NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5149 8.3049 120.3410 55.7006 33.6630 177.7344 2 T 4.1537 7.7780 115.5344 63.2016 66.5182 173.2092 3 H 4.7247 7.7273 126.2074 55.8551 31.5352 174.3340 4 D 4.6603 7.7832 117.5205 52.7463 41.0142 176.6103 5 N 4.3760 8.9107 118.0723 55.8498 36.8485 177.2370 6 K 4.8575 6.1534 116.0094 56.4964 30.6501 173.2547 7 L 4.8903 7.9429 127.2266 53.3635 44.8960 176.4129 8 Q 4.4160 8.1797 116.0549 54.6379 27.8947 177.1132 9 V 4.1394 7.2172 114.5019 62.4388 34.3896 171.5815 10 E 4.4366 8.7549 125.2943 55.5993 33.7740 175.8951 11 A 3.6556 8.2126 116.6315 53.7045 15.0593 176.2460 12 I 3.9919 7.4581 124.6374 60.7184 38.9108 176.0523 13 K 4.4755 8.2561 121.9132 57.7380 33.1991 178.0245 14 R 5.3252 7.2366 113.2924 56.1480 32.9708 176.1807 15 G 4.1089 7.5713 103.3578 45.7836 0.0000 171.8274 16 T 4.9585 8.2131 116.1071 61.7539 71.8478 173.8907 17 V 4.3374 8.5409 125.3677 61.0379 32.6210 175.5934 18 I 4.6586 7.4836 132.6190 59.3836 35.1982 174.8222 19 D 4.4851 7.8276 125.0185 53.9667 43.5865 175.1787 20 H 4.3109 8.7221 116.1836 56.8428 26.6293 175.3093 21 I 4.5007 7.4749 120.0725 59.2234 38.2157 174.5777 22 P 4.4600 0.0000 0.0000 62.6984 31.6919 175.4181 23 A 3.8802 8.5952 125.0468 53.9649 18.6439 176.5993 24 Q 3.6555 8.9071 120.1908 56.9843 27.6381 173.6940 25 I 4.5817 7.6478 113.3406 59.3811 40.0728 177.4003 26 G 3.6952 8.6799 107.3018 48.6369 0.0000 175.2238 27 F 4.3295 8.3847 123.2492 60.7758 39.1771 176.6397 28 K 3.5651 8.0651 118.5399 59.6470 31.8571 178.3843 29 L 3.9020 7.7374 118.8194 57.8542 41.5727 179.5526 30 L 3.9560 7.7451 118.5260 57.7903 41.5534 179.8107 31 S 3.8543 7.7928 114.9603 61.2603 62.7235 176.1293 32 L 3.5785 7.9482 122.7119 57.4137 41.7482 178.1416 33 F 4.6297 7.4905 115.5810 59.9348 39.9734 177.0276 34 K 4.0500 7.4943 115.9162 57.8701 29.5610 174.9793 35 L 4.1979 8.1845 126.7150 57.8644 42.4695 180.3146 36 T 3.9403 7.9693 103.5232 62.8255 68.2461 174.0748 37 E 4.4815 7.9943 123.4349 54.9315 28.9366 175.0559 38 T 4.2869 7.5555 117.2151 63.2535 72.2608 173.3118 39 D 4.6465 8.5808 121.7914 55.1842 41.6722 177.5999 40 Q 4.1381 7.7429 117.7612 55.6838 29.4075 175.9527 41 R 4.3055 8.2225 120.3526 56.7270 31.7303 175.1723 42 I 5.4465 7.9154 122.6779 60.2070 41.6929 174.5714 43 T 4.4988 8.6515 122.5121 62.0512 71.1945 172.5800 44 I 4.8630 8.4724 127.5074 59.3593 39.5750 175.5339 45 G 4.2597 8.6702 113.7426 44.4199 0.0000 172.2606 46 L 5.7970 7.8561 122.0343 52.0338 44.7083 176.2781 47 N 4.1019 8.8514 121.7811 53.9618 35.2782 173.6134 48 L 4.6569 8.2138 119.9774 52.4477 44.2251 175.0808 49 P 4.9212 0.0000 0.0000 62.3659 31.8040 176.0731 50 S 4.6593 8.3600 115.0008 56.5581 65.4111 174.4183 51 G 4.0774 8.7731 113.9804 46.1390 0.0000 173.8098 52 E 4.6074 7.9156 117.5903 56.0810 32.0611 176.2124 53 M 4.8016 7.8124 116.3616 52.9053 35.1406 174.9218 54 G 3.8815 8.5171 111.2617 48.6654 0.0000 172.6982 55 R 5.2077 7.5109 118.8762 53.7064 34.1996 174.2737 56 K 4.8495 9.0113 119.0452 56.1147 36.5088 174.6470 57 D 5.4330 8.8579 121.0547 53.0207 44.3600 175.2173 58 L 5.0118 8.4543 117.9002 53.7275 46.2225 176.0782 59 I 4.7146 7.9579 119.4851 59.6531 39.1346 172.5065 60 K 4.5419 8.9463 124.3954 55.7338 33.4648 175.8727 61 I 4.5904 8.1494 127.1590 59.2983 38.9806 175.5300 62 E 4.2501 8.5592 128.7648 55.2410 30.7158 175.6492 63 N 4.0607 8.5501 117.4225 53.5753 36.2864 175.7262 64 T 4.3151 6.9902 112.9284 63.1273 72.1247 173.4931 65 F 5.1448 8.8014 124.8739 54.9109 41.3208 175.2645 66 L 4.8281 8.3252 123.2673 53.3508 43.9616 176.8725 67 S 4.6766 7.9656 115.3268 57.0705 65.8592 174.4606 68 E 4.1752 8.3945 119.9096 57.4584 29.1454 177.2725 69 D 4.2175 7.7670 116.7791 