NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2043 8.3144 121.7901 55.6056 33.2807 175.1519 2 E 3.7454 8.7016 126.2964 55.1281 30.0083 175.1470 3 T 4.1915 8.7739 118.6062 61.2891 72.0076 174.8501 4 A 3.9943 8.5355 123.5949 55.2837 18.3244 180.0314 5 A 4.0892 7.9637 118.5586 55.4054 18.6163 179.6333 6 A 4.0249 8.0455 119.3524 55.0006 18.3435 179.7263 7 K 4.1077 8.4070 119.9545 58.9834 32.2027 178.5886 8 F 4.1209 8.5396 121.1130 61.6060 39.3206 176.9964 9 E 4.0186 8.2162 117.8348 59.4888 29.0403 179.4180 10 R 3.9186 7.8849 117.7554 59.3619 30.2265 178.0992 11 Q 4.0266 8.0212 116.9094 57.6271 29.1502 176.1096 12 H 4.7158 7.8947 113.7578 54.0843 31.1349 173.1414 13 M 4.9275 8.0513 118.9184 53.5260 33.9073 176.2030 14 D 4.8361 9.5314 123.5673 52.7617 41.2443 175.8978 15 S 4.4277 8.4210 116.2797 59.5352 63.5950 175.6243 16 S 4.7994 7.8631 114.4264 58.2944 63.3450 174.1389 17 T 4.7320 7.4217 116.5647 62.3316 72.0913 173.9793 18 S 4.2973 8.5657 119.6871 60.2805 63.5206 173.6050 19 A 3.7141 7.0050 120.0801 50.9939 21.4828 175.0902 20 A 3.6633 8.0950 123.1516 51.8353 18.9039 177.9190 21 S 4.6774 8.4101 114.0375 57.7458 64.0245 173.5174 22 S 4.6314 7.4534 114.8360 57.3961 65.3102 174.8916 23 S 4.4117 8.5408 114.4990 59.8366 63.1223 174.5180 24 N 4.6452 8.1849 118.7638 54.1057 39.1025 176.0933 25 Y 4.0039 7.8426 120.4921 61.1962 38.6374 177.5231 26 C 4.2175 8.1751 116.7241 60.1229 38.6300 175.8773 27 N 4.4100 8.2123 117.3897 56.4958 38.0998 177.3262 28 Q 3.9395 8.2059 119.4237 59.2735 28.8699 178.7098 29 M 3.6388 7.7286 119.9040 58.5287 31.7329 178.7259 30 M 4.0252 8.0464 119.0557 58.1278 31.9846 178.8683 31 K 3.9220 7.6449 118.5101 59.5973 32.3217 179.1788 32 S 4.1149 8.0202 113.2759 61.0611 62.8081 175.5423 33 R 4.3127 7.7795 119.2675 54.9953 29.9677 175.6187 34 N 4.2587 7.9419 115.8754 54.7557 37.4969 174.7930 35 L 4.3456 8.2138 115.8190 55.3195 42.0485 178.1428 36 T 6.0571 7.5190 107.5944 60.5939 69.2867 175.5737 37 K 4.2271 8.3767 123.0833 60.1903 32.3095 178.0319 38 D 4.6037 7.9418 116.3474 55.7258 41.7770 176.1146 39 R 3.8778 7.2772 113.1287 55.5526 31.3073 174.2037 40 C 4.6528 8.8379 116.4361 55.6622 39.7899 173.9094 41 K 4.2155 8.1704 127.5610 55.6569 32.3415 175.1359 42 P 4.6049 0.0000 0.0000 65.6472 32.4924 176.4156 43 V 5.0324 7.5880 117.8298 61.4837 34.7528 173.5705 44 N 4.8049 9.0315 124.2041 52.6951 42.8329 172.9393 45 T 4.8075 7.9333 120.8758 61.6200 71.9830 172.7699 46 F 4.8282 8.8124 123.9928 55.6207 42.0235 174.5500 47 V 4.5983 8.7935 123.3331 61.0577 33.5330 175.5402 48 H 5.8245 8.4333 127.0417 53.7082 26.4591 172.8569 49 E 4.7786 7.6585 117.9610 53.5254 34.7206 176.2589 50 S 4.4900 8.3155 116.1539 57.5929 65.0977 174.9518 51 L 4.0096 8.5190 124.8264 58.3141 41.9417 178.9565 52 A 4.0709 8.1291 120.2667 55.6932 18.0106 179.2671 53 D 4.3687 7.6695 115.1758 57.1651 41.0987 178.8884 54 V 3.8292 7.6538 118.5268 65.9863 31.6884 178.0711 55 Q 3.8732 8.9384 118.2821 58.8918 28.4971 178.7302 56 A 4.0606 8.0595 121.3849 54.4760 18.3412 179.5973 57 V 3.5340 7.7520 117.0436 65.8531 31.2886 176.7666 58 C 3.9120 7.8257 114.5468 57.8119 39.8766 173.9595 59 S 4.5797 7.4462 114.1260 57.8581 63.8873 174.9072 60 Q 4.1034 7.7633 122.3966 55.7972 28.0043 176.0000 61 K 4.2295 7.6049 127.0938 56.8397 33.2350 176.3808 62 N 4.3653 8.8559 127.3732 53.6941 39.6604 174.3577 63 V 4.5759 8.2465 118.4504 59.0503 36.4515 175.1288 64 A 4.2191 8.4505 125.9408 52.2363 19.0677 178.6264 65 C 4.6109 9.2504 120.3847 56.1829 41.0443 174.9047 66 K 3.7012 8.9203 