NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4676 8.2893 120.3224 54.6831 32.6988 174.6226 2 N 4.0014 8.8897 121.1041 54.5585 39.0773 178.1139 3 S 3.1270 8.7845 105.7297 56.9828 65.9901 176.7825 4 G 3.8682 9.2183 106.1615 47.4784 0.0000 174.7186 5 R 3.9611 8.1064 119.8242 59.2527 30.0470 178.9770 6 A 4.0230 7.5595 119.0355 55.2811 18.1305 179.2679 7 N 4.4087 7.7141 112.6568 55.6021 38.6979 176.5842 8 Q 4.2049 7.6065 117.3792 58.4482 29.2699 177.5175 9 R 4.0675 8.3351 116.0932 58.4590 29.9398 177.9251 10 S 3.2604 6.5484 108.0061 59.3289 63.8074 175.4953 11 K 4.4458 7.5991 121.7813 54.0189 33.9953 174.8674 12 P 4.3972 0.0000 0.0000 62.7982 31.9184 175.5318 13 M 4.2776 8.3756 120.2634 54.9284 32.6657 175.6984 14 T 4.5204 8.2561 122.4005 61.5306 71.9044 174.1237 15 G 3.3636 9.0847 115.8341 46.1141 0.0000 174.5047 16 L 3.4027 7.0934 120.0537 55.3232 39.7069 174.0637 17 I 5.2947 8.2394 127.1635 58.6965 39.0617 175.9615 18 N 4.7844 8.3310 122.6685 51.0887 39.3620 175.2116 19 D 4.4317 8.7798 117.4279 57.9114 40.7006 178.5659 20 K 4.2768 8.0816 115.3828 56.9713 31.7157 176.8110 21 K 4.0043 7.9605 116.2722 57.3055 30.4719 174.5237 22 E 4.5657 7.7871 117.9712 54.8778 31.0423 176.0743 23 K 4.5928 8.3164 121.4054 56.0233 33.3121 176.7749 24 I 4.2586 7.8297 120.9286 62.5024 39.8140 175.0457 25 D 4.2934 8.5252 120.4774 55.4028 40.5029 178.2023 26 A 3.9692 7.8093 128.2367 55.1240 19.4011 176.7301 27 Y 4.6034 7.6060 110.2697 56.3592 40.7461 174.0513 28 L 4.1564 8.3743 122.6286 52.2447 41.8551 174.9778 29 P 4.3990 0.0000 0.0000 62.6487 31.9737 176.4580 30 R 4.2309 8.4553 118.7533 56.2067 31.4608 175.1966 31 K 5.0328 8.3428 123.0402 54.3031 34.9994 175.1593 32 C 4.3043 9.0098 128.3779 59.9754 31.8605 174.2937 33 D 4.4080 8.9738 127.0770 56.5696 40.7974 176.9491 34 W 5.1684 9.1623 129.7679 53.3090 29.4908 174.6466 35 S 5.4220 9.7507 125.7225 57.9699 60.1565 176.4885 36 N 4.2047 7.9448 117.1406 54.1981 36.6149 171.4944 37 K 4.7092 7.4476 120.2762 54.6621 36.8245 174.7442 38 L 4.8392 8.3211 121.8890 53.3176 43.1553 176.7229 39 I 4.2400 8.4021 125.0910 60.4560 37.6333 175.9825 40 F 3.8997 9.2002 126.1303 57.8503 39.0953 175.1677 41 S 4.7803 8.6537 115.0870 59.4441 63.5342 175.2590 42 N 4.9409 7.9856 117.3804 52.2290 37.1872 174.5643 43 D 4.3575 8.4078 119.7651 54.9587 40.0838 175.6624 44 Q 4.1145 8.5573 125.0835 59.1272 28.8770 178.4569 45 S 4.4795 7.9400 108.7809 58.5495 63.1461 173.2944 46 S 4.9948 7.6390 116.5789 57.2980 64.3735 173.9122 47 V 4.5680 8.4177 121.5446 59.8731 35.1231 174.2487 48 Q 5.0147 8.6091 123.0521 54.5525 30.5927 174.9320 49 I 4.2633 8.7774 128.2572 60.8012 38.9905 175.1004 50 A 5.0549 8.4596 126.4525 49.4535 20.9668 175.4643 51 I 4.6170 8.8889 123.3621 59.7604 40.4966 175.0291 52 A 5.0161 8.4902 126.6289 50.6462 21.0348 175.9899 53 E 4.3537 9.1915 122.0634 55.2398 31.0846 175.7526 54 V 4.6879 8.4615 126.0263 61.2745 33.9570 175.6933 55 G 3.8589 8.1003 113.7498 45.3027 0.0000 172.6811 56 E 3.7644 8.4618 120.3835 57.3220 27.5865 176.3231 57 N 4.8491 8.1927 114.4999 53.6703 41.1745 175.9095 58 G 3.9487 8.4502 107.5270 45.4819 0.0000 174.2670 59 Q 4.2821 7.6556 118.2294 55.1219 29.9664 174.2591 60 A 4.9304 8.2004 121.8036 50.8470 21.1137 176.4509 61 T 4.5925 8.3382 118.2361 61.4997 71.2115 176.3800 62 G 4.0167 8.3742 114.5445 45.0806 0.0000 173.8658 63 S 4.6727 7.4551 114.1446 57.3293 67.8934 175.3953 64 K 5.0911 8.7712 123.0760 54.8454 35.8120 175.4304 65 T 4.7014 9.3586 119.1985 61.9713 71.6884 173.0631 66 N 5.5027 8.7187 122.2192 51.6526 42.0854 173.9107 67 V 4.4295 8.4056 120.9126 61.3075 35.0201 174.2098 68 V 4.4113 9.6286 128.9505 61.7052 33.3632 174.5053 69 L 4.8227 8.7720 127.8631 52.7094 44.5346 176.0670 70 C 4.2512 8.9916 119.3720 58.4395 29.9286 174.9897 71 G 3.6249 8.8824 104.8199 47.5741 0.0000 175.5158 72 S 4.0350 7.9455 116.6358 61.1576 62.9037 176.6501 73 V 3.4055 7.7372 121.8602 65.3985 30.8750 177.7370 74 R 3.9614 7.6521 117.4547 59.0210 29.7172 177.9540 75 S 4.3179 8.3136 113.2413 60.2120 62.1033 174.9768 76 K 4.4543 7.8473 119.4418 55.1535 32.6033 176.5336 77 G 3.9119 7.5208 105.7683 46.8688 0.0000 174.9414 78 E 4.1107 8.8009 120.0833 58.9077 30.3676 179.8302 79 A 3.6704 6.9250 119.8893 54.7194 20.0846 178.5636 80 H 4.2920 8.3327 109.5462 58.2273 28.9683 176.9720 81 I 3.7563 8.5517 119.9580 62.3745 38.8067 177.3954 82 A 4.4952 7.8481 122.0357 55.1453 18.3579 179.0598 83 L 3.8623 9.1317 119.1573 58.3794 41.1797 178.7637 84 E 3.6933 7.7255 117.9469 58.5875 29.2384 177.8092 85 N 4.6523 7.3870 114.3757 54.9398 39.6429 176.9813 86 I 3.6682 7.5702 120.7284 63.4717 37.1501 177.8690 