NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 M 4.4038 8.3049 120.3502 55.3247 33.4294 174.4873 1 D 4.4751 8.3543 118.6843 53.4212 41.9508 174.4321 2 I 4.2328 9.4435 123.9884 60.5381 39.4716 174.9252 3 I 4.8143 8.4241 127.8276 59.6420 39.5440 174.7112 4 L 4.8679 9.1268 127.8065 52.8629 44.9368 176.2473 5 G 4.5520 8.4171 107.9984 44.9580 0.0000 171.9654 6 I 4.6258 8.8031 123.7874 59.3919 41.8064 173.4072 7 R 4.7766 8.7108 130.3058 55.3406 30.4823 175.6815 8 V 4.3227 8.1360 125.7089 60.9931 32.6520 176.3709 9 Q 4.1054 8.9247 122.6121 60.1761 29.1099 177.8449 10 D 5.0915 7.6818 113.6920 53.3868 42.0550 175.0016 11 S 4.6641 7.4376 113.5402 57.9065 65.2276 173.5391 12 V 4.8896 8.2951 119.5397 61.1647 34.1006 174.3920 13 I 4.5771 8.9038 128.2589 59.4505 39.8970 174.4048 14 L 5.2164 8.6152 125.8628 52.8989 44.3006 175.4940 15 A 4.8144 8.7949 125.9940 50.2053 21.7130 175.4076 16 S 5.1488 8.4122 117.5441 56.3782 66.5288 174.2691 17 S 4.2358 8.7497 120.0818 59.3014 62.8867 174.7345 18 K 4.7120 8.9717 119.3285 56.6129 33.4665 176.5556 19 A 4.5668 7.9500 121.7374 51.9168 19.4931 177.7493 20 V 4.2384 8.7771 120.1602 61.6477 33.9390 173.8295 21 T 4.8491 8.4302 123.8072 62.1514 70.2933 175.3853 22 R 4.2845 8.8705 125.1011 55.0927 31.2947 177.5856 23 G 3.7990 9.0006 117.9067 46.3594 0.0000 173.0316 24 I 4.0040 8.9648 123.9653 61.9155 39.1144 174.5912 25 S 4.7019 7.7952 115.5697 56.3949 65.3271 173.3136 26 V 4.3705 8.1222 123.7427 61.5607 31.0526 175.7519 27 L 4.1846 8.6977 129.4420 57.0623 41.9929 177.6823 28 K 4.7040 7.6841 117.3959 54.9605 35.2889 175.3191 29 D 5.0845 8.6350 120.6051 52.8391 40.2001 175.5008 30 S 4.7627 7.7925 113.0175 58.4485 63.3080 173.1131 31 D 4.5258 8.5692 121.1621 54.9522 42.4702 174.5852 32 D 4.7815 8.6570 126.2827 52.0545 41.3291 176.8580 33 K 3.8708 7.7360 131.7254 55.4951 31.4458 176.0669 34 T 4.9856 6.9539 108.8417 60.8367 71.6201 173.8819 35 R 4.7630 8.9958 123.3082 54.7734 35.1211 173.9971 36 Q 4.6808 8.7115 124.7611 55.1662 29.6660 176.2302 37 L 4.1076 8.6445 127.9887 57.1497 42.4633 177.1431 38 S 4.5822 7.8880 110.3981 56.5444 65.1143 174.2149 39 P 4.4155 0.0000 0.0000 65.5742 31.0265 176.5981 40 H 4.9518 9.5248 114.6153 55.2186 29.5852 172.7326 41 T 5.0657 8.6044 117.0307 61.8043 72.2671 172.7293 42 L 5.2093 9.3098 128.3875 53.3312 45.8104 174.5936 43 M 5.3824 9.2536 125.3421 53.8378 35.2908 174.3751 44 S 5.1753 8.9693 120.8861 57.0470 66.0253 172.9040 45 F 5.6137 7.7180 114.7412 56.3291 40.9889 173.1361 46 A 4.6827 8.6472 120.2038 50.8666 22.6997 177.0678 47 G 3.7176 8.7544 106.1667 44.9737 0.0000 172.0346 48 E 3.8390 8.3774 122.4828 56.3760 29.5094 177.8592 49 A 3.8331 8.2936 125.8745 56.9885 19.1796 179.7890 50 G 3.7307 8.1140 99.4254 47.5895 0.0000 174.9092 51 D 4.6575 8.3005 121.3508 58.0472 40.9158 178.5904 52 T 3.6994 7.8216 114.7822 67.5584 68.4542 176.4916 53 V 3.1159 7.4277 118.6702 65.9325 31.9889 177.9747 54 Q 4.0344 7.7819 117.9320 59.1443 28.4946 179.2193 55 F 3.6958 8.4291 121.3623 61.0283 39.4067 176.7047 56 A 3.7719 7.4599 120.1167 55.5755 18.0513 179.5059 57 E 3.9098 8.4474 116.9780 59.5734 29.4846 179.0756 58 Y 4.1292 7.7892 119.1640 60.6827 38.7661 178.2309 59 I 3.2916 7.5476 120.8677 64.2046 37.1244 177.7784 60 Q 3.8395 8.2231 120.5117 59.2900 28.7933 178.1714 61 A 3.9489 8.2325 121.7661 55.6303 18.4196 179.4026 62 N 4.1654 7.7786 114.4116 56.5581 38.5654 177.8563 63 I 3.6022 7.8952 121.4363 64.2625 37.0280 178.5654 64 Q 4.0219 8.2482 119.2760 58.6545 28.4930 178.3672 65 L 3.9135 7.9372 121.6216 58.2128 42.1007 178.4066 66 Y 3.8119 8.0615 119.5685 60.5326 38.6129 178.1034 67 S 4.9192 8.1269 117.4415 61.2805 62.7995 176.4841 68 I 3.6548 7.6274 121.0277 64.5057 36.9926 178.0627 69 R 3.9496 7.7345 117.6676 59.2371 30.0674 177.6206 70 E 4.1705 7.8637 114.4591 54.9302 31.2157 175.3639 71 D 4.4050 7.8537 118.1253 