NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3458 8.2649 123.5824 52.2956 20.0028 177.3452 3 R 4.0101 7.9582 123.8254 58.9124 32.5498 177.6867 4 R 4.1072 9.0788 116.2462 56.6744 29.5186 179.2652 5 R 4.1071 9.1380 125.9102 57.4736 31.2138 175.9181 6 R 4.2220 7.9293 117.0435 60.1970 30.0121 177.7397 7 A 3.5277 7.7862 114.6238 52.7199 16.1634 176.8997 8 E 4.1018 8.4332 124.7445 56.1196 30.6071 176.8111 9 V 3.8025 8.1562 121.7020 61.8614 31.7660 175.9621 10 R 3.8160 8.6258 126.8830 56.9057 30.2016 176.1266 11 Q 4.4100 8.5983 122.7123 54.2267 29.2070 175.2019 12 L 4.5178 8.1230 123.4841 53.9818 42.1979 176.6152 13 Q 4.0619 8.4658 120.0518 55.1495 29.1183 174.9107 14 P 4.4453 0.0000 0.0000 62.4967 31.9419 175.4134 15 D 4.5340 9.2522 119.4654 55.2531 41.5036 176.5205 16 L 4.7616 8.0470 124.1506 54.8182 41.7739 177.6675 17 V 4.2066 8.0903 117.2256 63.5994 35.5334 175.0026 18 Y 4.5054 9.7117 115.0178 56.5804 39.1290 175.5994 19 G 4.5813 8.1415 107.1896 46.1091 0.0000 172.6846 20 D 5.0839 7.9771 116.7639 52.1251 44.0421 177.0350 21 V 3.5463 8.2453 117.3317 63.9113 31.9230 178.5980 22 L 4.3186 8.7241 120.4596 57.7154 41.4875 179.3696 23 V 2.9505 7.8402 118.0384 66.0677 31.6518 177.5435 24 T 3.8274 7.9294 114.7598 66.7656 68.3194 175.7092 25 A 3.9267 8.4448 122.5074 55.5065 18.1644 179.5211 26 F 4.1764 8.5033 119.0698 61.3349 39.3933 177.4261 27 I 3.3272 8.4312 120.4341 64.1305 36.6191 178.0358 28 N 4.2072 8.1309 116.4379 56.4308 38.5337 177.3328 29 K 3.9029 7.5349 117.9537 59.3136 32.0664 179.0138 30 I 3.7452 6.7256 119.1574 62.9944 37.6642 176.4979 31 M 4.0771 7.1516 118.2069 55.9031 32.9314 175.4422 32 R 4.6058 7.8592 119.1465 55.7065 32.6187 174.3761 33 D 4.5700 9.4668 117.4858 55.5343 38.3944 173.9566 34 G 3.9418 8.2017 102.8928 46.7277 0.0000 175.8291 35 K 4.3259 7.5048 118.3034 54.6561 30.7614 178.0055 36 K 3.9873 7.6923 120.2270 58.4057 32.5152 176.7492 37 N 4.3428 7.8930 116.7614 57.0087 39.4210 176.1998 38 L 3.9318 7.9175 120.9519 58.1156 41.9818 178.6737 39 A 3.9267 8.1089 120.4794 55.0250 18.4542 179.3498 40 A 3.7982 7.6718 119.1427 56.0531 18.3664 179.2991 41 R 4.1037 8.7617 116.7860 58.5052 30.0957 180.0176 42 I 3.5519 8.0309 118.6666 64.2364 37.3383 177.7282 43 F 4.1457 7.9893 121.9726 61.4040 39.0681 176.4885 44 Y 4.3367 7.4211 115.2541 61.4083 38.0066 178.4696 45 D 4.5218 8.5491 119.5247 57.5224 40.9665 178.5677 46 A 3.9266 7.7612 120.7290 55.6866 18.0587 179.3511 47 C 3.8949 7.7974 114.3068 62.7596 28.2937 176.4622 48 K 4.1374 8.1796 120.2069 59.6231 31.8007 179.4072 49 I 3.6954 7.7815 119.4756 64.5963 36.7356 178.3611 50 I 3.8429 8.0746 120.2114 63.3851 36.9538 177.0940 51 Q 4.7272 7.8766 119.7139 55.2785 29.3598 175.4422 52 E 4.5493 7.6547 117.1115 58.4363 31.0105 177.5775 53 K 4.4082 7.8210 114.6216 56.6207 31.5843 176.9046 54 T 4.4513 7.7277 113.8819 62.9981 72.6343 174.6146 55 G 3.8248 8.5951 112.4415 47.0256 0.0000 174.5988 56 Q 4.1971 7.8233 118.0928 55.6710 29.0693 176.5882 57 E 4.4291 8.5211 119.7241 55.8194 31.5424 175.9737 58 P 4.0847 0.0000 0.0000 65.7621 31.4496 178.3050 59 L 3.8785 8.0199 120.3958 57.5052 41.9922 179.0536 60 K 4.1157 7.7673 119.3984 58.8569 32.1238 179.0426 61 V 3.6311 8.2493 119.4336 65.5462 31.4114 177.6524 62 F 4.1070 8.1800 119.9981 61.3281 39.3426 176.7327 63 K 3.4723 8.0076 118.0121 59.5678 31.6627 178.8586 64 Q 3.8378 7.6196 117.8508 59.2643 29.2179 177.6204 65 A 3.9929 7.8935 121.5745 55.6810 18.2673 179.1887 66 V 3.2309 7.2410 115.2034 66.6049 31.2788 177.7690 67 E 3.8185 8.0692 118.9974 59.1544 29.4854 178.1671 68 N 4.6258 8.0463 114.7270 54.3252 39.1890 176.5616 69 V 4.2145 7.6612 118.2007 62.6133 31.9379 175.8592 70 K 4.0814 7.6677 118.3330 56.0387 32.0721 174.5803 71 P 4.8368 0.0000 