NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 A 4.2035 8.2649 123.5825 51.4235 19.8172 176.3460 13 K 3.7777 8.5881 122.0820 55.7731 31.5950 175.2512 14 A 4.0865 9.1141 128.6821 52.1658 19.8235 177.1875 15 K 4.3477 8.4789 121.0545 55.0833 34.1671 176.0487 16 T 3.7919 7.7622 115.3893 57.8706 73.0161 174.3858 17 R 3.9669 8.5502 121.1411 59.4775 30.1480 179.1371 18 S 4.1346 8.1905 114.5827 61.9037 62.6913 176.4452 19 S 4.1050 7.6144 114.1974 61.7753 61.8244 176.6311 20 R 3.9198 7.3651 117.5209 59.1658 29.9746 178.5038 21 A 4.2263 8.1800 118.3036 52.1438 18.7464 177.2471 22 G 3.8229 7.8233 105.4540 46.4985 0.0000 173.5368 23 L 4.9503 7.9010 117.4494 53.4170 43.8177 176.5487 24 Q 4.2003 9.1309 118.4121 58.7453 29.0922 177.5275 25 F 3.9915 8.9330 116.4887 56.5284 39.5364 174.5170 26 P 4.4582 0.0000 0.0000 62.5103 30.7103 177.3007 27 V 3.7215 8.5361 125.3440 66.3591 31.7956 177.8207 28 G 3.6961 8.1809 104.8740 47.5845 0.0000 175.4923 29 R 3.9444 7.7859 120.3382 59.3762 30.3168 178.3327 30 V 3.6463 7.9567 118.0979 66.2523 31.3653 177.4696 31 H 4.1219 8.4840 117.9423 59.4077 29.9039 177.1579 32 R 3.9473 7.9431 120.0981 59.4177 29.5791 178.5162 33 L 4.0445 8.1578 118.2586 57.8417 41.7908 178.9740 34 L 4.4158 8.0047 117.6715 58.1588 41.9346 179.4620 35 R 4.1551 8.1313 117.8165 59.4315 29.8574 178.7218 36 K 4.3094 7.8726 113.9633 57.3277 31.9424 178.6813 37 G 3.4867 7.8453 106.7241 44.0553 0.0000 173.4298 38 N 4.1138 7.8673 116.3813 54.6980 35.4331 174.2048 39 Y 4.4298 7.6733 114.9816 59.4413 39.6016 175.6718 40 A 4.5173 7.3728 119.5602 51.5125 22.1210 176.0040 41 E 4.1115 8.8800 118.1661 59.2578 29.6644 177.7501 42 R 4.7756 7.6647 114.2993 54.1735 33.6941 175.1786 43 V 4.3789 8.0941 118.0679 60.8290 34.4653 175.5766 44 G 3.7759 8.6038 115.5428 45.2242 0.0000 174.0243 45 A 4.1319 8.6639 123.8792 54.7384 18.8168 179.4133 46 G 3.7763 8.0430 103.7675 47.5712 0.0000 175.5263 47 A 3.9502 7.7504 121.4028 54.9827 18.2187 177.9487 48 P 4.3413 0.0000 0.0000 65.8408 31.2530 178.7743 49 V 3.5592 7.6381 117.5592 65.9359 31.6013 177.0138 50 Y 3.7957 8.4825 119.6165 60.7019 38.5953 177.8586 51 L 4.0273 8.5824 121.2897 58.1363 42.1100 178.6540 52 A 4.0140 8.3685 120.6740 55.1548 18.2503 179.2703 53 A 3.8520 8.0140 119.1539 55.3694 18.4014 180.0105 54 V 3.5613 7.6764 116.4950 66.0891 31.5741 178.1002 55 L 3.8217 7.9410 118.7181 57.6969 41.4074 178.9841 56 E 2.5915 7.5709 119.0645 59.0337 29.5263 177.8996 57 Y 4.1329 7.9475 119.5418 61.0710 38.8212 178.4401 58 L 3.4165 7.8568 119.4749 57.6857 41.5778 179.5936 59 T 3.7804 7.8401 115.7018 66.5701 68.3591 176.4086 60 A 3.9247 8.0207 122.7561 54.9987 18.4257 178.9180 61 E 3.6789 7.6937 117.7105 59.6091 29.5557 179.0836 62 I 3.6132 7.6441 119.2331 64.5181 37.3006 178.3470 63 L 3.9794 7.9743 119.6884 58.1914 41.3930 178.6333 64 E 3.8554 8.6009 119.2213 59.5668 29.4331 178.6328 65 L 3.9327 8.1347 117.9143 58.1317 41.9156 179.7930 66 A 4.1556 8.5597 120.9538 54.7565 18.3103 179.8271 67 G 3.6219 8.6511 104.7949 48.0937 0.0000 175.5643 68 N 4.2885 8.3377 118.9459 55.9260 38.6017 177.0948 69 A 3.9257 7.9287 121.8411 55.2005 18.3692 179.2994 70 A 3.8900 8.0946 118.9948 55.5672 18.5250 179.5446 71 R 3.8300 7.9095 116.8121 60.0402 29.7926 178.3627 72 D 4.4004 7.9491 117.4315 57.1656 40.9030 177.5866 73 N 4.5823 7.8654 113.8565 52.1453 39.8166 175.0555 74 K 3.9496 7.8671 118.7835 57.3578 29.6657 175.4664 75 K 4.7246 8.1434 116.2157 55.1297 36.6847 177.6599 76 T 4.1017 8.6682 119.1061 66.1350 68.9447 175.5599 77 R 4.3504 7.6768 119.5209 54.6210 30.9517 176.3353 78 I 3.7517 8.3344 124.9330 61.0757 37.7666 175.3043 79 I 4.5596 7.4876 117.3695 57.5755 40.8690 174.3856 80 P 4.2006 0.0000 0.0000 66.1452 30.8828 178.6193 81 R 3.9148 8.1423 116.4949 59.8299 29.7244 178.1588 82 H 4.1687 8.4261 116.0065 58.8083 28.6976 177.6338 83 L 3.9864 7.9393 120.3162 57.7683 