NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 L 4.3484 8.1731 122.5970 56.4196 43.9221 177.1151 1 G 3.7280 8.6615 115.5937 45.1433 0.0000 172.7730 2 D 4.6479 8.4470 125.1975 54.5309 42.5330 173.4746 3 K 4.7959 8.2591 120.1244 56.0228 35.3429 174.6714 4 L 4.5748 8.6391 121.8663 53.8790 43.6652 175.8296 5 I 4.7359 8.2162 122.5404 59.5051 40.1278 174.8525 6 L 4.5782 8.9341 127.7713 52.9560 43.7964 175.2347 7 K 4.7231 8.4811 125.3770 54.7999 34.5326 175.8234 8 G 3.7764 9.7728 115.5708 46.3945 0.0000 173.5490 9 L 3.8884 7.9532 120.6655 54.5177 42.5259 176.4369 10 K 4.9062 8.2009 123.8580 54.7140 33.8179 175.9604 11 F 5.2767 9.0685 123.0460 55.9539 43.5686 173.0862 12 Y 4.8604 8.9676 123.0504 56.8095 40.2661 174.5905 13 G 4.0054 8.3538 112.0482 45.1435 0.0000 172.7280 14 F 5.1768 8.1867 115.9871 57.3814 40.1062 175.3916 15 H 4.6110 7.8934 116.8860 55.6519 29.1298 174.1599 16 G 4.3997 8.1810 107.0872 42.8096 0.0000 174.6152 17 A 4.2380 8.2108 124.0243 54.0243 19.5875 178.8055 18 I 3.8750 7.7930 117.4154 60.9651 38.0750 176.4213 19 A 3.9928 9.0062 127.7203 55.8172 18.1840 179.6543 20 E 3.9998 8.3135 116.0516 59.6755 29.3693 179.5160 21 E 4.0302 8.1655 118.6789 59.5223 29.3271 179.5445 22 R 4.3901 7.8861 117.8557 58.9596 30.2301 178.8879 23 T 4.1627 7.7787 114.6908 66.6184 68.7135 176.7155 24 L 4.4063 8.5403 119.9390 55.3783 42.1377 178.2454 25 G 3.3426 9.4213 105.9902 44.9714 0.0000 171.1525 26 Q 4.0105 6.6309 115.1650 55.5372 32.1647 172.9003 27 M 4.6142 8.2457 119.0531 54.9780 32.9752 176.2219 28 F 4.8244 9.6122 121.3668 55.4747 43.0560 173.8083 29 L 5.0623 9.0206 124.5824 53.2801 44.5730 175.2199 30 V 5.0007 8.9464 125.7343 61.2101 35.2139 173.6857 31 D 5.4541 9.3106 126.9036 52.6131 44.4956 174.9463 32 I 5.1743 8.9665 123.1346 59.7323 41.6449 173.8004 33 D 5.0688 9.1365 126.4410 52.3209 43.6079 174.9467 34 A 5.1161 8.5305 126.2193 49.7007 21.2400 175.2927 35 W 4.7440 9.4218 123.4590 57.6434 30.0953 176.3524 36 V 4.6591 8.1134 121.6051 60.7706 34.0711 172.9765 37 S 4.2608 8.9206 118.4132 58.5850 62.8496 174.2324 38 L 4.6274 8.8437 126.4313 54.3150 42.1615 178.2531 39 K 3.9033 7.9460 121.4343 59.3455 32.1595 178.2536 40 K 3.8591 8.0541 119.0371 59.6318 32.1805 178.4083 41 A 4.0854 8.0355 120.5897 55.1535 18.1603 179.6418 42 G 3.6159 8.4529 103.5768 47.4701 0.0000 174.9075 43 E 4.3995 7.9066 119.0041 57.2811 30.1729 177.7013 44 S 4.4388 7.9905 113.1751 57.7547 63.9879 173.9150 45 D 4.3710 8.5329 119.9618 55.0061 40.0703 172.2614 46 N 4.8487 7.8362 116.1227 50.7658 40.4664 174.7355 47 L 4.0678 8.6527 128.1280 58.2869 42.2223 178.7229 48 E 4.0728 8.2203 116.9257 58.7891 29.3826 177.3306 49 D 4.6439 8.2570 117.3027 54.9241 41.4417 175.6520 50 T 4.6225 7.6447 113.2823 60.4991 70.1248 171.8412 51 I 4.3336 7.9347 119.9966 59.0739 39.9298 175.7569 52 S 3.9092 8.1917 119.5890 57.9981 63.6651 174.5966 53 Y 4.2525 7.5532 127.3741 59.3754 37.8690 178.2568 54 V 3.8496 7.6710 120.7955 66.1778 31.7953 177.6123 55 D 4.5303 8.0431 118.2539 57.3426 40.8622 178.6274 56 I 4.0591 7.6843 120.5424 64.0312 37.0457 178.2220 57 F 4.2114 8.5908 121.6488 61.4987 39.3397 177.1995 58 S 4.1213 8.7140 115.2010 61.5949 62.5656 176.4454 59 L 3.8977 7.9046 122.0996 58.1982 41.7448 178.9818 60 A 3.8563 7.7846 120.0928 54.8993 18.2497 179.3212 61 K 2.0000 7.6698 118.5205 59.0090 31.8466 178.4552 62 E 3.7542 7.6194 118.0788 59.3312 29.6052 178.6229 63 I 3.8019 7.3353 119.5606 64.2397 36.9880 178.6367 64 V 3.4368 7.5000 118.7744 65.6573 31.4187 176.6501 65 E 4.4427 8.0569 117.2291 57.1157 