NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 H 4.6389 8.4293 120.3916 55.3094 30.5280 175.0870 6 E 4.5577 8.8563 108.8759 52.5526 32.1623 174.6134 7 T 4.2179 8.8015 111.5319 61.4147 71.9950 176.3588 8 D 4.4009 8.5560 121.2535 57.6533 40.8295 178.9606 9 E 4.0908 8.1720 118.6450 59.4887 29.5333 179.1004 10 E 4.0755 7.9818 117.5639 59.0547 29.6284 179.2079 11 F 4.1757 8.3673 120.8056 61.5069 39.4930 176.8300 12 D 4.5705 8.5446 118.3608 57.4631 40.5754 178.8116 13 A 4.0229 8.1482 121.0480 55.2944 18.4296 179.7078 14 R 3.7387 7.8546 116.5450 59.4090 30.0954 179.4166 15 W 4.0290 7.9056 118.1163 59.4049 29.0579 178.8741 16 V 3.8120 8.2956 118.5819 66.4358 30.8045 178.0930 17 T 3.8883 8.0355 114.4609 66.7868 68.2562 175.4210 18 Y 3.9926 7.7974 121.2222 60.9580 38.5762 178.3971 19 F 4.6749 8.1142 116.3847 59.8693 39.2239 176.8009 20 N 4.7875 8.0805 114.4458 52.7398 39.0080 175.0314 21 K 3.8415 7.3172 122.0951 56.1144 32.6133 174.8835 22 P 4.2614 0.0000 0.0000 65.7715 31.2324 177.7808 23 D 4.8381 7.7343 114.5401 53.0243 40.0245 176.2125 24 I 3.7859 7.4376 120.5165 62.1516 38.5457 175.8077 25 D 4.8279 8.5080 128.0086 51.8145 42.6132 177.3444 26 A 4.0066 8.4511 120.1454 55.1500 18.3150 179.1614 27 W 4.1106 8.4355 126.2928 61.0650 30.7597 177.8721 28 E 4.5003 9.5094 118.6153 59.2228 28.8436 179.3104 29 L 4.3062 8.0313 120.6117 58.3292 42.2665 179.2327 30 R 3.8822 8.1127 118.0580 59.1167 30.0102 178.8996 31 K 3.6959 8.1858 119.8967 59.2434 31.9330 179.0602 32 G 3.7354 8.3925 105.8884 48.2518 0.0000 175.7102 33 M 4.0896 8.3922 121.6775 58.1233 31.7758 178.7098 34 N 4.3048 8.3909 115.9441 56.3446 38.9117 177.4390 35 T 3.9203 7.8576 117.3242 66.3367 68.7276 176.6643 36 L 3.4276 7.7558 122.8752 58.0266 42.0649 178.7983 37 V 3.8529 7.4179 108.9658 62.3625 31.4180 177.1324 38 G 3.5641 7.3679 109.0842 47.1676 0.0000 174.1823 39 Y 4.5715 6.9063 116.8766 57.6749 38.9511 175.7823 40 D 4.6514 8.3240 122.6795 51.0443 39.7197 175.1298 41 L 4.3180 7.0252 119.1187 55.0739 42.7352 174.5393 42 V 4.1684 8.2788 120.1408 60.5848 32.4725 174.1586 43 P 4.4709 0.0000 0.0000 62.3045 32.0241 176.1514 44 E 4.2038 8.7444 120.9958 55.9454 30.3821 176.2226 45 P 4.2324 0.0000 0.0000 65.9375 31.1960 179.0703 46 K 4.1742 8.1186 116.8200 60.0345 32.3684 179.1481 47 I 3.9682 8.0364 121.1622 64.1886 37.0687 178.3333 48 I 3.5931 7.6846 120.2653 64.1630 37.0229 177.4222 49 D 4.2783 8.6688 119.0342 57.6525 41.1463 178.2995 50 A 4.0580 7.9168 120.7031 55.3004 18.4613 179.4997 51 A 3.6119 7.8504 119.1797 54.9698 18.2939 179.8996 52 L 3.8906 8.0664 117.8485 57.9620 41.5692 179.9501 53 R 3.9644 8.0062 117.7601 59.0865 30.0369 178.9477 54 A 4.0390 7.9391 120.4680 55.2709 18.2852 179.4731 55 C 4.1153 7.9543 115.2672 62.7641 28.0577 176.2804 56 R 3.8945 7.9162 120.2888 59.6939 29.5805 178.9131 57 R 3.9769 8.1411 116.2817 58.3864 30.0372 177.9856 58 L 4.5087 7.5347 116.3361 53.1004 42.5602 175.8385 59 N 4.1572 8.1948 115.8205 54.8476 36.6078 175.2854 60 D 4.8231 8.2186 117.5704 52.1915 41.7982 175.2317 61 F 4.2599 8.6403 127.2491 60.5281 39.7140 176.1654 62 A 4.0026 8.2193 120.0395 55.6239 18.1112 179.7085 63 S 4.0410 8.5869 113.1932 61.4669 62.6729 176.8149 64 A 3.8210 7.4961 123.2792 54.9930 18.0648 179.8988 65 V 3.3519 7.0963 116.3132 65.8763 31.6183 178.0024 66 R 4.1406 7.7454 119.8699 58.9570 29.9771 178.5186 67 I 3.6108 7.8165 119.6049 64.4113 37.1167 178.4587 68 L 4.1174 7.6026 119.9323 57.6292 41.2046 179.3997 69 E 3.8251 8.1216 119.0413 59.2384 29.3063 179.7200 70 V 3.5569 7.9325 119.4220 64.7803 31.1901 178.6389 71 V 3.5720 7.4783 117.8595 65.4998 31.6396 177.6789 72 K 3.9664 7.7398 119.1139 59.2227 31.8777 178.3027 73 D 4.2493 8.0934 118.4138 57.3935 40.9638 178.4354 