NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 F 4.8538 8.3201 119.4246 57.5160 39.9743 174.3109 17 A 4.4848 8.4695 127.3402 50.1873 20.5344 177.1852 18 R 4.0199 8.3948 118.6981 59.1191 31.1535 175.7015 19 S 4.7428 7.5607 109.1890 56.0455 66.5042 173.8020 20 L 4.2957 8.6177 122.4395 56.2936 42.1271 176.3501 21 S 4.8980 9.3867 121.0451 56.8602 67.6059 172.8565 22 I 5.0668 8.1771 122.2201 59.5666 39.9230 175.6238 23 T 3.8154 8.8652 124.2361 64.7254 68.8819 174.8643 24 T 3.4204 8.6200 121.7434 64.2261 65.5354 170.7726 25 P 4.4204 0.0000 0.0000 64.0850 32.9579 176.3885 26 E 5.2274 7.8272 120.8955 54.7566 32.4862 173.8835 27 E 4.7924 9.0673 123.9026 55.8915 33.7791 173.1777 28 M 5.2717 8.6008 119.0272 53.8093 34.9843 174.5323 29 I 4.6750 8.7166 125.4507 59.4359 40.7436 174.0558 30 E 5.1961 8.7683 126.5071 54.5436 32.4187 174.6433 31 K 4.7698 8.8429 123.9403 55.0096 37.5341 175.2431 32 A 4.7872 9.8278 124.6672 50.7647 20.2642 177.2014 33 K 4.0455 8.3940 121.1329 58.4445 32.5342 177.4873 34 G 4.1953 9.0925 114.8090 44.6947 0.0000 173.1311 35 E 4.4720 7.9177 119.3736 55.8392 32.1326 174.8436 36 T 5.0789 8.3251 116.3905 62.1297 70.5273 174.2149 37 A 4.5793 8.8031 128.6022 50.7468 21.1265 175.0426 38 Y 4.7722 8.5861 123.5087 56.0683 40.4926 174.9341 39 L 4.5169 8.3545 128.5138 52.1856 43.2605 173.9985 40 P 4.4681 0.0000 0.0000 62.7569 32.6904 177.3676 41 C 4.7845 9.4520 123.3754 55.6624 45.7713 171.3840 42 K 5.2727 8.6640 124.9884 54.2091 34.1757 175.2334 43 F 5.5948 8.6422 120.1295 55.3431 41.1126 174.8037 44 T 4.7209 9.0859 116.0269 61.9688 72.3217 173.7799 45 L 5.1010 8.7523 125.6111 54.1512 44.2105 175.6924 46 S 5.3476 9.0695 115.5167 55.2425 65.5725 173.5878 47 P 3.6148 0.0000 0.0000 64.9393 31.0059 177.4133 48 E 4.2676 7.8364 113.4720 56.7080 29.8033 177.1773 49 D 4.7519 8.0063 121.8377 53.7478 39.0059 176.3110 50 Q 4.5334 8.1097 118.4499 55.2657 30.4491 176.2347 51 G 3.9446 8.0149 108.0643 43.5582 0.0000 171.4081 52 P 4.3777 0.0000 0.0000 62.0316 31.8506 175.9637 53 L 4.3301 8.4467 124.5240 55.4621 42.9123 175.5048 54 D 5.0773 9.2641 125.1139 52.7948 45.0883 173.8816 55 I 5.1664 9.1668 125.8408 59.6008 41.2991 174.0071 56 E 5.2909 9.3924 126.9283 54.3241 33.3196 174.0661 57 W 5.3570 9.1730 125.2983 54.9944 32.5333 174.6955 58 L 5.3330 9.0947 122.2463 52.9598 45.5383 175.2485 59 I 4.5201 8.7111 121.2622 59.3368 41.5483 174.5912 60 S 4.9011 8.7518 124.7915 55.8006 64.9128 171.3780 61 P 4.7855 0.0000 0.0000 62.0646 31.9033 177.7575 62 A 4.0355 8.9178 127.2511 55.0743 18.4776 178.2728 63 D 4.7216 8.0243 113.1728 53.3752 39.6606 175.0349 64 N 4.8555 7.3464 115.4623 52.3898 40.1779 174.4516 65 Q 4.1873 8.4511 116.3601 57.1602 29.2227 177.2057 66 K 4.1683 8.0472 118.3037 56.4787 32.5918 176.6990 67 V 4.4367 7.5620 114.3949 60.4535 35.7495 174.5121 68 D 4.3255 8.3058 118.8799 55.5429 38.9177 174.3044 69 Q 4.4187 7.9651 117.5493 54.6781 30.6085 176.9284 70 V 4.1057 8.3889 124.8020 63.0324 31.5993 175.4013 71 I 4.4786 8.3671 120.5229 61.4000 39.8247 175.2999 72 I 4.7801 7.2455 120.3998 60.2521 41.4184 172.6889 73 L 5.4765 9.3909 128.6437 53.9415 45.8203 173.7379 74 Y 5.5050 9.7385 127.4488 56.1595 41.2278 174.1967 75 S 4.3397 9.2114 120.4932 57.6087 66.6228 174.4030 76 G 3.6472 9.1521 113.8012 46.6931 0.0000 172.9737 77 D 4.2922 7.7639 113.8497 53.6579 39.8774 172.9234 78 K 4.6184 7.4788 115.2708 53.9526 35.4243 175.1874 79 I 4.9560 8.0936 122.4971 59.9036 38.9500 174.8278 80 Y 4.6231 9.4782 123.2917 56.3939 39.2234 174.0088 81 D 5.0660 8.1385 122.5458 54.9196 42.3560 177.6572 82 D 