NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.7149 8.1648 122.9829 52.3891 20.0995 175.6496 2 T 4.6670 8.6116 116.2458 61.3150 71.9433 171.9872 3 K 5.2965 8.9400 124.6532 54.9214 37.3353 174.5618 4 A 5.4631 9.0808 123.6960 50.9792 23.5740 175.0529 5 V 5.0623 8.7295 116.6914 60.7069 35.2538 173.2906 6 A 5.0639 9.2159 124.5064 50.2758 22.3071 175.0271 7 V 4.3892 8.3883 122.7071 61.5484 33.3352 174.5550 8 L 4.7262 8.9540 129.8212 53.9807 42.8987 176.3491 9 K 4.8524 9.0392 122.4544 55.3967 37.0147 176.4481 10 G 4.1397 8.0032 108.2002 46.1444 0.0000 172.3123 11 D 4.6220 8.7830 118.3853 54.7562 41.7922 176.3942 12 G 4.4418 7.4994 109.0461 43.5805 0.0000 171.1817 13 P 4.3973 0.0000 0.0000 63.8881 32.0085 175.7345 14 V 4.4731 7.5653 120.6836 62.8773 32.0963 174.9736 15 Q 4.8239 8.6378 124.6355 55.4009 32.4776 173.5051 16 G 4.2873 8.3179 106.5787 46.1136 0.0000 172.0285 17 I 5.1099 8.1621 119.7663 59.3851 40.8174 174.9468 18 I 4.6125 8.6788 127.8138 59.4984 39.9493 174.5649 19 N 4.9166 8.5922 124.8834 51.7077 40.7721 174.1168 20 F 5.3877 8.9566 120.0461 55.8242 43.1819 173.8138 21 E 5.1995 9.7763 123.2972 54.8031 33.5718 173.7082 22 Q 4.9070 9.3457 127.5643 54.3180 31.5391 175.8306 23 K 4.0606 8.9480 127.5344 58.5732 32.7017 177.3278 24 E 4.9010 7.8282 117.0579 53.9677 32.7135 177.0039 25 S 4.1121 8.8797 117.2013 60.6905 63.1669 174.7384 26 N 4.8193 8.2246 116.4162 52.1876 37.2339 174.0192 27 G 4.1554 7.8031 108.4678 43.0347 0.0000 171.6238 28 P 4.6517 0.0000 0.0000 62.8212 32.4056 175.8681 29 V 4.5742 8.7999 121.6846 61.4343 33.4620 174.7460 30 K 4.8165 9.3748 128.5190 55.8500 33.6962 175.9090 31 V 4.8491 9.3773 126.0246 60.8089 34.0797 174.2518 32 W 5.3067 8.1067 123.6242 55.0603 31.7182 175.2094 33 G 4.0344 7.3407 106.3689 45.9593 0.0000 170.7618 34 S 5.0162 7.8156 114.4033 56.7077 66.3521 174.0630 35 I 5.0611 8.9467 127.6898 59.3330 40.4367 174.8596 36 K 4.7008 9.1512 125.7203 55.4475 36.1818 176.7879 37 G 3.8256 8.6241 104.7862 46.6830 0.0000 173.2790 38 L 4.5533 7.6415 119.5904 52.7229 43.2323 176.6263 39 T 4.2945 8.1710 111.7150 61.0839 69.5398 173.9843 40 E 4.0561 8.5045 124.4111 57.6772 30.6202 175.6111 41 G 3.8434 8.4584 110.1209 43.8445 0.0000 172.2829 42 L 4.7019 8.2191 119.1142 55.0200 42.7312 176.5719 43 H 5.0186 9.3792 119.8699 53.5891 32.8662 173.2965 44 G 4.0353 9.1231 111.0114 47.0194 0.0000 172.4781 45 F 5.5294 8.9100 125.0992 57.0449 42.2815 172.8717 46 H 5.2080 8.8987 122.7159 54.0264 33.8563 172.8635 47 V 4.4760 8.5088 121.3661 62.4943 32.7465 175.1056 48 H 5.0351 9.5360 125.9083 54.6047 30.5104 176.0121 49 E 3.7729 8.9635 122.5289 59.0610 29.7949 177.0791 50 F 4.9982 8.3789 118.4706 54.8564 41.5803 176.7973 51 G 4.5959 8.3217 112.5053 44.3567 0.0000 174.4086 52 D 4.7286 7.8707 117.1690 52.7139 42.7901 174.0392 53 N 5.4334 8.8062 124.3102 52.7664 39.2622 175.7247 54 T 3.9139 8.5462 109.8377 63.3985 69.5183 174.7303 55 A 4.6573 8.0814 124.3790 51.0518 19.2498 175.7138 56 G 3.8936 7.7202 112.7006 45.5754 0.0000 173.0611 57 A 4.0966 8.4047 118.9026 54.8744 18.0210 179.9379 58 T 3.8921 7.9104 114.7964 66.6589 68.4040 175.8594 59 S 4.5061 7.6948 112.5351 59.3703 63.4876 175.3414 60 A 4.7053 7.4988 126.0094 53.7173 18.3070 178.7446 61 G 3.6888 7.9500 105.2785 43.9865 0.0000 170.7647 62 P 4.6998 0.0000 0.0000 61.9939 33.9257 175.0079 63 H 4.4521 8.4577 116.4540 55.9253 29.4102 175.5681 64 F 4.2220 9.2401 125.9363 58.0671 40.2749 175.0448 65 N 5.0068 7.7494 125.9085 51.6763 38.7491 173.1745 66 P 4.1057 0.0000 0.0000 64.9438 32.1473 177.7596 67 L 4.2847 7.5575 117.0238 53.6706 42.1592 176.2849 