NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8070 8.3393 109.7270 45.6830 0.0000 172.6492 2 I 4.0646 7.4729 114.6571 59.0667 39.5180 173.0655 3 S 4.5604 8.6191 116.4428 56.2790 67.4569 175.0563 4 Y 4.2968 8.5725 120.4108 58.6710 37.6176 177.0564 5 S 4.3822 9.0517 119.8770 59.3511 63.6952 174.3029 6 V 4.4789 7.3804 119.8132 60.8207 34.3970 174.4725 7 E 4.2214 8.5730 123.9919 55.9603 30.1898 176.3223 8 A 4.4913 8.0700 124.2352 50.1963 22.1502 175.2025 9 D 4.5076 8.6467 123.3440 52.8941 41.6217 175.0119 10 P 4.3228 0.0000 0.0000 65.9996 31.3167 177.4849 11 D 4.6361 8.2135 117.7952 56.5836 40.9236 176.4986 12 T 5.2400 7.9173 109.2901 61.1324 69.7927 173.6252 13 T 4.6942 7.9759 115.2624 63.4542 72.8865 172.9487 14 A 4.7056 8.5714 125.3084 50.2037 22.3162 175.7152 15 K 4.9656 8.3205 120.2062 55.1164 35.1666 175.5547 16 A 4.5874 8.2871 119.5348 51.8367 22.8723 175.5452 17 M 5.7078 8.6480 119.6104 52.7884 36.7441 174.4368 18 L 4.8154 8.3116 119.4499 53.0223 45.5549 175.6099 19 R 4.8075 8.4645 121.1924 55.1106 32.8793 175.7690 20 E 3.7038 9.0271 122.7624 57.1311 27.9794 175.9560 21 R 4.0205 8.1496 118.7294 56.3811 31.4024 177.4417 22 Q 5.0536 9.0516 124.0861 55.0136 27.9129 174.7463 23 M 4.7121 7.9769 119.8155 53.8032 34.6592 174.4734 24 S 4.1467 8.6128 114.1142 58.3922 63.2976 174.6336 25 F 4.4710 8.9222 129.5976 61.3212 39.2908 177.4534 26 K 3.6032 7.8240 117.7478 59.5081 31.7809 178.8625 27 H 4.2579 8.5442 116.9650 58.6318 28.6326 178.0189 28 S 4.3032 7.7650 117.4403 61.3369 62.6799 176.7762 29 K 3.7992 7.6525 120.6673 59.2958 31.2748 179.1463 30 A 3.8314 7.2872 119.5649 55.0954 18.2157 179.8755 31 I 3.5116 7.4012 117.5378 64.2906 37.1907 178.2826 32 A 3.9205 7.5911 121.4277 55.3751 18.0435 179.2883 33 R 3.7317 7.4904 115.5260 59.9580 30.0581 177.8398 34 E 3.9605 7.5200 117.2601 58.5914 30.0398 177.8773 35 I 4.0423 7.5913 111.1446 59.8515 38.0427 175.3776 36 K 4.1190 7.2684 123.4957 58.2322 32.1638 176.6514 37 G 4.0022 8.6628 115.2423 45.1537 0.0000 173.6900 38 K 4.4386 7.8261 119.3036 55.7071 33.2996 176.6418 39 T 4.4510 9.3259 118.1647 63.0317 70.3261 175.6322 40 A 4.1101 8.7832 127.2489 55.7932 18.3732 180.8428 41 G 3.5942 8.1496 103.8069 47.8052 0.0000 175.7478 42 E 3.9828 8.1184 120.1633 59.1561 29.5900 179.0352 43 A 4.0266 8.2115 120.8470 55.2196 18.6021 179.6432 44 V 3.5850 7.9288 116.6969 66.4881 31.3531 177.9380 45 D 4.4045 8.1339 117.1860 57.5150 40.9550 177.8690 46 Y 4.1877 8.3487 120.1103 60.8665 38.8860 177.9556 47 L 3.8671 8.7130 120.1194 58.1250 41.7166 179.6196 48 E 4.0224 8.1749 117.6210 59.0654 29.4191 179.0964 49 A 3.9599 7.9742 121.0335 54.7029 18.3617 179.9739 50 V 4.2437 7.2630 117.8026 65.9862 31.5508 178.1410 51 I 3.7178 7.3854 118.1012 64.4155 36.9947 177.7815 52 E 4.0956 8.1803 119.1679 57.1756 29.4374 177.3897 53 G 3.4841 7.9553 106.2810 45.8554 0.0000 173.6887 54 D 4.7124 8.4304 120.1718 53.7254 42.6778 176.4215 55 Q 4.4910 7.8382 120.1058 53.3172 31.1685 172.1466 56 P 4.5085 0.0000 0.0000 62.2451 33.1455 175.4070 57 V 4.4128 8.2368 122.0675 60.6111 33.3342 173.3289 58 P 4.8744 0.0000 0.0000 63.2320 31.8485 176.5991 59 F 4.7949 9.2194 124.4788 56.1351 38.0396 175.4512 60 K 3.4564 8.2924 122.5555 57.2395 32.5913 177.2277 61 Q 4.2757 7.6738 116.8492 57.6858 30.6411 176.2389 62 H 4.6873 7.4859 117.9203 54.2620 27.4477 174.4986 63 N 5.1608 8.0491 115.8462 51.8262 38.3797 174.9482 64 S 4.2876 8.1810 114.0136 60.9656 62.8168 174.4149 65 G 3.9915 8.9530 114.7732 44.9828 0.0000 173.4602 66 V 3.6867 7.5867 119.5679 62.8871 30.8529 175.4992 67 G 4.0385 8.2940 113.0309 45.3487 