123.6784 59.6382 31.6935 177.4213 67 N 4.5664 8.0729 113.1179 52.9662 37.5088 175.7173 68 G 3.9681 8.3171 108.6418 45.3667 0.0000 174.3770 69 Q 4.1126 8.2727 119.4548 56.5439 29.1662 176.7630 70 T 4.5483 8.3800 116.8108 63.6175 69.1344 174.2919 71 N 4.9701 7.8721 118.7953 53.1879 38.7349 175.1199 72 C 5.2719 7.4968 115.7337 56.8968 42.4835 172.4066 73 Y 4.9649 8.7561 118.0102 56.4259 42.3841 173.7942 74 Q 5.1158 9.3102 125.4601 53.8451 31.5865 174.8694 75 S 4.3622 8.9644 122.4090 58.8108 62.9567 174.2621 76 Y 4.4702 9.1497 122.4466 60.5959 37.8874 176.3582 77 S 4.9861 7.8445 112.4131 56.4525 64.8940 173.8604 78 T 4.2319 8.2229 113.2525 61.8192 69.8307 173.6665 79 M 5.0361 9.3694 122.5080 53.4785 37.1576 174.5279 80 S 4.8946 8.9961 116.9725 58.2094 63.5396 173.0646 81 I 5.2350 9.1107 120.6902 59.4740 41.5823 174.2807 82 T 5.0216 8.7811 119.6516 61.9650 71.7660 172.3464 83 D 4.9999 9.4793 127.0447 52.9401 43.5494 174.2695 84 C 5.6308 9.1218 123.0763 55.2500 41.6390 172.8734 85 R 5.3457 8.9359 124.2378 53.9814 32.9298 174.2110 86 E 3.9604 9.0819 127.6235 57.0837 30.3606 176.5873 87 T 4.4054 8.3704 122.9594 62.3438 70.1737 176.3284 88 G 3.6473 8.7164 111.6857 48.0874 0.0000 174.6685 89 S 4.4608 7.7848 114.0905 58.3327 63.3115 174.0690 90 S 4.1232 7.6934 117.0782 57.9746 62.4741 173.6187 91 K 4.3097 9.0568 129.2948 54.6644 33.4893 174.3580 92 Y 4.1702 8.7527 127.4429 57.8458 38.8379 174.4394 93 P 3.2189 0.0000 0.0000 62.9385 32.1695 176.8147 94 N 4.5982 7.9929 120.0095 52.3538 36.9496 172.9570 95 C 4.6324 7.9206 117.3437 56.4346 41.3335 173.2050 96 A 5.0326 8.4543 124.9719 50.4193 21.9793 174.5626 97 Y 5.1973 9.5964 118.8545 56.0220 42.3247 174.8854 98 K 4.4477 9.4615 124.5855 55.9400 34.0343 175.3369 99 T 5.0727 8.5698 123.9275 62.5904 70.0586 174.0284 100 T 4.6188 9.2208 123.7371 61.7108 71.5053 172.8059 101 Q 4.9271 8.6772 127.3759 54.7527 30.6750 174.1437 102 A 4.6661 9.2499 126.7782 51.1749 23.7778 174.4065 103 N 5.4277 8.6439 115.8875 51.8803 40.9470 174.3365 104 K 4.6952 8.7942 122.4661 55.3355 37.7512 175.0031 105 H 5.1451 8.8487 117.7393 55.5017 30.3475 174.9895 106 I 4.8098 8.7957 115.4591 59.2754 41.0455 174.3731 107 I 4.9353 8.0710 123.7330 59.7344 40.0323 175.1520 108 V 4.6912 8.7765 119.5965 59.3350 36.1874 174.2479 109 A 5.0634 8.6861 124.3097 50.7590 20.9091 175.5402 110 C 5.5513 8.4902 119.2095 54.7284 37.2989 173.1942 111 E 4.7153 8.1799 118.8401 56.8788 33.7153 176.4249 112 G 4.0911 9.7875 109.2184 44.9268 0.0000 171.5600 113 N 5.1470 8.3279 117.6726 51.2419 41.0472 173.2356 114 P 4.3129 0.0000 0.0000 62.8819 31.8986 175.7179 115 Y 4.7398 8.3217 121.3591 57.0456 38.7271 174.5154 116 V 4.4245 8.0262 118.9873 58.2511 36.6532 173.4709 117 P 4.5019 0.0000 0.0000 62.8360 30.9461 177.0191 118 V 4.4897 8.6204 121.6822 61.4344 33.2651 175.1153 119 H 5.1584 7.9254 120.3492 54.6742 33.6781 171.6395 120 F 4.5128 8.8863 127.3550 57.5106 39.3654 174.3491 121 D 4.4529 8.4409 126.7544 55.6406 41.8549 175.9537 122 A 4.6684 6.6013 117.0857 51.3652 22.4785 174.6061 123 S 5.2716 8.9096 113.7981 56.5404 65.7451 174.5730 124 V 4.1495 9.2922 122.8139 62.0827 31.0099 174.9254 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 K 8.31 4.20 0.00 1.74 1.79 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.70 3.75 0.00 2.13 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 2.46 2.38 0.00 3 T 8.77 4.19 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 4 A 8.54 3.99 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 5 A 7.96 4.09 