NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2454 8.2644 123.5813 52.0235 19.8468 175.5257 2 E 4.6089 8.3109 121.8363 52.5871 32.7309 173.2802 3 W 4.5504 8.8451 130.5205 57.2339 31.9730 175.9389 4 S 3.9898 8.1364 117.5894 59.0975 62.9492 175.1870 5 G 2.2980 5.6002 109.1994 44.5848 0.0000 173.9728 6 E 3.3980 6.3610 119.4053 54.3867 28.1064 174.6608 7 Y 4.7019 7.6082 123.9793 57.5769 39.5752 175.3969 8 I 4.5101 7.9021 127.6338 59.0988 39.8956 175.3629 9 S 3.8741 8.5631 120.4443 57.6022 62.7733 172.2204 10 P 4.2551 0.0000 0.0000 63.7951 31.5869 175.5828 11 Y 4.8583 6.9427 116.4240 56.3785 39.4483 176.7645 12 A 4.5016 8.5249 128.8590 50.6985 17.0701 175.9097 13 E 4.8345 7.6440 118.9300 54.9428 34.3354 174.4786 14 H 4.5731 9.3524 120.0723 57.5205 35.7531 175.3320 15 G 4.2570 6.9048 110.0649 47.0518 0.0000 172.7390 16 K 4.4031 7.9622 116.0453 55.8757 35.6515 177.4440 17 K 4.2729 7.8884 120.3164 57.4649 34.4540 176.9795 18 S 4.6208 7.5117 112.2737 57.0190 64.3166 174.0195 19 E 4.6546 8.0220 122.4629 54.5127 28.8271 177.3455 20 Q 4.3118 7.9145 116.7342 55.9395 28.5979 177.1749 21 V 4.4305 7.5444 116.5648 61.8762 34.5187 174.4825 22 K 4.6533 8.4510 124.4265 54.5630 34.7525 175.4691 23 K 4.6986 8.2966 118.9947 54.6585 34.8936 175.9462 24 I 4.7154 8.0080 114.4677 59.4366 40.7581 174.2968 25 T 4.6383 8.3180 117.4760 61.8581 70.7629 174.3312 26 V 4.4532 8.0856 117.8631 59.5801 35.3404 175.1626 27 S 4.5970 8.5628 118.8730 57.1703 63.5471 173.8096 28 I 4.4547 8.0668 126.4572 58.4013 39.1833 174.5537 29 P 4.3847 0.0000 0.0000 62.3572 33.1330 177.1093 30 L 3.9756 8.6580 121.4359 58.2523 41.4325 179.9625 31 K 3.9408 8.0328 118.7488 59.3917 32.1704 178.8327 32 V 3.6216 7.6714 118.0834 65.5088 31.5628 177.5430 33 L 3.9527 7.9748 120.2348 57.8644 41.8521 178.6772 34 K 3.8475 8.1654 119.5839 59.7976 32.1395 178.6174 35 I 3.6852 7.2843 119.3543 64.2916 37.0350 178.1790 36 L 3.9675 7.8787 121.0029 58.6114 41.8921 179.2309 37 T 3.9229 8.2883 116.0435 66.5319 68.3275 176.4262 38 D 4.3438 8.2781 120.9738 57.5094 41.0014 178.5838 39 E 3.9653 8.2678 119.7154 59.0631 29.6277 178.7895 40 R 3.8868 8.1277 118.8620 59.7772 30.1983 178.6768 41 T 3.8829 8.2341 115.9175 66.5616 68.5359 176.5623 42 R 3.9233 8.0417 120.6530 59.4403 29.9690 178.8796 43 R 3.8730 7.9199 117.5189 59.2293 30.2375 178.6095 44 Q 4.0236 8.0274 119.2184 59.5320 28.8654 179.0842 45 V 3.6562 8.0713 111.9881 64.1469 31.7081 176.8275 46 N 4.6744 8.0204 114.7746 52.4476 38.4333 174.5257 47 N 4.1613 7.5787 114.2885 54.2962 36.6563 174.3134 48 L 4.5218 8.2853 116.9398 53.3362 43.4909 177.2718 49 R 4.0516 8.3705 120.4620 56.5162 30.9055 175.8325 50 H 4.5330 8.2593 112.1359 56.1914 26.4578 175.9625 51 A 4.5405 7.7238 119.4253 51.6226 18.5446 177.7331 52 T 4.7781 7.1304 112.5403 58.7752 73.9842 174.2684 53 N 4.3319 8.7246 119.4852 56.8052 38.6133 177.7877 54 S 4.1620 8.0316 115.7782 61.8140 63.1619 176.5608 55 E 4.2430 8.0309 120.9051 59.3204 29.1594 179.4134 56 L 4.0913 7.9743 118.8558 57.8727 41.6405 179.5682 57 L 4.0671 8.1620 118.9558 58.0358 41.6062 179.4450 58 C 4.2506 8.2790 116.7804 62.6903 28.1402 175.9357 59 E 3.8785 8.6570 120.4385 59.3855 29.0844 179.3120 60 A 4.0427 8.2899 120.9144 55.0007 18.4092 179.4672 61 F 4.1917 8.5731 119.4154 61.5927 39.5372 177.4707 62 L 3.9005 7.9645 118.4546 57.6770 41.4447 179.1190 63 H 4.4747 8.2256 118.9449 58.6143 29.6586 177.2447 64 A 3.5846 7.9932 121.4243 54.9380 18.3523 179.0744 65 F 4.2046 8.0819 113.8835 58.3538 39.3652 176.5589 66 T 4.4837 7.7725 105.9765 60.3369 69.8465 175.0383 67 G 3.8041 7.9077 110.3187 44.9977 0.0000 173.6116 68 Q 2.5200 7.0927 122.2316 54.6992 29.2660 174.0820 69 P 4.3766 0.0000 0.0000 62.7113 31.9958 175.9418 70 L 4.3829 7.8971 121.2535 52.8894 42.8596 175.0808 71 P 4.5181 0.0000 0.0000 62.6951 32.2884 175.8313 72 D 4.6505 9.0135 120.7852 53.5267 41.7623 176.9165 73 D 4.4264 8.6885 122.8307 57.4186 40.5407 179.0822 74 A 4.0384 9.1494 122.0994 55.2560 17.0591 179.4242 75 D 4.3655 8.1549 117.3684 57.1441 40.8000 178.0760 76 L 4.3280 7.5686 116.7057 55.5423 41.5051 178.5339 77 R 4.1202 7.9675 118.5195 58.3912 31.4027 177.6059 78 K 5.1864 7.4437 105.5762 54.5233 34.2310 177.8611 79 E 4.7818 8.9096 125.6817 55.9808 33.3178 176.2222 80 R 4.1018 8.6210 121.5316 58.6766 30.4297 177.8170 