NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2917 8.2549 119.6931 56.2688 31.5315 174.4620 3 H 4.7633 8.8811 116.6909 53.3098 31.7147 170.6497 4 L 4.0614 9.9471 126.6420 54.5094 42.1864 174.4543 5 K 3.9330 8.1478 116.0953 58.1396 32.1706 175.8750 6 S 4.8139 9.5430 113.0139 55.9132 65.8731 173.9349 7 G 3.7784 8.3791 109.5891 44.7229 0.0000 173.8790 8 R 3.9441 8.4255 120.1005 55.2781 30.3980 175.9828 9 K 4.2213 8.3237 117.7449 57.1877 33.2748 176.6543 10 L 4.1168 7.8296 113.6248 54.5858 43.7768 174.0492 11 N 4.5658 8.6174 123.7482 52.7046 40.8944 173.5278 12 R 3.6473 10.6400 121.6421 55.4978 30.0450 176.3865 13 H 4.6418 7.9127 115.1588 54.5324 31.0868 176.1812 14 S 4.1160 8.7093 116.0520 61.9660 62.3489 176.6803 15 S 4.0946 8.2250 117.8976 61.0571 62.6744 175.7146 16 H 4.0184 8.0527 121.6830 58.8257 29.9123 176.7630 17 R 3.6557 8.0670 120.8081 59.3752 29.5560 178.0876 18 L 3.7379 7.8259 119.6965 57.9559 42.2274 178.5128 19 A 3.9146 7.8862 120.7789 55.2001 18.2695 179.0163 20 L 3.7613 8.1680 118.7820 58.7477 42.0268 178.8220 21 Y 4.0927 7.0997 115.8233 61.1104 37.5942 178.6812 22 R 4.0766 7.9464 118.8862 59.5548 30.2413 178.4984 23 N 4.2819 8.7140 116.1940 56.8064 38.6485 177.4865 24 Q 3.9768 8.3869 118.9001 58.8131 28.8321 178.2760 25 A 4.0906 8.3338 122.2318 55.4796 18.1667 179.5823 26 K 3.8534 8.0441 115.0802 59.8996 32.5023 179.1794 27 S 4.2907 8.0132 115.0257 61.6956 62.8465 176.4894 28 L 4.0179 8.4838 122.8244 58.3716 41.7183 178.6953 29 L 4.2873 8.3731 115.1946 56.3802 41.5131 178.1300 30 T 4.4416 7.8512 115.4587 63.9706 70.2995 174.6852 31 H 4.8480 8.1606 115.4475 54.4740 31.5620 174.8372 32 G 4.2485 9.4712 108.8710 44.9821 0.0000 173.4282 33 R 5.1909 7.6955 116.2180 54.4894 33.9200 174.9168 34 I 4.7248 8.6184 121.4208 59.8635 42.1850 173.4332 35 T 5.3408 8.5188 123.6664 62.3617 70.7861 173.7623 36 T 4.6319 8.4403 116.4245 61.0909 72.3391 173.1397 37 T 4.5483 8.5173 110.2205 61.4641 70.3521 175.3099 38 V 3.5525 8.3264 123.6917 66.0152 31.4802 176.5328 39 P 4.2404 0.0000 0.0000 65.8955 31.0202 178.6831 40 K 4.0402 7.6851 115.0108 59.7501 32.2127 178.8165 41 A 4.0951 8.5118 121.5069 54.5761 18.1187 179.7943 42 K 4.0514 8.4005 117.1928 59.5151 32.1641 178.4485 43 E 4.0215 8.2514 119.4824 58.6514 29.6252 178.2335 44 L 3.7243 8.3069 121.1152 58.6186 42.0540 178.4084 45 R 3.8686 8.2509 114.4022 59.8807 28.7238 178.1017 46 G 3.8368 8.0384 105.5817 47.2774 0.0000 174.8343 47 F 4.0431 7.6935 122.7266 60.7026 39.2436 177.2721 48 V 3.9588 8.1304 117.8599 65.7461 31.3746 177.1242 49 D 4.5105 8.5529 118.7357 58.6029 40.6711 178.5474 50 H 3.9018 8.0940 117.0193 59.4241 30.1327 176.5018 51 L 3.7720 7.4838 120.7667 58.5626 41.6335 179.2965 52 I 3.4305 7.9196 118.9464 64.7040 37.0310 177.6764 53 H 3.7861 8.6070 118.5414 59.5286 29.6271 177.1977 54 L 3.8353 7.9190 119.5481 57.8275 41.6065 179.2952 55 A 2.5800 7.1179 118.2879 53.7592 18.0438 179.2788 56 K 3.7938 7.5953 118.4084 58.8499 32.5166 177.5193 57 R 4.1085 7.0467 116.1680 56.4070 30.5414 176.6575 58 G 4.1867 8.3739 106.5953 45.5874 0.0000 174.3038 59 D 4.5032 8.1418 120.0767 53.8064 40.9469 177.3526 60 L 3.9469 8.5889 122.1419 58.1289 41.9878 179.0535 61 H 4.1771 8.2439 117.7630 59.2968 29.9249 176.3386 62 A 3.9849 8.1120 122.7003 55.6276 18.1708 179.1082 63 R 3.7393 8.0735 116.5426 60.0419 29.7965 178.6911 64 R 3.9415 7.9871 116.7618 59.2056 30.4180 178.9699 65 L 4.0748 8.3750 118.9721 57.9721 41.6287 179.6098 66 V 3.6216 8.5553 118.5005 66.1774 31.1353 177.9076 67 L 4.1337 8.2745 117.8179 57.2906 41.4230 179.1548 68 R 4.1554 7.8514 117.6848 59.1037 30.0856 176.9057 69 D 4.6860 7.8210 118.0688 56.2413 41.7337 176.7543 70 L 4.2720 7.6546 120.7357 55.1255 42.5022 176.8746 71 Q 4.4293 8.4264 120.8322 56.5122 31.2589 175.8452 72 D 4.4793 7.9620 117.9335 53.5168 42.0941 176.1154 73 V 3.5161 8.4847 126.8734 66.0629 31.6456 177.2950 74 K 3.7898 8.2049 118.7464 59.6679 31.8007 177.9221 75 L 3.8903 8.3773 120.0211 58.3442 42.1101 178.8648 76 V 3.6887 8.1326 118.5036 66.3724 31.3177 177.6063 77 R 3.8704 8.4995 117.8953 59.3360 29.8660 178.3489 78 K 3.7892 8.1188 118.7963 59.7717 32.1024 178.0881 79 L 3.9479 8.1841 120.4618 58.5092 41.7187 179.0761 80 F 3.9417 8.6734 116.1345 