NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 H 4.6570 8.4293 120.3922 55.3801 30.5791 175.3263 6 E 4.5507 8.8609 110.1971 52.5380 32.1207 174.2618 7 T 4.2399 8.8341 110.4252 61.3263 71.8828 176.4861 8 D 4.4068 8.6293 121.6982 57.6993 40.8148 178.9512 9 E 4.0471 8.2233 118.4561 59.6652 29.4820 179.2101 10 E 4.0385 7.9049 118.0178 59.1243 29.6184 179.1365 11 F 4.1970 8.3988 120.7672 61.5208 39.4811 176.7297 12 D 4.5793 8.6583 118.3308 57.5069 40.5972 178.7861 13 A 4.0318 8.2452 121.0034 55.4105 18.5457 179.7850 14 R 3.7204 8.1320 116.6092 59.3184 30.1985 179.3583 15 W 4.0136 7.9894 118.2804 59.2193 29.0855 178.9918 16 V 3.8382 8.2804 118.6411 66.4560 30.8284 178.1375 17 T 3.8933 7.9762 114.4060 66.7698 68.7096 175.5957 18 Y 3.9423 7.6783 120.8023 60.7742 38.6142 178.0997 19 F 4.5941 7.9961 116.1349 59.7160 39.2672 176.8864 20 N 4.7172 8.0303 114.7217 52.9782 38.7997 175.2366 21 K 3.8147 7.1639 122.1110 56.1213 32.7302 174.9223 22 P 4.2614 0.0000 0.0000 65.7475 31.2455 177.4315 23 D 4.8223 7.7610 114.4392 52.9740 39.9042 176.1065 24 I 3.7800 7.3119 120.8788 62.1074 38.4637 175.9422 25 D 4.8138 8.6094 127.5293 51.9223 42.5406 177.2886 26 A 4.0264 8.4642 120.2223 55.0770 18.2731 179.3078 27 W 4.0153 8.3989 126.2750 60.9456 30.8674 177.9557 28 E 4.4314 9.5040 118.6749 59.0919 28.8209 179.3108 29 L 4.2550 7.9519 120.6997 58.3184 42.2852 179.2136 30 R 3.8820 8.0891 118.0756 58.9815 30.0136 178.7657 31 K 3.5677 8.0714 119.9461 59.3660 31.9897 178.9006 32 G 3.8158 8.2428 105.7031 48.3359 0.0000 175.6176 33 M 4.1035 8.3732 121.6484 58.0942 31.7651 178.7214 34 N 4.3203 8.4471 115.9945 56.3242 38.9553 177.3962 35 T 3.9227 7.9083 117.3691 66.2565 68.6777 176.7286 36 L 3.2645 7.6491 122.7113 57.9384 42.1003 178.7040 37 V 3.8598 7.3508 108.4306 62.1971 31.3208 177.0068 38 G 3.6164 7.3237 109.0221 46.7688 0.0000 174.2008 39 Y 4.6441 6.9238 117.0028 57.5672 39.0511 175.7410 40 D 4.6459 8.3047 122.7343 51.0526 39.7130 175.0706 41 L 4.3221 7.0264 119.3951 55.0995 42.7524 174.4723 42 V 4.2156 8.2509 119.8685 60.4908 32.6392 174.1430 43 P 4.4941 0.0000 0.0000 62.2590 32.0948 176.1541 44 E 4.2248 8.7019 120.7654 55.8792 30.3717 176.3210 45 P 4.2415 0.0000 0.0000 65.8513 31.1773 179.1400 46 K 4.2267 8.0893 116.9260 59.8936 32.4155 179.2368 47 I 3.9412 7.9448 121.1355 64.2794 37.1381 178.2640 48 I 3.5684 7.7006 120.1950 64.1922 36.9081 177.5195 49 D 4.2580 8.6153 119.0333 57.5443 41.0670 178.1674 50 A 4.0547 7.8712 120.8084 55.3634 18.3753 179.5129 51 A 3.6447 7.8120 119.0970 54.9911 18.2832 179.9097 52 L 3.8691 8.0010 117.6929 57.9754 41.6000 179.9431 53 R 3.9330 8.0967 117.8603 59.1447 29.9972 178.9260 54 A 4.0530 8.1199 120.6479 55.4142 18.3013 179.4530 55 C 4.1256 8.0156 115.2735 62.7657 28.0487 176.3498 56 R 3.8884 7.9041 120.2733 59.7077 29.5758 178.8257 57 R 3.9590 8.1453 116.5973 58.7043 30.0448 178.0115 58 L 4.4728 7.6930 116.2516 53.1758 42.3894 176.0738 59 N 4.1688 8.1193 115.6993 54.8482 36.6534 175.2663 60 D 4.8369 8.1515 117.5016 52.0344 41.8244 175.3055 61 F 4.2362 8.6688 126.7122 60.6494 39.7715 175.9680 62 A 4.0220 8.2910 120.0171 55.6488 18.0215 179.6384 63 S 4.0262 8.3498 113.1263 61.5179 62.7268 176.7777 64 A 3.8169 7.5272 123.0490 55.0835 18.1042 179.9159 65 V 3.3282 7.1093 116.1847 65.9774 31.6933 177.9023 66 R 4.3223 7.7991 119.7795 59.0096 29.9285 178.5030 67 I 3.6484 7.9318 119.7323 64.3778 37.1700 178.4589 68 L 4.1122 7.6444 119.5940 57.6804 41.3322 179.3805 69 E 3.8470 8.1501 119.0217 59.2410 29.3538 179.7490 70 V 3.6070 7.8942 119.3158 64.6335 31.2579 178.6783 71 V 3.6275 7.4795 118.0656 65.5875 31.7703 177.6644 72 K 3.9601 7.7663 119.0533 59.2750 31.8750 178.2900 73 D 4.2519 8.0349 118.4175 57.3904 40.9699 178.4062 74 K 3.8976 8.2859 117.6003 58.9851 32.3264 178.3250 75 A 4.2881 8.1236 119.6954 50.9937 18.7579 178.8619 76 G 3.7048 8.4807 106.4596 