57.8397 41.8642 177.5341 70 Q 4.0559 7.7497 118.0352 58.7388 28.5981 178.5925 71 V 3.5236 8.2879 119.5270 65.8469 31.2242 177.8682 72 D 4.4199 7.6557 118.6578 57.3402 40.5166 178.2737 73 Q 4.0926 7.7713 118.6910 59.3970 28.5036 179.4380 74 L 4.3152 7.6037 117.6261 57.0639 41.4888 179.0977 75 A 4.2621 8.9797 122.6109 55.4232 18.1164 179.2454 76 L 3.9329 7.6538 113.9674 56.3165 41.6646 177.1946 77 Y 4.4651 7.4990 114.2129 58.8586 41.0020 176.0862 78 A 4.7953 8.9521 121.6246 49.7298 18.1993 173.8806 79 P 4.0612 0.0000 0.0000 65.7111 32.4719 177.6897 80 Q 4.4117 7.7406 117.1545 56.4242 29.5230 175.5961 81 A 5.1101 7.5239 119.2652 50.4924 19.8011 178.1969 82 T 4.3718 8.3877 116.9262 61.6335 69.2855 174.1325 83 V 4.7661 8.4131 125.4203 61.9412 34.8698 173.2334 84 N 5.4209 8.8253 124.7207 50.6696 42.6130 174.7197 85 R 4.8537 8.3699 120.8843 55.6106 33.2648 174.9655 86 I 5.0127 7.8790 110.7000 60.4102 41.1115 173.3363 87 D 5.1901 8.6343 124.1454 50.6528 43.1492 174.6506 88 N 3.9877 9.4825 116.6901 57.0924 37.9123 173.7184 89 Y 3.9080 7.9863 110.0067 57.5561 37.4631 171.4252 90 E 4.6315 8.2693 119.9757 54.7625 33.4283 174.3582 91 V 4.1266 8.5079 125.8615 63.4315 32.2535 174.0324 92 V 4.1437 8.5511 125.3022 64.0523 33.2172 176.4514 93 G 4.0857 7.8854 113.5647 43.8498 0.0000 171.5757 94 K 4.5941 8.8529 125.7026 55.8849 33.4233 176.2256 95 S 4.6737 7.8890 114.7193 58.2577 66.5463 175.2378 96 R 4.9713 8.4771 118.5533 53.6543 33.7190 173.6689 97 P 4.6218 0.0000 0.0000 62.4893 32.0497 176.0839 98 S 4.7241 8.7158 117.7851 55.7285 65.8017 173.9185 99 L 3.8917 8.5908 121.8999 54.7476 41.5690 175.7386 100 P 4.4814 0.0000 0.0000 62.3216 32.2907 176.4747 101 E 4.1089 8.8586 119.9741 58.8311 29.7836 176.5058 102 R 4.9177 7.3693 110.7077 55.1880 32.1235 174.2644 103 I 4.0745 8.7036 124.5492 61.6959 38.6615 175.4970 104 D 4.7511 9.3056 127.2651 55.6963 44.1686 178.5370 105 N 3.7545 8.8868 114.0634 57.5419 40.0065 177.5376 106 V 3.4587 7.3058 116.3495 63.8627 32.1966 175.2955 107 L 5.2552 6.9777 117.2979 53.9379 44.3872 176.1298 108 V 4.5401 7.4843 113.0244 60.9467 35.6324 174.0679 109 C 4.3038 9.6360 126.3066 60.0443 31.2209 172.1518 110 P 4.1055 0.0000 0.0000 65.0308 30.6408 174.5807 111 N 4.3975 7.9729 117.7563 53.7792 38.1387 175.9825 112 S 4.7039 8.4717 122.7400 57.8489 61.6295 174.2654 113 N 4.9326 9.6065 115.8441 52.4978 40.9414 174.0249 114 C 4.1806 8.0124 117.1938 59.9508 32.4878 173.8409 115 I 4.0787 7.9229 126.5265 60.2949 35.0832 175.7323 116 S 4.3309 7.4183 114.1940 58.2684 65.6752 175.4414 117 H 4.7065 7.8647 116.7360 57.3483 30.2452 175.8999 118 A 4.2418 7.9110 118.8830 53.6649 18.2852 175.9472 119 E 4.7210 7.3715 112.8419 53.9877 34.2375 174.3727 120 P 4.5695 0.0000 0.0000 61.7633 29.9321 176.2965 121 V 4.2259 7.1076 111.9276 60.0738 33.9518 176.3367 122 S 4.7308 8.3553 117.5097 56.7074 64.2507 174.1710 123 S 4.3684 8.7975 120.0401 58.4522 63.1965 173.4264 124 S 5.5407 8.0069 117.3752 58.2485 65.4382 175.6406 125 F 5.2262 9.4992 125.8167 55.6339 42.9963 174.1781 126 A 4.7348 8.9416 125.3453 51.7939 19.6118 177.3315 127 V 4.2518 8.3842 121.2117 61.1026 33.8378 176.1639 128 R 4.2909 7.9902 115.4412 55.3477 32.5476 172.8453 129 K 4.2227 8.9139 128.4565 56.8839 32.5353 176.1341 130 R 4.3400 9.2126 128.5615 54.2020 31.5122 173.4222 131 A 4.2006 8.1650 126.0797 52.7190 17.6366 176.5282 132 N 4.4481 9.3813 117.2653 53.3653 37.5041 173.1824 133 D 4.4211 7.9243 115.5401 52.9251 42.5019 174.2744 134 I 4.8475 7.8646 119.0533 59.4997 39.6485 174.8946 135 A 5.2631 8.6253 128.1735 50.1906 21.4424 175.7043 136 L 5.4455 10.1537 119.7262 51.9378 45.8087 175.5515 137 K 5.1187 8.5498 122.2008 54.4145 35.3538 175.1237 138 C 3.8031 