60.7007 39.0532 177.3416 81 D 4.5148 8.5922 117.3780 57.0770 40.8189 178.0319 82 E 4.3272 7.8814 116.4430 59.2576 30.6568 177.9821 83 I 3.7752 8.3666 120.3980 63.0694 37.0452 178.7070 84 A 3.7567 8.9294 122.7144 54.9894 18.9961 177.8945 85 P 4.1576 0.0000 0.0000 65.7298 31.5362 178.1644 86 R 3.7095 7.3119 115.9279 59.1769 29.7597 176.7948 87 Y 4.3905 7.5560 114.9959 58.8103 38.2954 180.5305 88 R 3.4295 7.4434 115.7782 58.7124 32.4052 176.8186 89 D 4.5278 7.7678 119.9275 55.6642 41.5507 176.4447 90 R 4.3967 8.9147 121.7160 55.2535 30.8578 176.4614 91 Q 4.2259 8.5593 127.5211 54.9098 27.5871 175.5097 92 G 3.0289 8.4787 112.2352 44.7518 0.0000 170.1920 93 G 3.4303 7.2826 102.8815 46.8851 0.0000 174.1227 94 Y 4.1062 6.5873 113.0069 57.9243 37.8202 175.7136 95 T 5.5814 7.0203 112.7384 61.6782 70.6386 172.6712 96 R 4.7221 9.0959 126.9053 54.5296 34.0610 173.7733 97 V 5.4288 8.3236 124.0322 60.1675 34.2663 174.5057 98 L 4.8890 8.3267 126.3491 52.7799 45.7967 175.6975 99 K 4.4917 8.7116 122.8175 56.1937 32.8520 176.5383 100 L 4.5696 8.5046 124.8559 53.5283 42.8332 176.9086 101 A 4.1265 8.3996 125.0331 53.0024 19.0999 176.1932 102 E 4.2474 9.2494 119.9697 56.6817 28.9861 174.3145 103 R 4.7838 7.9667 116.7481 53.8094 32.9440 174.6966 104 R 3.8166 8.3170 117.6976 57.1433 30.2721 177.1326 105 R 4.4914 8.5153 123.6957 53.6443 28.0789 175.7586 106 G 4.5456 7.6280 117.8370 46.1501 0.0000 170.6410 107 D 4.3781 8.5041 117.1857 52.6566 41.2873 175.9319 108 G 3.8568 8.9768 107.8386 46.5841 0.0000 173.7057 109 A 4.2647 8.3655 122.8080 50.6114 19.6658 176.2427 110 P 4.6154 0.0000 0.0000 62.9510 32.7341 176.0406 111 L 5.2077 8.0839 120.6271 53.5723 44.6187 175.0705 112 A 5.0885 8.9883 121.0404 50.4604 23.3725 175.1618 113 L 4.6188 9.1265 122.4444 54.7065 43.9298 176.0815 114 V 4.8358 9.5246 126.6501 60.2517 33.6120 173.6987 115 E 4.4156 8.5144 128.8542 55.6500 31.3060 175.1392 116 L 4.2903 9.6013 125.6552 53.6516 41.6784 175.9233 117 V 4.7691 7.2499 125.2973 62.6121 34.2226 170.1944 118 E 4.3334 8.2742 127.7232 56.5334 29.8051 174.5704 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 2 R 8.25 4.29 0.00 1.79 1.92 0.00 3.15 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 3 H 8.88 4.76 0.00 3.17 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.95 4.06 0.00 1.74 1.91 0.93 0.70 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 5 K 8.15 3.93 0.00 1.77 1.86 0.00 1.64 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.52 7.81 6 S 9.54 4.81 0.00 3.94 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 7 G 8.38 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 8 R 8.43 3.94 0.00 1.81 1.98 0.00 3.37 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 9 K 8.32 4.22 0.00 1.89 1.85 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.51 7.81 10 L 7.83 4.12 0.00 1.60 1.60 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.62 4.57 0.00 2.64 2.67 0.00 0.00 7.26 7.65 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 12 R 10.64 3.65 0.00 1.75 1.56 0.00 2.93 0.00 0.00 2.76 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.33 0.00 13 H 7.91 4.64 0.00 3.39 3.46 0.00 5.69 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.71 4.12 0.00 4.09 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 0.00 15 S 8.22 4.09 0.00 4.10 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 0.00 16 H 8.05 4.02 0.00 2.87 3.14 0.00 5.70 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.07 3.66 0.00 1.91 1.86 0.00 3.11 0.00 0.00 3.08 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.35 0.00 18 L 7.83 3.74 0.00 1.96 1.71 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.89 3.91 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 L 8.17 3.76 0.00 1.56 1.48 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.10 4.09 0.00 2.21 1.43 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 0.00 22 R 7.95 4.08 0.00 2.04 2.08 0.00 3.22 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 23 N 8.71 4.28 0.00 2.70 2.90 0.00 0.00 7.16 7.43 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 24 Q 8.39 3.98 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 25 A 8.33 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.04 