NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6350 8.3649 120.5346 54.0449 42.2980 174.5978 2 I 3.9608 8.2763 124.1072 60.1241 38.0900 170.0465 3 V 4.4779 9.5347 127.9481 61.1500 34.6953 173.7992 4 L 5.2364 8.4726 125.4662 53.3238 44.1802 175.8423 5 T 4.4954 8.9612 121.3080 62.2222 70.0349 173.2976 6 Q 5.3724 8.7071 128.2913 54.6045 31.0805 174.6115 7 S 4.8940 8.9100 119.1911 56.3856 66.9646 172.0214 8 P 4.9077 0.0000 0.0000 61.9772 32.4947 176.1468 9 A 4.2789 8.5032 119.7965 54.8488 19.1942 177.7006 10 S 5.2015 7.8670 108.1845 57.1679 67.5285 173.9958 11 L 4.8371 8.9202 121.1702 53.3059 45.7661 175.5020 12 S 5.3685 8.8090 119.0232 57.0191 64.7214 173.3624 13 A 4.7932 9.3312 125.1449 50.8714 23.1220 175.3228 14 S 5.0424 9.0246 115.7448 56.6344 65.6141 174.3858 15 V 3.9515 8.3827 121.9156 64.7180 31.6296 176.2135 16 G 4.0205 9.1921 115.9198 45.2257 0.0000 173.4151 17 E 4.1336 7.9761 118.9986 56.7308 31.0194 175.9116 18 T 4.9215 8.2746 117.7374 62.2401 71.1810 174.1836 19 V 4.7811 8.3500 117.4613 59.9750 36.5889 174.5246 20 T 4.9809 8.2315 117.2429 61.9715 72.2157 173.5598 21 I 4.7058 8.6333 126.4091 59.5834 40.7315 174.6786 22 T 5.3981 9.0216 115.6894 60.2199 72.3565 172.1285 23 C 5.6157 9.6318 120.3664 55.3372 43.8299 172.7794 24 R 5.2076 9.1881 124.4239 54.4865 32.0345 174.5320 25 A 5.0273 9.1689 129.0682 51.1713 20.0547 178.1037 26 S 4.2056 8.8465 116.0879 60.0772 63.5238 174.2771 27 G 4.1324 7.5038 108.4365 43.7652 0.0000 172.2169 28 N 4.3449 8.6339 119.1712 53.8535 39.2739 174.6210 29 I 4.0087 8.2232 118.2359 60.0484 38.2473 175.3303 30 H 3.8567 8.9376 116.9323 57.3830 26.5804 175.4417 31 N 4.6868 8.2267 113.3942 54.3029 37.1679 174.4492 32 Y 4.8135 7.7097 118.3481 56.6154 36.7147 173.4797 33 L 5.2550 7.7331 122.6717 53.0332 46.4116 174.5595 34 A 5.3139 9.1573 126.4671 49.9393 22.9706 174.7289 35 W 5.3299 8.9917 119.1120 55.1511 32.8400 174.4911 36 Y 5.3541 9.5101 120.5828 56.3374 41.7003 174.1162 37 Q 4.7834 9.0597 123.3263 54.3359 32.0030 174.1042 38 Q 4.7280 9.0005 126.7631 54.2270 32.0340 174.6755 39 K 4.5299 8.6418 125.9202 55.5185 34.0682 176.5304 40 Q 4.0662 8.7856 121.2136 57.8350 28.7444 177.3529 41 G 3.9030 8.9690 110.7320 46.2429 0.0000 172.4509 42 K 4.6894 7.8647 117.5355 53.6387 35.6068 176.2995 43 S 4.3227 8.2917 115.7508 57.7253 63.3467 172.8768 44 P 4.6655 0.0000 0.0000 63.1905 32.0919 175.5257 45 Q 4.6719 9.1383 123.3024 53.8700 32.3250 174.1869 46 L 4.1894 9.0276 128.7205 56.0197 42.3570 175.6500 47 L 4.4724 9.1273 126.1728 56.0105 43.7297 176.6912 48 V 5.0612 7.6128 117.5619 61.2681 35.3217 173.3103 49 Y 5.0666 8.5594 124.5376 54.5626 41.9370 174.0642 50 Y 4.2126 9.4138 117.7628 58.0002 37.3094 171.9896 51 T 3.8957 8.3764 123.6588 64.7187 68.6806 174.5083 52 T 4.5068 7.4943 106.0184 60.9139 70.4435 173.4349 53 T 4.1944 7.6631 120.6443 62.2328 69.5956 174.3758 54 L 4.5505 8.3817 126.9112 54.5264 42.5830 177.1036 55 A 4.5447 9.0845 125.4423 51.3739 20.0774 176.7557 56 D 4.5563 8.6228 119.5952 56.0995 41.1368 177.6232 57 G 3.9687 9.0051 112.7328 45.0869 0.0000 173.4487 58 V 3.8127 7.4744 120.4291 61.3653 32.3816 174.1043 59 P 4.5235 0.0000 0.0000 62.7176 31.7179 177.2390 60 S 4.4298 8.5754 114.2205 60.0280 63.3102 175.1913 61 R 4.0163 7.9132 118.1670 58.2676 30.3355 176.0437 62 F 4.9032 8.0611 119.9290 56.6820 39.9900 175.5009 63 S 4.6900 9.2825 118.1836 56.5416 66.3848 173.2010 64 G 4.5850 8.9463 109.0765 44.0672 0.0000 171.9978 65 S 4.7071 9.1762 115.6021 56.9383 67.1837 172.3154 66 G 4.3031 7.8824 105.2150 43.6805 0.0000 172.8237 67 S 4.3341 7.7372 114.7756 57.9336 68.6710 178.7238 68 G 3.9369 9.1912 114.0064 46.4977 0.0000 174.6244 69 T 4.7514 8.6956 115.0704 60.7726 72.0518 174.8031 70 Q 5.1368 7.5002 123.0944 54.5852 31.7150 173.8141 71 Y 5.0611 9.1315 122.4666 56.5278 42.7445 