74 K 3.9130 8.1891 117.5854 59.0211 32.2845 178.4185 75 A 4.2688 8.0996 119.7911 50.5610 18.6637 179.3651 76 G 3.7681 8.4793 106.2230 46.1765 0.0000 175.3610 77 P 4.3740 0.0000 0.0000 64.6299 31.9101 176.7661 78 H 4.6049 7.8869 118.4231 54.3209 26.7140 175.8706 79 K 4.1053 8.1716 121.8138 58.3790 32.3230 177.6726 80 E 4.4198 8.0871 115.7037 56.8768 30.7267 178.2569 81 I 3.8479 8.0230 122.0523 64.6081 37.3676 177.1695 82 Y 4.2984 8.0886 119.8187 60.4962 38.6382 176.1149 83 P 4.1066 0.0000 0.0000 65.8558 31.3516 177.9469 84 Y 3.9994 7.5811 118.2940 60.6089 38.7220 178.0795 85 V 3.3530 7.9713 119.2230 65.9881 31.4300 178.0405 86 I 3.4557 7.4770 118.9252 64.1225 37.1799 177.7901 87 Q 3.9465 7.6619 120.3803 59.4568 28.6955 178.4877 88 E 3.8418 7.7641 118.3651 58.5404 29.7067 178.4069 89 L 4.3905 7.4958 117.1829 54.2832 42.1247 177.9688 90 R 3.8300 7.6126 120.4259 59.2624 29.8670 176.3291 91 P 4.2328 0.0000 0.0000 66.0068 31.3709 178.7928 92 T 3.9331 7.7929 113.9978 66.5384 68.3319 176.6814 93 L 4.0014 8.3468 121.4186 57.7153 41.2844 179.3863 94 N 4.2966 8.2471 116.3620 56.2911 38.3576 176.8092 95 E 3.9460 8.2515 119.6209 59.4583 29.8222 178.4541 96 L 4.3916 8.0674 115.9829 54.5419 42.0578 177.3002 97 G 3.7901 7.5944 106.4479 46.3484 0.0000 173.6687 98 I 4.4548 8.0153 121.7607 60.2555 37.0766 175.9597 99 S 4.7688 9.0161 122.7094 57.4721 63.5862 175.2836 100 T 4.1519 8.5033 115.7957 61.0216 70.4496 173.5373 101 P 4.3123 0.0000 0.0000 66.0462 31.2523 178.5566 102 E 4.3940 8.1303 117.8971 59.1385 29.3459 179.1079 103 E 4.2152 7.7391 115.7337 58.5248 29.6383 178.3758 104 L 4.6395 7.3551 115.7524 53.4524 42.4466 176.7767 105 G 3.9146 8.1952 107.2867 46.5289 0.0000 174.7587 106 L 4.2775 8.2090 119.1552 55.2512 41.7094 177.2690 107 D 4.6794 7.9614 118.0926 52.7300 40.1166 175.5266 108 K 4.6153 7.5874 119.7025 55.1369 34.3446 176.7205 109 V 3.7778 8.3236 114.8800 61.7368 31.4328 175.9521 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 4.64 0.00 3.12 2.83 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 4.56 0.00 2.32 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 2.30 2.50 0.00 7 T 8.80 4.22 4.48 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 1.23 0.00 0.00 8 D 8.56 4.40 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 8.17 4.09 0.00 2.10 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 2.43 2.50 0.00 10 E 7.98 4.08 0.00 2.30 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 2.35 2.35 0.00 11 F 8.37 4.18 0.00 3.11 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 12 D 8.54 4.57 0.00 3.07 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 13 A 8.15 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 14 R 7.85 3.74 0.00 1.76 1.53 0.00 2.92 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 1.53 1.84 0.00 15 W 7.91 4.03 0.00 3.31 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 16 V 8.30 3.81 2.36 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 1.12 0.00 0.00 1.17 0.00 0.00 17 T 8.04 3.89 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 1.18 0.00 0.00 18 Y 7.80 3.99 0.00 2.78 2.76 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 19 F 8.11 4.67 0.00 3.28 3.21 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 20 N 8.08 4.79 0.00 2.89 2.90 0.00 0.00 6.91 6.90 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 21 K 7.32 3.84 0.00 1.68 1.58 0.00 1.70 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 2.13 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 23 D 7.73 4.84 0.00 2.77 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 24 I 7.44 3.79 1.91 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 1.38 0.81 1.01 0.00 0.00 25 D 8.51 4.83 0.00 3.00 