8.4344 127.4954 59.8150 31.9841 173.2381 139 K 3.7148 8.0687 122.3581 57.4377 31.5153 175.6785 140 Y 4.4352 8.0471 114.4938 58.9302 40.9625 176.7370 141 C 3.9015 8.2589 117.4468 60.0069 30.0360 175.7307 142 E 3.8101 7.7296 115.4749 56.5886 27.7952 174.3608 143 K 4.1455 7.4175 118.2529 56.1351 33.5250 175.6779 144 E 5.0840 8.2238 122.9686 55.2304 30.7372 175.4794 145 F 5.1860 9.6306 123.3359 55.5712 43.1356 174.1380 146 S 4.9139 8.7592 116.1788 57.7503 63.3791 174.6315 147 H 4.2098 9.0537 122.4726 57.4911 28.2546 175.8427 148 N 4.3998 7.5122 117.5103 55.2719 38.7331 175.8483 149 V 4.0661 8.7147 117.4504 62.5388 31.4171 175.8056 150 V 3.6183 7.4205 117.6616 63.2186 31.4794 176.1210 151 L 4.3844 8.1851 126.1280 53.1698 44.9159 174.4420 152 A 4.2473 8.4742 126.3844 52.6364 18.9226 176.7289 153 N 4.2700 8.5219 119.6329 54.7931 39.3662 174.1019 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 4.51 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 2 T 7.78 4.15 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 1.24 0.00 0.00 3 H 7.73 4.72 0.00 3.22 3.31 0.00 5.92 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 4 D 7.78 4.66 0.00 2.83 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 5 N 8.91 4.38 0.00 2.71 2.82 0.00 0.00 6.93 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 K 6.15 4.86 0.00 1.73 1.86 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.65 7.81 7 L 7.94 4.89 0.00 1.64 1.58 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.18 4.42 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 9 V 7.22 4.14 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 0.69 0.00 0.00 0.92 0.00 0.00 10 E 8.75 4.44 0.00 1.91 1.76 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 2.19 2.28 0.00 11 A 8.21 3.66 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 12 I 7.46 3.99 1.87 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 1.28 0.81 0.89 0.00 0.00 13 K 8.26 4.48 0.00 1.87 1.94 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.54 7.81 14 R 7.24 5.33 0.00 1.78 1.83 0.00 3.38 0.00 0.00 4.01 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.99 0.00 15 G 7.57 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 T 8.21 4.96 4.15 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 1.19 0.00 0.00 17 V 8.54 4.34 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 0.96 0.00 0.00 0.91 0.00 0.00 18 I 7.48 4.66 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 1.07 1.12 0.92 0.00 0.00 19 D 7.83 4.49 0.00 2.66 2.42 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 20 H 8.72 4.31 0.00 3.36 3.32 0.00 5.66 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 21 I 7.47 4.50 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.08 0.97 0.00 0.00 22 P 0.00 4.46 0.00 2.23 2.04 0.00 3.70 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 23 A 8.60 3.88 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 24 Q 8.91 3.66 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 25 I 7.65 4.58 2.11 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 1.35 1.42 1.03 0.00 0.00 26 G 8.68 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 27 F 8.38 4.33 0.00 3.06 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.07 3.57 0.00 1.85 1.96 0.00 1.50 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.23 7.81 29 L 7.74 3.90 0.00 1.90 1.81 0.98 0.77 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 30 L 7.75 3.96 0.00 1.80 1.69 1.03 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 31 S 7.79 3.85 0.00 3.38 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.95 3.58 0.00 1.01 1.13 0.53 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.49 4.63 0.00 3.20 