0.0000 172.8445 68 H 4.8912 8.5909 118.8042 55.7608 30.0013 174.9978 69 K 4.6420 8.9330 120.4790 54.4955 34.7915 177.7780 70 S 4.1178 9.0391 120.0626 61.3792 63.0571 175.4046 71 K 4.2076 7.9617 117.0513 56.7956 31.9744 176.5889 72 V 3.9323 7.4614 120.1251 61.9165 32.0244 174.4447 73 D 4.7307 8.8768 126.9415 53.8812 42.2148 176.2419 74 G 4.0432 10.0043 114.9770 45.2470 0.0000 171.8322 75 W 5.2540 7.5057 127.2140 56.3981 33.9296 171.9378 76 D 4.3585 6.8401 113.4698 54.7431 40.4957 175.2622 77 A 4.6152 7.2353 122.9360 51.2298 19.6858 175.9421 78 G 4.1088 7.6597 105.9219 46.1159 0.0000 172.8113 79 R 4.0074 7.4978 118.5284 54.6046 34.8634 173.7928 80 Y 4.7191 7.9109 113.3954 56.1459 37.7718 174.4658 81 P 4.5173 0.0000 0.0000 62.1728 30.3491 177.1599 82 E 4.0041 8.6240 122.5338 58.9749 29.7443 178.8563 83 K 3.9154 8.0750 119.9948 59.2890 32.4206 178.5166 84 A 4.1847 8.0666 120.5163 55.2637 18.5094 179.5310 85 S 4.1555 8.2593 113.7419 61.8151 62.7927 177.0831 86 K 4.0454 8.4811 121.0921 59.4566 31.7880 179.2612 87 A 4.0428 7.9805 121.2256 55.2186 18.3001 179.7330 88 F 4.0127 8.3660 115.9008 60.4176 38.9361 177.8615 89 L 4.1979 8.0215 118.2842 57.4065 41.4240 178.9939 90 D 4.4486 7.8482 119.4420 56.8864 40.7974 178.4138 91 L 3.9852 7.7082 120.6337 57.8488 42.0864 178.7042 92 L 4.2229 8.1629 118.6103 56.7441 41.6940 178.9388 93 E 3.9404 7.8985 119.5340 59.2233 29.6648 178.2485 94 N 4.3132 8.1576 116.8458 56.4855 38.9953 176.5276 95 A 3.9428 8.0019 122.2129 55.4491 18.5874 179.8586 96 V 3.6757 8.0120 116.5058 65.7628 31.6299 178.5752 97 G 3.5995 8.1106 105.6493 48.0257 0.0000 175.4846 98 N 4.4244 8.5091 118.5677 55.5342 38.7872 177.1495 99 A 4.2992 8.2144 122.2140 55.4467 18.5867 179.3799 100 D 4.5412 8.2699 117.2535 57.8555 40.7930 178.3642 101 H 4.4670 8.1100 116.1337 58.0275 29.9078 175.9269 102 Q 4.4924 8.0859 117.6782 55.8815 29.4536 176.0905 103 G 3.7755 8.4728 109.1067 45.1422 0.0000 173.7314 104 F 4.5821 7.6239 118.1679 56.3594 40.4319 174.9736 105 D 4.7972 8.5412 120.6011 52.2227 40.7368 176.4924 106 G 3.9257 9.0385 114.4878 48.6991 0.0000 173.5622 107 E 3.9071 8.3313 119.6405 58.4556 29.6393 178.4784 108 A 4.3930 7.5358 118.0608 52.4449 19.1435 176.8809 109 M 4.4570 7.8723 117.3118 55.2342 33.9632 175.8049 110 T 4.6041 8.4637 118.0443 63.0823 70.9637 174.7266 111 I 4.4560 8.2684 126.6495 60.2452 36.3102 176.3417 112 K 4.0377 8.7231 129.0741 59.3102 32.9737 176.4026 113 H 5.1171 7.9898 118.1011 54.9553 33.6204 172.9980 114 V 5.3114 8.1747 122.3641 61.9101 33.7789 172.4963 115 A 4.7966 8.4927 126.3373 50.0946 22.7694 174.0962 116 A 5.1995 8.6457 122.4752 50.7886 21.4737 176.1104 117 H 4.8608 9.1702 117.4109 53.8453 33.3593 172.8189 118 K 4.0433 7.9292 124.1608 55.5023 31.9326 176.2889 119 V 3.9972 8.9106 120.8582 60.6365 32.4238 176.7627 120 G 4.0299 6.6683 109.1593 44.9627 0.0000 170.7273 121 E 5.0298 7.8694 118.0141 54.4495 33.2478 175.6027 122 Q 4.3170 9.1961 126.3173 55.2954 30.1942 174.6723 123 Q 4.8680 8.7506 126.3739 55.7661 30.0058 175.4546 124 G 4.5639 9.6422 109.7161 43.5735 0.0000 171.0372 125 R 5.1667 8.4776 118.9576 54.4455 33.2289 173.7536 126 K 4.2812 9.0043 128.1305 53.7000 34.2912 173.4188 127 P 4.6354 0.0000 0.0000 63.0427 31.9206 176.0792 128 R 4.7959 8.7202 123.8065 54.0586 33.0648 175.3511 129 A 4.1723 8.4149 122.1823 53.1714 19.1387 177.4714 130 M 3.0515 9.2811 115.3795 56.3520 29.3072 177.8127 131 G 3.8490 8.3407 104.3674 46.3059 0.0000 173.6927 132 R 4.8119 7.5515 118.3198 54.1081 33.1679 174.4509 133 A 5.3017 8.4593 123.7234 50.2246 22.4462 175.1694 134 S 4.8671 8.8489 113.3113 