4.4740 8.0307 122.9664 55.7626 41.5232 177.0469 83 Y 3.9732 8.2554 119.7060 60.3582 38.7101 176.0824 84 Y 4.5137 7.7834 117.2719 56.0262 39.1300 173.9993 85 P 4.3422 0.0000 0.0000 65.5370 31.8105 176.4261 86 D 4.5659 8.0806 119.1250 55.1502 41.0946 175.6740 87 L 3.7214 8.8523 122.8544 55.1472 39.3173 174.3106 88 K 4.0430 7.6969 117.5873 58.5705 32.5733 177.5232 89 G 4.0513 9.4116 110.2373 45.7838 0.0000 173.8813 90 R 4.8526 8.5819 116.6316 54.0679 32.7997 175.1397 91 V 5.0637 7.4731 118.5167 59.2231 33.5849 174.7623 92 H 4.8484 8.2658 119.7532 54.0005 33.5153 173.0250 93 F 4.7348 8.7044 119.7399 58.0539 39.4423 175.8035 94 T 4.2883 8.6856 114.3584 63.4102 69.5367 175.5600 95 S 4.4903 7.9733 115.4867 57.5519 63.2191 173.0459 96 N 4.7737 8.5350 121.5151 53.0672 38.0578 175.5012 97 D 4.6679 8.2008 119.3513 52.5431 41.9931 175.1247 98 L 4.1762 7.7186 122.8490 56.6273 42.1558 179.8997 99 K 4.1975 7.8725 116.6970 58.8806 32.0388 177.7050 100 S 4.1734 7.6979 112.0515 58.5197 63.3195 174.7402 101 G 2.4553 7.7592 110.4138 44.8433 0.0000 172.8363 102 D 4.8470 7.8665 119.5730 52.5428 41.3850 174.9769 103 A 4.9261 9.0917 127.3249 51.8319 19.8607 177.1639 104 S 4.8379 8.7393 114.7106 59.6712 64.2978 173.4422 105 I 5.0663 8.0677 115.2412 59.0126 41.4048 173.6952 106 N 5.3821 8.9181 119.5214 51.0021 41.0522 173.3927 107 V 4.8046 8.5763 120.5469 61.4838 34.0935 174.9498 108 T 4.4961 8.8790 118.6778 60.0473 71.3699 173.7405 109 N 4.3734 8.4457 118.4424 54.1953 37.3604 173.9713 110 L 4.4148 8.0315 119.2902 55.5166 43.0036 177.3623 111 Q 4.9929 9.0669 121.5277 53.6523 31.9185 176.8645 112 L 4.0027 8.4443 120.0687 57.9549 41.7997 179.5913 113 S 4.4588 7.9578 111.1991 60.1703 63.1218 174.6267 114 D 4.6149 8.0612 120.6366 55.7973 41.0956 176.8883 115 I 4.0219 7.9060 121.8965 60.4078 37.7824 176.2989 116 G 3.9834 7.5975 111.1591 46.4263 0.0000 170.0102 117 T 5.0331 7.7409 116.3818 62.3039 70.5685 173.6287 118 Y 5.1076 9.4862 124.8717 56.2719 40.7116 174.4332 119 Q 4.9638 9.2624 125.4128 54.3940 32.0241 173.0332 120 C 3.7621 8.5056 127.1542 54.5029 45.4471 172.1411 121 K 4.8706 8.7340 126.1393 54.4832 34.7021 175.1682 122 V 4.5798 8.6530 125.3372 60.7571 34.3336 174.1080 123 K 4.8655 8.9739 128.5788 54.6844 35.7929 175.1243 124 K 4.6778 9.1593 128.2567 54.5030 34.2785 174.2186 125 A 4.4298 8.5912 128.4499 51.6106 19.2982 175.7929 126 P 4.6141 0.0000 0.0000 62.7204 32.2256 176.6672 127 G 3.8093 7.9122 109.1314 45.3622 0.0000 173.2439 128 V 4.9696 7.9535 114.1443 59.6736 35.7725 174.3592 129 A 4.7556 8.8955 124.5207 50.8429 22.9349 174.8095 130 N 5.4373 8.5358 115.6128 51.4548 42.9526 173.9101 131 K 4.7802 8.8593 121.6232 54.6956 36.4279 174.9061 132 K 5.0968 9.1531 125.4649 54.6333 35.4256 175.0634 133 I 4.9970 9.0853 125.0546 59.8539 40.6502 174.2232 134 H 5.1709 9.1963 125.1170 54.7617 30.0094 173.8923 135 L 4.9485 9.0590 127.0129 53.5510 43.9457 175.1541 136 V 4.5593 8.8151 126.4032 61.0243 34.3077 174.0614 137 V 4.9101 8.4803 127.2310 61.2091 33.4166 174.3831 138 L 4.7501 8.7024 128.0655 52.7905 44.2282 177.3865 139 V 3.7856 8.2689 114.5290 61.8172 31.5232 176.1877 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 16 F 8.32 4.85 0.00 3.08 2.95 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 17 A 8.47 4.48 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 18 R 8.39 4.02 0.00 1.83 2.02 0.00 3.19 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 19 S 7.56 4.74 0.00 3.81 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 20 L 8.62 4.30 0.00 1.78 1.64 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.39 