NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6245 8.3049 120.6173 55.3536 33.6513 174.7732 2 I 4.0470 8.8603 127.8268 60.6274 38.8079 173.5090 3 K 4.9911 9.4836 126.5440 54.7697 35.2889 174.7811 4 V 4.8584 9.1448 126.2724 61.4056 33.8020 174.4583 5 T 5.1004 9.0228 124.4809 61.7387 71.7132 173.1547 6 V 4.8549 8.8499 125.9698 61.4640 34.5860 174.4596 7 T 5.0561 8.3525 117.7009 60.1231 71.6898 173.3411 8 N 4.7551 8.9306 116.7944 54.8111 39.1663 176.0655 9 S 4.7125 7.7187 114.4827 59.2701 64.8077 173.3042 10 F 3.5716 6.5166 113.2607 55.7711 40.6762 172.6772 11 F 5.4642 8.3680 113.3972 55.2733 41.2572 173.6200 12 E 5.1186 9.6571 120.7440 54.6086 33.6876 174.2345 13 V 4.9879 8.9454 125.2097 61.4216 34.8743 174.3759 14 T 5.0742 7.9918 116.6257 60.3308 72.8455 174.5443 15 G 4.1248 8.9270 111.0109 45.3957 0.0000 171.9232 16 H 4.8988 8.3688 113.9678 53.8536 32.6797 172.7973 17 A 4.8551 8.1232 122.7461 49.6599 21.4800 175.1637 18 P 4.2975 0.0000 0.0000 65.4997 31.8230 177.5968 19 D 4.4008 7.9201 118.5312 54.0184 41.9311 176.8681 20 K 4.0448 8.6629 127.5390 59.4589 32.0977 179.4508 21 T 3.8401 8.3520 110.7105 64.5604 68.6874 176.4324 22 L 3.5935 7.8004 122.7943 57.8502 41.9896 178.4100 23 C 3.9923 7.8715 116.3194 62.9568 28.0745 176.1607 24 A 4.3359 7.8600 123.4698 54.6094 17.8722 179.8978 25 S 4.0153 8.2301 113.8643 61.6704 62.8777 177.0090 26 V 3.5456 7.8600 121.1228 66.0164 31.4282 177.9270 27 S 4.1162 8.2874 114.3263 61.5855 62.6359 176.3289 28 L 3.9542 8.0933 124.0434 57.5760 41.9223 178.6413 29 L 3.9708 8.1241 120.7035 58.4322 42.0900 179.0912 30 T 4.0024 8.2163 110.0052 64.9979 68.8309 176.6637 31 Q 4.1642 8.4846 120.8687 58.4529 28.6173 178.0483 32 H 4.1366 8.3582 119.6877 59.3866 29.9278 177.4827 33 V 3.6408 7.9291 119.7429 65.9243 31.3688 177.7588 34 A 4.1452 8.4619 120.5780 55.4150 18.3274 179.4237 35 N 4.3645 8.8619 115.3956 56.2378 38.1575 177.4694 36 F 4.1948 8.5242 122.2732 61.3536 39.4994 177.2364 37 L 3.5404 8.3137 118.7451 57.6079 41.3670 179.4550 38 K 4.0905 8.2251 119.3801 59.3394 31.8827 178.5088 39 A 4.0062 7.6985 120.4220 54.4517 18.2349 178.4977 40 E 4.4177 7.1863 113.0674 55.3746 30.4832 175.9315 41 K 3.8172 7.8271 116.3553 58.4251 30.4227 175.8833 42 K 4.6552 8.4198 115.2265 55.2758 33.1935 175.8800 43 A 5.0910 7.5457 119.5340 50.9820 22.1754 175.8448 44 K 4.5317 8.7616 121.3110 54.6306 34.9908 174.8235 45 I 4.6998 8.3639 127.7733 59.6609 39.0891 175.0140 46 K 4.5026 9.0120 127.1222 54.6249 34.1636 174.9974 47 K 4.9894 8.6740 126.6626 54.5659 34.5237 174.6822 48 E 4.7744 9.9086 127.4194 54.6126 33.1813 175.6801 49 S 3.4165 7.4708 109.6667 57.3726 64.6726 174.8233 50 G 4.3386 8.3621 107.3775 44.1594 0.0000 172.7661 51 Y 5.0272 8.1929 120.1181 56.0755 43.3152 173.8721 52 L 5.0312 8.3283 128.0072 53.1832 45.9348 174.8012 53 K 4.5828 9.0517 126.9062 54.5585 35.9203 174.6870 54 V 4.4046 8.6569 127.7366 60.9179 33.9256 174.0261 55 K 4.6481 8.5732 130.7972 54.8120 33.2099 176.1011 56 F 5.2885 8.4821 127.0413 58.1976 39.7527 175.1813 57 E 4.5346 9.3633 119.8322 55.8789 34.0059 175.6832 58 E 3.7120 8.8901 125.9285 57.2100 27.2854 175.4747 59 L 4.0626 7.7470 116.7726 54.9301 42.8771 177.0413 60 E 4.7482 9.1537 122.4072 53.9881 32.8953 176.0205 61 N 4.2146 8.8307 116.3793 57.6288 38.5377 175.8981 62 C 4.0768 8.1223 119.4429 62.7370 31.6611 175.3627 63 E 4.1920 8.1637 118.5866 59.3086 29.2230 178.8331 64 V 3.4391 7.8026 119.2757 65.9059 31.5352 178.2578 65 K 3.9406 7.9825 117.8920 59.2871 31.9192 179.5639 66 V 3.4744 7.8023 118.5589 65.9479 31.4413 178.1079 67 L 3.9062 8.6337 118.9644 57.7440 41.4647 179.3557 68 A 3.9652 8.2632 120.7271 55.0459 18.2727 179.5953 69 A 3.9091 8.1072 119.4237 55.3329 18.4483 179.4927 70 M 3.8796 7.9611 116.8078 58.6875 32.2633 178.7067 71 V 3.4769 7.7434 118.3417 65.8567 31.7553 177.6923 72 R 3.8252 7.9376 118.5134 59.7882 29.8617 178.3891 73 S 4.3701 7.9651 113.9225 60.8677 62.3507 176.1122 74 L 4.0442 7.9413 121.7877 57.6249 41.3318 179.5858 75 K 4.0095 8.7169 118.9021 59.3875 31.6198 179.2405 76 E 3.9841 8.2017 118.9905 59.4545 29.3668 179.4184 77 L 4.2814 8.0501 118.9747 57.4741 41.4287 179.0517 78 E 4.0464 8.3320 119.7118 59.3273 29.3139 178.8762 79 Q 4.0618 7.8306 117.1119 58.9717 28.8692 178.7309 80 K 3.8705 7.5277 118.3521 58.0691 33.5828 177.8508 81 F 4.9286 8.4153 116.8819 54.8543 38.9428 174.2647 82 P 4.5242 0.0000 0.0000 64.6739 31.3081 177.8970 83 S 4.5886 8.0599 110.3463 58.5185 63.8778 174.0574 84 Q 4.6431 8.4787 120.0978 56.2433 30.8110 175.0811 85 I 5.0605 7.6028 118.0061 59.5521 41.4377 173.6301 86 R 