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 8.45 4.01 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.44 4.11 0.00 3.44 3.42 0.00 0.00 0.00 0.00 0.00 0.00 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 9.51 4.50 0.00 2.25 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 2.76 2.86 0.00 29 L 8.03 4.31 0.00 1.92 1.93 1.02 1.03 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 8.11 3.88 0.00 1.81 1.82 0.00 3.14 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 31 K 8.19 3.70 0.00 0.79 1.46 0.00 1.25 0.00 0.00 1.34 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.41 7.81 32 G 8.39 3.74 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 0.00 0.00 0.00 33 M 8.39 4.09 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.69 0.00 34 N 8.39 4.30 0.00 2.61 2.79 0.00 0.00 7.12 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 7.86 3.92 4.49 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 1.31 0.00 0.00 36 L 7.76 3.43 0.00 0.96 1.51 0.06 1.07 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 7.42 3.85 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 0.61 0.00 0.00 0.91 0.00 0.00 38 G 7.37 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 6.91 4.57 0.00 3.01 2.77 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 40 D 8.32 4.65 0.00 2.65 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.28 4.17 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 0.89 0.00 0.00 0.99 0.00 0.00 43 P 0.00 4.47 0.00 2.07 1.97 0.00 3.74 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.09 0.00 44 E 8.74 4.20 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 2.49 2.75 0.00 45 P 0.00 4.23 0.00 2.15 2.05 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.22 0.00 46 K 8.12 4.17 0.00 2.03 2.12 0.00 1.59 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.63 7.81 47 I 8.04 3.97 2.04 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.75 1.14 0.00 0.00 48 I 7.68 3.59 1.96 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 1.74 0.89 0.86 0.00 0.00 49 D 8.67 4.28 0.00 2.80 2.92 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 0.00 0.00 0.00 50 A 7.92 4.06 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 3.61 0.57 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 52 L 8.07 3.89 0.00 1.82 1.68 0.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.01 3.96 0.00 2.09 2.00 0.00 3.15 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 54 A 7.94 4.04 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.95 4.12 0.00 3.26 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 7.92 3.89 0.00 1.96 2.10 0.00 3.19 0.00 0.00 3.19 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 8.14 3.98 0.00 1.99 2.01 0.00 3.22 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 58 L 7.53 4.51 0.00 1.72 1.72 1.04 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.19 4.16 0.00 2.83 2.88 0.00 0.00 6.61 8.45 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 60 D 8.22 4.82 0.00 2.59 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 8.64 4.26 0.00 3.21 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 62 A 8.22 4.00 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 63 S 8.59 4.04 0.00 3.94 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 64 A 7.50 3.82 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 65 V 7.10 3.35 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 0.98 0.00 0.00 0.46 0.00 0.00 66 R 7.75 4.14 0.00 1.91 1.98 0.00 3.19 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 1.57 1.52 0.00 67 I 7.82 3.61 1.92 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.07 0.79 0.00 0.00 68 L 7.60 4.12 0.00 1.78 1.88 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.12 