46.1223 0.0000 175.1909 77 P 4.3730 0.0000 0.0000 64.4766 31.7958 176.8732 78 H 4.9761 7.8608 117.9274 54.0016 26.6248 175.9212 79 K 4.1291 8.1077 121.3368 58.5700 32.4745 177.8438 80 E 4.3781 8.1011 117.1867 57.2247 30.4030 178.3422 81 I 3.8899 7.8686 120.6361 64.2502 37.4370 177.1749 82 Y 4.2891 8.0944 119.7975 60.5636 38.6455 176.1123 83 P 4.1170 0.0000 0.0000 65.9177 31.3126 177.9437 84 Y 4.0586 7.9224 117.6217 60.5774 38.8188 177.8326 85 V 3.2773 7.9850 119.2402 65.9415 31.7144 177.9547 86 I 3.4031 7.7103 119.8838 64.1942 36.5950 177.8873 87 Q 3.8155 7.4604 119.1829 59.5272 28.9793 178.4936 88 E 3.8986 7.8180 117.8162 58.3525 29.6388 178.3052 89 L 4.3803 7.4714 117.5691 54.3228 42.2451 178.0422 90 R 3.8162 7.5143 119.8968 59.1870 29.9168 176.1447 91 P 4.2200 0.0000 0.0000 66.0401 31.3532 178.7354 92 T 3.9003 7.8055 113.8827 66.5423 68.3544 176.5404 93 L 3.9749 8.2452 121.2783 57.8315 41.5133 179.3646 94 N 4.2913 8.2188 116.2160 56.3331 38.3510 176.7660 95 E 3.9068 8.3746 119.5788 59.4505 29.7845 178.4282 96 L 4.4313 8.1475 116.0668 54.4385 42.0960 177.4800 97 G 3.8230 7.6826 106.6086 46.1299 0.0000 173.5746 98 I 4.3239 7.8603 121.3162 60.4141 36.9552 176.0888 99 S 4.7291 8.9401 122.5042 57.7795 64.0757 175.2350 100 T 4.2261 8.7178 115.1493 60.8590 70.7416 173.8781 101 P 4.2693 0.0000 0.0000 66.0204 31.2107 178.7048 102 E 4.3814 8.0884 117.8662 59.2045 29.3507 179.1779 103 E 4.0291 7.7965 116.6892 58.7289 29.5785 178.4598 104 L 4.5594 7.6008 116.2039 53.6971 42.5824 177.1317 105 G 3.9260 8.2168 107.9998 46.3532 0.0000 175.2490 106 L 4.3347 8.4105 118.7014 55.4285 41.5712 177.2722 107 D 4.6721 7.9626 118.2478 52.7752 40.1734 175.5733 108 K 4.6008 7.2575 119.0020 55.1489 34.2304 176.9111 109 V 3.7794 8.3154 114.8474 61.7346 31.4420 175.9577 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 5 H 8.43 4.66 0.00 3.11 2.73 0.00 5.73 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.86 4.55 0.00 2.37 1.90 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 2.33 2.52 0.00 7 T 8.83 4.24 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 1.23 0.00 0.00 8 D 8.63 4.41 0.00 2.73 2.79 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 9 E 8.22 4.05 0.00 2.10 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 2.44 2.51 0.00 10 E 7.90 4.04 0.00 2.36 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 0.00 2.36 2.36 0.00 11 F 8.40 4.20 0.00 3.23 3.29 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 12 D 8.66 4.58 0.00 3.08 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 13 A 8.25 4.03 1.40 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 0.00 0.00 0.00 14 R 8.13 3.72 0.00 1.73 1.55 0.00 2.94 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.84 0.00 15 W 7.99 4.01 0.00 3.36 3.36 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 16 V 8.28 3.84 2.39 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 1.11 0.00 0.00 1.15 0.00 0.00 17 T 7.98 3.89 4.39 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 1.17 0.00 0.00 18 Y 7.68 3.94 0.00 2.76 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 19 F 8.00 4.59 0.00 3.29 3.24 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 20 N 8.03 4.72 0.00 2.90 2.90 0.00 0.00 6.90 7.66 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 21 K 7.16 3.81 0.00 1.73 1.57 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.75 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.34 7.81 22 P 0.00 4.26 0.00 2.07 2.12 0.00 3.69 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 2.03 2.10 0.00 23 D 7.76 4.82 0.00 2.77 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 24 I 7.31 3.78 1.86 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 1.36 0.82 1.01 0.00 0.00 25 D 8.61 4.81 0.00 3.06 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 26 A 8.46 4.03 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 