4.7700 9.3517 129.2248 54.5296 33.0942 173.9120 87 V 4.6454 9.5095 127.1201 61.4528 33.0709 174.7272 88 E 4.5646 9.5648 129.4105 54.6645 31.6445 175.5626 89 V 4.3541 8.3372 125.7579 61.7286 32.5435 175.6156 90 I 4.0973 8.4980 130.7381 60.4771 37.2834 176.0397 91 D 4.6175 8.6180 128.6329 52.7966 40.1955 175.5843 92 N 5.0528 8.6198 122.1043 52.2317 42.4415 173.0977 93 G 4.1843 8.1712 110.3572 43.5412 0.0000 174.1582 94 S 4.4137 8.6670 121.2518 58.9084 62.3540 176.5578 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 4.62 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 2 I 8.86 4.05 1.85 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 1.18 0.49 0.89 0.00 0.00 3 K 9.48 4.99 0.00 1.64 1.72 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.36 7.81 4 V 9.14 4.86 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 0.96 0.00 0.00 0.93 0.00 0.00 5 T 9.02 5.10 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 1.21 0.00 0.00 6 V 8.85 4.85 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 1.16 0.00 0.00 0.92 0.00 0.00 7 T 8.35 5.06 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 0.75 0.00 0.00 8 N 8.93 4.76 0.00 2.78 2.98 0.00 0.00 6.69 7.57 0.00 0.00 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 S 7.72 4.71 0.00 4.05 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 10 F 6.52 3.57 0.00 2.71 2.68 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 0.00 0.00 0.00 0.00 11 F 8.37 5.46 0.00 3.11 3.27 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 12 E 9.66 5.12 0.00 2.25 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 2.02 1.86 0.00 13 V 8.95 4.99 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 0.93 0.00 0.00 1.09 0.00 0.00 14 T 7.99 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 1.26 0.00 0.00 15 G 8.93 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 0.00 0.00 0.00 16 H 8.37 4.90 0.00 3.07 3.18 0.00 5.85 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 17 A 8.12 4.86 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 18 P 0.00 4.30 0.00 2.06 2.13 0.00 3.68 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 2.04 2.09 0.00 19 D 7.92 4.40 0.00 2.67 2.35 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 0.00 20 K 8.66 4.04 0.00 1.87 1.82 0.00 1.60 0.00 0.00 1.86 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.54 7.81 21 T 8.35 3.84 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 1.21 0.00 0.00 22 L 7.80 3.59 0.00 0.84 1.50 0.56 0.61 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 23 C 7.87 3.99 0.00 3.17 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 24 A 7.86 4.34 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 25 S 8.23 4.02 0.00 4.00 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 26 V 7.86 3.55 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 1.11 0.00 0.00 0.91 0.00 0.00 27 S 8.29 4.12 0.00 4.08 4.13 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 28 L 8.09 3.95 0.00 1.83 1.92 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.12 3.97 0.00 1.77 1.71 0.88 0.73 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 30 T 8.22 4.00 4.53 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 1.18 0.00 0.00 31 Q 8.48 4.16 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.54 0.00 32 H 8.36 4.14 0.00 3.33 3.58 0.00 5.59 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.93 3.64 2.25 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 1.24 0.00 0.00 0.97 0.00 0.00 34 A 8.46 4.15 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 35 N 8.86 4.36 0.00 2.95 2.93 0.00 0.00 6.68 8.15 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 36 F 8.52 4.19 0.00 2.92 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 37 L 8.31 3.54 0.00 1.97 1.75 1.22 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.23 4.09 0.00 1.94 1.80 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.44 7.81 39 A 7.70 4.01 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 40 E 7.19 4.42 0.00 1.94 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 1.95 2.17 0.00 41 K 7.83 3.82 0.00 1.87 1.90 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.36 7.81 42 K 8.42 4.66 0.00 1.64 1.86 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.44 7.81 43 A 7.55 5.09 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 44 K 8.76 4.53 0.00 1.81 1.60 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.36 7.81 45 I 8.36 4.70 1.85 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 1.34 0.55 0.89 0.00 0.00 46 K 9.01 4.50 0.00 1.74 1.79 