NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 E 4.1845 8.4444 121.4603 55.9983 31.5919 174.9824 10 M 4.1077 7.6781 117.8813 54.1254 33.2585 173.4951 11 K 4.3735 9.3726 126.9375 55.0895 34.9401 175.2095 12 K 5.0089 8.3919 121.1363 54.8370 35.7445 175.6981 13 G 4.2551 8.9410 111.9669 43.5031 0.0000 172.9169 14 R 3.8354 8.5664 118.5409 58.9619 29.6789 178.7498 15 G 4.1196 6.0881 104.3789 44.5239 0.0000 171.5598 16 Y 4.7664 6.4477 113.4379 55.7244 40.9498 172.8436 17 V 5.0816 8.4244 120.6842 61.5979 34.6020 173.8373 18 Y 4.8062 8.7094 124.5487 56.9111 42.0793 173.6401 19 Q 4.6003 8.5956 120.5291 55.5877 30.6531 172.6828 20 L 4.6320 8.6438 126.5436 52.7511 44.7667 175.4525 21 E 5.7104 8.1450 122.3891 53.8144 33.8588 174.5058 22 Y 5.3420 8.3895 118.9193 56.8852 43.1066 173.4462 23 H 5.4253 9.3395 119.6666 54.4403 31.2829 173.8789 24 L 5.3930 9.4385 124.9015 53.4927 45.2873 175.1572 25 I 5.5743 9.5641 126.4485 58.4236 41.5076 174.3311 26 W 5.4752 8.0283 120.6311 55.7321 31.6786 173.1036 27 C 5.3410 8.7942 118.1294 57.8677 31.4475 173.2228 28 V 4.5905 8.9561 120.5525 62.3214 32.7442 175.5001 29 K 3.9082 9.0410 127.8466 58.0280 32.4165 176.8928 30 Y 3.6224 8.5156 120.9430 57.9266 35.5250 169.5447 31 R 3.9806 8.1623 117.6828 57.3182 29.2063 175.8217 32 H 4.4425 7.9090 112.1741 55.7848 29.6135 176.7662 33 Q 4.4647 8.4234 124.8896 55.1254 27.4012 176.4357 34 V 3.8725 7.4008 111.7019 63.6688 33.0138 178.4049 35 L 4.3357 8.1359 121.4791 54.5800 39.0027 176.1315 36 V 4.7140 7.1942 114.6422 59.6728 37.3902 178.3575 37 G 3.8150 8.3046 110.8974 46.2964 0.0000 176.2413 38 E 3.9535 8.7898 122.1800 59.1847 29.0778 178.7108 39 V 2.3855 7.3703 117.5864 65.4045 31.4945 177.8583 40 A 3.9656 7.6877 120.1836 55.1788 18.2460 179.3880 41 D 4.4161 8.2304 117.6256 57.4270 40.8836 179.2730 42 G 4.3454 8.3029 107.7957 47.2269 0.0000 175.3419 43 L 4.0937 8.0413 122.7989 57.9387 41.9995 179.0436 44 K 3.9006 7.8729 118.0237 59.9021 31.9904 178.9710 45 D 4.3789 7.7427 118.1088 57.2917 40.7356 178.8713 46 I 3.7483 7.8199 120.2887 64.5309 37.1214 178.5099 47 L 4.1028 8.4783 120.0913 57.8610 41.4679 179.7782 48 R 3.9441 8.2583 118.1219 59.4255 30.0276 178.8485 49 D 4.3902 8.4156 118.8294 57.4278 40.9196 178.9441 50 I 3.7136 7.9327 120.0643 64.1855 37.1182 178.2840 51 A 3.9210 8.3891 121.7488 55.1285 18.2585 179.5108 52 A 3.9028 8.0513 119.1917 55.4779 18.2949 179.6578 53 Q 4.0052 8.0690 116.5497 58.5820 29.0080 177.2980 54 N 4.9068 7.6517 115.3010 52.0715 39.0063 174.8671 55 G 3.9438 7.9593 107.4482 46.6386 0.0000 173.8992 56 L 4.8665 8.1677 118.3614 52.4267 44.7596 175.6303 57 E 4.5234 8.6345 122.3133 54.4146 32.1239 175.1767 58 V 4.1821 8.4145 127.5246 62.5110 31.0688 175.7405 59 I 3.9961 8.6647 129.6119 64.1682 37.4497 176.9802 60 T 4.7393 7.7180 117.2214 61.8943 72.8548 172.4948 61 M 5.0405 8.5427 123.8397 53.9476 35.5110 173.8769 62 E 4.5307 9.3380 125.4538 54.6212 33.1449 174.9915 63 V 4.3409 8.4425 125.4792 61.6174 32.5131 175.0376 64 M 4.4874 8.5199 128.3456 52.8483 34.0847 175.6201 65 P 4.8449 0.0000 0.0000 64.5626 31.7223 177.7273 66 D 5.0556 7.8310 114.4967 53.0619 40.2258 174.4357 67 H 5.0211 7.5999 114.8501 55.2021 32.5572 172.5444 68 V 4.5063 8.0147 118.5864 61.0972 34.8088 173.6158 69 H 5.2971 9.0249 126.1054 54.4126 32.9147 172.0283 70 L 5.1778 9.3000 125.1654 52.7304 46.0371 175.1518 71 L 5.1458 8.7978 124.3017 53.4925 44.2223 175.1943 72 L 5.3042 9.2981 126.2644 52.9396 45.7349 175.2917 73 S 5.1813 8.7813 115.4997 56.6578 64.9793 172.8488 74 A 5.0814 9.1479 128.3031 50.5702 23.0411 174.7474 75 T 3.8846 8.8125 109.5288 