NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3012 8.3049 118.1931 53.3751 33.2429 171.1969 2 L 3.4375 7.8784 128.0231 52.9852 42.0241 171.9180 3 T 4.1810 8.8584 113.5587 62.9091 71.1725 174.3864 4 D 4.7374 7.5759 128.1491 50.8899 41.2925 174.3558 5 P 4.3251 0.0000 0.0000 65.2708 31.2856 178.2865 6 I 3.6900 7.8833 118.6110 64.0011 37.1706 177.5478 7 A 3.9975 8.8294 121.8288 56.3207 18.1911 178.1566 8 D 4.2040 8.6256 115.3801 57.3409 40.9959 178.8920 9 M 3.5050 8.8313 117.3647 58.3423 33.0591 178.8407 10 L 3.8788 8.5495 119.4971 58.2860 41.9351 179.9124 11 T 3.8004 8.0647 115.6959 66.6002 68.3668 176.6031 12 R 3.9102 8.3799 120.3020 59.5961 30.0293 179.1745 13 I 3.6591 7.6336 119.1210 64.3223 36.7182 178.3133 14 R 3.7501 8.1468 119.9666 59.6727 29.6051 178.3176 15 N 4.3686 8.4677 115.3016 55.9243 38.6533 176.9180 16 A 4.1183 7.9127 122.5789 55.5532 18.4374 179.6167 17 T 4.0724 8.1801 107.8594 65.1446 68.4447 176.3037 18 R 3.4830 7.1247 118.5186 58.5003 30.1823 177.5275 19 V 3.9476 7.0469 107.2682 60.0182 32.6415 171.9603 20 Y 3.8921 8.2102 125.5021 57.2318 38.3772 169.1305 21 K 4.2171 9.4572 120.5510 55.6211 35.6306 174.1129 22 E 3.7980 8.0873 125.6120 58.9711 30.1069 177.4772 23 S 5.2897 7.4478 112.0088 57.6756 66.9886 172.2043 24 T 4.6610 8.4579 114.3023 62.3459 72.9402 173.4004 25 D 5.8500 8.8716 124.3925 51.1247 42.4417 175.2005 26 V 3.7233 8.0344 122.9552 60.7062 32.7602 174.1208 27 P 3.4264 0.0000 0.0000 62.0682 31.7327 176.1736 28 A 4.1418 8.4170 125.5089 52.5437 19.4427 177.1887 29 S 4.3931 8.0484 109.7422 56.2848 65.1164 176.9091 30 R 4.1532 8.9344 126.8086 58.1634 30.0521 177.1057 31 F 4.7906 7.9390 119.5032 60.2868 40.4035 177.4754 32 K 3.8271 7.7914 117.7999 59.0596 31.8702 178.7445 33 E 3.4861 8.7145 119.2690 59.7568 29.1903 179.0290 34 E 3.8137 7.8540 116.4052 59.7841 29.9449 179.2209 35 I 3.6212 7.8167 119.6086 64.5905 37.2945 178.5712 36 L 3.8699 7.8086 119.8424 57.7420 41.3429 179.3991 37 R 4.1320 8.5070 119.0360 59.5490 30.0643 178.1092 38 I 4.1132 7.6654 118.0627 62.7704 37.2500 178.2383 39 L 4.2685 7.9707 120.4147 57.7538 41.5479 179.1385 40 A 4.0273 8.0270 120.0551 55.3725 18.3587 179.4747 41 R 4.0565 7.9283 115.8472 58.7263 30.1859 176.8237 42 E 4.4178 7.6652 113.6613 55.5181 30.6969 175.2611 43 G 3.5567 8.4834 106.2684 46.8420 0.0000 174.2023 44 F 4.7764 8.4919 114.5462 57.1086 40.8872 175.7791 45 I 4.6562 7.2705 112.4056 59.4389 40.4476 175.1848 46 K 4.1998 9.0531 120.6182 57.8428 32.7203 178.4466 47 G 4.0849 7.4249 106.4859 46.4695 0.0000 170.0633 48 Y 6.0865 7.5536 118.8038 57.4145 40.4453 173.8050 49 E 4.9206 8.7306 117.8321 54.4429 33.8098 174.8317 50 R 4.5548 8.6489 119.0304 56.3709 30.8652 177.3475 51 V 4.2017 7.5204 116.0568 60.2056 38.1660 174.9724 52 D 4.7684 8.0359 128.8337 55.5079 43.7538 176.3646 53 V 4.2339 7.9207 122.4868 61.3911 31.6428 175.1500 54 D 4.3378 7.8128 122.5067 54.4993 36.8471 176.1536 55 G 3.9878 8.6529 107.5574 45.0428 0.0000 171.5885 56 K 4.4848 7.4357 118.5908 53.6087 32.6773 173.7393 57 P 4.8081 0.0000 0.0000 63.6057 31.9793 175.1572 58 Y 4.8826 8.6385 119.4095 56.4669 43.4180 173.6006 59 L 4.8695 9.4269 120.0781 53.0473 44.8876 176.8871 60 R 4.3186 8.5981 124.6276 55.8993 31.1683 176.4345 61 V 4.6203 8.4251 125.9065 61.2354 33.6973 174.2840 62 Y 4.8107 9.0622 127.9868 57.2422 38.8606 176.3188 63 L 4.7326 8.2758 125.4664 54.7972 43.1434 176.2013 64 K 4.8083 7.7506 118.9300 56.1512 35.1146 174.8477 65 Y 4.8729 8.6460 122.8263 56.5802 42.7500 174.4193 66 G 4.1455 8.9148 108.3622 45.1143 0.0000 171.0794 67 P 4.7342 0.0000 0.0000 61.6253 32.3478 175.9750 68 R 3.8634 8.4806 123.1977 56.8450 30.7163 175.1024 69 R 4.7169 8.0666 122.1443 54.6891 33.3846 175.1502 70 Q 4.3466 8.5768 119.2261 55.4314 30.7854 176.4876 71 G 3.8388 8.4061 107.6199 44.1269 0.0000 171.5545 72 P 4.3355 0.0000 0.0000 63.0167 32.0572 175.9114 73 D 4.3089 8.5285 116.4216 55.1996 38.3947 171.5022 74 P 4.7573 0.0000 0.0000 62.5999 32.0202 177.0803 75 R 4.0806 7.4427 118.2154 55.9450 30.5313 