4.90 0.00 3.81 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.18 5.07 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.64 0.93 0.00 0.00 23 T 8.87 3.82 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 24 T 8.62 3.42 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 1.24 0.00 0.00 25 P 0.00 4.42 0.00 2.07 2.21 0.00 3.57 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 2.11 2.22 0.00 26 E 7.83 5.23 0.00 2.06 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 27 E 9.07 4.79 0.00 2.10 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 2.23 2.29 0.00 28 M 8.60 5.27 0.00 2.05 2.01 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 2.76 0.00 29 I 8.72 4.68 1.83 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 1.12 0.93 0.89 0.00 0.00 30 E 8.77 5.20 0.00 1.93 1.78 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 2.18 2.44 0.00 31 K 8.84 4.77 0.00 1.67 1.73 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.53 7.81 32 A 9.83 4.79 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 33 K 8.39 4.05 0.00 1.72 1.76 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.56 7.81 34 G 9.09 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.92 4.47 0.00 2.05 1.91 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 2.29 2.37 0.00 36 T 8.33 5.08 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 1.28 0.00 0.00 37 A 8.80 4.58 1.13 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 0.00 0.00 0.00 0.00 0.00 38 Y 8.59 4.77 0.00 2.90 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 39 L 8.35 4.52 0.00 1.11 1.48 0.20 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.47 0.00 2.13 2.09 0.00 3.73 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 2.14 2.01 0.00 41 C 9.45 4.78 0.00 3.18 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 42 K 8.66 5.27 0.00 1.71 1.65 0.00 1.68 0.00 0.00 2.01 0.00 0.00 3.34 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.38 7.81 43 F 8.64 5.59 0.00 3.04 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 44 T 9.09 4.72 4.31 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 1.25 0.00 0.00 45 L 8.75 5.10 0.00 1.83 1.78 1.09 1.01 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 46 S 9.07 5.35 0.00 3.86 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 47 P 0.00 3.61 0.00 1.73 1.57 0.00 3.42 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 1.60 0.59 0.00 48 E 7.84 4.27 0.00 2.03 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 2.22 2.24 0.00 49 D 8.01 4.75 0.00 2.93 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 50 Q 8.11 4.53 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 51 G 8.01 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 0.00 0.00 0.00 52 P 0.00 4.38 0.00 2.17 2.06 0.00 3.77 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 1.94 0.00 53 L 8.45 4.33 0.00 1.77 1.83 0.74 1.31 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 54 D 9.26 5.08 0.00 2.67 2.42 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 55 I 9.17 5.17 2.12 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 1.01 0.63 1.23 0.00 0.00 56 E 9.39 5.29 0.00 2.01 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 57 W 9.17 5.36 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 58 L 9.09 5.33 0.00 1.51 1.46 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.71 4.52 1.41 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.43 0.82 0.00 0.00 60 S 8.75 4.90 0.00 3.70 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 61 P 0.00 4.79 0.00 2.13 