53.9104 40.2044 171.6042 72 Y 4.5019 6.9843 118.5124 57.0364 42.0053 171.9282 73 E 4.6392 7.8083 125.3329 53.8555 30.7269 175.7532 74 L 4.1321 8.5327 126.7589 54.8121 42.4588 178.0510 75 S 4.3172 8.5246 117.0745 57.9925 64.8510 173.8410 76 P 4.2389 0.0000 0.0000 65.6141 31.1002 178.7235 77 Q 3.9375 8.0607 117.7480 59.1952 29.0395 178.1342 78 A 3.9838 8.0075 121.6862 55.0570 18.3107 179.7261 79 V 3.5215 7.8183 116.9349 66.2691 31.6816 178.4273 80 S 4.1628 8.2123 113.9122 61.6404 62.6845 176.6774 81 S 4.1631 8.2014 118.7966 61.1440 62.5613 176.3062 82 F 4.1695 8.3510 123.4083 61.4678 39.2121 177.3036 83 V 3.5136 8.1958 118.0754 65.8910 31.2226 178.0450 84 R 3.8374 8.0632 118.4557 59.4228 30.1405 177.9763 85 Q 3.9547 8.0624 119.3872 59.4348 28.9145 178.5398 86 E 3.9809 7.9723 119.1916 59.4697 29.5462 179.3895 87 L 3.9177 8.0244 118.7770 57.7579 41.4605 179.3241 88 A 4.0359 8.3594 119.9284 55.0448 18.4492 179.7557 89 K 4.0375 7.9817 116.5265 59.8404 32.2851 179.1944 90 S 4.0185 8.0307 113.3736 61.8235 61.9157 176.0920 90A I 3.7243 7.6468 120.1074 63.2472 37.6122 176.5317 90B R 4.4736 7.7445 116.2681 55.6985 30.2856 176.1024 91 S 4.5022 7.5658 114.3805 56.9917 64.7721 174.2957 92 R 3.8206 8.4997 119.6768 58.9427 29.7257 176.8015 93 R 4.3504 7.3836 121.5252 53.2934 30.9364 172.6556 94 P 4.3275 0.0000 0.0000 62.0988 32.0239 176.3697 95 Y 4.3362 8.8563 121.3331 58.5671 38.2306 177.0005 96 Q 4.5015 8.8199 126.1051 54.2938 27.6711 174.3334 97 V 4.8844 7.5556 120.0836 60.8444 35.5671 173.8588 98 N 5.2000 9.2476 123.0825 51.6684 42.0021 173.9348 99 V 5.1349 8.4088 114.4146 59.7858 36.4035 174.4637 100 L 4.8652 8.7289 122.1195 53.0389 44.8477 175.5898 101 I 4.8279 8.5808 123.7409 59.4761 39.8778 174.9435 102 G 4.1614 9.3334 115.5208 44.3970 0.0000 172.3420 103 G 4.6120 8.6394 111.3297 44.9691 0.0000 170.9840 104 Y 4.5175 8.5997 122.4767 55.2851 40.4418 175.2595 105 D 4.3739 8.0843 125.2715 54.4763 41.3902 175.6333 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 4.40 0.00 2.00 2.09 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 2.50 2.59 0.00 1 D 8.35 4.48 0.00 2.80 2.57 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 0.00 0.00 0.00 0.00 2 I 9.44 4.23 1.86 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 1.22 0.50 0.90 0.00 0.00 3 I 8.42 4.81 1.87 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 1.34 0.87 0.91 0.00 0.00 4 L 9.13 4.87 0.00 1.63 1.52 0.91 0.60 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 5 G 8.42 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 6 I 8.80 4.63 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 1.12 1.45 0.96 0.00 0.00 7 R 8.71 4.78 0.00 1.87 1.84 0.00 3.27 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 8 V 8.14 4.32 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 0.71 0.00 0.00 1.02 0.00 0.00 9 Q 8.92 4.11 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 7.32 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 10 D 7.68 5.09 0.00 2.68 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 11 S 7.44 4.66 0.00 3.97 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 12 V 8.30 4.89 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 0.86 0.00 0.00 0.97 0.00 0.00 13 I 8.90 4.58 1.87 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 1.23 0.56 0.91 0.00 0.00 14 L 8.62 5.22 0.00 1.46 1.53 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.79 4.81 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 16 S 8.41 5.15 0.00 3.61 3.61 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 17 S 8.75 4.24 0.00 3.86 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 18 K 8.97 4.71 0.00 1.76 1.88 0.00 1.93 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.26 7.81 19 A 7.95 4.57 1.22 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 0.00 0.00 20 V 8.78 4.24 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 1.08 0.00 0.00 0.95 0.00 0.00 21 T 8.43 4.85 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 1.24 0.00 0.00 22 R 8.87 4.28 0.00 1.61 1.84 0.00 3.39 0.00 0.00 3.24 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 23 G 9.