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 34 K 7.49 4.05 0.00 1.87 2.21 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.37 1.36 7.81 35 L 8.18 4.20 0.00 1.73 1.70 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.97 3.94 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 1.23 0.00 0.00 37 E 7.99 4.48 0.00 1.90 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 2.23 2.37 0.00 38 T 7.56 4.29 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 1.21 0.00 0.00 39 D 8.58 4.65 0.00 2.66 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 40 Q 7.74 4.14 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.04 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 41 R 8.22 4.31 0.00 1.88 1.90 0.00 3.34 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 42 I 7.92 5.45 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.99 0.99 0.00 0.00 43 T 8.65 4.50 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 1.20 0.00 0.00 44 I 8.47 4.86 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.58 1.04 0.00 0.00 45 G 8.67 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.86 5.80 0.00 1.47 1.55 0.91 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.85 4.10 0.00 2.88 2.89 0.00 0.00 7.10 7.85 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 48 L 8.21 4.66 0.00 1.78 1.57 0.92 0.93 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 49 P 0.00 4.92 0.00 2.04 1.98 0.00 3.62 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 50 S 8.36 4.66 0.00 3.87 3.87 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 51 G 8.77 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 52 E 7.92 4.61 0.00 1.92 1.91 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 2.20 2.23 0.00 53 M 7.81 4.80 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 54 G 8.52 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 0.00 0.00 0.00 55 R 7.51 5.21 0.00 1.67 1.81 0.00 3.54 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 56 K 9.01 4.85 0.00 1.87 1.89 0.00 1.17 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.64 7.81 57 D 8.86 5.43 0.00 2.65 2.69 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 58 L 8.45 5.01 0.00 1.57 1.47 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 59 I 7.96 4.71 1.87 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 1.25 0.99 0.91 0.00 0.00 60 K 8.95 4.54 0.00 1.89 1.72 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.40 7.81 61 I 8.15 4.59 1.79 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 1.08 0.76 0.86 0.00 0.00 62 E 8.56 4.25 0.00 1.88 1.80 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 2.28 2.24 0.00 63 N 8.55 4.06 0.00 3.08 2.87 0.00 0.00 6.75 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 6.99 4.32 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 1.20 0.00 0.00 65 F 8.80 5.14 0.00 2.95 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.33 4.83 0.00 1.61 1.54 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.97 4.68 0.00 4.09 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 68 E 8.39 4.18 0.00 2.06 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 0.00 2.37 2.36 0.00 69 D 7.77 4.22 0.00 2.71 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 70 Q 7.75 4.06 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.56 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 71 V 8.29 3.52 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 1.02 0.00 0.00 0.93 0.00 0.00 72 D 7.66 4.42 0.00 2.93 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 73 Q 7.77 4.09 0.00 1.87 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.70 0.00 74 L 7.60 4.32 0.00 1.81 1.80 0.90 0.56 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 