174.4592 72 S 5.3271 9.4284 117.4867 56.7998 67.7948 172.5628 73 L 4.6142 8.2543 124.9422 52.9119 44.0846 174.8678 74 K 4.8194 9.0121 127.5754 54.5305 35.4386 174.6779 75 I 4.4288 8.2188 127.0025 59.5048 39.8848 174.1452 76 N 4.9289 8.5794 125.4507 51.8290 39.4648 176.0986 77 S 3.7766 8.6290 118.2252 58.1019 60.3919 172.4426 78 L 4.0745 7.9576 121.3015 55.8115 41.4491 177.1577 79 Q 4.9682 8.5549 118.9300 53.2029 32.1502 174.8999 80 P 4.5841 0.0000 0.0000 66.1433 31.3602 178.0166 81 E 4.4881 8.1821 112.2083 57.1383 29.7972 176.7655 82 D 4.7643 8.1868 119.5096 55.5288 41.4415 176.9231 83 F 4.4124 7.7072 117.8783 56.2187 39.7198 176.1530 84 G 3.8875 7.3988 110.9403 45.9972 0.0000 171.1474 85 S 5.3508 7.8513 115.4282 57.3070 65.8242 173.2905 86 Y 5.2961 8.5116 118.7591 56.6772 42.0611 174.2097 87 Y 5.5521 9.5092 119.8332 56.5284 42.7425 171.9641 88 C 5.0930 9.1203 116.6654 53.7978 44.1132 172.2767 89 Q 4.7936 8.6787 120.8414 54.7679 32.3020 173.4246 90 H 5.3474 8.1336 120.7144 53.7078 31.1599 174.0033 91 F 4.8014 9.1796 116.9770 57.1105 39.7172 175.3311 92 W 4.5040 8.9069 129.4387 56.3731 31.5530 175.9100 93 S 3.0723 7.7816 123.5128 59.2218 61.5428 170.8161 94 T 4.6833 7.8982 106.5439 58.7820 71.7855 171.9386 95 P 4.3677 0.0000 0.0000 62.7500 32.1088 176.2903 96 R 4.0298 8.0416 119.3375 56.1920 31.3037 175.5407 97 T 4.7025 7.6491 110.4468 60.2086 72.9016 172.2259 98 F 5.1863 8.6905 119.8028 55.3839 41.9369 175.9829 99 G 3.9405 9.2750 111.0647 45.1919 0.0000 174.4199 100 G 3.7545 8.5700 107.6610 46.2996 0.0000 175.0200 101 G 3.5712 8.8001 106.9461 45.7042 0.0000 173.1206 102 T 4.7994 8.3674 117.4110 61.4329 72.4585 173.1324 103 K 4.6533 9.1287 126.9385 55.3909 33.6584 175.5336 104 L 5.1606 9.1883 129.2697 53.7001 43.4479 175.0734 105 E 5.0574 9.3503 124.3291 54.1403 33.4604 175.2508 106 I 3.8722 8.0831 121.6901 61.3637 37.8808 176.0554 107 K 4.2042 8.6410 127.1440 56.4983 31.7244 175.7000 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 D 8.36 4.64 0.00 2.68 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 2 I 8.28 3.96 1.69 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.62 0.81 0.00 0.00 3 V 9.53 4.48 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 1.00 0.00 0.00 0.95 0.00 0.00 4 L 8.47 5.24 0.00 1.56 1.55 0.89 0.79 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 5 T 8.96 4.50 4.29 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 1.25 0.00 0.00 6 Q 8.71 5.37 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.73 0.00 7 S 8.91 4.89 0.00 3.94 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 8 P 0.00 4.91 0.00 2.38 2.13 0.00 3.78 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 2.00 1.96 0.00 9 A 8.50 4.28 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 10 S 7.87 5.20 0.00 3.73 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 11 L 8.92 4.84 0.00 1.58 1.52 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.81 5.37 0.00 3.76 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 13 A 9.33 4.79 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 14 S 9.02 5.04 0.00 3.90 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 15 V 8.38 3.95 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 0.89 0.00 0.00 1.15 0.00 0.00 16 G 9.19 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 0.00 0.00 0.00 0.00 17 E 7.98 4.13 0.00 2.08 1.84 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 2.31 2.29 0.00 18 T 8.27 4.92 4.17 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 0.00 0.00 1.15 0.00 0.00 19 V 8.35 4.78 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 0.67 0.00 0.00 0.70 0.00 0.00 20 T 8.23 4.98 4.17 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 0.00 0.00 1.13 0.00 0.00 21 I 8.63 4.71 1.47 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.53 