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.05 4.02 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 7 K 8.41 4.11 0.00 1.91 2.05 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.47 1.32 7.81 8 F 8.54 4.12 0.00 3.25 3.28 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 9 E 8.22 4.02 0.00 2.21 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 2.48 2.64 0.00 10 R 7.88 3.92 0.00 1.83 2.09 0.00 3.35 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.02 4.03 0.00 1.54 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 12 H 7.89 4.72 0.00 1.95 2.68 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.05 4.93 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.72 0.00 14 D 9.53 4.84 0.00 2.65 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 15 S 8.42 4.43 0.00 3.96 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 16 S 7.86 4.80 0.00 3.95 3.97 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 17 T 7.42 4.73 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 1.41 0.00 0.00 18 S 8.57 4.30 0.00 3.81 3.88 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 19 A 7.00 3.71 1.07 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 20 A 8.10 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.41 4.68 0.00 3.93 3.88 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 22 S 7.45 4.63 0.00 3.99 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 23 S 8.54 4.41 0.00 4.03 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 24 N 8.18 4.65 0.00 2.82 2.89 0.00 0.00 6.51 7.50 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 25 Y 7.84 4.00 0.00 3.05 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 26 C 8.18 4.22 0.00 3.11 3.14 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 0.00 0.00 0.00 0.00 27 N 8.21 4.41 0.00 2.89 2.91 0.00 0.00 7.10 7.69 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 28 Q 8.21 3.94 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 29 M 7.73 3.64 0.00 0.77 1.28 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.79 0.00 30 M 8.05 4.03 0.00 1.74 1.99 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 2.45 0.00 31 K 7.64 3.92 0.00 1.86 1.95 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.42 7.81 32 S 8.02 4.11 0.00 3.97 3.96 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 33 R 7.78 4.31 0.00 1.91 2.14 0.00 3.62 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.93 0.00 34 N 7.94 4.26 0.00 2.82 2.87 0.00 0.00 7.11 7.33 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 35 L 8.21 4.35 0.00 1.81 1.63 0.79 0.75 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 36 T 7.52 6.06 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 1.45 0.00 0.00 37 K 8.38 4.23 0.00 1.79 1.96 0.00 1.66 0.00 0.00 1.92 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.57 7.81 38 D 7.94 4.60 0.00 2.63 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 39 R 7.28 3.88 0.00 1.82 1.79 0.00 2.92 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 40 C 8.84 4.65 0.00 3.12 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 41 K 8.17 4.22 0.00 1.75 1.78 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.39 7.81 42 P 0.00 4.60 0.00 2.20 2.33 0.00 3.78 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 43 V 7.59 5.03 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 0.85 0.00 0.00 0.99 0.00 0.00 44 N 9.03 4.80 0.00 2.64 2.26 0.00 0.00 6.86 6.49 0.00 0.00 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 T 7.93 4.81 2.81 