55.9484 67.2613 173.2037 135 A 4.3249 8.6656 122.1392 52.4776 18.8299 178.1578 136 W 5.0621 9.0349 130.6620 56.0498 31.5483 173.3520 137 N 5.3125 8.1366 120.7670 51.3148 41.5147 174.0584 138 S 4.7261 8.5882 115.4450 56.0806 66.4391 172.6500 139 P 4.6240 0.0000 0.0000 62.6743 32.9924 175.2723 140 Q 4.8648 8.8943 121.3812 54.2585 31.7516 174.5989 141 V 4.8580 8.6320 124.5680 61.1137 34.4064 174.1034 142 D 5.6872 9.0983 126.9046 52.0586 44.4981 175.8584 143 V 4.8769 7.8688 119.9806 60.7612 34.6709 172.7884 144 E 4.8419 8.7976 123.5592 55.1802 31.9251 174.9257 145 L 5.2339 8.8663 122.7528 53.8307 46.4038 174.6235 146 I 4.7955 9.1648 126.2455 59.6153 40.8355 174.2191 147 L 5.0238 9.0102 127.6535 53.2809 43.8066 175.3619 148 E 5.0652 9.2208 123.3037 53.9523 33.5503 174.5821 149 E 4.3231 8.2727 124.8131 55.4499 30.3040 175.5619 150 P 4.3808 0.0000 0.0000 63.2385 31.4345 176.0826 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 G 8.34 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 7.47 4.06 1.66 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.60 0.73 0.00 0.00 3 S 8.62 4.56 0.00 3.79 3.76 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 4 Y 8.57 4.30 0.00 2.96 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 5 S 9.05 4.38 0.00 4.02 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 6 V 7.38 4.48 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.63 0.00 0.00 7 E 8.57 4.22 0.00 1.99 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 0.00 2.31 2.30 0.00 8 A 8.07 4.49 1.06 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 0.00 0.00 9 D 8.65 4.51 0.00 2.68 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 10 P 0.00 4.32 0.00 2.23 2.17 0.00 3.81 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 2.00 2.00 0.00 11 D 8.21 4.64 0.00 2.90 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.92 5.24 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 1.36 0.00 0.00 13 T 7.98 4.69 4.46 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 1.10 0.00 0.00 14 A 8.57 4.71 1.08 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 15 K 8.32 4.97 0.00 1.54 1.62 0.00 1.48 0.00 0.00 0.61 0.00 0.00 2.21 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.73 1.14 7.81 16 A 8.29 4.59 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 17 M 8.65 5.71 0.00 1.75 1.88 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.32 0.00 18 L 8.31 4.82 0.00 1.41 1.41 0.73 0.74 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 19 R 8.46 4.81 0.00 1.62 1.76 0.00 3.45 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 20 E 9.03 3.70 0.00 1.99 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 2.23 2.22 0.00 21 R 8.15 4.02 0.00 1.81 1.86 0.00 3.27 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 22 Q 9.05 5.05 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.20 0.00 23 M 7.98 4.71 0.00 2.03 2.09 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 2.58 2.75 0.00 24 S 8.61 4.15 0.00 3.73 3.73 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 25 F 8.92 4.47 0.00 3.07 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 26 K 7.82 3.60 0.00 1.58 1.50 0.00 1.53 0.00 0.00 1.43 0.00 0.00 2.59 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.95 1.32 7.81 27 H 8.54 4.26 0.00 3.30 3.34 0.00 5.64 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 28 S 7.77 4.30 0.00 4.11 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 29 K 7.65 3.80 0.00 1.54 1.61 0.00 1.37 0.00 0.00 1.32 0.00 0.00 2.13 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.85 0.86 7.81 30 A 7.29 3.83 