.5146 60.0713 31.9600 177.4930 121 E 4.1076 8.3289 119.3788 58.9459 29.7869 177.3937 122 F 4.3229 7.7989 122.2663 57.5551 37.4690 175.1308 123 T 4.3640 7.5373 115.8911 59.8658 71.5679 173.2054 124 P 4.1923 0.0000 0.0000 66.3062 31.1006 178.2784 125 E 3.9169 8.1722 116.0740 60.0655 29.6567 178.8333 126 C 4.0493 7.4715 117.7281 62.6008 31.6282 175.4830 127 Q 4.0825 8.2625 120.8962 58.8391 28.7011 178.2061 128 A 4.1471 8.3831 122.0160 54.5372 18.3597 179.4824 129 A 4.1411 8.2544 120.0199 55.1468 18.6076 179.9510 130 W 4.0022 8.2098 117.0532 59.9319 29.1009 178.3415 131 Q 3.9029 8.0545 118.0882 59.1459 28.5905 178.3238 132 K 4.0689 7.8812 119.2177 59.3339 32.2140 178.1555 133 L 4.2374 8.6470 121.1474 58.8213 41.7851 179.6679 134 V 4.0387 8.8028 111.1260 64.1746 31.6377 178.1381 135 R 4.0604 8.3477 119.6386 59.6568 29.9167 178.9263 136 V 3.6494 7.6965 111.6876 64.0379 31.5390 178.0268 137 V 3.2762 7.4745 115.7337 63.9403 31.4130 176.5806 138 A 4.3325 7.7875 118.7054 53.9335 20.0217 178.1351 139 H 4.3966 7.8885 116.2706 58.9007 30.1593 176.7586 140 A 4.1146 8.4225 121.5578 53.6952 18.3293 177.5680 141 L 4.1735 7.5861 115.7581 55.2112 42.5094 176.3601 142 A 5.0946 7.8346 121.2871 52.7456 19.5482 178.6137 143 R 4.1334 8.0471 119.5426 60.8406 30.5493 179.5135 144 K 3.8292 7.3727 115.7817 59.2656 32.4550 177.7319 145 Y 4.4852 7.6252 115.2371 59.5389 38.2749 175.3808 146 H 4.6070 10.3954 122.1588 55.8378 29.7278 173.0548 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 3.86 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.32 0.00 0.00 2 Q 8.11 4.37 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.67 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 3 W 8.20 4.94 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 S 12.00 4.37 0.00 4.03 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.76 4.38 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 6 E 7.89 4.12 0.00 2.20 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 2.33 2.40 0.00 7 E 9.47 4.02 0.00 2.43 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 8 K 8.05 3.84 0.00 1.73 1.68 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.28 1.53 7.81 9 Q 7.23 3.98 0.00 2.40 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 10 L 8.39 3.93 0.00 1.83 1.68 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.06 3.20 1.46 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.35 0.10 0.00 0.00 12 S 7.75 4.43 0.00 4.06 3.97 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 13 G 8.34 3.97 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 0.00 0.00 0.00 14 L 8.18 4.31 0.00 2.04 2.16 0.31 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.36 4.52 0.00 3.85 3.35 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 16 G 7.77 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 17 K 7.50 4.47 0.00 2.05 1.93 0.00 1.93 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.44 1.42 7.81 18 V 7.43 3.55 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.74 0.00 0.00 19 N 8.47 4.46 0.00 2.71 2.56 0.00 0.00 6.82 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 8.08 3.47 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 1.05 0.00 0.00 0.78 0.00 0.00 21 A 7.99 4.09 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 22 D 7.60 4.43 0.00 2.60 2.65 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 0.00 23 C 8.01 4.01 0.00 2.85 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 24 G 7.80 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 25 A 7.29 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.68 3.83 0.00 1.94 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 2.31 2.47 0.00 27 A 7.81 3.86 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 28 L 7.87 4.13 0.00 1.93 1.64 0.95 0.88 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 29 A 8.14 3.95 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 30 R 8.78 3.80 0.00 1.97 1.93 0.00 3.09 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.81 0.00 31 L 8.25 3.97 0.00 1.79 1.83 1.06 0.74 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 32 L 7.83 4.31 0.00 1.66 1.67 0.72 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.03 3.95 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.72 0.82 0.00 0.00 34 V 7.72 3.88 1.07 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 0.32 0.00 0.00 0.72 0.00 0.00 35 Y 7.24 4.14 0.00 2.66 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 4.53 0.00 2.28 2.13 0.00 4.02 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 2.25 2.02 0.00 37 W 8.49 4.18 0.00 3.49 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.65 4.04 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 1.07 0.00 0.00 39 Q 8.85 4.24 