NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4089 8.4045 118.1932 54.4599 32.7460 175.4143 2 E 4.0020 8.5409 118.0486 56.4803 30.5676 175.2610 3 L 5.2886 8.7229 123.9862 52.6707 45.8841 175.4077 4 T 4.7832 8.9911 115.0911 61.2893 71.1581 172.1102 5 T 5.3140 8.5141 109.8063 60.2921 72.1259 173.0873 6 R 4.7518 8.7254 121.1606 55.2901 34.2893 173.4784 7 T 5.0092 8.3443 120.2019 61.6543 70.8871 173.9214 8 L 4.3672 8.6940 127.5814 53.3791 42.6926 175.5038 9 P 4.5656 0.0000 0.0000 62.3050 32.1062 176.2745 10 A 4.0868 8.5217 121.8306 54.4162 18.4070 178.1384 11 R 4.2078 7.7360 116.2440 55.3129 30.5966 175.6442 12 K 4.5442 8.6621 124.7993 55.8803 34.6518 175.7465 13 H 5.2574 9.6049 120.8497 54.8493 30.1767 173.9393 14 I 5.0090 9.3071 125.4094 59.5542 39.5487 174.7520 15 A 5.1560 9.1405 129.1855 50.4324 21.1290 175.5519 16 L 5.0142 9.0205 123.3713 52.9496 44.3449 175.9434 17 V 4.6797 8.9128 123.7057 61.1274 35.1281 173.9904 18 A 5.3461 8.4298 127.6639 51.0054 22.4800 175.7576 19 H 4.7597 9.3613 118.8633 55.4522 30.0665 176.4212 20 D 4.4520 9.1667 121.1061 58.3081 40.7058 179.2725 21 H 4.3875 8.2880 112.7153 57.6536 29.1254 176.1671 22 C 4.7557 8.4461 116.8639 59.3975 28.5655 175.6058 23 K 4.1442 8.0194 124.7713 60.2290 31.6496 179.7419 24 Q 4.0697 8.1262 120.5229 60.2865 28.1042 180.0430 25 M 4.3257 8.1193 119.7252 58.6910 32.3435 178.0393 26 L 4.1958 8.2607 120.4528 58.2165 42.1219 178.7296 27 M 4.1131 8.4882 119.0476 58.5522 31.9534 178.7141 28 S 4.1643 8.2589 115.1034 61.4740 63.1182 176.4934 29 W 4.2399 8.4329 130.8326 60.6584 30.2258 178.0807 30 V 3.4677 8.3170 117.0678 66.1445 31.1894 177.5026 31 E 4.0692 8.5382 118.6250 59.3506 29.0201 179.4986 32 R 3.8423 8.1118 117.6862 58.8928 30.2816 178.2398 33 H 4.6638 7.3192 114.2159 55.2774 29.4966 176.4652 34 Q 3.8748 7.5027 124.4439 59.2164 28.5618 176.5511 35 P 4.1808 0.0000 0.0000 65.6613 31.5845 177.9463 36 L 4.1751 7.7292 118.3402 58.0494 42.1617 178.7316 37 L 4.1786 8.1551 119.1050 57.7510 41.3132 179.1384 38 E 4.0477 8.2692 117.5726 58.6528 29.4340 178.3912 39 Q 4.2540 7.8319 116.5947 56.8243 29.2882 174.2882 40 H 5.0075 8.0915 116.6265 53.8022 32.8801 172.7563 41 V 4.2082 8.5057 119.0986 61.8505 32.9230 174.6584 42 L 5.2275 8.3375 127.7550 53.6025 43.9474 175.1566 43 Y 5.1983 9.0394 120.0167 56.6480 42.6280 174.0591 44 A 5.1742 8.6088 120.7645 52.2853 23.6279 175.9951 45 T 4.0485 8.4235 109.7734 61.2215 70.6217 175.2185 46 G 3.8302 9.1285 106.8367 49.0458 0.0000 176.1743 47 T 3.9010 7.7153 116.4532 66.0353 68.9510 176.8026 48 T 3.9846 8.0438 117.2498 66.8227 68.5800 176.3577 49 G 3.7792 8.5466 107.6350 48.2680 0.0000 175.3487 50 N 4.4293 8.1234 118.3702 55.8847 38.6283 177.6544 51 L 4.0459 8.1319 120.5778 57.5940 41.6971 179.5574 52 I 3.7194 7.8977 120.0320 64.5447 37.1186 178.7532 53 S 4.4835 8.1773 117.3892 62.0995 62.5698 177.2606 54 R 3.9513 7.9396 123.2929 60.5730 29.1794 181.1016 55 A 4.5677 7.7263 118.7912 54.0248 19.4931 178.6252 56 T 4.3374 8.4181 106.4791 61.0833 69.9573 176.2189 57 G 3.9383 8.1642 109.1156 45.6678 0.0000 173.8425 58 M 4.1370 7.6622 119.0009 55.1114 32.4973 175.4898 59 N 4.5946 8.4534 119.8024 52.6026 39.2749 174.3325 60 V 4.3941 8.0691 125.5618 61.1876 34.4563 175.3484 61 N 4.6412 9.0168 126.1782 52.4178 38.1919 172.9289 62 A 4.7264 8.2331 124.9050 51.8982 19.4078 176.9080 63 M 4.5756 8.9093 124.4719 54.4111 35.5513 175.8887 64 L 4.2044 8.8452 120.1157 55.0726 43.4550 176.9069 65 S 4.4018 8.6421 115.1930 58.5322 63.5099 175.0503 66 G 3.7636 9.0546 112.3296 47.8999 0.0000 174.3259 67 P 4.1630 0.0000 0.0000 64.3730 