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 0.86 0.00 0.00 46 F 8.81 4.83 0.00 3.03 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 47 V 8.79 4.60 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 1.04 0.00 0.00 1.01 0.00 0.00 48 H 8.43 5.82 0.00 3.16 3.37 0.00 5.64 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 49 E 7.66 4.78 0.00 1.96 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 2.27 2.29 0.00 50 S 8.32 4.49 0.00 4.07 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 51 L 8.52 4.01 0.00 1.84 1.75 1.03 1.14 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 52 A 8.13 4.07 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 53 D 7.67 4.37 0.00 2.86 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 54 V 7.65 3.83 2.31 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 1.19 0.00 0.00 1.08 0.00 0.00 55 Q 8.94 3.87 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 56 A 8.06 4.06 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 57 V 7.75 3.53 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 1.05 0.00 0.00 0.97 0.00 0.00 58 C 7.83 3.91 0.00 2.84 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 59 S 7.45 4.58 0.00 3.91 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 60 Q 7.76 4.10 0.00 1.75 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 61 K 7.60 4.23 0.00 1.67 1.74 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.21 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.42 7.81 62 N 8.86 4.37 0.00 2.75 2.66 0.00 0.00 7.00 7.71 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 63 V 8.25 4.58 1.96 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 0.67 0.00 0.00 0.82 0.00 0.00 64 A 8.45 4.22 1.19 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 65 C 9.25 4.61 0.00 3.09 3.01 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 66 K 8.92 3.70 0.00 1.69 1.93 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.40 7.81 67 N 8.07 4.57 0.00 2.86 2.90 0.00 0.00 6.28 7.00 0.00 0.00 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 G 8.32 3.97 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 0.00 0.00 0.00 69 Q 8.27 4.11 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 70 T 8.38 4.55 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 1.19 0.00 0.00 71 N 7.87 4.97 0.00 3.04 3.11 0.00 0.00 6.12 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 72 C 7.50 5.27 0.00 3.14 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 73 Y 8.76 4.96 0.00 2.75 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 74 Q 9.31 5.12 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 75 S 8.96 4.36 0.00 3.98 3.88 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 76 Y 9.15 4.47 0.00 3.03 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 77 S 7.84 4.99 0.00 3.94 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.22 4.23 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 1.05 0.00 0.00 79 M 9.37 5.04 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 80 S 9.00 4.89 0.00 3.93 3.79 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 0.00 0.00 0.00 0.00 81 I 9.11 5.23 1.96 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 1.35 0.80 1.07 0.00 0.00 82 T 8.78 5.02 4.37 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 1.24 0.00 0.00 83 D 9.48 5.00 0.00 2.77 2.55 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 84 C 9.12 5.63 0.00 2.98 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 85 R 8.94 5.35 0.00 1.97 1.80 0.00 3.19 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 