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 40 R 6.96 3.67 0.00 1.53 1.11 0.00 3.13 0.00 0.00 3.02 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.43 0.00 41 F 6.51 4.67 0.00 2.63 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 42 F 8.08 4.79 0.00 3.03 2.56 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 43 A 8.40 4.19 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 44 S 8.38 4.39 0.00 4.17 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 45 F 9.10 4.73 0.00 3.11 3.32 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 46 G 8.11 3.97 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 0.00 0.00 0.00 47 N 8.70 4.76 0.00 2.69 2.77 0.00 0.00 6.62 7.78 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 48 L 8.13 4.86 0.00 1.72 1.60 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 49 S 9.43 4.15 0.00 3.91 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.55 4.61 0.00 3.85 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 51 P 0.00 4.68 0.00 2.15 2.12 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 T 7.81 3.82 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 1.20 0.00 0.00 53 A 8.19 3.99 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 54 I 8.86 3.73 1.93 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 1.51 0.68 0.87 0.00 0.00 55 L 7.74 4.27 0.00 1.92 1.70 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 56 G 7.90 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 57 N 7.55 4.18 0.00 2.73 2.90 0.00 0.00 7.21 7.24 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 58 P 0.00 4.45 0.00 2.26 2.25 0.00 3.75 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 1.98 2.01 0.00 59 M 7.88 3.85 0.00 1.10 1.56 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 60 V 8.02 3.78 2.28 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 1.04 0.00 0.00 1.02 0.00 0.00 61 R 8.59 4.03 0.00 2.01 1.96 0.00 3.16 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 62 A 7.93 4.28 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 63 H 8.36 4.63 0.00 3.60 3.72 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 7.95 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 0.00 0.00 0.00 65 K 7.46 3.89 0.00 1.82 2.07 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.55 7.81 66 K 8.16 3.97 0.00 2.07 1.80 0.00 1.86 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.51 1.83 7.81 67 V 8.49 3.26 2.35 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 1.34 0.00 0.00 0.99 0.00 0.00 68 L 8.57 4.50 0.00 1.88 1.85 1.10 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.14 4.07 4.48 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 1.29 0.00 0.00 70 S 8.45 3.98 0.00 3.85 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 71 F 8.70 4.18 0.00 3.49 3.27 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 72 G 8.87 3.55 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 0.00 0.00 0.00 73 D 7.99 4.37 0.00 2.63 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 74 A 7.37 3.97 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 75 V 7.57 3.16 0.93 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 0.35 0.00 0.00 -0.01 0.00 0.00 76 K 7.46 4.23 0.00 1.79 1.77 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.60 7.81 77 N 7.78 4.66 0.00 2.55 2.62 0.00 0.00 7.12 7.47 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 78 L 8.15 4.08 0.00 1.06 1.17 -0.39 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.64 5.05 0.00 2.70 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 7.70 4.66 0.00 2.73 2.66 0.00 0.00 7.08 7.82 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 81 I 8.00 3.91 1.94 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.53 0.89 0.00 0.00 82 K 8.18 3.91 0.00 1.77 1.86 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.58 7.81 83 N 8.02 4.53 0.00 2.77 2.83 0.00 0.00 6.93 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 84 T 7.50 3.78 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 85 F 8.25 4.04 0.00 3.07 2.98 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 86 A 7.64 3.97 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 87 Q 7.42 3.95 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 88 L 8.01 4.30 0.00 1.77 1.80 0.90 1.03 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 89 S 7.81 3.99 0.00 4.