31.3895 177.5563 68 M 4.4387 7.7011 115.1842 54.6544 32.5860 175.7814 69 G 3.8289 8.0307 107.5504 45.4123 0.0000 176.5647 70 G 3.6589 8.8538 108.6457 48.1345 0.0000 175.5853 71 D 4.2916 8.0019 120.6637 57.2210 40.8500 178.7576 72 Q 4.0061 7.9953 118.0164 58.6893 28.7716 178.5148 73 Q 3.9484 7.9402 119.4874 58.8522 28.7245 178.8643 74 V 3.5849 7.8555 119.4428 65.8604 31.5673 178.2730 75 G 3.5804 8.3862 105.6674 47.7114 0.0000 175.4815 76 A 3.9360 8.3308 123.5309 54.9462 18.3666 179.7324 77 L 3.7937 7.8182 117.4646 57.8030 41.6160 179.8934 78 I 3.5357 7.7440 120.0777 64.3167 36.8714 178.6913 79 S 2.7900 7.5941 113.4650 60.2540 62.8768 175.3058 80 E 4.0238 7.3212 119.7489 55.5219 29.4710 176.7329 81 G 3.6258 7.1855 107.0322 46.2142 0.0000 174.6815 82 K 4.1475 8.0137 117.7990 55.8014 32.7125 176.6111 83 I 4.3702 7.2224 119.7304 59.5176 39.6973 174.6957 84 D 4.8208 9.0068 124.7684 54.9122 42.6461 177.1286 85 V 4.6891 7.6203 117.6377 61.0106 35.4892 173.4171 86 L 5.0702 9.0120 129.3978 53.4881 44.7032 175.0243 87 I 4.5721 8.8984 128.6083 59.8097 38.8952 174.4651 88 F 5.3490 9.3642 131.1952 56.5814 41.2546 173.4448 89 F 5.6260 9.4198 126.9123 56.1944 38.0012 175.2231 90 W 4.5014 7.9274 119.6834 55.1838 29.9834 176.0038 91 D 4.4417 9.0866 121.4894 52.9300 40.4393 174.3261 92 P 4.4728 0.0000 0.0000 63.3318 31.8155 176.3853 93 L 4.7459 8.2223 118.1363 54.3888 42.3377 175.7319 94 N 4.9547 7.8326 114.5038 51.5966 42.5376 173.7742 95 A 4.3694 8.5461 125.1196 51.5418 19.7277 177.1092 96 V 4.4376 8.0911 116.2393 58.5218 33.8402 175.1576 97 P 4.2990 0.0000 0.0000 65.9933 31.4744 176.9379 98 H 4.8313 8.0180 114.4262 55.4220 29.9406 176.7984 99 D 4.2842 7.8058 123.2779 58.1998 41.0310 175.2238 100 P 4.2007 0.0000 0.0000 66.1055 31.0840 178.0887 101 D 4.3466 8.0679 118.0704 56.9672 40.7910 178.6702 102 V 3.7959 7.6290 118.2925 66.2081 31.5397 178.3179 103 K 3.8194 8.2350 118.1667 59.2240 31.8011 179.2770 104 A 3.9620 8.3434 121.5671 54.8975 18.3129 179.4577 105 L 3.8784 8.1279 118.8771 58.4666 42.3410 179.2803 106 L 4.1047 7.9772 118.9351 57.7186 41.4852 179.5269 107 R 3.9072 8.2487 118.9876 59.3472 29.9166 178.6602 108 L 4.0743 8.0614 118.6966 57.7475 41.5476 179.2808 109 A 4.1049 8.2417 120.6879 55.2912 18.2114 179.9724 110 T 3.8799 7.7515 114.0420 66.6643 68.3965 177.2304 111 V 3.3489 7.5553 119.2511 65.7857 31.4961 176.7659 112 W 4.3662 8.3211 116.4095 56.0422 29.3311 175.6656 113 N 4.1630 7.5795 116.2711 54.9021 37.1031 173.2348 114 I 4.6970 7.3070 110.2719 58.2147 41.0974 175.3366 115 P 4.4391 0.0000 0.0000 63.2707 32.2394 175.3741 116 V 5.0820 8.5317 123.2730 61.0045 34.6354 174.2047 117 A 4.9285 9.2481 129.2530 50.4159 21.5135 176.4297 118 T 5.3923 9.0688 110.7059 60.6572 70.0368 173.8460 119 N 4.1905 7.4157 119.2593 50.3232 41.4452 175.1108 120 V 3.3710 7.5416 119.8772 65.9871 31.6328 177.7711 121 A 4.0835 7.8438 119.9172 55.7939 18.2458 179.6797 122 T 3.8607 8.5293 114.1940 66.4569 68.4491 177.0265 123 A 3.9886 7.9612 122.9217 55.1909 18.3290 179.4317 124 D 4.5727 8.6935 117.7636 57.7137 40.7449 178.9613 125 F 3.9334 8.2397 116.8008 60.5576 39.2240 177.6435 126 I 3.9861 8.0313 119.3032 64.6070 36.8454 178.4828 127 I 2.5160 7.6958 117.6937 63.1612 37.7980 176.9520 128 Q 4.2051 7.6754 116.6513 55.2791 29.6902 176.0505 129 S 4.2640 7.5721 116.6849 57.2849 63.1872 172.8779 130 P 4.2500 0.0000 0.0000 66.3478 30.9756 176.6102 131 H 5.1735 7.9386 113.8890 54.8802 28.8174 176.9861 132 F 4.1313 8.2183 124.7721 60.9878 39.2345 175.7192 133 N 4.9313 8.2663 114.7451 53.1171 38.5603 173.8255 134 D 5.0695 7.6015 118.6755 