30.3198 177.8924 66 G 3.9215 7.1334 112.6036 44.7083 0.0000 173.2551 67 S 3.9814 8.8153 116.3345 58.1769 62.6337 173.3705 68 P 4.5488 0.0000 0.0000 62.7625 32.0443 175.5455 69 R 4.7835 8.4295 118.4785 54.3361 33.7330 176.4085 70 N 4.5998 8.6200 115.6235 54.8903 39.0587 175.6113 71 L 4.8657 7.4767 116.6981 52.7291 45.6148 177.5572 72 L 4.0737 8.4004 121.5595 57.7033 41.6874 179.5260 73 E 3.9788 8.2443 118.4037 59.8075 29.3724 179.4510 74 T 3.8425 7.6708 114.9929 66.5908 68.6751 176.8103 75 V 3.4319 7.4657 119.7984 65.9395 31.4378 177.9074 76 A 3.9893 8.2813 120.8359 55.1626 18.1947 179.2176 77 E 3.8658 8.3253 117.8384 59.2846 29.5651 179.1414 78 L 3.9541 7.9965 119.1941 57.6863 41.6143 179.4127 79 I 3.6435 7.8445 119.4935 64.2805 37.0857 178.2587 80 A 4.0163 8.1738 121.8455 55.3547 18.2701 179.9215 81 S 4.0944 8.2181 112.8130 61.5146 63.1464 176.8058 82 K 3.9612 8.3731 122.4124 59.2564 31.6962 179.5900 83 T 3.9446 8.2013 116.2981 66.7913 68.2576 176.8590 84 L 4.0696 7.6814 119.4276 57.6074 41.6419 178.9873 85 E 4.0453 8.0645 118.6490 59.2169 29.7367 178.4832 86 K 4.0766 7.8170 117.9625 57.0146 33.0476 176.3016 87 F 4.9287 7.8916 118.1385 55.2380 39.3715 175.0713 88 H 4.3325 8.7315 122.8958 58.8681 28.8315 177.4698 89 Q 4.1597 8.1941 116.8494 58.3500 28.7796 176.7982 90 I 4.1125 7.7256 119.7810 61.5384 37.6869 175.6372 91 N 4.7755 9.4500 123.2911 55.1484 40.0263 174.9111 92 A 4.7033 7.6154 116.9897 51.2933 22.4423 175.4049 93 V 5.2792 8.9404 120.2842 61.2194 35.8555 174.2158 94 R 5.2713 9.3714 126.7208 54.7345 32.9036 174.1855 95 V 4.8518 8.9972 126.8884 61.1079 34.2766 174.2777 96 K 5.1402 9.3828 128.0022 54.0080 34.2229 174.5472 97 L 5.1798 8.4058 127.6889 53.3625 44.4425 175.2784 98 S 5.1174 9.3560 121.2977 57.0687 68.4784 172.9713 99 K 4.5128 8.9267 121.8396 54.5319 32.8106 176.1969 100 P 4.6217 0.0000 0.0000 63.7437 31.7008 176.1676 101 N 4.7850 7.5639 114.4824 50.9316 39.4721 172.5900 102 V 3.7694 7.8885 122.0954 61.4487 32.6108 175.5387 103 A 4.0864 8.3990 130.1926 53.4978 18.7777 176.8706 104 L 3.6265 8.5747 119.5119 55.3825 39.2440 174.3028 105 I 4.3545 7.0932 119.1994 59.5308 37.8187 176.0495 106 K 4.1089 8.6330 126.2911 58.7032 32.3268 178.0257 107 S 4.5092 7.7037 112.1891 57.4925 64.2200 173.5929 108 T 4.2677 8.0841 117.7628 63.3664 69.0078 174.1763 109 I 4.4402 7.6314 116.3855 60.2114 40.6692 174.6375 110 D 4.4453 8.4364 120.2715 55.4290 41.0560 176.0315 111 Y 4.8627 6.3075 113.2809 56.6452 40.2395 172.1154 112 L 4.8396 7.9634 119.4212 53.4965 45.2677 176.6841 113 G 4.0921 8.1243 107.3767 46.3452 0.0000 172.1431 114 V 4.7154 8.3426 112.9020 59.8599 35.9312 175.2493 115 D 5.0372 8.5812 121.7250 53.7752 42.6038 173.9269 116 I 4.7665 8.8538 119.9690 58.8613 40.9863 174.1685 117 F 5.4408 8.8435 125.5062 56.6326 41.8436 174.4391 118 R 4.2713 8.8779 124.6023 54.4075 33.5162 174.1247 119 Q 4.7084 8.1739 125.2069 54.0821 31.0205 175.2498 120 R 4.1981 8.2078 120.6774 56.1273 30.7808 176.3891 121 N 4.5242 8.4825 116.5190 53.5325 38.8933 175.0128 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 0 L 8.17 4.35 0.00 1.59 1.56 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 1 G 8.66 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 0.00 0.00 0.00 2 D 8.45 4.65 0.00 2.78 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 3 K 8.26 4.80 0.00 1.26 1.16 0.00 0.61 0.00 0.00 0.74 0.00 0.00 2.76 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.06 1.13 7.81 4 L 8.64 4.57 0.00 1.58 1.65 0.91 0.91 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 