0.0000 62.4021 32.4311 176.2301 72 R 4.4293 9.1704 117.7296 57.4512 31.0785 175.8746 73 M 5.3019 7.9649 118.0222 53.6387 36.3262 174.0588 74 E 4.8172 9.0212 118.9153 55.0794 34.2110 173.8051 75 V 4.8662 8.3732 119.6241 61.2960 33.5856 174.5564 76 R 4.6084 8.7911 127.6524 54.2181 31.9936 176.2015 77 S 4.7157 8.8408 118.6647 58.9306 63.8065 173.4435 78 R 4.4005 8.2200 119.5695 55.4103 33.8971 173.9756 79 R 4.2739 8.7990 126.6807 56.4244 30.9267 176.5332 80 V 3.7629 8.0946 124.2958 61.4903 33.4178 176.9475 81 G 4.1764 8.6842 116.9063 45.2319 0.0000 174.5082 82 G 4.4155 7.1555 117.3168 46.8211 0.0000 172.8865 83 A 4.1609 6.8087 122.3826 51.1206 20.2702 175.9105 84 N 4.9660 8.6150 117.8055 52.3272 38.9423 173.7592 85 Y 4.5068 8.3178 122.2029 57.0270 39.3276 175.0263 86 Q 4.1621 9.0868 124.1679 56.4723 29.5857 175.9035 87 V 4.7559 8.9754 126.0655 60.3963 33.3986 173.4806 88 P 5.0675 0.0000 0.0000 63.2270 32.3220 175.4384 89 M 4.3785 8.4290 116.2112 54.5453 34.5903 174.2149 90 E 4.4748 9.1087 120.0430 57.2024 30.6709 176.3975 91 V 4.4120 7.7760 121.8377 60.7108 33.3745 175.8698 92 S 4.2394 8.6549 123.0571 57.4843 63.5678 173.2757 93 P 4.4016 0.0000 0.0000 66.2440 30.5539 178.7563 94 R 3.8387 7.8102 117.8184 59.4865 30.2391 178.3299 95 R 3.7959 7.8212 118.2717 59.1184 30.1095 177.9084 96 Q 3.8199 8.5801 119.9543 59.4145 28.9597 178.6745 97 Q 3.8496 7.7303 120.2725 59.1054 29.2333 177.9026 98 S 4.0393 7.7050 116.0441 61.8248 62.8285 176.9000 99 L 3.2280 8.1066 121.3848 57.3501 41.0624 179.1136 100 A 4.0141 7.4435 120.4394 55.3671 18.3755 179.6051 101 L 4.1703 8.0890 116.6576 57.7671 41.6771 179.9564 102 R 3.8565 7.8076 118.2873 59.3362 30.0729 178.5550 103 W 4.5390 8.2545 118.9230 60.1853 29.0332 177.9260 104 L 4.1008 8.6539 119.1150 58.0306 41.1225 179.4269 105 V 3.6704 8.2847 117.4342 66.5553 31.2998 178.3424 106 Q 4.0412 8.2922 116.0176 59.0190 28.8164 178.5535 107 A 4.1397 8.6280 121.8608 55.0402 18.5775 179.2909 108 A 4.0459 8.5111 119.7619 55.5845 18.2606 178.9359 109 N 4.6623 8.0632 110.8224 54.2791 38.6104 176.4262 110 Q 4.4153 8.0730 120.6676 56.0661 29.8433 176.2140 111 R 4.1597 7.0563 118.1409 55.8289 30.6965 174.5749 112 P 4.5389 0.0000 0.0000 64.0678 32.2815 176.4987 113 E 3.9334 8.2638 115.9020 56.7863 29.5810 177.2959 114 R 4.0326 8.6960 121.6090 59.2173 30.6660 178.2265 115 R 4.1324 7.8619 117.2916 55.3757 31.4937 176.6142 116 A 3.9383 8.7511 126.0680 55.5831 18.4661 179.2972 117 A 4.0648 8.0866 118.1541 55.3926 18.2584 179.7860 118 V 3.4047 7.7048 115.9043 66.3479 31.7170 178.0265 119 R 3.9544 7.7197 117.2223 59.6009 29.8967 179.1853 120 I 3.8664 7.7364 118.5398 64.2598 37.2073 178.0702 121 A 4.0285 8.0786 121.6526 56.2061 18.1685 178.8973 122 H 4.2232 8.7383 115.1579 58.3481 28.6615 177.2784 123 E 3.9632 8.7118 120.7107 59.7636 29.4869 179.6961 124 L 3.9784 8.2202 118.5835 58.1454 41.8025 179.1506 125 M 4.0298 8.0053 118.5052 58.8163 31.9300 178.5842 126 D 4.3736 8.6156 118.9232 57.3243 41.0132 178.8806 127 A 3.9458 8.2108 121.1723 55.1171 18.1900 179.5421 128 A 3.9768 8.0514 118.4537 55.1729 18.4656 179.5150 129 E 4.1115 7.9434 116.4239 60.5351 29.8598 178.5921 130 G 4.0371 6.7367 106.5301 45.4323 0.0000 173.1002 131 K 4.4009 8.5019 119.3750 55.4475 35.9774 176.3826 132 G 4.0822 8.7844 102.2740 45.9023 0.0000 174.4797 133 G 3.6960 8.7184 105.8772 48.3712 0.0000 174.8450 134 A 3.9158 8.3149 121.7475 55.7809 18.1540 179.5063 135 V 3.4630 7.7204 114.1759 65.5725 31.6465 178.5221 136 K 3.7867 7.8346 119.2415 59.3959 31.9512 178.8220 137 K 3.6433 7.9948 118.8039 59.1376 31.8965 178.8426 138 K 3.6947 7.4109 119.9104 60.0307 32.0435 178.3894 139 E 3.9946 8.4521 118.7094 59.1159 29.2796 178.7457 140 D 4.3007 8.5621 119.1259 57.6327 41.1528 