52.3328 44.2578 175.1406 135 A 5.2561 8.6227 121.9358 50.9927 19.7467 177.4491 136 V 4.4567 8.0958 120.6939 59.8917 34.9808 174.3754 137 D 5.2316 8.8301 124.5806 54.0314 41.7656 175.6810 138 I 4.7332 8.6683 115.8714 58.9725 41.4084 174.2346 139 L 4.9828 8.5386 124.1387 54.1725 42.5004 176.1302 140 I 4.8716 8.7483 117.3572 57.8504 41.3714 173.1198 141 P 4.3879 0.0000 0.0000 63.1936 32.0688 176.8780 142 D 4.6814 9.3885 122.9122 53.2314 40.3185 176.1431 143 Y 4.2519 8.7350 129.3793 61.0731 39.0553 177.8866 144 Q 4.0723 8.5765 123.4594 61.2389 28.2341 181.4125 145 R 4.1569 7.9645 122.6394 61.1358 29.1450 180.2458 146 Y 4.1484 7.7145 119.0979 60.6595 39.2977 177.6427 147 L 3.5282 8.0803 121.2968 57.8587 41.5858 178.6152 148 A 3.9392 7.9303 120.7062 55.3967 18.0204 179.3907 149 D 4.2814 7.5648 116.0026 57.3377 40.9427 178.9080 150 R 3.9062 7.3556 117.2974 57.8956 30.0366 177.2048 151 L 4.3811 7.1372 122.1320 54.6778 42.0986 175.9993 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.40 4.41 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 2 E 8.54 4.00 0.00 1.76 1.89 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 2.31 1.98 0.00 3 L 8.72 5.29 0.00 1.48 1.57 0.90 0.81 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 4 T 8.99 4.78 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 1.30 0.00 0.00 5 T 8.51 5.31 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 1.23 0.00 0.00 6 R 8.73 4.75 0.00 1.92 1.80 0.00 3.01 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 7 T 8.34 5.01 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 8 L 8.69 4.37 0.00 1.59 1.56 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.57 0.00 2.29 2.06 0.00 3.89 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 2.12 2.01 0.00 10 A 8.52 4.09 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 11 R 7.74 4.21 0.00 1.73 1.79 0.00 3.17 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 12 K 8.66 4.54 0.00 1.53 1.58 0.00 1.51 0.00 0.00 1.79 0.00 0.00 2.46 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 0.58 7.81 13 H 9.60 5.26 0.00 3.18 3.29 0.00 5.78 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 9.31 5.01 2.03 0.00 0.00 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 1.32 0.79 1.13 0.00 0.00 15 A 9.14 5.16 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 16 L 9.02 5.01 0.00 1.56 1.56 1.01 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.91 4.68 1.66 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 0.74 0.00 0.00 0.66 0.00 0.00 18 A 8.43 5.35 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 H 9.36 4.76 0.00 3.28 3.34 0.00 5.68 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 20 D 9.17 4.45 0.00 2.72 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 21 H 8.29 4.39 0.00 3.37 3.38 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.45 4.76 0.00 3.24 3.09 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 23 K 8.02 4.14 0.00 1.98 1.92 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.71 7.81 24 Q 8.13 4.07 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.90 0.00 0.00 0.00 0.00 0.00 2.36 1.99 0.00 25 M 8.12 4.33 0.00 2.39 2.16 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.55 0.00 26 L 8.26 4.20 0.00 1.74 1.83 0.20 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 27 M 8.49 4.11 0.00 2.11 2.33 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.99 0.00 28 S 8.26 4.16 0.00 4.17 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 29 W 8.43 4.24 0.00 3.72 3.57 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 30 V 8.32 3.47 