NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3470 8.0333 117.3312 63.4418 70.6378 172.6274 2 E 4.4550 8.8314 126.1932 55.0626 29.6537 174.8353 3 L 4.5426 8.6191 125.8923 54.3883 43.7396 176.2449 4 T 4.5638 8.0635 109.9323 60.1834 71.2971 175.6936 5 K 3.3202 8.8221 122.8302 59.9556 32.0645 179.5332 6 C 4.2856 8.0672 115.9902 59.8991 39.3069 175.9758 7 K 3.8210 8.1756 120.2825 59.3910 31.5614 179.3761 8 V 3.4214 7.8447 118.6737 66.2440 31.1835 178.0821 9 S 4.0908 7.9719 113.6429 61.9155 62.8117 176.1389 10 H 4.2463 8.4811 120.6133 59.2446 29.4689 177.1366 11 A 4.0823 8.1780 121.9141 54.6310 18.4546 178.6121 12 I 4.1657 7.8578 109.6957 60.9228 37.8676 177.7514 13 K 3.9592 7.5962 122.3367 60.3178 31.6958 178.2420 14 D 4.5255 8.1531 116.6645 57.2483 41.0672 177.7580 15 I 3.8025 8.0953 118.7048 62.1463 38.6399 175.0329 16 D 4.6671 8.2704 121.4103 56.3849 41.4103 176.6716 17 G 4.0406 9.3808 115.1951 45.6201 0.0000 173.1646 18 Y 4.0335 8.0601 118.3364 59.3422 38.1704 176.3078 19 Q 3.2917 9.6453 123.5648 56.6973 27.6485 173.4636 20 G 3.8995 8.3901 102.3703 45.9905 0.0000 173.5996 21 I 4.3606 7.7230 121.2006 59.5348 38.5421 176.1320 22 S 5.6145 8.6746 122.1117 56.4885 65.9330 175.3517 23 L 4.2082 8.5702 121.2445 57.7242 41.3510 179.8768 24 L 4.1204 7.9519 118.6926 57.9561 41.7088 179.0911 25 E 3.9083 8.0077 118.1114 59.2868 29.2985 179.5846 26 W 4.1216 8.3647 118.7764 59.5804 29.1956 178.4374 27 A 4.0883 8.4439 121.0728 55.2252 17.9199 178.9834 28 C 2.0000 7.6042 116.5237 58.8859 44.6489 175.8787 29 V 3.4936 7.9984 120.0818 66.1664 31.1096 178.0734 30 L 4.0696 8.7044 119.0523 57.3532 41.3257 179.3834 31 F 3.0286 7.9083 120.6504 61.2624 39.1256 176.9284 32 H 4.1407 7.8684 113.8029 58.2890 28.5584 177.5983 33 T 4.3132 7.6745 117.5692 65.5963 68.4138 175.7966 34 S 4.4426 7.7750 111.2927 56.9389 64.5507 174.4874 35 G 3.2395 8.4344 107.5464 46.5083 0.0000 173.7169 36 Y 3.6963 7.5848 113.6754 58.5908 35.3582 168.7579 37 D 5.0162 8.2455 121.7639 53.1616 40.6401 177.1454 38 T 4.1358 8.6767 118.2448 63.5846 68.8867 175.6350 39 Q 4.6706 8.2215 120.2219 55.4560 29.3242 175.2039 40 A 4.1074 7.9830 121.9685 52.4264 19.4258 177.5146 41 V 4.5058 8.3224 121.7574 61.0368 34.4261 174.7820 42 V 4.3978 8.4449 127.8292 61.0627 34.4449 174.3845 43 N 4.5759 8.8537 125.1653 54.5547 39.2091 172.6291 44 D 4.4106 9.4515 121.4742 54.4025 41.4846 177.5366 45 N 4.7614 8.4973 121.2946 52.6926 41.0238 174.9690 46 G 4.1147 8.9475 111.8820 44.7439 0.0000 170.9767 47 S 5.2097 7.6632 112.0753 56.6571 66.0570 172.7428 48 T 5.0607 9.4332 116.7876 61.8814 72.4227 172.9474 49 E 5.2729 9.2013 125.1665 54.8550 32.6131 174.5105 50 Y 4.9434 9.2446 121.5364 57.3590 41.4738 177.7024 51 G 4.3622 9.0355 112.4106 44.4636 0.0000 173.0808 52 L 3.9435 8.8234 119.0167 57.4332 41.7439 179.0981 53 F 4.6297 8.4420 113.0399 57.2361 40.0032 175.1927 54 Q 3.6357 8.0512 119.2936 57.0976 26.5634 174.0850 55 I 4.1440 8.1154 119.0978 61.2556 39.0587 177.3431 56 S 5.2297 9.1767 122.2215 57.9956 63.5043 174.0509 57 D 5.1346 9.1372 125.3052 53.7507 39.4080 177.5191 58 R 2.5779 8.0078 121.2750 58.4009 30.2811 177.9525 59 F 4.5099 7.5662 113.4247 57.3453 41.9671 176.9432 60 W 4.3678 8.1765 120.1346 58.3861 29.5312 173.5455 61 C 5.4273 7.9536 110.9575 53.2711 46.1447 172.5640 62 K 4.6432 8.9958 122.0819 55.4894 33.1821 175.7921 63 S 5.2090 8.4283 122.5133 56.4737 65.5061 173.6782 64 S 4.2460 8.7439 113.0124 61.1120 62.2816 175.0682 65 E 4.0036 8.2386 118.5874 57.4087 29.7182 176.6386 66 F 4.5570 7.7339 117.7934 