174.9755 76 P 4.4300 0.0000 0.0000 62.5460 32.4156 175.1353 77 E 4.3641 8.7628 121.3284 56.5680 31.2297 174.7864 78 Q 5.0235 8.3773 120.6763 54.0511 30.5228 176.6610 79 V 3.6060 8.5974 123.0518 65.1100 31.8617 175.6970 80 I 4.3822 7.3616 120.9058 59.9150 37.0627 174.6146 81 H 4.4370 8.6726 123.3121 57.9611 29.3837 175.8860 82 H 4.2629 8.0378 119.7417 54.5853 33.2368 172.5846 83 I 4.4632 7.6644 126.0591 59.6779 40.0348 173.4833 84 R 4.5399 8.2851 129.3897 54.0678 33.3912 174.3358 85 R 3.9507 8.5577 126.2576 58.0595 30.7124 173.8109 86 I 3.7555 8.3152 127.0453 62.8032 36.6764 177.0705 87 S 4.0555 5.8100 119.5778 59.7551 63.5425 174.0840 88 K 4.8169 8.3649 126.1324 53.6586 35.0261 175.6931 89 P 4.3116 0.0000 0.0000 64.9236 31.3593 177.3064 90 G 3.8983 7.7089 106.0529 45.4253 0.0000 174.3013 91 R 4.3760 7.5143 118.1683 55.1819 31.6580 173.0029 92 R 3.7825 8.1498 121.9962 55.9528 30.9543 177.1680 93 V 4.0909 7.8833 122.6969 61.2454 32.0825 173.8940 94 Y 5.1473 7.7957 122.8782 56.8614 39.8278 175.1864 95 V 4.6671 8.2265 113.3324 59.8104 36.3941 175.8357 96 G 3.8162 9.9695 115.4290 44.9205 0.0000 174.9692 97 V 3.6333 8.3171 118.0754 64.6654 31.4808 178.4026 98 K 4.2493 7.9693 117.1855 57.5171 32.0775 177.2489 99 E 4.3676 7.6545 117.7633 56.6989 30.1221 176.8192 100 I 3.7850 7.2990 120.2249 60.7487 37.5487 174.4004 101 P 4.5508 0.0000 0.0000 62.7528 32.4976 176.7324 102 R 4.5185 7.9871 117.5388 53.4835 30.0080 174.4477 103 V 3.5476 7.7894 117.8540 64.2524 31.9377 175.5424 104 R 3.3846 9.3135 125.2325 56.8806 29.1379 175.5693 105 R 3.5819 8.0331 111.6921 56.5349 25.3994 178.3231 106 G 4.0739 8.2108 107.1066 46.4898 0.0000 174.6073 107 L 4.1510 7.9920 118.9004 56.6237 41.7688 176.3074 108 G 4.6483 7.2588 104.1323 44.2194 0.0000 172.0811 109 I 4.7864 9.4558 119.3688 59.0128 41.0106 174.9794 110 A 4.9590 8.3961 129.9456 48.8398 18.5608 175.1036 111 I 4.0393 7.7366 122.2203 61.4743 38.7331 175.5760 112 L 4.7633 8.3352 121.6561 54.8271 43.6667 174.1046 113 S 4.5130 8.8421 119.6472 58.9919 63.8749 172.7341 114 T 4.7790 8.2674 115.1061 60.0022 72.3569 174.6753 115 S 4.3204 8.8968 115.9578 60.5453 62.7980 174.8233 116 K 4.5674 8.1225 120.7600 56.3369 33.2542 176.7704 117 G 3.9359 8.2015 104.9647 44.5161 0.0000 174.1786 118 V 3.8658 8.1090 119.4225 63.4464 31.4099 174.9834 119 L 5.1160 8.0993 132.4963 54.1724 45.1089 174.8848 120 T 5.3083 8.4444 109.7577 60.1328 72.6037 174.4908 121 D 4.3816 9.0726 120.7309 57.0343 39.0157 179.0317 122 R 4.0485 7.8873 118.8335 58.7462 30.3904 178.4136 123 E 3.9681 7.9966 117.6426 59.6182 29.4195 179.4697 124 A 4.0475 8.6570 120.9596 54.9623 18.3291 179.5084 125 R 3.8299 7.4573 115.1067 59.7885 30.0492 178.0074 126 K 4.1181 7.8170 118.7961 58.6921 32.4133 178.3442 127 L 4.0522 8.0884 121.1647 55.2129 43.1643 177.1657 128 G 3.8728 8.3172 107.2432 45.9233 0.0000 171.8921 129 V 4.4027 7.1161 109.5849 61.3476 36.1094 173.1936 130 G 4.0838 7.6322 107.4734 46.6007 0.0000 171.9094 131 G 3.7227 7.2710 104.4787 45.4981 0.0000 171.2557 132 E 4.5184 8.3185 122.4956 56.2136 29.6316 176.4970 133 L 3.9980 8.4598 128.7689 55.7093 42.1487 177.4740 134 I 3.9579 8.6811 128.0424 63.6781 38.3180 175.6854 135 C 4.8797 7.5474 114.6411 57.8851 33.5764 172.2880 136 E 5.1450 8.2194 117.1983 54.5996 31.5708 175.1921 137 V 4.6925 8.9093 123.9380 60.7442 35.3846 175.2271 138 W 4.9344 8.5303 123.3568 57.2813 28.2050 174.0863 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 8.30 4.30 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 L 7.88 3.44 0.00 1.88 1.71 0.89 0.57 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 3 T 8.86 4.18 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 4 D 7.58 4.74 0.00 2.74 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 5 P 0.00 4.33 0.00 2.19 2.06 0.00 3.66 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 6 I 7.88 3.69 2.22 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.49 0.88 0.00 0.00 7 A 8.83 4.00 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 8 