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 0.92 0.00 0.00 1.22 0.00 0.00 31 E 8.54 4.07 0.00 2.28 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 2.32 2.35 0.00 32 R 8.11 3.84 0.00 1.79 1.51 0.00 3.06 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 33 H 7.32 4.66 0.00 2.47 2.89 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.50 3.87 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.83 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 35 P 0.00 4.18 0.00 2.02 2.09 0.00 3.56 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 36 L 7.73 4.18 0.00 1.74 1.76 1.15 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.16 4.18 0.00 1.82 1.75 0.78 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.27 4.05 0.00 2.17 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 2.34 2.35 0.00 39 Q 7.83 4.25 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.64 0.00 0.00 0.00 0.00 0.00 2.55 2.53 0.00 40 H 8.09 5.01 0.00 3.08 3.52 0.00 5.64 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.51 4.21 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 0.89 0.00 0.00 0.90 0.00 0.00 42 L 8.34 5.23 0.00 1.73 1.58 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 43 Y 9.04 5.20 0.00 2.96 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 44 A 8.61 5.17 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 45 T 8.42 4.05 4.23 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 1.13 0.00 0.00 46 G 9.13 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 47 T 7.72 3.90 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 1.23 0.00 0.00 48 T 8.04 3.98 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 1.29 0.00 0.00 49 G 8.55 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 50 N 8.12 4.43 0.00 2.89 2.88 0.00 0.00 7.07 6.02 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 51 L 8.13 4.05 0.00 1.85 1.74 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.90 3.72 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.66 0.94 0.00 0.00 53 S 8.18 4.48 0.00 4.11 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 54 R 7.94 3.95 0.00 1.96 1.89 0.00 3.25 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 55 A 7.73 4.57 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 56 T 8.42 4.34 4.36 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 1.22 0.00 0.00 57 G 8.16 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 58 M 7.66 4.14 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.47 0.00 59 N 8.45 4.59 0.00 2.64 2.69 0.00 0.00 6.72 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 60 V 8.07 4.39 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 0.87 0.00 0.00 0.92 0.00 0.00 61 N 9.02 4.64 0.00 2.22 2.65 0.00 0.00 6.52 7.72 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 62 A 8.23 4.73 1.22 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 0.00 0.00 63 M 8.91 4.58 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.83 0.00 64 L 8.85 4.20 0.00 1.73 1.58 0.91 0.77 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 65 S 8.64 4.40 0.00 3.90 3.72 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 66 G 9.05 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 0.00 0.00 0.00 67 P 0.00 4.16 0.00 1.97 2.00 0.00 3.56 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 68 M 7.70 4.44 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 69 G 8.03 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 70 G 8.85 3.66 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 0.00 0.00 0.00 71 D 8.00 4.29 0.00 2.74 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 