5 I 8.22 4.74 1.79 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.33 0.84 0.00 0.00 6 L 8.93 4.58 0.00 1.64 1.66 0.97 0.90 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 7 K 8.48 4.72 0.00 1.68 1.60 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.45 7.81 8 G 9.77 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 9 L 7.95 3.89 0.00 1.68 0.98 0.97 0.93 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 K 8.20 4.91 0.00 1.53 1.68 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.55 7.81 11 F 9.07 5.28 0.00 2.99 2.76 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 12 Y 8.97 4.86 0.00 3.04 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 13 G 8.35 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 F 8.19 5.18 0.00 3.07 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 15 H 7.89 4.61 0.00 3.19 3.32 0.00 5.69 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 16 G 8.18 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 0.00 0.00 0.00 0.00 17 A 8.21 4.24 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 18 I 7.79 3.87 2.02 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 1.25 0.46 0.98 0.00 0.00 19 A 9.01 3.99 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 20 E 8.31 4.00 0.00 2.09 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 0.00 2.43 2.50 0.00 21 E 8.17 4.03 0.00 2.37 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 0.00 2.33 2.37 0.00 22 R 7.89 4.39 0.00 2.02 2.05 0.00 3.49 0.00 0.00 3.09 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.57 0.00 23 T 7.78 4.16 4.44 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 1.26 0.00 0.00 24 L 8.54 4.41 0.00 1.71 1.82 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 25 G 9.42 3.34 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 0.00 26 Q 6.63 4.01 0.00 1.72 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.93 0.00 0.00 0.00 0.00 0.00 1.66 1.19 0.00 27 M 8.25 4.61 0.00 1.88 1.93 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 28 F 9.61 4.82 0.00 3.12 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 29 L 9.02 5.06 0.00 1.57 1.44 0.81 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.95 5.00 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 0.99 0.00 0.00 1.11 0.00 0.00 31 D 9.31 5.45 0.00 2.55 2.50 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 32 I 8.97 5.17 1.92 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 1.29 0.79 0.96 0.00 0.00 33 D 9.14 5.07 0.00 2.26 1.61 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 34 A 8.53 5.12 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 35 W 9.42 4.74 0.00 3.66 3.12 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 36 V 8.11 4.66 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 0.61 0.00 0.00 1.04 0.00 0.00 37 S 8.92 4.26 0.00 3.90 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 38 L 8.84 4.63 0.00 1.73 1.64 0.96 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.95 3.90 0.00 1.83 1.82 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.51 7.81 40 K 8.05 3.86 0.00 1.87 1.80 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.68 1.52 7.81 41 A 8.04 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 42 G 8.45 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 43 E 7.91 4.40 0.00 1.99 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 2.28 2.50 0.00 44 S 7.99 4.44 0.00 4.02 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 45 D 8.53 4.37 0.00 2.76 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 