59.2460 70.7682 174.3764 76 P 4.0431 0.0000 0.0000 65.5241 31.2089 177.9397 77 Q 3.9594 7.1590 113.4736 56.7623 28.6450 176.1150 78 Q 4.3295 7.6073 117.9062 54.3628 28.4544 175.8133 79 A 4.1972 8.1843 125.5343 51.2177 20.5422 177.3298 80 I 2.0181 7.9354 124.5543 63.8163 37.2526 177.2336 81 P 3.8751 0.0000 0.0000 65.3204 31.0831 178.5753 82 D 4.1602 7.6150 117.5585 57.3603 40.8855 178.6126 83 F 4.3155 7.7878 114.8672 59.4243 37.9282 177.8254 84 V 3.1996 7.1826 119.4995 65.5571 31.1122 177.8071 85 K 3.7216 7.6385 119.1638 59.2529 31.9893 178.5463 86 A 3.9140 7.9010 120.8686 55.1456 18.0418 179.4021 87 L 3.8556 7.9693 117.5920 57.9547 41.7459 180.1638 88 K 3.5036 7.9240 118.4958 59.0250 32.1260 179.7600 89 G 3.6089 8.2056 106.0249 47.9761 0.0000 175.6979 90 A 4.1499 8.0938 124.1175 54.4854 18.2823 179.9070 91 S 4.2344 8.0177 111.6671 61.5402 63.2053 176.5863 92 A 3.7944 8.5404 124.4925 54.7581 17.9825 179.5071 93 R 3.9586 7.9824 116.7170 59.9163 30.2227 179.0553 94 R 4.0221 8.1042 117.7248 59.1791 30.0509 178.9244 95 M 4.1811 8.4691 119.1007 58.5699 31.7515 178.8280 96 F 4.3682 7.9251 116.6340 60.4138 39.0999 177.7040 97 V 3.7504 7.5034 117.0859 66.0431 31.4879 177.7171 98 A 4.0355 8.2128 119.4123 53.3142 19.6933 177.0902 99 Y 4.6921 8.2249 115.2624 54.3844 38.5237 173.9177 100 P 4.4338 0.0000 0.0000 65.5565 31.7830 177.5659 101 Q 4.1171 8.3495 115.7713 59.2286 28.3761 178.6478 102 L 4.1764 8.3358 121.0257 57.4122 41.3519 179.2227 103 K 4.9598 8.6962 119.5971 58.2864 32.0197 178.5138 104 E 4.3202 8.3847 117.2127 58.0859 29.7917 177.4125 105 K 4.9282 8.3034 116.1255 56.1052 34.6616 176.2541 106 L 4.5425 8.2069 118.5624 52.3636 42.3323 176.3345 107 W 4.7026 7.6915 116.4153 55.9995 29.0565 177.3847 108 G 3.7504 7.7010 107.4019 45.7825 0.0000 174.7192 109 G 3.8042 8.3374 106.9560 45.0397 0.0000 173.1376 110 N 5.0313 7.6610 115.6937 51.2701 42.0519 173.6858 111 L 4.2535 8.6216 124.2706 56.0715 43.7135 176.0548 112 W 5.6775 7.6474 116.4611 54.7340 31.3226 175.9827 113 N 4.5835 9.3117 122.4049 53.1071 38.9019 173.3466 114 P 4.5335 0.0000 0.0000 63.6883 31.6697 175.8105 115 S 4.8179 8.8508 115.4451 57.0573 65.6158 172.5628 116 Y 5.1988 7.5173 118.4304 55.6481 41.3029 173.7873 117 C 4.8952 9.6354 121.6365 57.7389 34.1149 172.4432 118 I 5.4113 8.4591 125.3252 59.4826 41.0212 174.0134 119 L 5.1179 9.2028 128.1805 52.9684 45.7919 176.1572 120 T 4.4661 8.7897 113.4597 61.8255 69.6889 173.8118 121 V 4.4380 8.4167 123.4885 62.7937 34.5917 173.3380 122 S 4.5540 8.6963 117.2881 58.2769 62.6872 172.7956 123 E 4.7300 9.2588 118.5124 56.1852 36.2129 174.0817 124 N 5.0834 7.8773 114.1809 51.6134 41.0276 175.4350 125 T 4.2213 8.3191 118.1886 63.0634 70.6417 176.3583 126 R 3.9545 8.5227 119.4802 59.3710 29.3601 178.9245 127 A 4.0002 7.9438 121.0931 55.2845 18.6092 179.5063 128 Q 4.0462 7.9655 115.9681 58.9054 28.9149 178.9566 129 I 3.7891 7.8183 121.1260 64.2942 36.9779 178.1395 130 Q 4.0577 8.2912 118.1844 59.1114 28.6673 179.1782 131 K 4.1350 7.8503 117.8563 59.7122 32.2284 178.2940 132 Y 4.2764 7.7431 118.1828 60.2239 39.7190 177.8646 133 I 4.2196 7.4947 120.6579 60.0102 34.6711 175.6101 134 E 4.2265 7.7781 123.3454 56.4799 29.3483 174.7784 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 9 E 8.44 4.18 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 10 M 7.68 4.11 0.00 2.05 1.87 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.64 0.00 11 K 9.37 4.37 0.00 0.79 1.12 0.00 1.32 0.00 0.00 1.48 0.00 0.00 2.82 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.26 1.27 7.81 12 K 8.39 5.01 0.00 1.54 1.63 