75 A 8.98 4.26 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 76 L 7.65 3.93 0.00 1.48 1.10 0.77 0.89 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 77 Y 7.50 4.47 0.00 3.14 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 78 A 8.95 4.80 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 79 P 0.00 4.06 0.00 2.06 2.07 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.34 0.00 80 Q 7.74 4.41 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 81 A 7.52 5.11 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 82 T 8.39 4.37 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 1.29 0.00 0.00 83 V 8.41 4.77 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 0.88 0.00 0.00 0.93 0.00 0.00 84 N 8.83 5.42 0.00 2.70 2.68 0.00 0.00 6.81 6.95 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 85 R 8.37 4.85 0.00 1.91 2.26 0.00 3.22 0.00 0.00 3.58 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.75 0.00 86 I 7.88 5.01 1.93 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 1.33 0.46 1.03 0.00 0.00 87 D 8.63 5.19 0.00 2.75 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 88 N 9.48 3.99 0.00 2.68 2.65 0.00 0.00 7.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 7.99 3.91 0.00 3.12 3.20 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 90 E 8.27 4.63 0.00 2.06 1.76 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 2.15 2.26 0.00 91 V 8.51 4.13 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 0.84 0.00 0.00 0.96 0.00 0.00 92 V 8.55 4.14 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 0.82 0.00 0.00 1.03 0.00 0.00 93 G 7.89 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 94 K 8.85 4.59 0.00 1.67 1.77 0.00 1.86 0.00 0.00 2.43 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.30 7.81 95 S 7.89 4.67 0.00 3.86 3.92 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 0.00 0.00 0.00 96 R 8.48 4.97 0.00 1.67 1.83 0.00 3.21 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 97 P 0.00 4.62 0.00 1.95 2.18 0.00 3.63 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 2.04 2.08 0.00 98 S 8.72 4.72 0.00 3.95 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 99 L 8.59 3.89 0.00 1.66 1.70 0.91 1.02 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 0.00 100 P 0.00 4.48 0.00 2.08 2.05 0.00 3.70 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 2.08 2.11 0.00 101 E 8.86 4.11 0.00 2.02 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 0.00 2.39 2.31 0.00 102 R 7.37 4.92 0.00 1.98 1.89 0.00 3.11 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 103 I 8.70 4.07 1.94 0.00 0.00 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 1.30 0.93 1.08 0.00 0.00 104 D 9.31 4.75 0.00 2.68 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 0.00 105 N 8.89 3.75 0.00 2.86 3.06 0.00 0.00 6.49 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.31 3.46 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.01 0.00 0.00 107 L 6.98 5.26 0.00 1.27 1.30 0.68 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.48 4.54 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 0.62 0.00 0.00 0.97 0.00 0.00 109 C 9.64 4.30 0.00 3.19 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 0.00 110 P 0.00 4.11 0.00 1.20 1.72 0.00 2.51 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.65 0.00 111 N 7.97 4.40 0.00 3.40 3.07 0.00 0.00 6.85 7.63 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 0.00 112 S 8.47 4.70 0.00 3.90 3.87 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 0.00 113 N 9.61 4.93 0.00 2.69 2.76 0.00 0.00 6.96 7.53 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 0.00 114 C 8.01 4.18 0.00 2.97 