178.0273 141 V 3.6094 8.5597 119.7386 65.5678 31.3057 177.4235 142 E 3.9601 8.3529 119.1964 59.8124 29.5858 179.5840 143 R 3.9948 8.2295 117.9701 59.4785 30.0226 177.7147 144 M 4.1284 8.2283 118.1724 57.8136 32.3424 176.4154 145 A 4.4104 7.9358 121.5118 52.2739 19.4186 178.4154 146 E 3.9555 8.6929 117.9130 56.9887 29.6066 174.9052 147 A 4.3942 8.1416 119.7356 52.9887 19.6256 177.3529 148 N 4.8095 7.4978 113.2546 52.8771 39.1297 177.0488 149 R 3.6916 7.8698 116.4339 59.8503 30.6950 179.0769 150 A 3.8067 7.3768 120.8928 55.6079 19.0417 178.0434 151 Y 4.2969 6.9287 112.4787 58.8072 38.0509 176.0416 152 A 4.6831 7.8014 121.4824 52.3478 20.6409 177.7662 153 H 4.6207 8.1669 110.5844 56.1437 28.8038 175.1892 154 Y 4.8948 7.4363 116.7082 61.6075 38.5286 180.4800 155 R 3.4560 7.8385 119.8578 58.4650 30.9288 176.0691 156 W 3.8602 7.9417 129.6447 57.7693 32.2217 173.4117 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 2 A 8.26 4.35 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 3 R 7.96 4.01 0.00 1.90 2.00 0.00 3.22 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 4 R 9.08 4.11 0.00 1.80 1.48 0.00 3.22 0.00 0.00 3.22 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 9.14 4.11 0.00 1.77 1.91 0.00 3.23 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 6 R 7.93 4.22 0.00 1.75 1.87 0.00 3.27 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 7 A 7.79 3.53 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 8 E 8.43 4.10 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 2.27 2.35 0.00 9 V 8.16 3.80 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 10 R 8.63 3.82 0.00 1.82 1.88 0.00 3.23 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 11 Q 8.60 4.41 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 12 L 8.12 4.52 0.00 1.72 1.65 0.92 0.59 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 13 Q 8.47 4.06 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 14 P 0.00 4.45 0.00 2.22 2.11 0.00 3.80 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 2.02 2.00 0.00 15 D 9.25 4.53 0.00 2.90 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 16 L 8.05 4.76 0.00 1.61 1.68 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.09 4.21 2.39 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 -0.01 0.00 0.00 0.33 0.00 0.00 18 Y 9.71 4.51 0.00 2.94 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.14 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.98 5.08 0.00 2.78 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 21 V 8.25 3.55 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 0.74 0.00 0.00 0.96 0.00 0.00 22 L 8.72 4.32 0.00 1.79 2.03 0.94 0.64 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 23 V 7.84 2.95 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 0.64 0.00 0.00 0.73 0.00 0.00 24 T 7.93 3.83 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 1.23 0.00 0.00 25 A 8.44 3.93 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 26 F 8.50 4.18 0.00 3.31 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 27 I 8.43 3.33 1.82 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.14 0.72 0.00 0.00 28 N 8.13 4.21 0.00 2.73 2.81 0.00 0.00 7.10 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.53 3.90 0.00 1.71 1.75 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.63 7.81 30 I 6.73 3.75 1.78 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 -0.11 0.80 0.00 0.00 31 M 7.15 4.08 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.45 0.00 32 R 7.86 4.61 0.00 1.94 1.91 0.00 3.15 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 33 D 9.47 4.57 0.00 2.82 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 34 G 8.20 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 