1.93 0.00 3.73 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 2.06 2.00 0.00 62 A 8.92 4.04 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.02 4.72 0.00 2.78 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 64 N 7.35 4.86 0.00 2.91 2.80 0.00 0.00 6.91 7.27 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 65 Q 8.45 4.19 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 66 K 8.05 4.17 0.00 1.91 1.72 0.00 1.63 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.40 7.81 67 V 7.56 4.44 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 0.73 0.00 0.00 0.91 0.00 0.00 68 D 8.31 4.33 0.00 2.78 2.68 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 0.00 0.00 0.00 0.00 69 Q 7.97 4.42 0.00 1.92 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 70 V 8.39 4.11 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 -0.10 0.00 0.00 0.80 0.00 0.00 71 I 8.37 4.48 1.87 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.81 0.87 0.00 0.00 72 I 7.25 4.78 1.70 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.25 0.67 0.00 0.00 73 L 9.39 5.48 0.00 1.92 1.88 1.12 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.74 5.51 0.00 2.96 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 75 S 9.21 4.34 0.00 4.05 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 76 G 9.15 3.65 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 0.00 0.00 0.00 77 D 7.76 4.29 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.48 4.62 0.00 1.78 1.21 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.52 7.81 79 I 8.09 4.96 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.83 1.29 0.00 0.00 80 Y 9.48 4.62 0.00 3.23 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 81 D 8.14 5.07 0.00 2.99 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 82 D 8.03 4.47 0.00 2.74 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 83 Y 8.26 3.97 0.00 2.90 2.67 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 84 Y 7.78 4.51 0.00 3.39 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 85 P 0.00 4.34 0.00 2.21 2.27 0.00 3.82 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 2.10 1.97 0.00 86 D 8.08 4.57 0.00 2.70 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 87 L 8.85 3.72 0.00 1.88 1.74 1.07 0.94 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 7.70 4.04 0.00 1.89 2.09 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.41 7.81 89 G 9.41 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.58 4.85 0.00 1.82 2.03 0.00 3.30 0.00 0.00 3.32 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.38 0.00 91 V 7.47 5.06 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 1.10 0.00 0.00 0.71 0.00 0.00 92 H 8.27 4.85 0.00 3.11 3.20 0.00 5.82 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.70 4.73 0.00 3.12 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 94 T 8.69 4.29 4.43 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 1.37 0.00 0.00 95 S 7.97 4.49 0.00 4.07 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 96 N 8.53 4.77 0.00 2.84 2.90 0.00 0.00 5.77 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 97 D 8.20 4.67 0.00 2.66 2.47 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 98 L 7.72 4.18 0.00 1.10 1.23 0.60 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.87 4.20 0.00 1.76 1.93 0.00 1.81 0.00 0.00 1.83 0.00 0.00 3.18 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.57 1.48 7.81 100 S 7.70 4.17 0.00 3.90 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 0.00 101 G 7.76 2.46 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 