D 8.63 4.20 0.00 2.78 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 9 M 8.83 3.51 0.00 2.18 1.90 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 10 L 8.55 3.88 0.00 1.71 1.59 0.81 0.67 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 11 T 8.06 3.80 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 1.16 0.00 0.00 12 R 8.38 3.91 0.00 1.95 1.97 0.00 3.27 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 13 I 7.63 3.66 1.96 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 1.34 0.66 0.80 0.00 0.00 14 R 8.15 3.75 0.00 1.84 1.96 0.00 3.00 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 15 N 8.47 4.37 0.00 2.72 2.82 0.00 0.00 7.02 7.39 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 16 A 7.91 4.12 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 17 T 8.18 4.07 4.38 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 1.09 0.00 0.00 18 R 7.12 3.48 0.00 1.93 1.95 0.00 3.05 0.00 0.00 3.44 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 19 V 7.05 3.95 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 0.64 0.00 0.00 0.93 0.00 0.00 20 Y 8.21 3.89 0.00 2.90 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 0.00 0.00 0.00 21 K 9.46 4.22 0.00 1.67 1.72 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.30 7.81 22 E 8.09 3.80 0.00 2.15 1.95 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 2.52 2.64 0.00 23 S 7.45 5.29 0.00 3.50 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 24 T 8.46 4.66 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 1.25 0.00 0.00 25 D 8.87 5.85 0.00 2.81 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 26 V 8.03 3.72 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 0.74 0.00 0.00 0.78 0.00 0.00 27 P 0.00 3.43 0.00 1.62 1.43 0.00 3.42 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.18 0.00 28 A 8.42 4.14 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 29 S 8.05 4.39 0.00 3.78 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 30 R 8.93 4.15 0.00 1.88 1.99 0.00 3.29 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 31 F 7.94 4.79 0.00 3.00 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 K 7.79 3.83 0.00 1.87 1.69 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.54 7.81 33 E 8.71 3.49 0.00 1.90 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 2.21 2.45 0.00 34 E 7.85 3.81 0.00 1.89 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 0.00 2.64 2.49 0.00 35 I 7.82 3.62 1.69 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.47 0.72 0.00 0.00 36 L 7.81 3.87 0.00 1.34 1.24 0.57 0.77 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 37 R 8.51 4.13 0.00 1.94 2.16 0.00 3.13 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 38 I 7.67 4.11 1.98 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 1.54 0.86 0.96 0.00 0.00 39 L 7.97 4.27 0.00 1.92 1.83 0.83 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.03 4.03 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 41 R 7.93 4.06 0.00 1.88 2.19 0.00 3.26 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 42 E 7.67 4.42 0.00 2.30 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 0.00 2.35 2.49 0.00 43 G 8.48 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.49 4.78 0.00 3.13 2.98 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 45 I 7.27 4.66 2.13 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.55 0.98 0.00 0.00 46 K 9.05 4.20 0.00 2.01 1.92 0.00 1.93 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.52 1.73 7.81 47 G 7.42 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 48 Y 7.55 6.09 0.00 3.03 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 49 E 8.73 4.92 0.00 2.07 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 0.00 2.58 2.48 0.00 50 R 8.65 4.55 0.00 1.79 1.99 0.00 3.27 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.77 0.00 51 V 7.52 4.20 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 0.62 0.00 0.00 1.06 0.00 0.00 52 D 8.04 4.77 0.00 2.64 2.52 