54.4278 39.2827 173.7149 67 P 4.2626 0.0000 0.0000 64.9958 31.4404 177.4201 68 E 4.4660 8.1127 113.1547 55.9347 29.9100 175.9783 69 S 4.4262 7.6495 114.2681 57.9337 62.8129 174.2935 70 E 3.9661 8.7333 126.1013 57.3100 30.1057 176.0952 71 N 4.2183 8.0321 117.5527 53.8411 37.9599 175.3159 72 I 3.7000 7.8146 119.6674 64.9501 37.6221 177.4152 73 C 4.4435 8.7982 115.6156 57.1211 40.5649 173.4087 74 G 3.9025 8.3581 108.3752 45.8049 0.0000 173.2804 75 I 4.5338 7.0559 115.3849 59.0628 41.8743 173.4285 76 S 4.7001 8.4251 120.1702 57.8829 63.1087 175.8743 77 C 4.0933 8.7636 124.9937 60.0544 38.4344 176.1914 78 D 4.0898 7.7660 119.7621 56.5788 40.1364 178.0529 79 K 4.2760 8.0866 117.8673 57.5706 32.3114 177.8457 80 L 4.7610 7.9949 119.5128 54.4341 41.6996 177.0424 81 L 5.2053 7.9120 117.4705 53.6000 42.4014 175.8240 82 D 5.0887 7.7940 119.4859 52.1938 41.7523 175.6600 83 D 4.6305 8.5845 118.8154 54.7683 41.1148 176.6661 84 E 4.3825 8.0663 120.4800 55.2323 28.5369 176.6066 85 L 4.4848 8.2017 123.3022 55.6954 41.9899 178.3869 86 D 4.3112 7.9936 120.3112 57.2485 40.8060 178.0706 87 D 4.3101 7.9822 119.3026 56.3694 39.5779 178.0783 88 D 4.3118 8.0590 119.8434 57.2222 40.8140 178.7604 89 I 3.0019 7.8264 120.0132 64.1652 37.0797 178.4064 90 A 3.7614 7.7343 121.5267 55.1139 18.1120 178.9117 91 C 4.1447 8.0289 116.9448 59.5515 41.0126 175.5526 92 A 3.7470 7.7112 122.7177 54.9715 17.6890 179.7374 93 K 3.7633 7.8386 117.0658 59.4737 32.0541 179.7215 94 K 3.9800 7.6597 118.3072 59.4214 31.8639 179.4971 95 I 2.8763 7.5117 120.0338 64.0751 36.7261 178.4144 96 L 4.1246 8.4283 120.0108 57.9170 41.2296 179.5160 97 A 4.1157 8.1762 119.9060 54.3722 18.3797 179.1427 98 I 4.1198 7.6822 117.2594 63.4795 38.0373 177.4698 99 K 4.3418 8.1686 118.6316 57.2143 33.1129 176.1986 100 G 4.0784 8.0606 103.3798 44.9708 0.0000 173.6972 101 I 3.9334 8.3689 117.5258 63.9499 37.7780 176.7721 102 D 4.7400 8.0879 117.4893 55.4615 40.8840 176.3960 103 Y 3.8400 7.9575 121.3388 59.8847 38.9429 175.9593 104 W 4.3283 8.4386 121.2626 55.1895 28.0876 176.9001 105 K 3.9906 8.4783 123.9261 59.1802 31.7601 178.5649 106 A 4.1413 8.1033 120.5844 54.5829 18.3390 178.5677 107 Y 4.0392 8.0892 118.6684 60.8086 38.5834 178.4291 108 K 3.6170 7.9955 118.8979 58.8376 32.5664 176.2109 109 P 4.3540 0.0000 0.0000 65.0377 31.5387 176.7273 110 M 4.4388 7.9056 116.5107 55.5039 33.1022 175.5933 111 C 4.9557 7.7453 115.8203 56.8030 41.3214 174.8490 112 S 4.0622 8.0088 114.8518 58.8482 62.9845 173.2549 113 E 4.5050 7.8238 116.8134 55.5094 32.4621 174.5241 114 K 3.8345 8.4555 115.6620 57.6538 29.4641 175.5877 115 L 4.6236 7.5144 118.6027 56.8602 43.1208 179.5667 116 E 4.0826 8.3704 119.6895 59.0600 29.6313 178.4118 117 Q 3.9647 7.9792 115.0837 57.8739 28.6303 176.6283 118 W 4.6440 8.1445 117.9713 56.5560 29.5632 176.5296 119 R 4.1381 7.7822 119.9484 55.7820 30.1028 175.3500 120 C 4.4390 8.6638 124.5592 56.6072 44.3562 173.1573 121 E 4.0531 8.9848 127.1324 59.4177 29.3091 177.8640 122 K 3.7642 8.0784 115.8367 56.3085 32.5373 175.0004 123 P 4.4121 0.0000 0.0000 63.2006 31.2321 175.9658 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 T 8.03 4.35 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 1.23 0.00 0.00 2 E 8.83 4.46 0.00 1.98 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 2.31 2.44 0.00 3 L 8.62 4.54 0.00 1.50 1.55 0.89 0.74 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 4 T 8.06 4.56 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 1.23 0.00 0.00 5 K 8.82 3.32 0.00 2.06 1.92 0.00 