3.83 0.00 2.14 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 2.23 2.24 0.00 70 V 7.93 3.56 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 0.92 0.00 0.00 0.86 0.00 0.00 71 V 7.48 3.57 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 0.93 0.00 0.00 1.00 0.00 0.00 72 K 7.74 3.97 0.00 0.79 1.48 0.00 0.65 0.00 0.00 1.13 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.19 1.10 7.81 73 D 8.09 4.25 0.00 2.75 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 74 K 8.19 3.91 0.00 1.88 1.87 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.58 7.81 75 A 8.10 4.27 1.47 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 0.00 0.00 76 G 8.48 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 77 P 0.00 4.37 0.00 2.07 2.12 0.00 3.95 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 78 H 7.89 4.60 0.00 3.33 3.28 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.17 4.11 0.00 1.77 1.92 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.39 7.81 80 E 8.09 4.42 0.00 2.17 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 2.31 0.00 81 I 8.02 3.85 1.95 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 1.39 0.90 0.99 0.00 0.00 82 Y 8.09 4.30 0.00 2.92 3.05 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 83 P 0.00 4.11 0.00 2.24 2.11 0.00 3.84 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 2.30 2.26 0.00 84 Y 7.58 4.00 0.00 3.06 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 7.97 3.35 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 0.96 0.00 0.00 1.15 0.00 0.00 86 I 7.48 3.46 1.58 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.06 0.72 0.00 0.00 87 Q 7.66 3.95 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.09 2.28 0.00 88 E 7.76 3.84 0.00 1.81 1.80 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 1.50 1.70 0.00 89 L 7.50 4.39 0.00 1.60 1.62 0.87 0.75 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 90 R 7.61 3.83 0.00 2.14 1.90 0.00 3.25 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 1.59 1.71 0.00 91 P 0.00 4.23 0.00 2.17 2.06 0.00 3.70 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 2.14 0.00 92 T 7.79 3.93 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 1.22 0.00 0.00 93 L 8.35 4.00 0.00 1.75 1.90 0.87 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 94 N 8.25 4.30 0.00 2.97 2.86 0.00 0.00 6.63 6.94 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 95 E 8.25 3.95 0.00 1.99 2.20 0.00 0.00 0.00 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 8.07 4.39 0.00 1.69 1.74 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.59 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 0.00 0.00 0.00 98 I 8.02 4.45 1.91 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 1.35 0.67 0.85 0.00 0.00 99 S 9.02 4.77 0.00 4.07 3.89 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 0.00 100 T 8.50 4.15 4.48 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 1.23 0.00 0.00 101 P 0.00 4.31 0.00 2.17 2.13 0.00 3.74 0.00 0.00 3.83 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 8.13 4.39 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 2.62 0.00 103 E 7.74 4.22 0.00 2.18 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 7.36 4.64 0.00 1.81 1.75 1.18 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.20 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 0.00 0.00 0.00 106 L 8.21 4.28 0.00 1.79 1.72 0.95 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 107 D 7.96 4.68 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 7.59 4.62 0.00 1.87 1.84 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.23 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.43 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