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.32 7.81 13 G 8.94 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 14 R 8.57 3.84 0.00 1.67 1.83 0.00 3.15 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 15 G 6.09 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 6.45 4.77 0.00 3.26 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.42 5.08 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 0.86 0.00 0.00 0.94 0.00 0.00 18 Y 8.71 4.81 0.00 3.10 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 Q 8.60 4.60 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 20 L 8.64 4.63 0.00 1.79 1.35 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.14 5.71 0.00 1.88 1.69 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 2.22 2.06 0.00 22 Y 8.39 5.34 0.00 2.94 2.94 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 23 H 9.34 5.43 0.00 3.18 3.28 0.00 5.56 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 9.44 5.39 0.00 1.87 1.68 1.09 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 25 I 9.56 5.57 1.91 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 0.85 1.45 0.92 0.00 0.00 26 W 8.03 5.48 0.00 3.41 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 27 C 8.79 5.34 0.00 2.99 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 28 V 8.96 4.59 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 0.97 0.00 0.00 1.10 0.00 0.00 29 K 9.04 3.91 0.00 1.76 1.46 0.00 1.30 0.00 0.00 1.53 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 0.21 7.81 30 Y 8.52 3.62 0.00 2.73 2.85 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 31 R 8.16 3.98 0.00 1.97 2.03 0.00 3.30 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 32 H 7.91 4.44 0.00 3.25 3.24 0.00 5.72 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 33 Q 8.42 4.46 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 34 V 7.40 3.87 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 0.73 0.00 0.00 0.86 0.00 0.00 35 L 8.14 4.34 0.00 1.92 1.62 0.86 0.95 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 36 V 7.19 4.71 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 0.90 0.00 0.00 0.95 0.00 0.00 37 G 8.30 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 38 E 8.79 3.95 0.00 1.94 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 2.40 2.35 0.00 39 V 7.37 2.39 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 0.72 0.00 0.00 0.41 0.00 0.00 40 A 7.69 3.97 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 41 D 8.23 4.42 0.00 2.86 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 42 G 8.30 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.04 4.09 0.00 1.98 1.94 1.30 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.87 3.90 0.00 2.02 1.88 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.72 7.81 45 D 7.74 4.38 0.00 2.88 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 46 I 7.82 3.75 2.15 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.96 1.03 0.00 0.00 47 L 8.48 4.10 0.00 1.72 1.82 1.06 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.26 3.94 0.00 2.00 1.99 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.98 0.00 49 D 8.42 4.39 0.00 2.89 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 50 I 7.93 3.71 2.05 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 1.48 1.28 0.94 0.00 0.00 51 A 8.39 3.92 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 52 A 8.05 3.90 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 53 Q 8.07 4.01 0.00 2.18 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.16 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 54 N 