1.11 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 31 I 7.40 3.51 1.11 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.70 -0.07 0.00 0.00 32 A 7.59 3.92 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 33 R 7.49 3.73 0.00 1.80 2.14 0.00 3.10 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 34 E 7.52 3.96 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.86 0.00 35 I 7.59 4.04 1.84 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.62 0.86 0.00 0.00 36 K 7.27 4.12 0.00 1.85 1.73 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.40 7.81 37 G 8.66 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 38 K 7.83 4.44 0.00 1.93 1.76 0.00 1.47 0.00 0.00 1.52 0.00 0.00 2.74 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.35 1.29 7.81 39 T 9.33 4.45 4.40 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 0.00 0.00 1.34 0.00 0.00 40 A 8.78 4.11 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 41 G 8.15 3.59 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 0.00 0.00 0.00 42 E 8.12 3.98 0.00 2.28 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 43 A 8.21 4.03 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 44 V 7.93 3.59 2.26 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 1.06 0.00 0.00 1.02 0.00 0.00 45 D 8.13 4.40 0.00 2.91 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 46 Y 8.35 4.19 0.00 3.14 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.71 3.87 0.00 1.74 1.76 1.04 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.17 4.02 0.00 2.17 1.99 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 2.34 2.57 0.00 49 A 7.97 3.96 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 50 V 7.26 4.24 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 0.90 0.00 0.00 0.39 0.00 0.00 51 I 7.39 3.72 1.99 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 1.42 0.92 0.91 0.00 0.00 52 E 8.18 4.10 0.00 2.02 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 2.30 2.43 0.00 53 G 7.96 3.48 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 0.00 54 D 8.43 4.71 0.00 2.58 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 55 Q 7.84 4.49 0.00 2.02 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.04 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 56 P 0.00 4.51 0.00 1.86 1.70 0.00 3.84 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 1.96 1.95 0.00 57 V 8.24 4.41 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 1.11 0.00 0.00 0.98 0.00 0.00 58 P 0.00 4.87 0.00 1.95 2.04 0.00 3.76 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.19 0.00 59 F 9.22 4.79 0.00 2.89 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 60 K 8.29 3.46 0.00 1.27 0.88 0.00 1.33 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.95 7.81 61 Q 7.67 4.28 0.00 1.75 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.39 0.00 0.00 0.00 0.00 0.00 1.93 2.18 0.00 62 H 7.49 4.69 0.00 3.01 3.16 0.00 5.69 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.05 5.16 0.00 3.11 3.49 0.00 0.00 5.85 7.64 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 64 S 8.18 4.29 0.00 4.03 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 65 G 8.95 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 0.00 0.00 0.00 66 V 7.59 3.69 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 0.69 0.00 0.00 1.06 0.00 0.00 67 G 8.29 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 68 H 8.59 4.89 0.00 2.98 3.15 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 69 K 8.93 4.64 0.00 1.55 1.63 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.40 1.30 