2.13 0.00 0.00 2.09 0.00 0.00 2.98 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.61 1.78 7.81 6 C 8.07 4.29 0.00 2.99 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 7 K 8.18 3.82 0.00 1.93 1.81 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.42 7.81 8 V 7.84 3.42 1.74 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 0.94 0.00 0.00 0.34 0.00 0.00 9 S 7.97 4.09 0.00 3.98 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 10 H 8.48 4.25 0.00 3.18 3.39 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.18 4.08 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 12 I 7.86 4.17 1.73 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.03 0.85 0.00 0.00 13 K 7.60 3.96 0.00 1.73 1.90 0.00 1.53 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.71 7.81 14 D 8.15 4.53 0.00 2.61 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 15 I 8.10 3.80 1.59 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.95 0.56 0.00 0.00 16 D 8.27 4.67 0.00 2.85 2.70 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 17 G 9.38 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 0.00 0.00 0.00 18 Y 8.06 4.03 0.00 3.30 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 19 Q 9.65 3.29 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.50 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 20 G 8.39 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 21 I 7.72 4.36 1.87 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 1.45 0.59 0.09 0.00 0.00 22 S 8.67 5.61 0.00 4.11 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 23 L 8.57 4.21 0.00 1.79 1.85 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.95 4.12 0.00 1.77 1.85 1.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.01 3.91 0.00 2.02 1.94 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 2.38 2.39 0.00 26 W 8.36 4.12 0.00 3.36 3.06 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 0.00 0.00 0.00 27 A 8.44 4.09 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.60 2.00 0.00 1.23 2.62 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 29 V 8.00 3.49 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 0.89 0.00 0.00 0.83 0.00 0.00 30 L 8.70 4.07 0.00 1.99 1.78 0.40 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 31 F 7.91 3.03 0.00 2.82 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 32 H 7.87 4.14 0.00 3.19 3.37 0.00 5.90 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.67 4.31 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 1.50 0.00 0.00 34 S 7.77 4.44 0.00 3.93 4.08 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 35 G 8.43 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 0.00 0.00 0.00 36 Y 7.58 3.70 0.00 3.30 2.95 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 37 D 8.25 5.02 0.00 2.66 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 38 T 8.68 4.14 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 1.24 0.00 0.00 39 Q 8.22 4.67 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.56 2.39 0.00 40 A 7.98 4.11 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 41 V 8.32 4.51 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 0.57 0.00 0.00 0.98 0.00 0.00 42 V 8.44 4.40 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 0.81 0.00 0.00 0.94 0.00 0.00 43 N 8.85 4.58 0.00 2.63 2.72 0.00 0.00 6.92 8.06 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 44 D 9.45 4.41 0.00 2.55 2.41 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 45 N 8.50 4.76 0.00 2.75 2.69 0.00 0.00 6.88 