46 N 7.84 4.85 0.00 2.83 2.78 0.00 0.00 6.86 6.65 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 47 L 8.65 4.07 0.00 1.63 1.63 0.84 0.83 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 48 E 8.22 4.07 0.00 2.10 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 2.34 2.27 0.00 49 D 8.26 4.64 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 50 T 7.64 4.62 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 1.20 0.00 0.00 51 I 7.93 4.33 1.65 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 1.15 0.57 -0.00 0.00 0.00 52 S 8.19 3.91 0.00 3.70 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 53 Y 7.55 4.25 0.00 3.16 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 54 V 7.67 3.85 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 1.19 0.00 0.00 1.05 0.00 0.00 55 D 8.04 4.53 0.00 2.85 3.05 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 56 I 7.68 4.06 2.09 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.84 1.02 0.00 0.00 57 F 8.59 4.21 0.00 3.35 3.40 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 0.00 58 S 8.71 4.12 0.00 3.99 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 59 L 7.90 3.90 0.00 1.92 1.97 0.92 0.92 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 60 A 7.78 3.86 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 61 K 7.67 2.00 0.00 0.79 1.48 0.00 1.94 0.00 0.00 1.66 0.00 0.00 3.38 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.22 0.84 7.81 62 E 7.62 3.75 0.00 2.07 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 2.25 2.29 0.00 63 I 7.34 3.80 1.86 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 1.33 0.53 0.81 0.00 0.00 64 V 7.50 3.44 1.72 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 0.68 0.00 0.00 0.93 0.00 0.00 65 E 8.06 4.44 0.00 1.92 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 2.49 2.10 0.00 66 G 7.13 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.82 3.98 0.00 3.82 3.82 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 0.00 0.00 0.00 68 P 0.00 4.55 0.00 2.28 2.10 0.00 3.75 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 1.99 1.97 0.00 69 R 8.43 4.78 0.00 1.75 1.80 0.00 3.26 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.46 0.00 70 N 8.62 4.60 0.00 2.77 2.88 0.00 0.00 7.45 6.74 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 71 L 7.48 4.87 0.00 1.66 1.77 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.40 4.07 0.00 1.74 1.78 1.01 1.21 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 73 E 8.24 3.98 0.00 2.06 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 2.42 2.50 0.00 74 T 7.67 3.84 4.34 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 1.18 0.00 0.00 75 V 7.47 3.43 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 0.80 0.00 0.00 0.46 0.00 0.00 76 A 8.28 3.99 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 77 E 8.33 3.87 0.00 2.30 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 2.30 2.38 0.00 78 L 8.00 3.95 0.00 1.86 1.65 0.87 0.59 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 79 I 7.84 3.64 2.02 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 1.41 0.82 0.94 0.00 0.00 80 A 8.17 4.02 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 81 S 8.22 4.09 0.00 4.04 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 82 K 8.37 3.96 0.00 1.82 1.84 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.57 7.81 83 T 8.20 3.94 4.45 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 1.44 0.00 0.00 84 L 7.68 4.07 0.00 1.64 1.75 0.91 1.00 