NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 P 4.4467 0.0000 0.0000 62.6228 32.8794 176.3091 5 T 4.1084 7.9517 110.3578 60.5491 71.1812 174.2529 6 I 3.6719 8.3485 121.9692 64.4512 37.4505 179.2045 7 N 4.2245 8.1401 117.2612 57.0556 38.8321 176.4785 8 Q 4.0278 8.6207 119.5048 59.1479 28.7613 179.3268 9 L 3.9813 7.7991 119.5750 57.7121 41.4735 179.4323 10 V 3.5869 8.0036 117.3724 66.7419 31.4411 177.6589 11 R 4.1382 8.2370 117.2806 58.5952 30.0998 178.4393 12 K 4.0916 8.8494 121.4147 57.3450 32.7731 178.4907 13 G 4.0125 7.4156 105.4313 44.7493 0.0000 172.7569 14 R 4.1804 8.1625 117.9643 54.8342 30.8434 176.4363 15 E 3.9760 8.6597 124.0596 55.5850 29.8861 176.2113 16 K 4.0706 8.5308 128.3656 56.1743 32.8448 176.8390 17 V 3.8231 8.1823 119.7975 61.4887 32.1965 175.7261 18 R 4.5568 8.2920 122.9990 54.6503 32.8363 174.0805 19 K 4.6316 8.5275 124.1140 54.8249 34.9101 175.7505 20 K 4.3076 8.3148 121.1852 55.2547 33.3227 176.6001 21 S 4.1905 8.4060 117.3371 58.1256 62.6813 174.9077 22 K 4.1535 8.5482 126.1378 57.6691 31.8706 177.2727 23 V 3.9539 7.2711 119.6325 61.3224 33.4304 173.4794 24 P 4.5704 0.0000 0.0000 61.8294 30.3911 176.8387 25 A 4.1872 7.8615 123.6714 54.9169 19.7859 177.2199 26 L 4.1256 7.2180 117.0791 55.4231 44.9574 174.5069 27 K 4.3786 9.3998 117.9098 55.6395 32.7038 178.0612 28 G 5.0890 7.6535 120.0602 46.9295 0.0000 172.6000 29 A 4.1319 7.5083 123.9702 51.4145 19.0070 176.2563 30 P 4.0822 0.0000 0.0000 64.9209 31.6861 176.5998 31 F 5.5103 7.5481 113.3192 55.0556 43.7093 174.2854 32 R 4.7138 8.4830 119.7184 54.6749 33.1938 174.1263 33 R 4.6711 8.8130 126.4202 56.5320 31.3330 175.0630 34 G 4.1158 8.6131 109.8103 45.3305 0.0000 172.2656 35 V 4.4554 7.9892 123.4671 61.6570 32.9340 175.5695 36 C 4.2860 9.0161 125.7868 60.9339 28.7329 171.9716 37 T 4.3938 8.7840 112.5445 62.5651 68.7420 173.0865 38 V 4.3798 7.9627 120.2551 61.8441 34.0287 175.0165 39 V 4.5919 8.0441 125.4070 61.8922 34.1318 173.8602 40 R 4.6412 8.7345 126.8399 55.5709 34.1182 173.2417 41 T 4.9691 8.5022 119.2518 61.4578 68.4068 174.1160 42 V 4.7091 8.6803 122.2309 59.3765 35.1479 175.3322 43 T 4.3419 8.4546 114.3202 61.1350 69.5884 172.4514 44 P 4.6577 0.0000 0.0000 61.1777 32.4973 178.4131 45 K 4.6151 8.6390 127.5479 56.2276 30.8409 179.3336 46 K 4.0534 8.7612 126.4157 60.2033 32.1155 176.2184 47 P 4.4644 0.0000 0.0000 63.4807 31.7345 175.0446 48 N 5.0637 7.2901 114.3442 51.2577 42.1095 173.4898 49 S 4.3989 8.1288 107.3948 58.8373 64.4643 176.0918 50 A 4.3432 9.1532 125.6122 51.6624 20.5666 176.0013 51 L 3.7418 8.1096 115.4335 57.1386 38.6327 173.6065 52 R 4.3981 8.9207 120.2380 55.5778 32.2159 176.2306 53 K 4.5098 9.0145 122.6556 56.2977 32.8679 175.9279 54 V 4.9940 8.1555 124.3411 61.1617 35.8172 173.8601 55 A 4.8172 8.2538 119.9227 50.7775 23.1996 176.2652 56 K 4.5124 8.3645 121.9964 56.4762 33.8800 176.8020 57 V 4.4506 9.1544 124.0135 61.0797 34.7175 174.2931 58 R 4.2809 8.4833 130.3448 56.2093 30.6473 176.1735 59 L 4.3582 8.5203 126.8024 54.3377 42.5318 177.6102 60 T 3.9889 8.3304 110.8374 64.9111 68.9945 176.5298 61 S 4.3028 8.1662 114.7912 58.2999 62.5815 176.4962 62 G 4.0413 8.2116 109.5508 47.0935 0.0000 176.2570 63 Y 4.0882 7.7280 116.9486 59.7249 38.0053 175.0637 64 E 5.2346 8.3154 121.3940 56.9659 32.2694 177.1555 65 V 4.6905 7.9334 126.4947 61.3677 35.8465 173.8117 66 T 5.0611 8.5014 113.9485 60.6361 70.6078 173.8729 67 A 5.0716 8.8946 124.9110 50.4713 23.1634 174.4422 68 Y 4.7526 8.8490 122.0635 57.2094 40.6034 174.4267 69 I 4.1691 7.8256 127.5650 59.2247 38.2203 174.4456 70 P 4.2034 0.0000 0.0000 62.6453 32.8216 176.5200 71 