7.94 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 46 G 8.95 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 0.00 0.00 0.00 47 S 7.66 5.21 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 48 T 9.43 5.06 4.58 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 0.71 0.00 0.00 49 E 9.20 5.27 0.00 1.96 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 2.33 2.27 0.00 50 Y 9.24 4.94 0.00 2.98 2.91 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 51 G 9.04 4.36 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 0.00 52 L 8.82 3.94 0.00 1.60 1.73 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.44 4.63 0.00 3.24 3.53 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 0.00 54 Q 8.05 3.64 0.00 2.43 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.84 0.00 0.00 0.00 0.00 0.00 2.55 2.70 0.00 55 I 8.12 4.14 2.04 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 1.10 0.75 0.97 0.00 0.00 56 S 9.18 5.23 0.00 4.19 4.19 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 57 D 9.14 5.13 0.00 2.90 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 58 R 8.01 2.58 0.00 1.22 1.26 0.00 2.43 0.00 0.00 2.62 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 59 F 7.57 4.51 0.00 2.03 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 0.00 0.00 0.00 0.00 60 W 8.18 4.37 0.00 3.56 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 61 C 7.95 5.43 0.00 3.12 3.19 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 62 K 9.00 4.64 0.00 2.00 1.70 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.42 7.81 63 S 8.43 5.21 0.00 3.96 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 64 S 8.74 4.25 0.00 3.86 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 65 E 8.24 4.00 0.00 1.98 1.59 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 2.27 2.20 0.00 66 F 7.73 4.56 0.00 3.15 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 67 P 0.00 4.26 0.00 2.04 2.11 0.00 3.61 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 1.96 2.02 0.00 68 E 8.11 4.47 0.00 2.11 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 0.00 2.34 2.31 0.00 69 S 7.65 4.43 0.00 3.95 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 70 E 8.73 3.97 0.00 2.00 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 2.22 2.31 0.00 71 N 8.03 4.22 0.00 2.88 2.75 0.00 0.00 7.00 7.67 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 72 I 7.81 3.70 1.67 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.43 0.98 0.00 0.00 73 C 8.80 4.44 0.00 3.16 3.16 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 74 G 8.36 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 75 I 7.06 4.53 2.00 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 1.16 1.33 0.91 0.00 0.00 76 S 8.43 4.70 0.00 3.86 3.66 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 77 C 8.76 4.09 0.00 2.15 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 78 D 7.77 4.09 0.00 2.63 2.71 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 79 K 8.09 4.28 0.00 1.84 2.06 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.60 7.81 80 L 7.99 4.76 0.00 1.94 1.81 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.91 5.21 0.00 1.84 1.74 1.16 1.24 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 82 D 7.79 5.09 0.00 2.76 2.71 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 83 D 8.58 4.63 0.00 2.68 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 84 E 8.07 4.38 0.00 1.96 1.93 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 2.29 2.31 0.00 85 L 8.20 