3.85 0.00 1.93 1.93 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.19 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.74 7.81 27 S 8.01 4.29 0.00 4.09 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 28 L 8.48 4.02 0.00 1.90 1.85 0.97 0.74 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 29 L 8.37 4.29 0.00 1.80 1.74 0.97 0.93 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 30 T 7.85 4.44 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 0.88 0.00 0.00 31 H 8.16 4.85 0.00 3.27 3.26 0.00 5.65 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 32 G 9.47 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 0.00 0.00 0.00 0.00 33 R 7.70 5.19 0.00 1.70 1.80 0.00 3.15 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 34 I 8.62 4.72 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.28 0.94 0.00 0.00 35 T 8.52 5.34 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 1.24 0.00 0.00 36 T 8.44 4.63 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 1.26 0.00 0.00 37 T 8.52 4.55 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 38 V 8.33 3.55 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 1.10 0.00 0.00 0.99 0.00 0.00 39 P 0.00 4.24 0.00 2.20 2.11 0.00 3.59 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 2.20 0.00 40 K 7.69 4.04 0.00 1.85 2.08 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.47 7.81 41 A 8.51 4.10 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 42 K 8.40 4.05 0.00 2.02 1.90 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.49 7.81 43 E 8.25 4.02 0.00 2.20 2.05 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 2.28 1.81 0.00 44 L 8.31 3.72 0.00 1.95 1.66 0.96 0.94 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 45 R 8.25 3.87 0.00 2.04 2.12 0.00 3.01 0.00 0.00 3.30 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 46 G 8.04 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 47 F 7.69 4.04 0.00 2.71 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 48 V 8.13 3.96 2.26 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 1.03 0.00 0.00 1.11 0.00 0.00 49 D 8.55 4.51 0.00 2.93 2.72 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 50 H 8.09 3.90 0.00 3.11 3.28 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.48 3.77 0.00 2.08 1.67 0.92 0.60 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 52 I 7.92 3.43 1.69 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.92 0.38 0.00 0.00 53 H 8.61 3.79 0.00 3.40 3.41 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.92 3.84 0.00 1.65 1.66 0.86 0.23 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 55 A 7.12 2.58 0.39 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 56 K 7.60 3.79 0.00 1.52 1.75 0.00 1.67 0.00 0.00 1.42 0.00 0.00 3.13 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.30 1.41 7.81 57 R 7.05 4.11 0.00 2.03 2.03 0.00 3.17 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 58 G 8.37 4.19 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 0.00 59 D 8.14 4.50 0.00 2.96 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 60 L 8.59 3.95 0.00 1.74 1.71 0.87 0.89 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 61 H 8.24 4.18 0.00 3.24 3.60 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.11 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.07 3.74 0.00 1.56 1.88 0.00 2.79 0.00 0.00 2.93 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.66 0.00 64 R 7.99 3.94 0.00 1.94 1.99 0.00 3.24 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 65 L 8.38 4.07 0.00 1.93 1.67 0.81 0.69 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 66 V 8.56 3.62 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 1.13 0.00 0.00 0.99 0.00 0.00 67 L 8.27 4.13 0.00 1.81 1.73 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.85 4.16 0.00 1.91 2.02 0.00 3.16 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 69 D 7.82 4.69 0.00 2.67 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 70 L 7.65 4.27 0.00 1.69 1.66 0.99 0.91 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 71 Q 8.43 4.43 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 72 D 7.96 4.48 0.00 2.80 2.56 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 