G 4.0704 8.7889 108.8357 46.0028 0.0000 172.0343 72 E 4.2141 8.6937 117.6853 55.8868 30.1318 177.7528 73 G 4.0141 8.7427 115.1648 45.4346 0.0000 171.3337 74 H 4.6556 7.9829 110.7999 56.0228 30.5948 174.9265 75 N 4.8584 8.6638 119.3916 53.4441 37.7173 173.5839 76 L 4.4005 8.2142 119.0764 54.8173 42.8534 176.0939 77 Q 4.8450 8.3187 123.1163 54.0611 31.7340 176.1091 78 E 4.1910 8.6050 117.7009 57.8933 29.1513 177.6059 79 H 4.8854 8.1099 110.3394 56.5550 33.1417 173.6971 80 S 4.5052 8.1683 116.8881 58.7621 63.1087 174.8346 81 V 4.3421 9.0361 119.0251 60.9981 33.3217 175.0887 82 V 4.5597 7.4730 119.4628 62.1260 34.8348 170.6616 83 L 5.0908 8.0140 120.5525 53.4880 44.4169 175.5685 84 I 4.8673 8.2638 122.5458 60.0744 38.6955 176.5434 85 R 4.2446 9.5698 128.9564 57.5523 30.9382 173.5567 86 G 3.6197 9.1698 113.0324 46.0840 0.0000 173.1170 87 G 4.0809 7.6155 112.0801 44.2149 0.0000 172.0854 88 R 4.0286 8.4278 122.9675 55.7339 30.1148 176.4039 89 V 4.1607 7.8973 115.8111 60.7618 32.8182 175.6857 90 K 4.0548 8.7710 127.9759 59.4196 32.0400 178.0923 91 D 4.4235 7.9309 116.6516 55.4748 41.5156 175.7080 92 L 4.7261 7.8246 119.1572 51.9285 44.3363 174.6842 93 P 4.3025 0.0000 0.0000 63.5061 31.9365 178.1634 94 G 3.9526 8.7178 109.1741 45.9923 0.0000 173.8300 95 V 3.9978 7.5571 120.3113 62.5856 31.3011 175.6270 96 R 4.6300 8.7317 124.9554 55.8304 32.2358 174.6942 97 Y 4.9915 7.8728 116.1466 56.7787 42.6407 174.1832 98 H 5.2619 9.0914 119.1244 54.5030 32.1299 173.1392 99 I 4.8713 7.9122 119.9431 59.2312 39.8445 175.1022 100 V 3.8569 8.4195 130.0183 62.5298 31.5169 176.0573 101 R 4.1092 8.5573 126.9863 56.9343 30.9141 177.5573 102 G 3.9317 8.5569 108.7695 45.5277 0.0000 173.5607 103 V 4.0959 6.9088 119.3100 61.8681 34.4887 175.1488 104 Y 3.6534 7.9948 123.1918 59.4232 36.0438 171.3704 105 D 4.4058 8.3795 121.5326 56.6801 41.1455 176.5665 106 A 4.2556 8.0262 123.8698 50.6718 17.5208 177.0388 107 A 4.3689 8.5085 124.5280 52.6005 19.1100 177.7405 108 G 3.9789 8.2056 107.5162 45.6357 0.0000 172.8701 109 V 4.1921 7.8115 119.6040 62.0218 32.4889 175.5964 110 K 4.3382 8.5968 128.5700 56.7284 33.5590 177.1130 111 D 4.7969 9.0577 124.8111 54.3032 38.8745 174.4564 112 R 4.0268 7.3508 118.7878 56.1928 30.7291 175.2694 113 K 4.3524 8.5306 123.4530 57.9998 33.7564 176.9583 114 K 4.0629 7.7864 116.8334 57.1140 32.2485 177.2013 115 S 3.7684 8.6598 117.9796 59.9017 59.9734 173.3927 116 R 4.1098 7.6634 121.6953 59.3261 31.2405 179.4990 117 S 4.0919 8.4556 112.3109 61.4551 62.2814 176.4627 118 K 3.9875 7.5517 115.0109 59.0031 31.6343 177.5400 119 Y 4.4245 8.2745 115.3445 57.1131 38.0732 176.1481 120 G 3.8067 7.8431 106.0695 46.7844 0.0000 173.9645 121 T 4.4248 7.8313 115.7925 60.9778 69.7031 174.9425 122 K 3.9946 8.4904 128.0564 55.8034 32.8810 176.1717 123 K 3.9607 8.4941 127.0201 55.8120 32.4197 175.0417 124 P 4.4672 0.0000 0.0000 62.1319 32.1334 175.1007 125 K 4.4636 8.1436 119.1525 54.8663 33.9699 175.6334 126 E 3.8901 9.1145 126.1964 59.1344 29.7771 177.0370 127 A 4.0481 7.9448 124.0968 52.6600 18.6970 176.9143 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 4 P 0.00 4.45 0.00 2.19 2.12 0.00 3.73 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 1.88 1.96 0.00 5 T 7.95 4.11 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 6 I 8.35 3.67 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.56 0.91 0.00 0.00 7 N 8.14 4.22 0.00 2.75 2.82 0.00 0.00 7.16 7.12 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 8 Q 8.62 4.03 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 9 L 7.80 3.98 0.00 1.91 1.71 0.92 0.70 