81 S 4.4289 8.0223 111.2644 59.9728 63.2159 173.6588 82 D 4.8249 8.3091 119.9277 52.3759 41.0006 174.4229 83 E 4.7172 8.3406 119.2647 55.6736 31.4542 177.6885 84 I 3.2161 7.4151 121.3456 60.1733 37.6329 174.5264 85 P 4.5266 0.0000 0.0000 63.1319 33.0274 177.3995 86 E 3.9206 9.0414 120.4948 59.4572 29.4124 179.7405 87 A 3.9667 7.9964 120.2250 54.9649 18.4171 179.3931 88 A 4.0655 7.8838 118.8158 55.4099 18.5418 179.8721 89 K 3.9014 8.2844 117.2527 59.4696 32.0543 179.2777 90 E 3.9291 8.3794 119.8478 59.3309 29.6067 178.9608 91 I 3.7723 7.8758 119.9104 64.4677 37.0656 178.2767 92 M 3.7071 8.2321 119.5968 58.4533 31.9170 178.8945 93 R 3.9686 8.0392 118.0836 59.5260 30.0591 179.0522 94 E 4.0495 8.0605 116.7930 58.8153 29.4716 178.2336 95 M 4.3705 7.4872 116.0956 54.4708 32.3684 176.6027 96 G 3.8285 7.6942 107.0611 45.8402 0.0000 173.1740 97 I 4.2837 7.6444 120.3716 58.9903 38.7801 174.8256 98 N 4.7072 8.6155 124.0864 51.6639 39.2965 173.6806 99 P 4.4149 0.0000 0.0000 65.7219 31.7351 178.6222 100 E 4.0726 8.3651 116.8736 58.6925 29.4674 177.5113 101 T 4.5378 7.6710 105.6469 60.6990 69.5908 173.7694 102 W 4.4131 7.9749 133.3108 57.2175 31.2671 174.8944 103 E 4.4167 7.8440 125.5024 54.6524 30.4276 175.4982 104 Y 4.4437 7.8581 121.1043 57.1035 38.2842 175.2444 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 A 8.26 4.25 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 2 E 8.31 4.61 0.00 2.00 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 2.21 2.37 0.00 3 W 8.85 4.55 0.00 3.12 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 4 S 8.14 3.99 0.00 3.80 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 5 G 5.60 2.30 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 6 E 6.36 3.40 0.00 1.96 2.18 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 2.20 1.94 0.00 7 Y 7.61 4.70 0.00 3.07 2.88 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 8 I 7.90 4.51 1.78 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.06 0.90 0.00 0.00 9 S 8.56 3.87 0.00 4.20 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 10 P 0.00 4.26 0.00 1.31 1.77 0.00 2.57 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.67 0.00 11 Y 6.94 4.86 0.00 3.11 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 12 A 8.52 4.50 1.32 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 0.00 0.00 13 E 7.64 4.83 0.00 2.04 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 2.36 2.35 0.00 14 H 9.35 4.57 0.00 3.11 3.19 0.00 5.71 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 6.90 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 0.00 0.00 0.00 0.00 16 K 7.96 4.40 0.00 1.94 1.71 0.00 1.65 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.47 7.81 17 K 7.89 4.27 0.00 1.72 1.86 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.40 7.81 18 S 7.51 4.62 0.00 3.82 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 19 E 8.02 4.65 0.00 1.93 1.83 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 2.17 2.21 0.00 20 Q 7.91 4.31 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 21 V 7.54 4.43 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 0.88 0.00 0.00 0.96 0.00 0.00 22 K 8.45 4.65 0.00 1.73 1.68 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.35 7.81 23 K 8.30 4.70 0.00 1.68 1.66 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.37 7.81 24 I 8.01 4.72 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 0.86 0.00 0.00 25 T 8.32 4.64 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 26 V 8.09 4.45 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 0.71 0.00 0.00 0.92 0.00 0.00 27 S 8.56 4.60 0.00 3.85 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 28 I 8.07 4.45 1.88 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 1.43 0.61 0.94 0.00 0.00 29 P 0.00 4.38 0.00 2.16 1.98 0.00 3.63 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 30 L 8.66 3.98 0.00 1.73 1.75 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 31 K 8.03 3.94 0.00 1.82 1.81 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.50 7.81 32 V 7.67 3.62 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 33 L 7.97 3.95 0.00 1.82 1.86 0.93 0.49 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 34 K 8.17 3.85 0.00 1.91 1.99 0.00 1.59 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.55 