35 K 7.50 4.33 0.00 1.85 1.76 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.68 7.81 36 K 7.69 3.99 0.00 1.80 1.80 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.47 7.81 37 N 7.89 4.34 0.00 2.81 2.79 0.00 0.00 6.82 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 38 L 7.92 3.93 0.00 1.80 1.65 0.92 1.25 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 39 A 8.11 3.93 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 40 A 7.67 3.80 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.76 4.10 0.00 2.08 1.94 0.00 3.19 0.00 0.00 3.20 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 42 I 8.03 3.55 2.02 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 1.42 1.42 0.95 0.00 0.00 43 F 7.99 4.15 0.00 2.89 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 44 Y 7.42 4.34 0.00 3.22 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 45 D 8.55 4.52 0.00 2.82 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 46 A 7.76 3.93 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 47 C 7.80 3.89 0.00 3.02 3.03 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 48 K 8.18 4.14 0.00 1.91 1.85 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.74 7.81 49 I 7.78 3.70 1.99 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 1.63 0.92 0.92 0.00 0.00 50 I 8.07 3.84 2.02 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 1.42 0.67 0.92 0.00 0.00 51 Q 7.88 4.73 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 52 E 7.65 4.55 0.00 2.03 1.94 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 2.30 2.53 0.00 53 K 7.82 4.41 0.00 1.88 1.84 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.43 7.81 54 T 7.73 4.45 4.64 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 1.26 0.00 0.00 55 G 8.60 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 56 Q 7.82 4.20 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.92 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 57 E 8.52 4.43 0.00 2.06 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 2.44 2.40 0.00 58 P 0.00 4.08 0.00 2.22 2.52 0.00 3.86 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.24 0.00 59 L 8.02 3.88 0.00 1.65 1.90 0.86 0.57 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 60 K 7.77 4.12 0.00 2.08 1.81 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.46 7.81 61 V 8.25 3.63 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 0.95 0.00 0.00 1.06 0.00 0.00 62 F 8.18 4.11 0.00 3.11 3.23 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 0.00 63 K 8.01 3.47 0.00 1.91 1.80 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.85 1.60 7.81 64 Q 7.62 3.84 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.88 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 65 A 7.89 3.99 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 66 V 7.24 3.23 1.87 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 0.88 0.00 0.00 0.15 0.00 0.00 67 E 8.07 3.82 0.00 1.90 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 2.29 2.39 0.00 68 N 8.05 4.63 0.00 2.83 2.84 0.00 0.00 6.90 8.51 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 69 V 7.66 4.21 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 1.23 0.00 0.00 1.01 0.00 0.00 70 K 7.67 4.08 0.00 1.79 1.75 0.00 1.89 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.55 1.65 7.81 71 P 0.00 4.84 0.00 2.37 2.50 0.00 3.70 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 72 R 9.17 4.43 0.00 1.91 2.22 0.00 2.72 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.58 0.00 73 M 7.96 5.30 0.00 1.87 1.96 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 74 E 9.02 4.82 0.00 2.05 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 2.15 2.21 0.00 75 V 8.37 4.87 