68 S 3.5943 7.5476 113.6424 60.0716 60.5310 171.0557 69 R 4.5716 8.2984 117.6298 54.2646 33.0325 176.2085 70 K 4.4844 8.7627 118.7791 55.4877 34.1043 176.2700 71 H 4.0588 8.7026 122.6504 56.7545 30.4337 174.6514 72 G 4.1953 7.5138 110.1876 45.0149 0.0000 172.1243 73 G 4.0886 9.3519 109.2067 43.6190 0.0000 173.1907 74 P 4.3339 0.0000 0.0000 65.4705 31.0577 177.6345 75 K 4.2239 7.8819 115.8534 57.3772 32.5771 176.7650 76 D 4.6001 7.7344 119.3558 53.6196 41.5518 176.2820 77 E 3.8995 8.7305 123.6930 59.1102 29.6356 176.7521 78 E 4.2143 7.9745 122.2722 55.4165 28.4998 174.9010 79 R 4.7017 7.5855 119.8400 55.1530 32.6049 174.7771 80 H 4.4930 9.2610 116.4271 55.3575 29.4519 176.8627 81 V 3.5795 8.3149 122.5889 66.3600 31.7042 177.2035 82 G 3.8386 8.5823 105.7284 47.5447 0.0000 173.5129 83 D 5.1646 8.1101 121.1615 53.9583 39.8223 175.8740 84 L 4.4921 8.4903 120.1697 52.9785 42.6695 178.0014 85 G 4.1129 8.5176 109.0451 46.1922 0.0000 174.4430 86 N 5.6707 8.6709 120.4830 51.3095 41.9606 173.1848 87 V 4.3642 8.5401 114.1202 59.9592 35.1585 174.8420 88 T 5.0214 8.2221 118.8846 61.8623 71.1369 173.1311 89 A 4.6958 8.8880 129.3476 50.8353 21.0044 177.2292 90 D 4.7835 8.8313 122.3193 51.9615 41.2872 177.2006 91 K 4.0914 8.4738 117.1889 59.4834 32.5721 177.2070 92 D 4.5341 8.3267 118.3049 54.2840 41.2206 177.1241 93 G 4.3777 8.4370 108.5513 44.1483 0.0000 172.5681 94 V 4.8501 7.8588 119.2418 60.7207 34.2350 174.0856 95 A 5.1043 9.1269 130.1500 49.9300 20.6345 175.7198 96 D 4.8946 8.5943 123.5706 53.5648 40.8297 176.1363 97 V 3.7208 8.6244 124.5800 62.5896 33.0324 175.1270 98 S 4.7376 8.4001 122.5814 57.6316 64.2665 172.8636 99 I 4.8146 9.5601 128.3499 59.3859 41.4655 174.1519 100 E 5.2126 8.8822 125.8082 54.5070 32.2064 174.4155 101 D 4.9997 9.3243 125.8450 52.5958 44.8780 175.6173 102 S 4.6822 8.9464 118.0200 58.2034 63.9090 174.4850 103 V 4.0805 7.9449 120.9057 64.6646 32.3408 176.4426 104 I 4.0431 7.9464 111.9514 60.8677 38.2322 175.0604 105 S 4.7209 8.2792 115.2706 56.8650 65.4393 174.2035 106 L 4.4293 9.1388 124.7421 54.9127 41.7986 176.1444 107 S 4.5008 7.6001 112.7108 57.2163 66.5191 173.7352 108 G 3.9351 8.5886 107.0842 44.7784 0.0000 173.7205 109 D 4.5653 8.3585 116.6208 55.2088 39.6060 176.6417 110 H 5.1630 7.9074 116.2897 55.3621 29.4210 174.1119 111 A 4.3337 7.6480 122.0279 52.7191 18.8649 178.7087 112 I 3.7479 8.2978 113.0749 60.7088 38.2950 176.0906 113 I 3.6913 7.2341 123.1719 62.9526 37.4619 176.2789 114 G 3.8008 9.3748 113.4342 45.4373 0.0000 172.9102 115 R 4.9722 7.3526 119.0114 54.7319 33.6959 174.5132 116 T 4.9375 8.0419 115.3904 62.0302 71.3347 173.6648 117 L 4.7461 8.7424 129.1540 54.2688 43.8782 175.4529 118 V 5.0208 8.8833 126.0353 61.0176 35.1153 174.1445 119 V 5.0940 8.6220 127.1073 60.5779 33.5979 174.8728 120 H 5.2739 9.1304 121.6705 54.0106 30.7944 174.6023 121 E 4.3051 9.2148 121.9719 59.0194 30.0065 176.2845 122 K 4.7825 8.5113 116.7465 54.4917 36.9947 175.4608 123 A 4.3695 8.4468 122.0797 52.3143 18.7647 176.1938 124 D 4.9516 9.2680 122.5251 53.7831 41.2872 176.1125 125 D 4.5669 9.4538 125.8968 53.2689 39.9683 176.7657 126 L 3.5001 9.9127 119.5826 56.1371 39.6339 175.9748 127 G 4.0343 8.7578 104.8959 45.8187 0.0000 174.7560 128 K 4.5026 8.0082 116.9893 56.0837 32.2178 177.2308 129 G 3.8201 7.9729 107.0249 44.5504 0.0000 175.1193 130 G 3.8805 8.9213 107.4332 46.2352 0.0000 173.2654 131 N 4.9978 7.5778 116.0183 50.1108 41.2626 174.4199 132 E 3.9439 8.7095 119.7379 59.5805 29.4739 179.2139 133 E 3.9097 8.1290 118.8351 59.1991 29.8438 178.5285 134 S 4.1142 8.7040 113.8078 61.4391 62.4014 