7.65 4.91 0.00 2.84 2.79 0.00 0.00 6.97 7.25 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 55 G 7.96 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 56 L 8.17 4.87 0.00 1.46 1.40 0.59 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.63 4.52 0.00 2.02 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 2.18 2.20 0.00 58 V 8.41 4.18 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 0.82 0.00 0.00 0.92 0.00 0.00 59 I 8.66 4.00 1.92 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 1.44 0.90 0.89 0.00 0.00 60 T 7.72 4.74 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 1.16 0.00 0.00 61 M 8.54 5.04 0.00 1.93 1.84 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 62 E 9.34 4.53 0.00 1.85 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 2.19 0.00 63 V 8.44 4.34 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 0.77 0.00 0.00 0.89 0.00 0.00 64 M 8.52 4.49 0.00 1.91 1.59 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 65 P 0.00 4.84 0.00 2.17 2.11 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 66 D 7.83 5.06 0.00 2.94 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 H 7.60 5.02 0.00 3.23 3.36 0.00 5.20 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.01 4.51 0.67 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 0.27 0.00 0.00 0.47 0.00 0.00 69 H 9.02 5.30 0.00 3.14 3.02 0.00 5.77 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 9.30 5.18 0.00 1.61 1.50 1.11 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.80 5.15 0.00 1.74 1.57 0.80 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 72 L 9.30 5.30 0.00 1.57 1.40 0.79 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.78 5.18 0.00 3.86 3.67 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 74 A 9.15 5.08 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 75 T 8.81 3.88 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 1.31 0.00 0.00 76 P 0.00 4.04 0.00 1.29 1.78 0.00 2.72 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 1.17 1.48 0.00 77 Q 7.16 3.96 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.21 0.00 78 Q 7.61 4.33 0.00 2.23 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 79 A 8.18 4.20 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 80 I 7.94 2.02 1.57 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.27 0.46 0.00 0.00 81 P 0.00 3.88 0.00 2.02 2.01 0.00 3.39 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 82 D 7.61 4.16 0.00 2.81 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 7.79 4.32 0.00 3.00 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 84 V 7.18 3.20 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 0.14 0.00 0.00 -0.04 0.00 0.00 85 K 7.64 3.72 0.00 1.79 1.88 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.39 7.81 86 A 7.90 3.91 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 7.97 3.86 0.00 1.54 1.54 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 88 K 7.92 3.50 0.00 1.34 1.36 0.00 0.61 0.00 0.00 0.98 0.00 0.00 2.61 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.30 0.21 7.81 89 G 8.21 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.09 4.15 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 91 S 8.02 4.23 0.00 4.45 4.39 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 92 A 8.54 3.79 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 93 R 7.98 3.96 0.00 2.04 2.19 0.00 3.22 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 94 R 8.10 4.02 0.00 1.98 1.99 0.00 3.23 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 95 M 8.47 4.18 0.00 1.83 2.04 