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 85 E 8.06 4.05 0.00 2.05 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 0.00 2.27 2.29 0.00 86 K 7.82 4.08 0.00 1.43 1.11 0.00 1.49 0.00 0.00 1.15 0.00 0.00 2.89 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 1.01 7.81 87 F 7.89 4.93 0.00 3.24 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 88 H 8.73 4.33 0.00 3.17 3.38 0.00 5.73 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 8.19 4.16 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 90 I 7.73 4.11 2.09 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 1.64 0.93 1.11 0.00 0.00 91 N 9.45 4.78 0.00 2.83 2.92 0.00 0.00 6.31 8.00 0.00 0.00 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 7.62 4.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.94 5.28 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 1.11 0.00 0.00 1.05 0.00 0.00 94 R 9.37 5.27 0.00 2.74 2.12 0.00 3.48 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.93 0.00 95 V 9.00 4.85 2.14 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 0.96 0.00 0.00 0.99 0.00 0.00 96 K 9.38 5.14 0.00 1.67 1.74 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.25 7.81 97 L 8.41 5.18 0.00 1.73 1.55 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 98 S 9.36 5.12 0.00 3.44 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 99 K 8.93 4.51 0.00 1.65 1.59 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.89 1.37 7.81 100 P 0.00 4.62 0.00 2.00 2.12 0.00 3.58 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.98 0.00 101 N 7.56 4.78 0.00 2.56 2.67 0.00 0.00 6.87 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 0.00 102 V 7.89 3.77 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 0.97 0.00 0.00 0.92 0.00 0.00 103 A 8.40 4.09 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 0.00 104 L 8.57 3.63 0.00 1.82 1.79 0.93 0.82 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 0.00 105 I 7.09 4.35 2.03 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 1.29 0.56 0.94 0.00 0.00 106 K 8.63 4.11 0.00 1.72 1.86 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 107 S 7.70 4.51 0.00 3.96 3.86 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 0.00 108 T 8.08 4.27 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 1.20 0.00 0.00 109 I 7.63 4.44 1.80 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 1.40 0.33 0.88 0.00 0.00 110 D 8.44 4.45 0.00 2.34 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 0.00 111 Y 6.31 4.86 0.00 3.01 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 0.00 112 L 7.96 4.84 0.00 1.66 1.60 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.12 4.09 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 0.00 114 V 8.34 4.72 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 0.86 0.00 0.00 1.01 0.00 0.00 115 D 8.58 5.04 0.00 2.72 2.61 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 0.00 116 I 8.85 4.77 1.93 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 1.16 0.97 0.96 0.00 0.00 117 F 8.84 5.44 0.00 3.00 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 0.00 118 R 8.88 4.27 0.00 1.54 1.62 0.00 3.26 0.00 0.00 3.01 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.64 0.00 119 Q 8.17 4.71 0.00 1.73 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.04 0.00 0.00 0.00 0.00 0.00 2.21 2.49 0.00 120 R 8.21 4.20 0.00 1.88 1.91 0.00 3.10 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 1.78 1.60 0.00 121 N 8.48 4.52 0.00 2.69 2.72 0.00 0.00 6.80 7.56 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