175.4469 135 T 4.3946 7.6394 110.1892 62.0072 68.5433 175.4369 136 K 4.2835 7.4596 119.9831 57.9860 33.9570 177.0338 137 T 4.0179 8.0838 106.3105 60.0761 70.1688 175.1896 138 G 3.8876 8.0640 110.1939 45.6814 0.0000 173.6407 139 N 4.2140 7.7078 114.0711 54.0185 36.6923 175.8452 140 A 4.3514 7.0354 119.7005 51.9101 19.5281 180.0271 141 G 4.0037 7.3639 103.6646 45.1419 0.0000 173.6865 142 S 4.4304 8.7356 115.6346 58.4345 64.7996 174.2254 143 R 4.3440 8.3579 120.2045 55.5440 29.6914 176.4504 144 L 4.3548 8.9192 125.4242 57.2175 43.1575 177.0391 145 A 4.9104 7.7520 117.4839 51.0785 22.8319 175.0196 146 A 5.0898 9.1397 120.4634 51.2535 23.3362 175.6495 147 G 4.6897 8.6570 104.9743 45.3240 0.0000 172.8127 148 V 4.2294 8.2827 122.7647 62.5062 32.8075 175.6879 149 I 4.1229 9.0895 129.3973 60.9576 37.7306 175.2072 150 G 4.3836 8.8850 115.2288 43.9036 0.0000 171.9881 151 I 4.2283 8.3100 122.0626 61.1946 37.5806 175.4534 152 A 4.8162 8.4132 128.1262 49.5779 22.1240 176.2054 153 Q 4.0681 8.5092 118.7272 56.4619 29.1949 176.0553 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 A 8.16 4.71 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 2 T 8.61 4.67 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 1.22 0.00 0.00 3 K 8.94 5.30 0.00 1.71 1.72 0.00 1.69 0.00 0.00 1.96 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.55 1.49 7.81 4 A 9.08 5.46 1.09 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 5 V 8.73 5.06 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 0.80 0.00 0.00 0.92 0.00 0.00 6 A 9.22 5.06 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 7 V 8.39 4.39 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 8.95 4.73 0.00 1.71 1.60 1.04 0.44 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 9 K 9.04 4.85 0.00 1.65 1.62 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 8.00 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 0.00 0.00 0.00 11 D 8.78 4.62 0.00 2.68 2.72 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 12 G 7.50 4.44 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 0.00 0.00 0.00 13 P 0.00 4.40 0.00 2.23 2.30 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.94 0.00 14 V 7.57 4.47 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 0.79 0.00 0.00 0.94 0.00 0.00 15 Q 8.64 4.82 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.42 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 16 G 8.32 4.29 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 0.00 17 I 8.16 5.11 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.20 0.83 0.00 0.00 18 I 8.68 4.61 1.84 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 1.26 1.33 0.48 0.00 0.00 19 N 8.59 4.92 0.00 1.44 1.46 0.00 0.00 6.35 8.22 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 20 F 8.96 5.39 0.00 2.89 2.92 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 21 E 9.78 5.20 0.00 2.43 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 2.31 2.39 0.00 22 Q 9.35 4.91 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 23 K 8.95 4.06 0.00 1.85 1.86 0.00 1.70 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.55 1.41 7.81 24 E 7.83 4.90 0.00 1.96 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 2.29 2.21 0.00 25 S 8.88 4.11 0.00 3.99 4.02 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 26 N 8.22 4.82 0.00 2.84 2.93 0.00 0.00 5.82 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.80 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.65 0.00 2.13 2.10 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 29 V 8.80 4.57 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 