27 W 8.40 4.02 0.00 3.47 3.46 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 0.00 0.00 0.00 0.00 28 E 9.50 4.43 0.00 2.20 1.99 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 2.75 2.88 0.00 29 L 7.95 4.25 0.00 1.91 1.94 1.06 1.01 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 30 R 8.09 3.88 0.00 1.80 1.83 0.00 3.15 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 1.63 1.82 0.00 31 K 8.07 3.57 0.00 0.79 1.61 0.00 1.19 0.00 0.00 1.30 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.40 7.81 32 G 8.24 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 33 M 8.37 4.10 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.75 0.00 34 N 8.45 4.32 0.00 2.60 2.79 0.00 0.00 7.11 7.55 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 35 T 7.91 3.92 4.46 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 0.00 0.00 0.00 1.27 0.00 0.00 36 L 7.65 3.26 0.00 1.01 1.49 0.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.35 3.86 1.99 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 0.60 0.00 0.00 0.91 0.00 0.00 38 G 7.32 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 39 Y 6.92 4.64 0.00 2.98 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 40 D 8.30 4.65 0.00 2.64 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 41 L 7.03 4.32 0.00 1.68 1.50 1.03 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.25 4.22 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 0.90 0.00 0.00 0.96 0.00 0.00 43 P 0.00 4.49 0.00 2.07 1.97 0.00 3.74 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 1.96 2.08 0.00 44 E 8.70 4.22 0.00 2.10 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 0.00 2.50 2.75 0.00 45 P 0.00 4.24 0.00 2.12 2.01 0.00 3.68 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 46 K 8.09 4.23 0.00 2.03 2.12 0.00 1.59 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.63 7.81 47 I 7.94 3.94 2.04 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.72 1.15 0.00 0.00 48 I 7.70 3.57 1.96 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 1.74 0.83 0.85 0.00 0.00 49 D 8.62 4.26 0.00 2.72 2.83 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 0.00 0.00 0.00 50 A 7.87 4.05 1.55 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 51 A 7.81 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.00 3.87 0.00 1.83 1.68 0.86 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.10 3.93 0.00 2.07 2.00 0.00 3.15 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 54 A 8.12 4.05 1.57 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 0.00 0.00 55 C 8.02 4.13 0.00 3.21 3.18 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 56 R 7.90 3.89 0.00 1.96 2.20 0.00 3.19 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 57 R 8.15 3.96 0.00 1.97 2.01 0.00 3.22 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 1.69 1.88 0.00 58 L 7.69 4.47 0.00 1.72 1.72 0.98 1.04 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 59 N 8.12 4.17 0.00 2.83 2.88 0.00 0.00 6.60 8.86 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 60 D 8.15 4.84 0.00 2.74 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 61 F 8.67 4.24 0.00 3.21 3.02 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 62 A 8.29 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 63 S 8.35 4.03 0.00 3.92 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 64 A 7.53 3.82 1.12 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 65 V 7.11 3.33 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 0.97 0.00 0.00 0.44 0.00 0.00 66 R 7.80 4.32 0.00 2.02 2.01 0.00 3.31 0.00 0.00 3.22 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 67 I 7.93 3.65 1.94 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.11 0.79 0.00 0.00 68 L 7.64 4.11 0.00 1.81 1.88 0.91 1.42 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 69 E 8.15 