0.00 102 D 7.87 4.85 0.00 2.60 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 9.09 4.93 1.60 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 0.00 104 S 8.74 4.84 0.00 3.94 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.07 5.07 1.34 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.21 -0.02 0.00 0.00 106 N 8.92 5.38 0.00 2.93 3.01 0.00 0.00 6.75 8.50 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 0.00 107 V 8.58 4.80 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 1.03 0.00 0.00 0.70 0.00 0.00 108 T 8.88 4.50 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 0.00 109 N 8.45 4.37 0.00 2.91 2.78 0.00 0.00 6.89 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 0.00 110 L 8.03 4.41 0.00 1.75 1.59 0.96 0.81 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 0.00 111 Q 9.07 4.99 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 112 L 8.44 4.00 0.00 1.72 1.73 0.93 0.67 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 0.00 113 S 7.96 4.46 0.00 4.07 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 0.00 114 D 8.06 4.61 0.00 2.86 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 0.00 115 I 7.91 4.02 1.99 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 1.34 0.85 1.02 0.00 0.00 116 G 7.60 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 0.00 0.00 0.00 117 T 7.74 5.03 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 1.22 0.00 0.00 118 Y 9.49 5.11 0.00 3.04 3.27 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 0.00 119 Q 9.26 4.96 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.10 2.31 0.00 120 C 8.51 3.76 0.00 1.23 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 0.00 0.00 0.00 0.00 121 K 8.73 4.87 0.00 1.65 1.57 0.00 1.75 0.00 0.00 1.51 0.00 0.00 2.71 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.20 7.81 122 V 8.65 4.58 1.83 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 0.19 0.00 0.00 0.72 0.00 0.00 123 K 8.97 4.87 0.00 1.74 1.67 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.31 7.81 124 K 9.16 4.68 0.00 1.76 1.62 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.53 7.81 125 A 8.59 4.43 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 0.00 126 P 0.00 4.61 0.00 2.17 2.15 0.00 3.93 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 127 G 7.91 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 0.00 128 V 7.95 4.97 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 0.68 0.00 0.00 0.90 0.00 0.00 129 A 8.90 4.76 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 N 8.54 5.44 0.00 2.49 2.58 0.00 0.00 6.63 7.61 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 0.00 131 K 8.86 4.78 0.00 1.68 1.38 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 1.45 7.81 132 K 9.15 5.10 0.00 1.65 1.57 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.34 7.81 133 I 9.09 5.00 2.06 0.00 0.00 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 1.29 0.76 0.92 0.00 0.00 134 H 9.20 5.17 0.00 3.13 3.30 0.00 5.60 0.00 0.00 0.00 0.00 6.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 9.06 4.95 0.00 1.54 1.64 0.87 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.82 4.56 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 0.96 0.00 0.00 0.97 0.00 0.00 137 V 8.48 4.91 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 0.88 0.00 0.00 0.95 0.00 0.00 138 L 8.70 4.75 0.00 1.62 1.55 0.95 1.08 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 0.00 139 V 8.27 3.79 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 0.66 0.00 0.00 0.94 0.00 0.00