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 0.99 0.00 0.00 0.99 0.00 0.00 76 R 8.79 4.61 0.00 1.30 1.34 0.00 2.59 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 1.31 1.31 0.00 77 S 8.84 4.72 0.00 3.98 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 78 R 8.22 4.40 0.00 2.21 1.88 0.00 2.21 0.00 0.00 2.88 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.00 0.00 79 R 8.80 4.27 0.00 1.62 1.74 0.00 3.15 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 80 V 8.09 3.76 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 0.20 0.00 0.00 0.49 0.00 0.00 81 G 8.68 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.16 4.42 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 0.00 83 A 6.81 4.16 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 84 N 8.61 4.97 0.00 2.66 2.87 0.00 0.00 6.99 7.46 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 85 Y 8.32 4.51 0.00 2.88 2.41 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 86 Q 9.09 4.16 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.73 0.00 0.00 0.00 0.00 0.00 2.48 2.40 0.00 87 V 8.98 4.76 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 1.45 0.00 0.00 1.43 0.00 0.00 88 P 0.00 5.07 0.00 2.15 2.07 0.00 4.20 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 89 M 8.43 4.38 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.50 0.00 90 E 9.11 4.47 0.00 1.87 1.94 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 2.33 2.34 0.00 91 V 7.78 4.41 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 0.72 0.00 0.00 1.00 0.00 0.00 92 S 8.65 4.24 0.00 4.01 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 93 P 0.00 4.40 0.00 2.25 2.36 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 94 R 7.81 3.84 0.00 1.91 1.92 0.00 3.19 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 95 R 7.82 3.80 0.00 1.87 1.94 0.00 3.08 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 96 Q 8.58 3.82 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.60 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 97 Q 7.73 3.85 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.53 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 98 S 7.70 4.04 0.00 3.93 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 8.11 3.23 0.00 0.93 0.13 0.68 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.44 4.01 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 0.00 101 L 8.09 4.17 0.00 1.80 2.06 1.07 0.61 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 0.00 102 R 7.81 3.86 0.00 1.89 1.86 0.00 3.03 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 103 W 8.25 4.54 0.00 3.70 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 0.00 104 L 8.65 4.10 0.00 2.21 2.01 0.76 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.28 3.67 2.23 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 0.97 0.00 0.00 0.74 0.00 0.00 106 Q 8.29 4.04 0.00 2.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 107 A 8.63 4.14 1.46 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 0.00 0.00 108 A 8.51 4.05 1.48 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 0.00 0.00 0.00 109 N 8.06 4.66 0.00 2.74 2.88 0.00 0.00 7.04 7.20 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 0.00 110 Q 8.07 4.42 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 6.90 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 111 R 7.06 4.16 0.00 2.09 2.23 0.00 3.31 0.00 0.00 3.38 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 112 P 0.00 4.54 0.00 2.18 2.18 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 113 E 8.26 3.93 0.00 2.09 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 2.30 2.37 0.00 114 R 8.70 4.03 0.00 1.83 2.04 0.00 3.21 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 