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 10 V 8.00 3.59 2.25 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 0.83 0.00 0.00 1.00 0.00 0.00 11 R 8.24 4.14 0.00 1.79 1.88 0.00 3.21 0.00 0.00 3.15 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 12 K 8.85 4.09 0.00 1.72 1.89 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.45 7.81 13 G 7.42 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 0.00 0.00 0.00 14 R 8.16 4.18 0.00 1.81 1.87 0.00 3.38 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 15 E 8.66 3.98 0.00 1.92 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 16 K 8.53 4.07 0.00 1.75 1.70 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.40 7.81 17 V 8.18 3.82 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 0.72 0.00 0.00 0.93 0.00 0.00 18 R 8.29 4.56 0.00 1.70 1.74 0.00 3.18 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 19 K 8.53 4.63 0.00 1.85 1.73 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.34 7.81 20 K 8.31 4.31 0.00 1.76 1.77 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.42 7.81 21 S 8.41 4.19 0.00 3.83 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 22 K 8.55 4.15 0.00 1.70 1.76 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.38 7.81 23 V 7.27 3.95 1.93 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 0.60 0.00 0.00 0.54 0.00 0.00 24 P 0.00 4.57 0.00 1.96 2.01 0.00 3.86 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 2.08 2.10 0.00 25 A 7.86 4.19 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 26 L 7.22 4.13 0.00 1.55 1.51 0.94 0.56 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 27 K 9.40 4.38 0.00 1.76 1.79 0.00 2.00 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.43 7.81 28 G 7.65 5.09 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 0.00 0.00 0.00 29 A 7.51 4.13 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 30 P 0.00 4.08 0.00 1.65 1.75 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 31 F 7.55 5.51 0.00 2.88 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 32 R 8.48 4.71 0.00 1.90 1.71 0.00 3.23 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 33 R 8.81 4.67 0.00 1.98 1.73 0.00 2.71 0.00 0.00 2.77 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.37 0.00 34 G 8.61 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 35 V 7.99 4.46 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 0.98 0.00 0.00 0.89 0.00 0.00 36 C 9.02 4.29 0.00 2.96 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 37 T 8.78 4.39 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 38 V 7.96 4.38 2.09 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 0.87 0.00 0.00 0.93 0.00 0.00 39 V 8.04 4.59 2.11 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 0.93 0.00 0.00 0.99 0.00 0.00 40 R 8.73 4.64 0.00 1.91 1.71 0.00 3.32 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 41 T 8.50 4.97 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 1.24 0.00 0.00 42 V 8.68 4.71 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 0.70 0.00 0.00 0.97 0.00 0.00 43 T 8.45 4.34 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 1.22 0.00 0.00 44 P 0.00 4.66 0.00 1.84 2.34 0.00 3.68 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 2.00 2.10 0.00 45 K 8.64 4.62 0.00 1.74 1.33 0.00 1.68 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.58 7.81 46 K 8.76 4.05 0.00 1.71 1.82 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 47 P 0.00 4.46 0.00 2.07 2.07 0.00 3.65 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 48 N 7.29 5.06 0.00 2.85 2.70 0.00 0.00 6.82 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 