1.32 0.00 0.00 1.07 0.00 0.00 30 K 9.37 4.82 0.00 1.87 1.81 0.00 1.55 0.00 0.00 1.40 0.00 0.00 2.72 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.45 1.42 7.81 31 V 9.38 4.85 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 0.67 0.00 0.00 1.02 0.00 0.00 32 W 8.11 5.31 0.00 3.53 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 33 G 7.34 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.82 5.02 0.00 3.85 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.95 5.06 1.80 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 0.70 0.95 0.00 0.00 36 K 9.15 4.70 0.00 1.73 1.89 0.00 1.36 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.34 7.81 37 G 8.62 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 38 L 7.64 4.55 0.00 1.83 1.46 0.81 0.15 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 39 T 8.17 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 1.24 0.00 0.00 40 E 8.50 4.06 0.00 1.96 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 2.30 2.47 0.00 41 G 8.46 3.84 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 0.00 0.00 0.00 42 L 8.22 4.70 0.00 1.52 1.75 0.92 0.93 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 43 H 9.38 5.02 0.00 2.99 3.33 0.00 5.63 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 44 G 9.12 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.91 5.53 0.00 2.97 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 46 H 8.90 5.21 0.00 3.10 2.97 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.51 4.48 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 0.86 0.00 0.00 0.91 0.00 0.00 48 H 9.54 5.04 0.00 3.06 3.45 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.96 3.77 0.00 1.63 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 0.00 1.47 2.07 0.00 50 F 8.38 5.00 0.00 3.14 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 51 G 8.32 4.60 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 52 D 7.87 4.73 0.00 2.61 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 53 N 8.81 5.43 0.00 2.70 2.74 0.00 0.00 7.37 7.70 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 54 T 8.55 3.91 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 1.23 0.00 0.00 55 A 8.08 4.66 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 56 G 7.72 3.89 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 0.00 0.00 0.00 57 A 8.40 4.10 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 58 T 7.91 3.89 4.44 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 1.23 0.00 0.00 59 S 7.69 4.51 0.00 3.98 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.50 4.71 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 61 G 7.95 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 62 P 0.00 4.70 0.00 2.03 2.20 0.00 3.62 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 1.97 1.97 0.00 63 H 8.46 4.45 0.00 2.81 3.19 0.00 5.73 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 64 F 9.24 4.22 0.00 2.91 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 65 N 7.75 5.01 0.00 2.62 2.42 0.00 0.00 6.93 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 66 P 0.00 4.11 0.00 1.64 1.79 0.00 3.