72 Q 8.00 4.01 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 73 Q 7.94 3.95 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 74 V 7.86 3.58 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 0.89 0.00 0.00 0.92 0.00 0.00 75 G 8.39 3.58 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 76 A 8.33 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 77 L 7.82 3.79 0.00 1.71 1.46 0.69 0.66 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 78 I 7.74 3.54 1.97 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 1.51 0.96 0.92 0.00 0.00 79 S 7.59 2.79 0.00 3.92 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 80 E 7.32 4.02 0.00 1.97 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 2.13 2.16 0.00 81 G 7.19 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.01 4.15 0.00 1.56 1.59 0.00 1.51 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.24 1.20 7.81 83 I 7.22 4.37 1.72 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.65 0.86 0.00 0.00 84 D 9.01 4.82 0.00 2.51 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.62 4.69 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.99 0.00 0.00 86 L 9.01 5.07 0.00 1.81 1.55 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.90 4.57 1.68 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.81 0.12 0.00 0.00 88 F 9.36 5.35 0.00 3.02 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 89 F 9.42 5.63 0.00 2.95 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 W 7.93 4.50 0.00 3.06 1.74 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 91 D 9.09 4.44 0.00 2.81 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 92 P 0.00 4.47 0.00 1.90 1.16 0.00 3.50 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.44 0.00 93 L 8.22 4.75 0.00 1.53 1.61 0.84 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.83 4.95 0.00 2.83 2.68 0.00 0.00 7.02 7.35 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 95 A 8.55 4.37 1.25 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 0.00 0.00 0.00 96 V 8.09 4.44 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.89 0.00 0.00 97 P 0.00 4.30 0.00 2.22 2.23 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 98 H 8.02 4.83 0.00 3.55 3.55 0.00 5.47 0.00 0.00 0.00 0.00 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 7.81 4.28 0.00 2.87 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.20 0.00 2.30 2.29 0.00 3.64 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 101 D 8.07 4.35 0.00 3.04 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 0.00 102 V 7.63 3.80 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 1.21 0.00 0.00 103 K 8.24 3.82 0.00 1.91 1.76 0.00 1.29 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.34 1.32 7.81 104 A 8.34 3.96 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 0.00 105 L 8.13 3.88 0.00 1.87 1.97 0.89 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.98 4.10 0.00 1.67 1.67 0.35 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.25 3.91 0.00 1.99 2.08 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 108 L 8.06 4.07 0.00 1.98 1.84 1.03 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.24 4.10 1.44 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 0.00 110 T 7.75 3.88 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 1.19 0.00 0.00 111 V 7.56 3.35 1.97 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 0.03 0.00 0.00 0.81 0.00 0.00 112 W 8.32 4.37 0.00 3.44 3.21 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 0.00 113 N 7.58 4.16 0.00 2.79 2.92 0.00 0.00 6.93 8.84 