7.81 70 S 9.04 4.12 0.00 3.98 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 71 K 7.96 4.21 0.00 1.81 1.93 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.45 7.81 72 V 7.46 3.93 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 0.91 0.00 0.00 0.96 0.00 0.00 73 D 8.88 4.73 0.00 2.66 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 74 G 10.00 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 75 W 7.51 5.25 0.00 3.25 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 76 D 6.84 4.36 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.24 4.62 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 78 G 7.66 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 79 R 7.50 4.01 0.00 0.67 1.38 0.00 2.83 0.00 0.00 3.06 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.00 0.00 80 Y 7.91 4.72 0.00 2.72 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 81 P 0.00 4.52 0.00 2.19 1.94 0.00 3.60 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.13 0.00 82 E 8.62 4.00 0.00 2.26 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 0.00 2.38 2.46 0.00 83 K 8.08 3.92 0.00 1.90 1.92 0.00 1.77 0.00 0.00 1.88 0.00 0.00 3.13 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.56 7.81 84 A 8.07 4.18 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.26 4.16 0.00 4.24 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.48 4.05 0.00 2.00 1.91 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.73 7.81 87 A 7.98 4.04 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 88 F 8.37 4.01 0.00 3.32 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 89 L 8.02 4.20 0.00 1.99 1.77 0.96 0.93 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 90 D 7.85 4.45 0.00 2.94 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 91 L 7.71 3.99 0.00 1.75 1.77 0.87 0.59 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 92 L 8.16 4.22 0.00 1.81 1.74 1.03 0.66 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 93 E 7.90 3.94 0.00 2.19 2.13 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 2.32 2.33 0.00 94 N 8.16 4.31 0.00 2.91 2.80 0.00 0.00 7.15 7.99 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 95 A 8.00 3.94 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.01 3.68 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 1.05 0.00 0.00 0.97 0.00 0.00 97 G 8.11 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.51 4.42 0.00 2.81 2.95 0.00 0.00 7.10 7.38 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 99 A 8.21 4.30 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 0.00 100 D 8.27 4.54 0.00 2.77 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 0.00 101 H 8.11 4.47 0.00 3.16 3.53 0.00 5.92 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 0.00 102 Q 8.09 4.49 0.00 2.52 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.39 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 103 G 8.47 3.78 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 0.00 0.00 0.00 104 F 7.62 4.58 0.00 3.21 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 0.00 105 D 8.54 4.80 0.00 2.78 2.60 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 0.00 106 G 9.04 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.33 3.91 0.00 2.06 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 2.43 2.35 0.00 108 A 7.54 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 0.00 109 M 7.87 4.46 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.51 0.00 110 T 8.46 4.60 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 1.24 0.00 0.00 111 I 8.27 4.46 1.94 