49 S 8.13 4.40 0.00 3.91 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 50 A 9.15 4.34 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 51 L 8.11 3.74 0.00 1.76 1.70 0.94 0.99 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 52 R 8.92 4.40 0.00 1.80 2.06 0.00 3.20 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.73 0.00 53 K 9.01 4.51 0.00 1.68 1.66 0.00 1.57 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.54 7.81 54 V 8.16 4.99 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 1.14 0.00 0.00 1.14 0.00 0.00 55 A 8.25 4.82 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 56 K 8.36 4.51 0.00 1.77 1.89 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.40 7.81 57 V 9.15 4.45 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 0.99 0.00 0.00 0.92 0.00 0.00 58 R 8.48 4.28 0.00 1.88 1.80 0.00 3.13 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 59 L 8.52 4.36 0.00 1.64 1.69 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.33 3.99 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 61 S 8.17 4.30 0.00 4.28 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 0.00 62 G 8.21 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 63 Y 7.73 4.09 0.00 2.92 2.87 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 64 E 8.32 5.23 0.00 1.96 1.85 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 2.04 2.06 0.00 65 V 7.93 4.69 1.73 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 0.94 0.00 0.00 0.68 0.00 0.00 66 T 8.50 5.06 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 1.24 0.00 0.00 67 A 8.89 5.07 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.85 4.75 0.00 3.07 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 69 I 7.83 4.17 1.70 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 1.01 0.45 0.70 0.00 0.00 70 P 0.00 4.20 0.00 1.78 1.87 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.89 0.00 71 G 8.79 4.07 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 0.00 0.00 0.00 72 E 8.69 4.21 0.00 1.97 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 2.29 0.00 73 G 8.74 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 0.00 0.00 0.00 74 H 7.98 4.66 0.00 3.21 3.24 0.00 5.53 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.66 4.86 0.00 2.79 2.85 0.00 0.00 5.88 7.79 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 76 L 8.21 4.40 0.00 1.77 1.69 1.01 0.88 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 77 Q 8.32 4.84 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.97 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 78 E 8.60 4.19 0.00 1.91 1.93 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 2.13 2.40 0.00 79 H 8.11 4.89 0.00 3.05 3.22 0.00 5.71 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.17 4.51 0.00 3.80 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 81 V 9.04 4.34 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 0.62 0.00 0.00 0.98 0.00 0.00 82 V 7.47 4.56 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 0.69 0.00 0.00 0.98 0.00 0.00 83 L 8.01 5.09 0.00 1.59 1.60 0.56 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.26 4.87 2.04 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 1.02 1.05 1.12 0.00 0.00 85 R 9.57 4.24 0.00 1.97 2.10 0.00 3.38 0.00 0.00 3.32 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.91 0.00 86 G 9.17 3.62 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 0.00 0.00 0.00 87 G 7.62 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.43 4.03 0.00 1.97 1.86 0.00 2.91 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 89 V 7.90 4.16 