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.71 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.30 7.81 47 K 8.67 4.99 0.00 1.72 1.68 0.00 1.82 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.48 7.81 48 E 9.91 4.77 0.00 2.00 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 2.20 2.22 0.00 49 S 7.47 3.42 0.00 4.08 3.76 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 50 G 8.36 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 0.00 0.00 0.00 0.00 51 Y 8.19 5.03 0.00 3.02 2.75 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 52 L 8.33 5.03 0.00 1.70 1.33 0.88 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 53 K 9.05 4.58 0.00 1.54 1.56 0.00 1.29 0.00 0.00 1.37 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 0.92 7.81 54 V 8.66 4.40 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 0.00 0.00 0.83 0.00 0.00 0.31 0.00 0.00 55 K 8.57 4.65 0.00 1.73 1.60 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.70 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.35 1.36 7.81 56 F 8.48 5.29 0.00 3.02 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 57 E 9.36 4.53 0.00 1.95 1.83 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 2.27 2.34 0.00 58 E 8.89 3.71 0.00 2.06 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 2.25 2.33 0.00 59 L 7.75 4.06 0.00 1.59 1.52 0.23 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 60 E 9.15 4.75 0.00 2.16 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 2.21 2.38 0.00 61 N 8.83 4.21 0.00 2.78 2.84 0.00 0.00 6.53 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 62 C 8.12 4.08 0.00 3.08 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 63 E 8.16 4.19 0.00 2.21 2.37 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 2.55 2.27 0.00 64 V 7.80 3.44 2.19 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 1.07 0.00 0.00 0.91 0.00 0.00 65 K 7.98 3.94 0.00 2.00 1.81 0.00 1.71 0.00 0.00 1.56 0.00 0.00 3.14 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.67 7.81 66 V 7.80 3.47 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 0.70 0.00 0.00 0.62 0.00 0.00 67 L 8.63 3.91 0.00 1.81 1.61 0.22 1.12 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 68 A 8.26 3.97 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 69 A 8.11 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 70 M 7.96 3.88 0.00 2.07 1.94 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 2.43 2.30 0.00 71 V 7.74 3.48 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 0.90 0.00 0.00 0.92 0.00 0.00 72 R 7.94 3.83 0.00 2.07 2.08 0.00 3.12 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 73 S 7.97 4.37 0.00 3.91 3.95 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 74 L 7.94 4.04 0.00 1.82 1.67 0.79 0.67 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 75 K 8.72 4.01 0.00 1.95 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.57 7.81 76 E 8.20 3.98 0.00 2.26 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 2.32 2.63 0.00 77 L 8.05 4.28 0.00 1.92 1.88 0.93 0.81 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 78 E 8.33 4.05 0.00 2.19 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 0.00 2.32 2.58 0.00 79 Q 7.83 4.06 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 80 K 7.53 3.87 0.00 1.53 0.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.26 1.34 7.81 81 F 8.42 4.93 0.00 3.00 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 82 P 0.00 4.52 0.00 2.18 2.22 0.00 3.42 0.00 0.00 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 83 S 8.06 4.59 0.00 4.02 4.04 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 84 Q 8.48 4.64 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 85 I 7.60 5.06 1.87 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 1.25 0.82 1.04 0.00 0.00 86 R 9.35 4.77 0.00 1.86 1.73 0.00 3.12 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 87 V 9.51 4.65 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 0.81 0.00 0.00 0.90 0.00 0.00 88 E 9.56 4.56 0.00 1.91 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 2.23 2.22 0.00 89 V 8.34 4.35 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 0.88 0.00 0.00 0.92 0.00 0.00 90 I 8.50 4.10 1.81 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 1.22 0.56 0.90 0.00 0.00 91 D 8.62 4.62 0.00 2.65 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.62 5.05 0.00 2.63 2.67 0.00 0.00 7.34 7.98 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 93 G 8.17 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.67 4.41 0.00 3.97 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