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.07 0.00 67 L 7.56 4.28 0.00 1.55 1.65 0.87 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.55 3.59 0.00 3.98 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 69 R 8.30 4.57 0.00 1.88 1.97 0.00 3.27 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 70 K 8.76 4.48 0.00 1.66 1.82 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.36 7.81 71 H 8.70 4.06 0.00 3.17 3.26 0.00 5.94 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 72 G 7.51 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 0.00 0.00 0.00 73 G 9.35 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 74 P 0.00 4.33 0.00 2.22 2.37 0.00 3.79 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 2.02 2.22 0.00 75 K 7.88 4.22 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.73 4.60 0.00 2.81 2.57 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 77 E 8.73 3.90 0.00 1.89 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 2.28 2.34 0.00 78 E 7.97 4.21 0.00 2.06 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 0.00 2.33 2.30 0.00 79 R 7.59 4.70 0.00 1.97 1.77 0.00 2.92 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.57 0.00 80 H 9.26 4.49 0.00 3.43 3.40 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.31 3.58 1.67 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 0.87 0.00 0.00 0.76 0.00 0.00 82 G 8.58 3.84 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 0.00 0.00 0.00 83 D 8.11 5.16 0.00 2.71 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 84 L 8.49 4.49 0.00 1.91 1.91 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.52 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 86 N 8.67 5.67 0.00 2.59 2.70 0.00 0.00 6.61 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 87 V 8.54 4.36 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 -0.23 0.00 0.00 0.73 0.00 0.00 88 T 8.22 5.02 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 1.20 0.00 0.00 89 A 8.89 4.70 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 90 D 8.83 4.78 0.00 2.87 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 91 K 8.47 4.09 0.00 1.88 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.33 4.53 0.00 2.83 2.73 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 93 G 8.44 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 0.00 0.00 0.00 0.00 94 V 7.86 4.85 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 0.99 0.00 0.00 0.92 0.00 0.00 95 A 9.13 5.10 1.15 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 0.00 0.00 96 D 8.59 4.89 0.00 2.56 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 97 V 8.62 3.72 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 0.65 0.00 0.00 0.58 0.00 0.00 98 S 8.40 4.74 0.00 3.90 3.71 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 99 I 9.56 4.81 1.97 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.89 1.02 0.00 0.00 100 E 8.88 5.21 0.00 1.96 1.81 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 2.21 2.31 0.00 101 D 9.32 5.00 0.00 2.86 2.52 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 0.00 102 S 8.95 4.68 0.00 4.02 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 0.00 103 V 7.94 4.08 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 0.86 0.00 0.00 0.94 0.00 0.00 104 I 7.95 4.04 1.95 0.00 0.00 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 1.51 0.81 1.05 0.00 0.00 105 S 8.28 4.72 0.00 3.85 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 0.00 106 L 9.14 4.43 0.00 1.73 1.65 1.04 0.48 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 0.00 107 S 7.60 4.50 0.00 3.86 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 0.00 108 G 8.59 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.36 4.57 0.00 2.78 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 0.00 110 H 7.91 5.16 0.00 3.20 3.43 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.65 4.33 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 0.00 112 I 8.30 3.75 1.63 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.26 