41.3822 179.2236 84 Q 3.9152 8.2599 119.3565 59.2023 28.7617 178.0284 85 L 3.9296 8.2115 120.0641 57.8289 41.4891 179.2484 86 A 4.0151 7.9979 119.4060 55.2481 18.6127 179.0704 87 V 3.6364 7.9222 116.8367 66.3461 31.7119 178.2916 88 R 4.1571 8.1412 116.5566 57.8720 29.9453 177.1214 89 N 4.6264 7.6887 114.2309 53.3003 39.3146 174.7143 90 D 4.8553 7.9829 119.0807 51.8745 43.5777 175.4308 91 E 3.9544 8.9108 127.0721 59.9207 29.5126 179.4245 92 E 3.9381 8.0589 117.4182 59.5686 29.7172 179.2942 93 L 3.9618 8.3842 119.0694 57.6650 41.3678 179.1737 94 N 4.2906 8.0149 116.4069 56.3990 39.1785 176.6118 95 K 4.0587 7.9672 120.8973 59.5518 32.1880 178.5383 96 L 4.0619 7.9631 119.0616 57.0803 41.9793 177.2713 97 L 4.7881 7.5071 117.8245 54.1728 42.4713 178.6483 98 G 3.6473 8.2248 111.0699 48.1514 0.0000 175.4029 99 R 4.5451 7.9097 116.7684 55.5770 30.5767 175.3181 100 V 4.2911 7.8252 118.3539 61.1346 33.2659 174.5974 101 T 4.4142 8.4206 121.5186 60.2043 68.5856 173.3193 102 I 4.0806 8.2146 129.8833 59.7881 37.5196 175.2970 103 A 3.9990 8.5456 128.8165 53.6644 18.6797 176.3481 104 Q 3.4991 8.6316 117.9293 56.9740 26.5375 175.1882 105 G 3.7724 7.8451 107.3927 44.7199 0.0000 176.3335 106 G 3.8626 7.9446 107.7601 44.9977 0.0000 172.1294 107 V 4.4470 8.0243 111.3253 59.1635 34.7883 174.7850 108 L 4.3945 8.1386 120.9163 52.9317 42.3750 175.4974 109 P 4.2365 0.0000 0.0000 63.1520 31.5579 175.4095 110 N 4.3237 8.1381 116.5335 52.9627 41.5214 173.2962 111 I 4.4730 8.3120 126.3195 59.0353 40.1809 175.1934 112 Q 3.9807 8.8494 124.4718 56.2918 29.1560 177.7753 113 S 4.2002 9.0131 118.1604 61.5256 62.8341 176.8298 114 V 3.6557 7.7803 118.8481 64.8994 31.3051 176.1532 115 L 4.3993 7.9504 118.0973 55.2281 42.1339 177.0104 116 L 4.2523 7.5811 118.8052 53.3743 42.2003 175.1335 117 P 4.3650 0.0000 0.0000 62.9504 31.6714 177.3337 118 K 4.1991 8.5174 120.2110 58.5563 32.4253 177.4402 119 K 4.1632 7.6776 122.6321 56.6468 33.1132 175.7729 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 12 A 8.26 4.20 1.27 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 0.00 0.00 0.00 13 K 8.59 3.78 0.00 1.84 1.82 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.44 7.81 14 A 9.11 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 15 K 8.48 4.35 0.00 1.70 1.72 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.42 7.81 16 T 7.76 3.79 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 17 R 8.55 3.97 0.00 1.91 2.05 0.00 3.20 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 18 S 8.19 4.13 0.00 3.88 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 19 S 7.61 4.10 0.00 3.98 4.14 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 20 R 7.37 3.92 0.00 2.02 1.98 0.00 3.22 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 1.67 1.82 0.00 21 A 8.18 4.23 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 22 G 7.82 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 0.00 0.00 0.00 23 L 7.90 4.95 0.00 1.98 1.75 1.02 0.65 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 24 Q 9.13 4.20 0.00 2.38 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.99 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 25 F 8.93 3.99 0.00 2.95 3.07 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 26 P 0.00 4.46 0.00 2.26 2.18 0.00 3.55 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 2.08 1.90 0.00 27 V 8.54 3.72 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 1.05 0.00 0.00 1.05 0.00 0.00 28 G 8.18 3.70 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 0.00 0.00 0.00 29 R 7.79 3.94 0.00 1.90 2.12 0.00 3.19 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 30 V 7.96 3.65 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 1.06 0.00 0.00 1.06 0.00 0.00 31 H 8.48 4.12 0.00 3.42 3.42 0.00 5.65 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 32 R 7.94 3.95 0.00 2.16 2.04 0.00 