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 53 V 7.92 4.23 1.70 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 0.71 0.00 0.00 0.49 0.00 0.00 54 D 7.81 4.34 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 55 G 8.65 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 0.00 0.00 0.00 56 K 7.44 4.48 0.00 1.94 1.97 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.21 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.61 7.81 57 P 0.00 4.81 0.00 2.17 2.25 0.00 3.72 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.05 0.00 58 Y 8.64 4.88 0.00 2.85 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 9.43 4.87 0.00 1.42 1.56 0.70 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.60 4.32 0.00 1.66 1.38 0.00 3.20 0.00 0.00 3.11 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.59 0.00 61 V 8.43 4.62 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 1.06 0.00 0.00 0.98 0.00 0.00 62 Y 9.06 4.81 0.00 2.97 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 63 L 8.28 4.73 0.00 1.82 1.29 0.86 1.09 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 64 K 7.75 4.81 0.00 1.75 1.72 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.53 7.81 65 Y 8.65 4.87 0.00 2.73 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 66 G 8.91 4.15 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 0.00 0.00 0.00 67 P 0.00 4.73 0.00 2.09 2.06 0.00 3.84 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 68 R 8.48 3.86 0.00 1.79 1.89 0.00 3.14 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 69 R 8.07 4.72 0.00 1.72 1.82 0.00 3.23 0.00 0.00 3.55 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 70 Q 8.58 4.35 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.67 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 71 G 8.41 3.84 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 0.00 0.00 0.00 72 P 0.00 4.34 0.00 2.06 2.00 0.00 3.84 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 73 D 8.53 4.31 0.00 2.83 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 74 P 0.00 4.76 0.00 2.23 2.23 0.00 3.75 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 2.04 1.97 0.00 75 R 7.44 4.08 0.00 1.75 1.83 0.00 3.50 0.00 0.00 3.40 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 76 P 0.00 4.43 0.00 2.10 2.04 0.00 2.93 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.48 0.00 77 E 8.76 4.36 0.00 2.19 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 0.00 2.47 2.50 0.00 78 Q 8.38 5.02 0.00 1.91 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.85 0.00 0.00 0.00 0.00 0.00 2.50 2.36 0.00 79 V 8.60 3.61 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 0.92 0.00 0.00 0.95 0.00 0.00 80 I 7.36 4.38 1.75 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.92 0.68 0.00 0.00 81 H 8.67 4.44 0.00 3.02 3.41 0.00 5.90 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 8.04 4.26 0.00 1.97 1.31 0.00 5.75 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 83 I 7.66 4.46 1.54 0.00 0.00 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 1.03 0.71 0.68 0.00 0.00 84 R 8.29 4.54 0.00 1.67 1.63 0.00 3.15 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 85 R 8.56 3.95 0.00 1.82 1.77 0.00 3.29 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 86 I 8.32 3.76 2.04 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 1.14 0.98 0.95 0.00 0.00 87 S 5.81 4.06 0.00 3.92 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 88 K 8.36 4.82 0.00 1.64 1.64 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.32 7.81 89 P 0.00 4.31 0.00 2.16 2.17 0.00 3.72 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 1.97 1.95 0.00 90 G 7.71 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.51 4.38 0.00 1.78 1.71 0.00 3.06 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.51 0.00 92 R 8.15 3.78 0.00 1.17 1.27 0.00 3.41 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 93 V 7.88 4.09 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 0.96 0.00 0.00 0.90 0.00 0.00 94 Y 7.80 5.15 0.00 2.92 