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 0.00 115 I 7.92 4.08 1.79 0.00 0.00 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 1.43 0.62 0.81 0.00 0.00 116 S 7.42 4.33 0.00 3.85 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 0.00 117 H 7.86 4.71 0.00 3.17 3.29 0.00 5.64 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 0.00 118 A 7.91 4.24 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 0.00 119 E 7.37 4.72 0.00 1.90 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 0.00 2.19 2.36 0.00 120 P 0.00 4.57 0.00 2.04 2.02 0.00 3.65 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 121 V 7.11 4.23 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.77 0.00 0.00 122 S 8.36 4.73 0.00 3.81 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 0.00 123 S 8.80 4.37 0.00 4.06 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 0.00 124 S 8.01 5.54 0.00 4.06 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 0.00 125 F 9.50 5.23 0.00 2.94 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 0.00 126 A 8.94 4.73 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 V 8.38 4.25 2.27 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 0.81 0.00 0.00 0.95 0.00 0.00 128 R 7.99 4.29 0.00 1.87 1.83 0.00 3.20 0.00 0.00 3.37 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 129 K 8.91 4.22 0.00 1.81 1.76 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.72 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.44 7.81 130 R 9.21 4.34 0.00 1.83 2.07 0.00 3.19 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 131 A 8.17 4.20 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 0.00 132 N 9.38 4.45 0.00 2.84 3.06 0.00 0.00 7.14 8.47 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 0.00 133 D 7.92 4.42 0.00 2.78 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 0.00 134 I 7.86 4.85 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.62 0.92 0.00 0.00 135 A 8.63 5.26 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 0.00 136 L 10.15 5.45 0.00 1.93 1.91 0.78 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.55 5.12 0.00 1.79 1.62 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.44 7.81 138 C 8.43 3.80 0.00 2.99 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 0.00 139 K 8.07 3.71 0.00 1.62 1.44 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.88 1.18 7.81 140 Y 8.05 4.44 0.00 2.98 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 0.00 141 C 8.26 3.90 0.00 3.23 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 0.00 142 E 7.73 3.81 0.00 2.16 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 2.19 2.41 0.00 143 K 7.42 4.15 0.00 1.61 1.17 0.00 1.91 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 144 E 8.22 5.08 0.00 1.72 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 2.35 2.28 0.00 145 F 9.63 5.19 0.00 3.01 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 0.00 146 S 8.76 4.91 0.00 3.94 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 0.00 147 H 9.05 4.21 0.00 3.12 3.39 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 0.00 148 N 7.51 4.40 0.00 2.64 2.85 0.00 0.00 6.83 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 0.00 149 V 8.71 4.07 2.12 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 0.53 0.00 0.00 1.00 0.00 0.00 150 V 7.42 3.62 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 0.85 0.00 0.00 0.87 0.00 0.00 151 L 8.19 4.38 0.00 1.50 1.47 0.83 0.81 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 0.00 152 A 8.47 4.25 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 0.00 153 N 8.52 4.27 0.00 2.64 2.61 0.00 0.00 7.09 6.84 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