86 E 9.08 3.96 0.00 2.25 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 2.07 1.83 0.00 87 T 8.37 4.41 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 1.18 0.00 0.00 88 G 8.72 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 89 S 7.78 4.46 0.00 3.84 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 90 S 7.69 4.12 0.00 3.84 3.75 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 91 K 9.06 4.31 0.00 1.78 1.59 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.41 7.81 92 Y 8.75 4.17 0.00 3.02 2.93 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 93 P 0.00 3.22 0.00 1.76 1.13 0.00 3.66 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 94 N 7.99 4.60 0.00 2.80 2.76 0.00 0.00 6.99 7.21 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 95 C 7.92 4.63 0.00 3.14 3.10 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 0.00 0.00 0.00 0.00 96 A 8.45 5.03 1.11 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 0.00 0.00 97 Y 9.60 5.20 0.00 2.89 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 98 K 9.46 4.45 0.00 1.88 1.88 0.00 1.54 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.51 7.81 99 T 8.57 5.07 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 1.28 0.00 0.00 100 T 9.22 4.62 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 0.00 101 Q 8.68 4.93 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.18 2.36 0.00 102 A 9.25 4.67 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 0.00 103 N 8.64 5.43 0.00 2.55 2.74 0.00 0.00 6.67 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 0.00 104 K 8.79 4.70 0.00 1.71 1.73 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.62 7.81 105 H 8.85 5.15 0.00 3.09 3.21 0.00 5.58 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.80 4.81 1.85 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.15 1.17 0.00 0.00 107 I 8.07 4.94 1.78 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 1.14 0.59 0.78 0.00 0.00 108 V 8.78 4.69 1.89 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 0.64 0.00 0.00 0.80 0.00 0.00 109 A 8.69 5.06 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 0.00 110 C 8.49 5.55 0.00 1.77 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 0.00 111 E 8.18 4.72 0.00 1.84 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 2.33 2.26 0.00 112 G 9.79 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 0.00 113 N 8.33 5.15 0.00 2.66 2.69 0.00 0.00 6.86 7.69 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 0.00 114 P 0.00 4.31 0.00 2.23 2.06 0.00 3.82 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 1.99 1.96 0.00 115 Y 8.32 4.74 0.00 2.88 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 0.00 116 V 8.03 4.42 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 0.57 0.00 0.00 0.84 0.00 0.00 117 P 0.00 4.50 0.00 0.49 1.13 0.00 3.33 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 118 V 8.62 4.49 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 0.72 0.00 0.00 0.91 0.00 0.00 119 H 7.93 5.16 0.00 3.28 3.14 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.89 4.51 0.00 2.67 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 0.00 121 D 8.44 4.45 0.00 2.46 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 0.00 122 A 6.60 4.67 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 0.00 123 S 8.91 5.27 0.00 3.98 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 0.00 124 V 9.29 4.15 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 0.75 0.00 0.00 0.94 0.00 0.00