3.85 0.00 2.17 1.91 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 2.24 2.25 0.00 70 V 7.89 3.61 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 0.93 0.00 0.00 0.86 0.00 0.00 71 V 7.48 3.63 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 0.92 0.00 0.00 1.00 0.00 0.00 72 K 7.77 3.96 0.00 0.79 1.49 0.00 0.72 0.00 0.00 1.15 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.19 1.13 7.81 73 D 8.03 4.25 0.00 2.83 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 74 K 8.29 3.90 0.00 1.86 1.87 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.57 7.81 75 A 8.12 4.29 1.48 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 0.00 0.00 76 G 8.48 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 77 P 0.00 4.37 0.00 2.08 2.11 0.00 3.86 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 1.58 1.83 0.00 78 H 7.86 4.98 0.00 3.41 3.27 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.11 4.13 0.00 1.77 1.91 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.42 7.81 80 E 8.10 4.38 0.00 2.07 1.99 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 2.37 2.41 0.00 81 I 7.87 3.89 1.95 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 1.41 0.66 1.01 0.00 0.00 82 Y 8.09 4.29 0.00 2.92 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 83 P 0.00 4.12 0.00 2.24 2.12 0.00 3.80 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 2.32 2.26 0.00 84 Y 7.92 4.06 0.00 3.01 3.08 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 0.00 0.00 0.00 85 V 7.98 3.28 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 0.93 0.00 0.00 1.12 0.00 0.00 86 I 7.71 3.40 1.60 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.18 0.03 0.72 0.00 0.00 87 Q 7.46 3.82 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.00 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 88 E 7.82 3.90 0.00 1.77 1.77 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 1.47 1.62 0.00 89 L 7.47 4.38 0.00 1.59 1.61 0.85 0.77 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 90 R 7.51 3.82 0.00 2.09 1.91 0.00 3.08 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 91 P 0.00 4.22 0.00 2.17 2.06 0.00 3.61 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 92 T 7.81 3.90 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 1.20 0.00 0.00 93 L 8.25 3.97 0.00 1.77 1.88 0.86 0.53 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 94 N 8.22 4.29 0.00 2.98 2.86 0.00 0.00 6.66 6.95 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 95 E 8.37 3.91 0.00 1.97 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 0.00 2.34 2.38 0.00 96 L 8.15 4.43 0.00 1.67 1.74 0.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.68 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 98 I 7.86 4.32 1.89 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 1.28 0.65 0.82 0.00 0.00 99 S 8.94 4.73 0.00 4.09 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 0.00 100 T 8.72 4.23 4.52 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.27 0.00 2.17 2.13 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 102 E 8.09 4.38 0.00 2.11 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 0.00 2.49 2.61 0.00 103 E 7.80 4.03 0.00 2.12 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 0.00 2.38 2.40 0.00 104 L 7.60 4.56 0.00 1.68 1.77 1.18 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.22 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 0.00 0.00 0.00 106 L 8.41 4.33 0.00 1.73 1.72 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 107 D 7.96 4.67 0.00 2.82 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 0.00 108 K 7.26 4.60 0.00 1.95 1.84 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.21 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.39 7.81 109 V 8.32 3.78 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 0.66 0.00 0.00 0.92 0.00 0.00