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 8.96 4.00 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 1.42 0.76 0.91 0.00 0.00 25 S 7.80 4.70 0.00 3.89 3.71 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 0.00 0.00 0.00 0.00 26 V 8.12 4.37 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 0.84 0.00 0.00 0.93 0.00 0.00 27 L 8.70 4.18 0.00 1.77 1.72 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 28 K 7.68 4.70 0.00 1.73 1.58 0.00 1.67 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.42 7.81 29 D 8.64 5.08 0.00 2.76 2.66 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 30 S 7.79 4.76 0.00 3.83 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 31 D 8.57 4.53 0.00 2.76 2.73 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 0.00 0.00 0.00 0.00 32 D 8.66 4.78 0.00 2.71 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.74 3.87 0.00 1.55 1.32 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.43 7.81 34 T 6.95 4.99 4.28 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 1.19 0.00 0.00 35 R 9.00 4.76 0.00 1.87 1.80 0.00 3.39 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.80 0.00 36 Q 8.71 4.68 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 37 L 8.64 4.11 0.00 1.68 1.67 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.89 4.58 0.00 3.99 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 39 P 0.00 4.42 0.00 1.95 2.17 0.00 3.29 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 1.97 0.00 40 H 9.52 4.95 0.00 3.32 3.47 0.00 5.75 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.60 5.07 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 1.22 0.00 0.00 42 L 9.31 5.21 0.00 1.68 1.46 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 43 M 9.25 5.38 0.00 2.16 1.91 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.64 0.00 44 S 8.97 5.18 0.00 3.79 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 45 F 7.72 5.61 0.00 3.06 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 46 A 8.65 4.68 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 47 G 8.75 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 48 E 8.38 3.84 0.00 2.05 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 2.43 2.35 0.00 49 A 8.29 3.83 1.29 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 0.00 0.00 0.00 50 G 8.11 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 8.30 4.66 0.00 2.77 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 52 T 7.82 3.70 4.45 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 53 V 7.43 3.12 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 1.06 0.00 0.00 0.97 0.00 0.00 54 Q 7.78 4.03 0.00 2.39 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.43 2.62 0.00 55 F 8.43 3.70 0.00 2.22 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 56 A 7.46 3.77 1.01 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 0.00 0.00 57 E 8.45 3.91 0.00 1.98 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 2.33 2.42 0.00 58 Y 7.79 4.13 0.00 3.08 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 59 I 7.55 3.29 1.70 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.05 0.85 0.00 0.00 60 Q 8.22 3.84 0.00 2.13 2.25 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 2.33 2.51 0.00 61 A 8.23 3.95 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 62 N 7.78 4.17 0.00 2.68 2.55 0.00 0.00 7.12 7.51 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 63 I 7.90 3.60 1.86 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.73 0.90 0.00 0.00 64 Q 8.25 4.02 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.62 