1.14 0.00 0.00 22 T 9.02 5.40 4.35 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 1.25 0.00 0.00 23 C 9.63 5.62 0.00 2.81 2.94 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 0.00 0.00 0.00 0.00 24 R 9.19 5.21 0.00 2.11 1.81 0.00 3.09 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.72 0.00 25 A 9.17 5.03 1.35 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 0.00 0.00 26 S 8.85 4.21 0.00 3.92 4.01 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 27 G 7.50 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 0.00 0.00 0.00 28 N 8.63 4.34 0.00 2.55 2.52 0.00 0.00 6.58 7.69 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 29 I 8.22 4.01 1.95 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.40 0.90 0.00 0.00 30 H 8.94 3.86 0.00 2.88 3.33 0.00 5.73 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.23 4.69 0.00 2.52 1.64 0.00 0.00 6.79 7.05 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 32 Y 7.71 4.81 0.00 3.48 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 33 L 7.73 5.26 0.00 1.08 0.95 0.46 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 34 A 9.16 5.31 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 35 W 8.99 5.33 0.00 3.21 3.12 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 36 Y 9.51 5.35 0.00 3.12 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 37 Q 9.06 4.78 0.00 1.99 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.72 0.00 0.00 0.00 0.00 0.00 2.05 1.63 0.00 38 Q 9.00 4.73 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 39 K 8.64 4.53 0.00 1.74 1.73 0.00 1.82 0.00 0.00 1.95 0.00 0.00 3.13 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.44 7.81 40 Q 8.79 4.07 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 41 G 8.97 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 0.00 0.00 0.00 42 K 7.86 4.69 0.00 1.72 1.71 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.52 7.81 43 S 8.29 4.32 0.00 3.86 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 44 P 0.00 4.67 0.00 1.75 1.91 0.00 3.52 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.94 0.00 45 Q 9.14 4.67 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 46 L 9.03 4.19 0.00 1.88 1.67 0.81 1.02 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 47 L 9.13 4.47 0.00 1.73 1.47 0.82 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.61 5.06 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 1.27 0.00 0.00 0.94 0.00 0.00 49 Y 8.56 5.07 0.00 2.92 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 Y 9.41 4.21 0.00 3.04 2.93 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 51 T 8.38 3.90 4.10 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 0.00 0.00 0.00 1.43 0.00 0.00 52 T 7.49 4.51 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 1.23 0.00 0.00 53 T 7.66 4.19 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 0.91 0.00 0.00 54 L 8.38 4.55 0.00 1.49 1.61 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 55 A 9.08 4.54 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 56 D 8.62 4.56 0.00 2.71 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 9.01 3.97 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 0.00 0.00 0.00 58 V 7.47 3.81 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 0.62 0.00 0.00 0.96 0.00 0.00 59 P 0.00 4.52 0.00 2.36 2.25 0.00 3.84 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.16 0.00 60 S 8.58 4.43 0.00 4.01 4.05 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 61 R 7.91 4.02 0.00 1.91 2.12 0.00 2.98 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.05 0.00 62 F 8.06 4.90 0.00 2.93 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 63 S 9.28 4.69 0.00 3.78 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 64 G 8.95 4.59 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 