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 1.13 1.34 0.93 0.00 0.00 112 K 8.72 4.04 0.00 1.77 1.95 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.39 7.81 113 H 7.99 5.12 0.00 3.23 3.11 0.00 5.78 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.17 5.31 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 0.52 0.00 0.00 1.13 0.00 0.00 115 A 8.49 4.80 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.65 5.20 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 0.00 117 H 9.17 4.86 0.00 3.04 3.10 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.93 4.04 0.00 0.79 1.07 0.00 1.52 0.00 0.00 1.49 0.00 0.00 2.66 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.09 1.06 7.81 119 V 8.91 4.00 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 0.61 0.00 0.00 0.94 0.00 0.00 120 G 6.67 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 0.00 121 E 7.87 5.03 0.00 1.77 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 2.16 2.22 0.00 122 Q 9.20 4.32 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 123 Q 8.75 4.87 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 124 G 9.64 4.56 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 0.00 125 R 8.48 5.17 0.00 1.78 1.76 0.00 3.30 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 126 K 9.00 4.28 0.00 1.07 1.59 0.00 1.10 0.00 0.00 1.11 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.67 1.14 7.81 127 P 0.00 4.64 0.00 1.89 1.93 0.00 3.50 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.06 0.00 128 R 8.72 4.80 0.00 1.74 1.86 0.00 3.34 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 129 A 8.41 4.17 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 0.00 130 M 9.28 3.05 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 131 G 8.34 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 0.00 0.00 0.00 132 R 7.55 4.81 0.00 1.90 1.94 0.00 3.05 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 133 A 8.46 5.30 1.18 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 0.00 134 S 8.85 4.87 0.00 3.94 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 0.00 135 A 8.67 4.32 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 0.00 136 W 9.03 5.06 0.00 3.40 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 0.00 137 N 8.14 5.31 0.00 2.59 2.80 0.00 0.00 7.01 7.57 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 0.00 138 S 8.59 4.73 0.00 3.73 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 0.00 139 P 0.00 4.62 0.00 2.32 1.97 0.00 3.52 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 2.10 2.09 0.00 140 Q 8.89 4.86 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 141 V 8.63 4.86 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 1.25 0.00 0.00 1.07 0.00 0.00 142 D 9.10 5.69 0.00 2.62 2.45 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 0.00 143 V 7.87 4.88 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.84 0.00 0.00 144 E 8.80 4.84 0.00 2.12 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 2.36 2.26 0.00 145 L 8.87 5.23 0.00 1.79 1.67 1.04 1.08 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 0.00 146 I 9.16 4.80 1.92 0.00 0.00 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 1.22 0.81 0.85 0.00 0.00 147 L 9.01 5.02 0.00 1.52 1.44 0.89 0.62 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 0.00 148 E 9.22 5.07 0.00 1.88 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 0.00 2.14 2.20 0.00 149 E 8.27 4.32 0.00 1.86 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 150 P 0.00 4.38 0.00 2.04 2.00 0.00 3.73 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.22 0.00