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 95 V 8.23 4.67 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 0.78 0.00 0.00 1.05 0.00 0.00 96 G 9.97 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 0.00 0.00 0.00 97 V 8.32 3.63 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 0.75 0.00 0.00 0.98 0.00 0.00 98 K 7.97 4.25 0.00 1.78 1.91 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 7.65 4.37 0.00 2.11 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 2.31 2.28 0.00 100 I 7.30 3.78 1.89 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 1.38 0.75 0.94 0.00 0.00 101 P 0.00 4.55 0.00 2.07 2.00 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 102 R 7.99 4.52 0.00 1.85 1.81 0.00 3.20 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 103 V 7.79 3.55 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 1.09 0.00 0.00 1.10 0.00 0.00 104 R 9.31 3.38 0.00 1.35 1.68 0.00 2.83 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.28 0.00 105 R 8.03 3.58 0.00 1.98 1.94 0.00 3.41 0.00 0.00 3.13 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 106 G 8.21 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 0.00 107 L 7.99 4.15 0.00 1.61 1.77 0.87 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.26 4.65 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 0.00 109 I 9.46 4.79 2.11 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 1.31 1.54 1.04 0.00 0.00 110 A 8.40 4.96 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 0.00 111 I 7.74 4.04 1.84 0.00 0.00 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 1.40 0.98 0.86 0.00 0.00 112 L 8.34 4.76 0.00 1.94 1.77 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.84 4.51 0.00 4.24 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 0.00 114 T 8.27 4.78 4.41 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 1.34 0.00 0.00 115 S 8.90 4.32 0.00 3.98 4.02 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 0.00 116 K 8.12 4.57 0.00 1.73 1.78 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.36 7.81 117 G 8.20 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 0.00 118 V 8.11 3.87 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 0.76 0.00 0.00 0.99 0.00 0.00 119 L 8.10 5.12 0.00 1.69 1.60 0.94 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.44 5.31 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 1.25 0.00 0.00 121 D 9.07 4.38 0.00 2.91 3.03 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 0.00 122 R 7.89 4.05 0.00 1.90 2.02 0.00 3.16 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 123 E 8.00 3.97 0.00 2.17 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 0.00 2.35 2.37 0.00 124 A 8.66 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 125 R 7.46 3.83 0.00 2.08 2.15 0.00 3.27 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 126 K 7.82 4.12 0.00 1.98 1.93 0.00 1.89 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.48 7.81 127 L 8.09 4.05 0.00 1.82 1.75 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.32 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 0.00 0.00 0.00 129 V 7.12 4.40 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 0.76 0.00 0.00 0.94 0.00 0.00 130 G 7.63 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 0.00 131 G 7.27 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 0.00 0.00 0.00 132 E 8.32 4.52 0.00 2.29 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 0.00 2.43 2.53 0.00 133 L 8.46 4.00 0.00 1.89 1.77 0.95 1.01 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 0.00 134 I 8.68 3.96 2.03 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 1.80 1.09 0.91 0.00 0.00 135 C 7.55 4.88 0.00 3.11 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 0.00 136 E 8.22 5.14 0.00 2.22 2.17 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 2.40 2.40 0.00 137 V 8.91 4.69 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 0.25 0.00 0.00 0.74 0.00 0.00 138 W 8.53 4.93 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