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 0.00 114 I 7.31 4.70 2.12 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.90 1.06 0.00 0.00 115 P 0.00 4.44 0.00 2.22 2.15 0.00 3.87 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 2.19 2.17 0.00 116 V 8.53 5.08 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 0.95 0.00 0.00 1.06 0.00 0.00 117 A 9.25 4.93 1.23 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 0.00 0.00 118 T 9.07 5.39 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 1.43 0.00 0.00 119 N 7.42 4.19 0.00 2.61 2.56 0.00 0.00 5.83 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 0.00 120 V 7.54 3.37 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 1.30 0.00 0.00 0.73 0.00 0.00 121 A 7.84 4.08 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 8.53 3.86 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 1.22 0.00 0.00 123 A 7.96 3.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.69 4.57 0.00 3.08 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 0.00 125 F 8.24 3.93 0.00 3.14 3.21 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 0.00 126 I 8.03 3.99 2.17 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 1.55 1.11 1.14 0.00 0.00 127 I 7.70 2.52 1.87 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 -0.36 0.75 0.00 0.00 128 Q 7.68 4.21 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.61 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 129 S 7.57 4.26 0.00 4.13 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 0.00 130 P 0.00 4.25 0.00 1.99 2.12 0.00 3.81 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.95 0.00 131 H 7.94 5.17 0.00 3.28 3.35 0.00 5.90 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 0.00 132 F 8.22 4.13 0.00 3.18 3.18 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 0.00 133 N 8.27 4.93 0.00 2.81 2.87 0.00 0.00 6.78 8.06 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 0.00 134 D 7.60 5.07 0.00 2.62 2.58 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 0.00 135 A 8.62 5.26 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 0.00 136 V 8.10 4.46 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 0.92 0.00 0.00 0.95 0.00 0.00 137 D 8.83 5.23 0.00 2.60 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 0.00 138 I 8.67 4.73 1.92 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 1.38 0.81 0.94 0.00 0.00 139 L 8.54 4.98 0.00 1.57 1.66 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 140 I 8.75 4.87 2.23 0.00 0.00 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 1.40 1.28 1.16 0.00 0.00 141 P 0.00 4.39 0.00 1.75 1.78 0.00 3.47 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.09 0.00 142 D 9.39 4.68 0.00 2.63 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 0.00 143 Y 8.74 4.25 0.00 3.40 3.17 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 0.00 144 Q 8.58 4.07 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.01 0.00 145 R 7.96 4.16 0.00 1.79 1.97 0.00 3.24 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 146 Y 7.71 4.15 0.00 2.86 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 L 8.08 3.53 0.00 1.06 1.34 0.84 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 148 A 7.93 3.94 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 0.00 149 D 7.56 4.28 0.00 2.67 2.62 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 0.00 150 R 7.36 3.91 0.00 1.69 1.80 0.00 3.04 0.00 0.00 2.70 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.96 0.00 151 L 7.14 4.38 0.00 1.56 1.50 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00