0.00 0.00 0.00 65 S 9.18 4.71 0.00 3.84 3.92 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 66 G 7.88 4.30 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 0.00 67 S 7.74 4.33 0.00 3.62 3.57 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 68 G 9.19 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.70 4.75 4.44 0.00 0.00 0.00 0.00 0.00 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 70 Q 7.50 5.14 0.00 2.12 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 71 Y 9.13 5.06 0.00 3.16 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 72 S 9.43 5.33 0.00 3.71 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 73 L 8.25 4.61 0.00 0.27 0.29 0.55 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 74 K 9.01 4.82 0.00 1.66 1.47 0.00 1.53 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.17 1.37 7.81 75 I 8.22 4.43 1.50 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.30 0.12 0.00 0.00 76 N 8.58 4.93 0.00 2.44 2.63 0.00 0.00 7.00 8.00 0.00 0.00 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 S 8.63 3.78 0.00 3.89 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 78 L 7.96 4.07 0.00 1.69 1.53 0.42 0.47 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 79 Q 8.55 4.97 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 80 P 0.00 4.58 0.00 2.27 2.24 0.00 3.65 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 81 E 8.18 4.49 0.00 2.16 2.13 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 2.37 2.35 0.00 82 D 8.19 4.76 0.00 2.47 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 83 F 7.71 4.41 0.00 3.17 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 84 G 7.40 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 0.00 0.00 0.00 85 S 7.85 5.35 0.00 3.83 3.57 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 86 Y 8.51 5.30 0.00 3.00 2.99 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 87 Y 9.51 5.55 0.00 3.20 3.10 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 0.00 0.00 0.00 0.00 88 C 9.12 5.09 0.00 2.02 1.23 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 0.00 0.00 0.00 89 Q 8.68 4.79 0.00 1.87 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 5.83 0.00 0.00 0.00 0.00 0.00 1.38 1.16 0.00 90 H 8.13 5.35 0.00 3.28 3.15 0.00 5.55 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 9.18 4.80 0.00 3.05 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 92 W 8.91 4.50 0.00 3.61 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 93 S 7.78 3.07 0.00 3.33 3.47 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 94 T 7.90 4.68 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 1.13 0.00 0.00 95 P 0.00 4.37 0.00 2.16 2.06 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.18 0.00 96 R 8.04 4.03 0.00 1.35 1.26 0.00 3.10 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.31 0.00 97 T 7.65 4.70 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 1.25 0.00 0.00 98 F 8.69 5.19 0.00 2.87 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 99 G 9.28 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.57 3.75 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 0.00 0.00 0.00 101 G 8.80 3.57 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 0.00 102 T 8.37 4.80 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 1.31 0.00 0.00 103 K 9.13 4.65 0.00 1.75 1.80 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.41 7.81 104 L 9.19 5.16 0.00 1.90 1.99 0.91 0.55 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 0.00 105 E 9.35 5.06 0.00 2.03 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 2.48 2.29 0.00 106 I 8.08 3.87 1.56 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.63 0.00 0.00 107 K 8.64 4.20 0.00 1.83 1.76 0.00 1.85 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.37 7.81