4.48 0.00 1.75 1.73 1.02 1.08 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 86 D 7.99 4.31 0.00 2.74 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 87 D 7.98 4.31 0.00 2.91 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 88 D 8.06 4.31 0.00 2.98 2.95 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 89 I 7.83 3.00 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.70 0.64 0.00 0.00 90 A 7.73 3.76 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 91 C 8.03 4.14 0.00 2.95 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 92 A 7.71 3.75 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.84 3.76 0.00 1.75 1.61 0.00 1.28 0.00 0.00 0.75 0.00 0.00 2.13 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.70 1.20 7.81 94 K 7.66 3.98 0.00 1.98 2.01 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.62 7.81 95 I 7.51 2.88 1.62 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.24 0.00 0.00 96 L 8.43 4.12 0.00 1.90 1.84 1.12 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.18 4.12 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 98 I 7.68 4.12 2.20 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.82 1.02 0.00 0.00 99 K 8.17 4.34 0.00 1.90 1.97 0.00 1.72 0.00 0.00 1.80 0.00 0.00 3.23 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.56 7.81 100 G 8.06 4.08 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 0.00 0.00 0.00 101 I 8.37 3.93 1.54 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.50 0.66 0.00 0.00 102 D 8.09 4.74 0.00 2.77 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 0.00 103 Y 7.96 3.84 0.00 2.56 2.22 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 0.00 104 W 8.44 4.33 0.00 3.73 3.14 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 0.00 105 K 8.48 3.99 0.00 1.69 1.87 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.35 7.81 106 A 8.10 4.14 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 0.00 107 Y 8.09 4.04 0.00 2.96 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 0.00 108 K 8.00 3.62 0.00 1.80 1.81 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.38 7.81 109 P 0.00 4.35 0.00 2.18 2.13 0.00 3.86 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.96 0.00 110 M 7.91 4.44 0.00 1.68 1.99 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 2.27 2.61 0.00 111 C 7.75 4.96 0.00 2.79 2.82 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 0.00 112 S 8.01 4.06 0.00 3.72 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 0.00 113 E 7.82 4.51 0.00 2.03 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 2.17 2.35 0.00 114 K 8.46 3.83 0.00 1.95 1.88 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.37 1.46 7.81 115 L 7.51 4.62 0.00 1.79 1.83 0.96 0.84 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 0.00 116 E 8.37 4.08 0.00 2.06 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 2.38 2.36 0.00 117 Q 7.98 3.96 0.00 1.84 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.20 1.23 0.00 118 W 8.14 4.64 0.00 3.49 3.35 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 0.00 119 R 7.78 4.14 0.00 1.84 1.97 0.00 3.53 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 120 C 8.66 4.44 0.00 2.99 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 0.00 121 E 8.98 4.05 0.00 1.99 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 2.29 2.26 0.00 122 K 8.08 3.76 0.00 1.74 1.80 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.44 7.81 123 P 0.00 4.41 0.00 2.03 2.01 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00