115 R 7.86 4.13 0.00 1.84 1.85 0.00 3.15 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 116 A 8.75 3.94 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 0.00 117 A 8.09 4.06 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 0.00 118 V 7.70 3.40 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 0.90 0.00 0.00 0.90 0.00 0.00 119 R 7.72 3.95 0.00 2.10 2.22 0.00 3.48 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.94 0.00 120 I 7.74 3.87 1.98 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.70 1.31 0.00 0.00 121 A 8.08 4.03 1.45 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 0.00 0.00 122 H 8.74 4.22 0.00 3.25 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.71 3.96 0.00 2.23 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 0.00 2.49 2.53 0.00 124 L 8.22 3.98 0.00 2.03 1.74 1.08 0.78 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 0.00 125 M 8.01 4.03 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.62 0.00 126 D 8.62 4.37 0.00 2.92 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 0.00 127 A 8.21 3.95 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 0.00 128 A 8.05 3.98 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 0.00 129 E 7.94 4.11 0.00 2.11 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 2.52 2.46 0.00 130 G 6.74 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 0.00 131 K 8.50 4.40 0.00 1.75 1.77 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.41 7.81 132 G 8.78 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 0.00 133 G 8.72 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 0.00 134 A 8.31 3.92 1.45 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 0.00 0.00 135 V 7.72 3.46 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 1.08 0.00 0.00 0.99 0.00 0.00 136 K 7.83 3.79 0.00 1.88 1.82 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.57 7.81 137 K 7.99 3.64 0.00 0.91 0.74 0.00 1.39 0.00 0.00 1.12 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.13 1.36 7.81 138 K 7.41 3.69 0.00 1.91 1.99 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.29 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.61 1.90 7.81 139 E 8.45 3.99 0.00 1.96 1.94 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 2.30 2.56 0.00 140 D 8.56 4.30 0.00 2.88 2.54 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 0.00 0.00 0.00 0.00 141 V 8.56 3.61 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 1.21 0.00 0.00 0.93 0.00 0.00 142 E 8.35 3.96 0.00 1.99 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 2.56 0.00 143 R 8.23 3.99 0.00 1.82 2.16 0.00 3.26 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 144 M 8.23 4.13 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.72 0.00 145 A 7.94 4.41 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 0.00 146 E 8.69 3.96 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 147 A 8.14 4.39 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 0.00 148 N 7.50 4.81 0.00 2.59 3.00 0.00 0.00 6.78 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 0.00 149 R 7.87 3.69 0.00 1.74 1.86 0.00 3.29 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 150 A 7.38 3.81 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 6.93 4.30 0.00 3.00 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 0.00 152 A 7.80 4.68 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.17 4.62 0.00 3.41 3.42 0.00 5.48 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.44 4.89 0.00 3.06 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 0.00 155 R 7.84 3.46 0.00 1.95 2.18 0.00 3.52 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 156 W 7.94 3.86 0.00 3.90 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