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.97 0.00 96 F 7.93 4.37 0.00 3.18 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 97 V 7.50 3.75 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 0.79 0.00 0.00 1.06 0.00 0.00 98 A 8.21 4.04 0.78 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 99 Y 8.22 4.69 0.00 3.10 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 0.00 100 P 0.00 4.43 0.00 2.21 2.17 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 101 Q 8.35 4.12 0.00 2.31 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.89 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 102 L 8.34 4.18 0.00 1.95 1.84 0.73 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.70 4.96 0.00 1.92 1.99 0.00 1.90 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.41 7.81 104 E 8.38 4.32 0.00 2.21 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 2.64 2.43 0.00 105 K 8.30 4.93 0.00 1.83 1.89 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.53 7.81 106 L 8.21 4.54 0.00 2.13 1.88 0.92 0.71 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 0.00 107 W 7.69 4.70 0.00 3.32 3.50 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 0.00 108 G 7.70 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 0.00 0.00 0.00 109 G 8.34 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 0.00 110 N 7.66 5.03 0.00 2.56 2.65 0.00 0.00 6.92 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 0.00 111 L 8.62 4.25 0.00 1.26 0.61 -0.51 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 112 W 7.65 5.68 0.00 3.21 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 9.31 4.58 0.00 2.95 3.00 0.00 0.00 7.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.53 0.00 2.21 2.14 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 115 S 8.85 4.82 0.00 3.88 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 0.00 116 Y 7.52 5.20 0.00 2.89 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 0.00 117 C 9.64 4.90 0.00 2.98 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 0.00 118 I 8.46 5.41 2.06 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 1.49 1.42 1.11 0.00 0.00 119 L 9.20 5.12 0.00 1.75 1.57 0.99 0.82 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 0.00 120 T 8.79 4.47 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 1.29 0.00 0.00 121 V 8.42 4.44 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 0.76 0.00 0.00 0.86 0.00 0.00 122 S 8.70 4.55 0.00 3.90 3.50 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 0.00 123 E 9.26 4.73 0.00 1.82 1.88 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 2.08 2.28 0.00 124 N 7.88 5.08 0.00 2.68 2.76 0.00 0.00 6.93 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 0.00 125 T 8.32 4.22 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 1.24 0.00 0.00 126 R 8.52 3.95 0.00 2.08 2.20 0.00 3.03 0.00 0.00 3.35 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 127 A 7.94 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.97 4.05 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 129 I 7.82 3.79 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.36 0.90 0.00 0.00 130 Q 8.29 4.06 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.42 2.59 0.00 131 K 7.85 4.13 0.00 1.79 1.90 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.46 7.81 132 Y 7.74 4.28 0.00 3.09 3.16 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 0.00 133 I 7.49 4.22 2.10 0.00 0.00 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 1.55 0.99 0.95 0.00 0.00 134 E 7.78 4.23 0.00 2.08 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 2.17 2.31 0.00