1.93 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 0.72 0.00 0.00 0.75 0.00 0.00 90 K 8.77 4.05 0.00 1.74 1.85 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.75 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.37 7.81 91 D 7.93 4.42 0.00 2.56 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 92 L 7.82 4.73 0.00 1.49 1.49 0.73 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.30 0.00 2.17 1.96 0.00 3.67 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 94 G 8.72 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 0.00 0.00 0.00 95 V 7.56 4.00 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 1.02 0.00 0.00 0.97 0.00 0.00 96 R 8.73 4.63 0.00 1.50 1.37 0.00 3.18 0.00 0.00 3.29 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 97 Y 7.87 4.99 0.00 2.88 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 98 H 9.09 5.26 0.00 3.16 3.23 0.00 5.59 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 7.91 4.87 1.96 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 1.12 1.00 0.89 0.00 0.00 100 V 8.42 3.86 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 0.59 0.00 0.00 0.85 0.00 0.00 101 R 8.56 4.11 0.00 1.83 1.80 0.00 3.33 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.00 102 G 8.56 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 0.00 103 V 6.91 4.10 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 -0.04 0.00 0.00 0.71 0.00 0.00 104 Y 7.99 3.65 0.00 3.16 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 0.00 105 D 8.38 4.41 0.00 3.02 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 0.00 106 A 8.03 4.26 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 0.00 107 A 8.51 4.37 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 0.00 108 G 8.21 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 0.00 109 V 7.81 4.19 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 0.74 0.00 0.00 1.17 0.00 0.00 110 K 8.60 4.34 0.00 1.88 1.64 0.00 1.83 0.00 0.00 1.81 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.46 7.81 111 D 9.06 4.80 0.00 2.88 2.84 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 0.00 0.00 0.00 112 R 7.35 4.03 0.00 1.72 1.77 0.00 3.04 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.45 0.00 113 K 8.53 4.35 0.00 1.73 1.79 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.35 7.81 114 K 7.79 4.06 0.00 1.70 1.70 0.00 1.88 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.43 7.81 115 S 8.66 3.77 0.00 4.05 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 0.00 116 R 7.66 4.11 0.00 1.89 2.27 0.00 3.35 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 117 S 8.46 4.09 0.00 3.86 3.91 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 0.00 118 K 7.55 3.99 0.00 2.05 1.76 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.51 7.81 119 Y 8.27 4.42 0.00 3.02 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 0.00 120 G 7.84 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 0.00 121 T 7.83 4.42 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 1.21 0.00 0.00 122 K 8.49 3.99 0.00 1.68 1.70 0.00 1.65 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.48 7.81 123 K 8.49 3.96 0.00 1.75 1.71 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.46 7.81 124 P 0.00 4.47 0.00 2.07 2.00 0.00 3.66 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 2.02 2.06 0.00 125 K 8.14 4.46 0.00 1.63 1.65 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.48 7.81 126 E 9.11 3.89 0.00 1.99 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 2.31 2.25 0.00 127 A 7.94 4.05 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