87 L 4.2699 7.9325 119.8007 56.6222 41.6514 179.3946 88 R 3.9101 7.2616 115.6129 59.2767 29.8855 178.2530 89 E 3.9465 7.9247 117.0093 59.4396 29.7263 179.6745 90 R 4.2302 7.9721 115.7169 58.2180 30.4802 178.0996 91 G 3.9582 7.9277 101.0023 46.4450 0.0000 172.1763 92 L 4.5836 9.1765 123.8357 56.3236 49.8100 176.1950 93 Y 4.2302 8.2948 118.8548 60.0632 38.6191 174.7530 94 P 3.8658 0.0000 0.0000 62.6119 31.2740 176.2335 95 I 4.1465 7.6991 125.6042 59.4148 36.8753 175.2214 96 Q 4.1141 8.7234 124.7533 55.8362 29.4595 176.3408 97 E 4.0342 8.0664 121.9822 55.5331 29.9043 176.5266 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 8.29 4.47 0.00 2.02 2.11 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 2.48 0.00 2 N 8.89 4.00 0.00 3.00 3.06 0.00 0.00 5.93 6.76 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 3 S 8.78 3.13 0.00 4.06 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 4 G 9.22 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 0.00 0.00 0.00 5 R 8.11 3.96 0.00 2.03 1.95 0.00 2.95 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 6 A 7.56 4.02 1.33 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 7 N 7.71 4.41 0.00 2.85 2.89 0.00 0.00 7.06 7.57 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 8 Q 7.61 4.20 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.00 0.00 0.00 0.00 0.00 0.00 2.60 2.34 0.00 9 R 8.34 4.07 0.00 1.82 2.03 0.00 3.23 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 10 S 6.55 3.26 0.00 3.79 3.83 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 11 K 7.60 4.45 0.00 1.81 1.74 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.36 7.81 12 P 0.00 4.40 0.00 2.17 2.04 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 13 M 8.38 4.28 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 14 T 8.26 4.52 4.23 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 1.20 0.00 0.00 15 G 9.08 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 0.00 0.00 0.00 16 L 7.09 3.40 0.00 1.99 1.82 0.90 0.95 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 17 I 8.24 5.29 1.86 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 1.09 0.46 0.88 0.00 0.00 18 N 8.33 4.78 0.00 2.86 2.96 0.00 0.00 6.24 8.07 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 19 D 8.78 4.43 0.00 2.68 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 20 K 8.08 4.28 0.00 1.86 1.81 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.40 7.81 21 K 7.96 4.00 0.00 1.77 1.90 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.53 7.81 22 E 7.79 4.57 0.00 2.20 1.85 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 2.26 2.46 0.00 23 K 8.32 4.59 0.00 1.74 1.72 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 24 I 7.83 4.26 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 1.30 0.88 0.91 0.00 0.00 25 D 8.53 4.29 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 26 A 7.81 3.97 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 Y 7.61 4.60 0.00 3.10 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 28 L 8.37 4.16 0.00 1.61 1.59 0.91 0.95 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 29 P 0.00 4.40 0.00 2.08 1.76 0.00 3.45 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.73 0.00 30 R 8.46 4.23 0.00 1.85 1.93 0.00 3.10 0.00 0.00 3.31 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 31 K 8.34 5.03 0.00 1.73 1.67 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.41 7.81 32 C 9.01 4.30 0.00 3.07 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 33 D 8.97 4.41 0.00 2.82 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 34 W 9.16 5.17 0.00 3.16 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 35 S 9.75 5.42 0.00 3.95 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 36 N 7.94 4.20 0.00 2.97 2.99 0.00 0.00 7.00 6.25 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 37 K 7.45 4.71 0.00 1.84 1.64 0.00 1.77 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.47 7.81 38 L 8.32 4.84 0.00 1.55 1.54 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.40 4.24 2.10 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 1.29 0.43 1.01 0.00 0.00 40 F 9.20 3.90 0.00 3.03 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.65 4.78 0.00 3.89 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 42 N 7.99 4.94 0.00 2.80 2.89 0.00 0.00 6.02 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 43 D 8.41 4.36 0.00 2.92 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 44 Q 8.56 4.11 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.19 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 45 S 7.94 4.48 