3.16 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 33 L 8.16 4.04 0.00 1.93 1.81 0.98 0.93 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 34 L 8.00 4.42 0.00 1.82 1.83 0.89 0.96 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 35 R 8.13 4.16 0.00 1.92 2.01 0.00 3.14 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.14 0.00 36 K 7.87 4.31 0.00 1.85 1.84 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.58 7.81 37 G 7.85 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.87 4.11 0.00 2.65 2.78 0.00 0.00 6.87 7.46 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 39 Y 7.67 4.43 0.00 3.01 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 40 A 7.37 4.52 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 41 E 8.88 4.11 0.00 1.99 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 2.32 2.28 0.00 42 R 7.66 4.78 0.00 1.76 1.82 0.00 3.16 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 43 V 8.09 4.38 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 0.77 0.00 0.00 1.00 0.00 0.00 44 G 8.60 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 45 A 8.66 4.13 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 46 G 8.04 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 47 A 7.75 3.95 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 48 P 0.00 4.34 0.00 2.43 2.32 0.00 3.73 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.72 0.00 49 V 7.64 3.56 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 1.03 0.00 0.00 1.02 0.00 0.00 50 Y 8.48 3.80 0.00 3.16 3.04 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 51 L 8.58 4.03 0.00 1.83 1.77 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.37 4.01 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.01 3.85 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 54 V 7.68 3.56 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 1.09 0.00 0.00 1.07 0.00 0.00 55 L 7.94 3.82 0.00 1.65 1.51 1.01 0.76 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 56 E 7.57 2.59 0.00 1.49 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 0.00 2.22 2.24 0.00 57 Y 7.95 4.13 0.00 2.99 3.13 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 0.00 0.00 0.00 0.00 58 L 7.86 3.42 0.00 1.58 1.54 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.84 3.78 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 1.35 0.00 0.00 60 A 8.02 3.92 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 61 E 7.69 3.68 0.00 1.63 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 2.12 2.29 0.00 62 I 7.64 3.61 1.82 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 1.47 0.41 0.89 0.00 0.00 63 L 7.97 3.98 0.00 1.68 1.73 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.60 3.86 0.00 2.10 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 2.30 2.40 0.00 65 L 8.13 3.93 0.00 1.87 1.71 0.90 0.98 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 66 A 8.56 4.16 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 67 G 8.65 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 68 N 8.34 4.29 0.00 2.95 2.87 0.00 0.00 6.93 6.62 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 69 A 7.93 3.93 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 70 A 8.09 3.89 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.91 3.83 0.00 1.92 2.14 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 72 D 7.95 4.40 0.00 2.86 2.69 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 0.00 0.00 0.00 0.00 73 N 7.87 4.58 0.00 2.77 2.84 0.00 0.00 7.07 7.47 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 74 K 7.87 3.95 0.00 1.93 1.86 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.39 7.81 75 K 8.14 4.72 0.00 1.76 1.68 0.00 1.73 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.61 7.81 76 T 8.67 4.10 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 77 R 7.68 4.35 0.00 1.78 1.84 0.00 