73 V 8.48 3.52 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 0.90 0.00 0.00 0.92 0.00 0.00 74 K 8.20 3.79 0.00 2.00 1.99 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.60 7.81 75 L 8.38 3.89 0.00 2.00 1.87 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.13 3.69 2.21 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 0.97 0.00 0.00 1.04 0.00 0.00 77 R 8.50 3.87 0.00 2.04 1.98 0.00 3.21 0.00 0.00 3.07 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 78 K 8.12 3.79 0.00 1.86 2.05 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.64 7.81 79 L 8.18 3.95 0.00 1.96 2.06 0.89 1.05 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 80 F 8.67 3.94 0.00 3.12 3.11 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 81 D 8.59 4.51 0.00 2.62 2.74 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 82 E 7.88 4.33 0.00 2.04 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 2.24 2.38 0.00 83 I 8.37 3.78 2.02 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 1.66 0.84 1.02 0.00 0.00 84 A 8.93 3.76 1.17 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 0.00 0.00 85 P 0.00 4.16 0.00 1.96 2.09 0.00 3.75 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.08 0.00 86 R 7.31 3.71 0.00 0.85 1.56 0.00 3.00 0.00 0.00 2.94 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.41 0.00 87 Y 7.56 4.39 0.00 2.92 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 88 R 7.44 3.43 0.00 1.93 1.98 0.00 3.41 0.00 0.00 3.23 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 89 D 7.77 4.53 0.00 2.75 2.74 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 90 R 8.91 4.40 0.00 1.86 2.20 0.00 3.42 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 91 Q 8.56 4.23 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.70 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 92 G 8.48 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 0.00 0.00 0.00 93 G 7.28 3.43 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 0.00 0.00 0.00 0.00 94 Y 6.59 4.11 0.00 2.55 1.88 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 95 T 7.02 5.58 4.30 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 1.26 0.00 0.00 96 R 9.10 4.72 0.00 1.87 1.69 0.00 3.09 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 97 V 8.32 5.43 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 1.05 0.00 0.00 0.93 0.00 0.00 98 L 8.33 4.89 0.00 1.58 1.49 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.71 4.49 0.00 1.64 1.74 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.47 7.81 100 L 8.50 4.57 0.00 1.68 1.59 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.40 4.13 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 0.00 102 E 9.25 4.25 0.00 2.22 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 2.26 2.27 0.00 103 R 7.97 4.78 0.00 1.84 1.86 0.00 3.07 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 104 R 8.32 3.82 0.00 2.06 2.01 0.00 3.17 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 105 R 8.52 4.49 0.00 1.80 1.90 0.00 3.30 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 7.63 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.50 4.38 0.00 2.73 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 0.00 108 G 8.98 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 0.00 0.00 0.00 109 A 8.37 4.26 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 0.00 110 P 0.00 4.62 0.00 2.13 2.20 0.00 3.68 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 2.07 2.00 0.00 111 L 8.08 5.21 0.00 1.68 1.68 0.92 0.47 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 0.00 112 A 8.99 5.09 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 0.00 113 L 9.13 4.62 0.00 1.98 1.55 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.52 4.84 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 1.22 0.00 0.00 0.94 0.00 0.00 115 E 8.51 4.42 0.00 2.11 1.81 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 2.36 2.36 0.00 116 L 9.60 4.29 0.00 1.78 1.68 1.03 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.25 4.77 2.30 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 0.92 0.00 0.00 0.97 0.00 0.00 118 E 8.27 4.33 0.00 1.91 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 2.16 2.35 0.00