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.05 3.80 0.00 2.01 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 2.35 2.33 0.00 91 L 7.96 3.91 0.00 1.73 1.69 0.89 0.96 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 92 H 8.46 4.43 0.00 3.45 3.59 0.00 5.82 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 93 C 7.68 4.76 0.00 2.69 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 0.00 0.00 0.00 94 D 10.61 4.72 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 4.52 0.00 1.63 1.85 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.41 7.81 96 L 7.60 4.54 0.00 1.63 1.42 0.75 1.03 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 97 H 7.87 3.96 0.00 3.21 3.32 0.00 5.68 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.19 3.76 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 0.56 0.00 0.00 0.36 0.00 0.00 99 D 8.34 4.12 0.00 2.69 2.43 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 0.00 100 P 0.00 2.97 0.00 2.00 2.04 0.00 3.25 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.87 0.00 101 E 8.19 3.77 0.00 2.07 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 2.30 2.47 0.00 102 N 8.19 4.48 0.00 2.82 2.94 0.00 0.00 6.92 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 0.00 103 F 9.37 4.57 0.00 3.15 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 0.00 104 R 8.27 3.99 0.00 1.89 2.20 0.00 3.55 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.73 0.00 105 L 7.93 4.07 0.00 1.81 1.40 0.63 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.70 4.23 0.00 1.92 1.89 1.05 1.16 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 0.00 107 G 8.37 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 0.00 0.00 0.00 108 D 8.26 4.50 0.00 2.90 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 0.00 109 I 7.55 3.77 2.14 0.00 0.00 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 1.90 1.00 0.97 0.00 0.00 110 L 8.33 3.81 0.00 1.60 1.82 0.63 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.86 3.58 2.08 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.29 0.98 0.00 0.00 112 I 7.24 3.75 1.83 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 1.38 0.57 0.86 0.00 0.00 113 V 7.69 3.67 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 0.98 0.00 0.00 0.92 0.00 0.00 114 L 7.78 3.85 0.00 1.35 1.02 0.11 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.27 3.50 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.37 4.43 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 0.00 117 H 8.14 4.44 0.00 3.05 2.54 0.00 5.80 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 0.00 118 F 7.58 4.76 0.00 3.10 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 0.00 119 T 7.39 3.44 4.28 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 1.25 0.00 0.00 120 K 8.99 4.09 0.00 1.79 1.93 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.46 7.81 121 E 8.33 4.11 0.00 2.08 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 122 F 7.80 4.32 0.00 3.00 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 7.54 4.36 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 0.00 124 P 0.00 4.19 0.00 2.19 2.18 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 125 E 8.17 3.92 0.00 1.89 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 2.33 2.47 0.00 126 C 7.47 4.05 0.00 2.92 2.46 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 0.00 127 Q 8.26 4.08 0.00 2.41 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 128 A 8.38 4.15 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 0.00 129 A 8.25 4.14 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 0.00 130 W 8.21 4.00 0.00 3.57 3.45 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 0.00 131 Q 8.05 3.90 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 132 K 7.88 4.07 0.00 2.05 2.05 0.00 1.51 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.14 0.00 0.00 0.00 0.00 1.25 1.23 7.81 133 L 8.65 4.24 0.00 1.68 1.79 0.82 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.80 4.04 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 1.20 0.00 0.00 135 R 8.35 4.06 0.00 2.14 2.09 0.00 3.11 0.00 0.00 3.20 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 136 V 7.70 3.65 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.13 0.00 0.00 137 V 7.47 3.28 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 -0.37 0.00 0.00 0.75 0.00 0.00 138 A 7.79 4.33 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.89 4.40 0.00 3.23 3.41 0.00 5.67 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 0.00 140 A 8.42 4.11 1.26 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 0.00 0.00 141 L 7.59 4.17 0.00 1.23 1.36 0.79 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.83 5.09 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.05 4.13 0.00 1.87 1.98 0.00 3.18 0.00 0.00 3.44 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 144 K 7.37 3.83 0.00 1.46 1.69 0.00 1.52 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.41 7.81 145 Y 7.63 4.49 0.00 3.05 2.71 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 0.00 146 H 10.40 4.61 0.00 3.24 3.13 0.00 5.69 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