3.19 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 78 I 8.33 3.75 1.86 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 1.50 0.47 0.91 0.00 0.00 79 I 7.49 4.56 1.82 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 1.06 0.85 0.89 0.00 0.00 80 P 0.00 4.20 0.00 2.33 2.36 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 81 R 8.14 3.91 0.00 1.95 2.03 0.00 3.19 0.00 0.00 3.46 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 82 H 8.43 4.17 0.00 3.41 3.47 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 83 L 7.94 3.99 0.00 1.86 1.72 0.92 0.96 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 84 Q 8.26 3.92 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.66 2.45 0.00 85 L 8.21 3.93 0.00 1.83 1.70 0.87 0.81 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 86 A 8.00 4.02 1.39 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 87 V 7.92 3.64 2.18 0.00 0.00 0.00 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 0.92 0.00 0.00 88 R 8.14 4.16 0.00 1.82 1.96 0.00 3.65 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.76 0.00 89 N 7.69 4.63 0.00 3.02 2.84 0.00 0.00 6.66 7.73 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 90 D 7.98 4.86 0.00 2.75 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.91 3.95 0.00 2.01 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 2.41 2.38 0.00 92 E 8.06 3.94 0.00 2.02 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 2.41 2.40 0.00 93 L 8.38 3.96 0.00 1.67 1.70 0.88 0.38 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 94 N 8.01 4.29 0.00 2.97 3.06 0.00 0.00 7.17 6.01 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 95 K 7.97 4.06 0.00 1.90 1.95 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.45 7.81 96 L 7.96 4.06 0.00 1.65 1.88 0.92 1.02 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 97 L 7.51 4.79 0.00 1.77 1.59 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.22 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 99 R 7.91 4.55 0.00 1.79 1.92 0.00 3.16 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 1.54 1.58 0.00 100 V 7.83 4.29 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 0.77 0.00 0.00 0.94 0.00 0.00 101 T 8.42 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 1.21 0.00 0.00 102 I 8.21 4.08 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 1.35 0.67 0.92 0.00 0.00 103 A 8.55 4.00 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 Q 8.63 3.50 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 105 G 7.85 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 0.00 0.00 0.00 106 G 7.94 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 0.00 107 V 8.02 4.45 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 0.78 0.00 0.00 0.93 0.00 0.00 108 L 8.14 4.39 0.00 1.63 1.59 1.02 1.06 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 0.00 109 P 0.00 4.24 0.00 2.17 2.07 0.00 3.79 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 110 N 8.14 4.32 0.00 2.62 2.68 0.00 0.00 6.95 7.94 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 0.00 111 I 8.31 4.47 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 1.41 0.79 0.91 0.00 0.00 112 Q 8.85 3.98 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 113 S 9.01 4.20 0.00 3.99 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 0.00 114 V 7.78 3.66 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 0.82 0.00 0.00 0.93 0.00 0.00 115 L 7.95 4.40 0.00 1.78 1.69 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.58 4.25 0.00 1.73 1.60 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.37 0.00 2.03 2.00 0.00 3.68 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 2.03 2.12 0.00 118 K 8.52 4.20 0.00 1.74 1.87 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.46 7.81 119 K 7.68 4.16 0.00 1.68 1.63 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.42 7.81