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 46 S 7.64 4.99 0.00 3.88 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 0.00 47 V 8.42 4.57 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 0.77 0.00 0.00 0.95 0.00 0.00 48 Q 8.61 5.01 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 49 I 8.78 4.26 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.47 0.94 0.00 0.00 50 A 8.46 5.05 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 51 I 8.89 4.62 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.03 0.94 0.00 0.00 52 A 8.49 5.02 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 53 E 9.19 4.35 0.00 2.00 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 0.00 2.26 2.25 0.00 54 V 8.46 4.69 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 0.90 0.00 0.00 0.93 0.00 0.00 55 G 8.10 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 0.00 0.00 0.00 56 E 8.46 3.76 0.00 2.04 2.17 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 2.24 2.26 0.00 57 N 8.19 4.85 0.00 3.00 2.74 0.00 0.00 6.99 7.72 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 58 G 8.45 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 0.00 0.00 0.00 59 Q 7.66 4.28 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 60 A 8.20 4.93 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 61 T 8.34 4.59 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 1.22 0.00 0.00 62 G 8.37 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 63 S 7.46 4.67 0.00 3.95 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 64 K 8.77 5.09 0.00 1.60 1.81 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.43 7.81 65 T 9.36 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 1.22 0.00 0.00 66 N 8.72 5.50 0.00 2.64 2.72 0.00 0.00 6.51 7.68 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 67 V 8.41 4.43 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 1.06 0.00 0.00 0.96 0.00 0.00 68 V 9.63 4.41 2.34 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 0.94 0.00 0.00 0.97 0.00 0.00 69 L 8.77 4.82 0.00 1.63 1.57 0.97 0.66 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 70 C 8.99 4.25 0.00 2.98 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 71 G 8.88 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 72 S 7.95 4.04 0.00 3.98 4.09 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 0.00 0.00 0.00 73 V 7.74 3.41 1.97 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 0.84 0.00 0.00 0.62 0.00 0.00 74 R 7.65 3.96 0.00 2.05 2.06 0.00 3.32 0.00 0.00 3.29 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 75 S 8.31 4.32 0.00 3.87 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 76 K 7.85 4.45 0.00 1.71 1.76 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.36 1.66 7.81 77 G 7.52 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 78 E 8.80 4.11 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 2.01 2.27 0.00 79 A 6.93 3.67 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 80 H 8.33 4.29 0.00 3.32 3.58 0.00 5.45 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.55 3.76 1.49 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 1.21 1.28 0.93 0.00 0.00 82 A 7.85 4.50 1.60 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 83 L 9.13 3.86 0.00 1.86 1.78 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 84 E 7.73 3.69 0.00 1.76 1.75 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 1.75 1.47 0.00 85 N 7.39 4.65 0.00 3.01 2.53 0.00 0.00 6.84 7.16 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 86 I 7.57 3.67 1.87 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 1.44 0.85 0.90 0.00 0.00 87 L 7.93 4.27 0.00 1.82 1.90 1.04 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 88 R 7.26 3.91 0.00 1.89 1.96 0.00 3.37 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.76 0.00 89 E 7.92 3.95 0.00 2.04 1.98 0.00 0.00 0.00 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 2.48 0.00 90 R 7.97 4.23 0.00 1.82 1.94 0.00 3.28 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 91 G 7.93 3.96 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 0.00 0.00 0.00 92 L 9.18 4.58 0.00 1.70 1.69 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.29 4.23 0.00 2.89 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 94 P 0.00 3.87 0.00 2.05 1.97 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.23 0.00 95 I 7.70 4.15 1.72 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 1.32 0.59 0.85 0.00 0.00 96 Q 8.72 4.11 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 97 E 8.07 4.03 0.00 1.90 1.75 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 2.27 2.41 0.00