0.93 0.00 0.00 113 I 7.23 3.69 1.78 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.77 0.83 0.00 0.00 114 G 9.37 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 0.00 115 R 7.35 4.97 0.00 1.61 1.84 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.31 0.00 116 T 8.04 4.94 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 1.22 0.00 0.00 117 L 8.74 4.75 0.00 1.79 1.53 0.36 0.92 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 0.00 118 V 8.88 5.02 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 0.75 0.00 0.00 0.79 0.00 0.00 119 V 8.62 5.09 2.31 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 0.76 0.00 0.00 1.01 0.00 0.00 120 H 9.13 5.27 0.00 3.22 3.58 0.00 5.67 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.21 4.31 0.00 2.12 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 2.37 2.31 0.00 122 K 8.51 4.78 0.00 1.80 1.88 0.00 1.38 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.56 7.81 123 A 8.45 4.37 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 0.00 124 D 9.27 4.95 0.00 2.72 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 0.00 125 D 9.45 4.57 0.00 2.91 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 9.91 3.50 0.00 1.86 1.85 0.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.76 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.01 4.50 0.00 1.85 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.46 7.81 129 G 7.97 3.82 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 0.00 0.00 0.00 130 G 8.92 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 0.00 131 N 7.58 5.00 0.00 2.94 2.89 0.00 0.00 6.14 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 0.00 132 E 8.71 3.94 0.00 2.03 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 2.40 2.37 0.00 133 E 8.13 3.91 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 134 S 8.70 4.11 0.00 4.02 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 7.64 4.39 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 1.21 0.00 0.00 136 K 7.46 4.28 0.00 1.69 1.80 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.55 7.81 137 T 8.08 4.02 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 1.18 0.00 0.00 138 G 8.06 3.89 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 0.00 0.00 0.00 139 N 7.71 4.21 0.00 3.05 2.89 0.00 0.00 6.93 7.42 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 0.00 140 A 7.04 4.35 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 0.00 141 G 7.36 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 0.00 142 S 8.74 4.43 0.00 3.93 4.04 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 0.00 0.00 0.00 143 R 8.36 4.34 0.00 1.68 1.83 0.00 3.28 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.66 0.00 144 L 8.92 4.35 0.00 1.74 1.70 0.99 0.52 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 0.00 145 A 7.75 4.91 1.17 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 0.00 0.00 146 A 9.14 5.09 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 0.00 147 G 8.66 4.69 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 0.00 148 V 8.28 4.23 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 0.82 0.00 0.00 0.97 0.00 0.00 149 I 9.09 4.12 1.78 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.35 0.31 0.00 0.00 150 G 8.88 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 0.00 0.00 0.00 0.00 151 I 8.31 4.23 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.53 0.90 0.00 0.00 152 A 8.41 4.82 1.21 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 0.00 0.00 153 Q 8.51 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00