0.00 65 L 7.94 3.91 0.00 1.75 1.81 0.90 0.87 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 66 Y 8.06 3.81 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 67 S 8.13 4.92 0.00 4.13 3.93 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 68 I 7.63 3.65 1.85 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 1.40 0.72 0.88 0.00 0.00 69 R 7.73 3.95 0.00 1.73 1.78 0.00 3.00 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 70 E 7.86 4.17 0.00 1.60 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 0.00 1.99 2.16 0.00 71 D 7.85 4.40 0.00 2.73 2.66 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 72 Y 6.98 4.50 0.00 3.18 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 7.81 4.64 0.00 1.86 1.64 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 2.15 2.27 0.00 74 L 8.53 4.13 0.00 1.50 1.45 0.05 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.52 4.32 0.00 4.03 4.03 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 76 P 0.00 4.24 0.00 2.15 2.13 0.00 3.56 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 2.12 2.12 0.00 77 Q 8.06 3.94 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 78 A 8.01 3.98 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 79 V 7.82 3.52 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 1.15 0.00 0.00 0.85 0.00 0.00 80 S 8.21 4.16 0.00 4.13 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 81 S 8.20 4.16 0.00 4.10 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 82 F 8.35 4.17 0.00 2.99 3.25 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 83 V 8.20 3.51 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 1.12 0.00 0.00 1.05 0.00 0.00 84 R 8.06 3.84 0.00 2.08 2.01 0.00 3.17 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 85 Q 8.06 3.95 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 86 E 7.97 3.98 0.00 2.22 2.23 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 1.69 1.90 0.00 87 L 8.02 3.92 0.00 1.82 1.63 0.88 0.00 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 88 A 8.36 4.04 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 89 K 7.98 4.04 0.00 2.07 1.88 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.75 7.81 90 S 8.03 4.02 0.00 4.03 4.11 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 90A I 7.65 3.72 1.98 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 1.50 1.18 0.92 0.00 0.00 90B R 7.74 4.47 0.00 1.80 1.88 0.00 3.20 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 91 S 7.57 4.50 0.00 3.91 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 92 R 8.50 3.82 0.00 1.74 1.93 0.00 3.14 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 93 R 7.38 4.35 0.00 1.67 1.66 0.00 3.25 0.00 0.00 3.17 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.54 0.00 94 P 0.00 4.33 0.00 2.03 2.02 0.00 3.67 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 1.98 2.16 0.00 95 Y 8.86 4.34 0.00 2.69 2.49 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 96 Q 8.82 4.50 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 97 V 7.56 4.88 1.68 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 0.89 0.00 0.00 0.84 0.00 0.00 98 N 9.25 5.20 0.00 2.75 2.67 0.00 0.00 6.78 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 99 V 8.41 5.13 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 0.95 0.00 0.00 1.05 0.00 0.00 100 L 8.73 4.87 0.00 1.59 1.54 0.90 0.89 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 0.00 101 I 8.58 4.83 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.94 0.00 0.00 102 G 9.33 4.16 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 0.00 103 G 8.64 4.61 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 0.00 0.00 0.00 104 Y 8.60 4.52 0.00 3.01 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 0.00 105 D 8.08 4.37 0.00 2.53 2.29 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 0.00