7.81 35 I 7.28 3.69 2.02 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 1.41 0.94 0.92 0.00 0.00 36 L 7.88 3.97 0.00 1.79 1.84 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.29 3.92 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 1.22 0.00 0.00 38 D 8.28 4.34 0.00 2.88 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 39 E 8.27 3.97 0.00 2.10 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 2.32 2.37 0.00 40 R 8.13 3.89 0.00 2.01 2.05 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 41 T 8.23 3.88 4.27 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 1.21 0.00 0.00 42 R 8.04 3.92 0.00 2.06 2.07 0.00 3.09 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 43 R 7.92 3.87 0.00 2.07 1.95 0.00 3.34 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 44 Q 8.03 4.02 0.00 2.42 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 45 V 8.07 3.66 2.08 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 0.72 0.00 0.00 1.02 0.00 0.00 46 N 8.02 4.67 0.00 2.88 2.83 0.00 0.00 7.07 7.48 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 47 N 7.58 4.16 0.00 2.86 2.87 0.00 0.00 6.85 7.62 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 48 L 8.29 4.52 0.00 1.57 1.57 0.96 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.37 4.05 0.00 1.73 1.39 0.00 3.23 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 50 H 8.26 4.53 0.00 3.14 3.04 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.72 4.54 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 0.00 0.00 52 T 7.13 4.78 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 1.21 0.00 0.00 53 N 8.72 4.33 0.00 2.77 2.94 0.00 0.00 6.87 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 54 S 8.03 4.16 0.00 3.91 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 55 E 8.03 4.24 0.00 2.12 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.44 0.00 56 L 7.97 4.09 0.00 1.94 1.76 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.16 4.07 0.00 1.92 1.76 0.94 0.86 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 58 C 8.28 4.25 0.00 3.09 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 59 E 8.66 3.88 0.00 2.17 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 0.00 2.36 2.57 0.00 60 A 8.29 4.04 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 61 F 8.57 4.19 0.00 3.24 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 62 L 7.96 3.90 0.00 1.67 1.55 0.77 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.23 4.47 0.00 3.24 3.41 0.00 5.83 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 64 A 7.99 3.58 0.96 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 65 F 8.08 4.20 0.00 1.98 2.81 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 66 T 7.77 4.48 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 1.22 0.00 0.00 67 G 7.91 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 0.00 0.00 0.00 68 Q 7.09 2.52 0.00 1.28 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.89 0.00 0.00 0.00 0.00 0.00 1.87 1.24 0.00 69 P 0.00 4.38 0.00 1.89 1.85 0.00 2.50 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.94 0.00 70 L 7.90 4.38 0.00 1.49 1.51 0.72 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.52 0.00 2.23 2.13 0.00 3.76 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 2.03 2.22 0.00 72 D 9.01 4.65 0.00 2.76 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.69 4.43 0.00 2.80 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 74 A 9.15 4.04 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 75 D 8.15 4.37 0.00 3.02 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 76 L 7.57 4.33 0.00 1.88 1.69 0.94 0.98 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 77 R 7.97 4.12 0.00 1.84 1.96 0.00 3.18 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 78 K 7.44 5.19 0.00 1.95 1.20 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.29 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.71 7.81 79 E 8.91 4.78 0.00 2.13 1.87 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 2.25 2.45 0.00 80 R 8.62 4.10 0.00 1.86 2.10 0.00 3.32 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 81 S 8.02 4.43 0.00 3.87 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 82 D 8.31 4.82 0.00 2.77 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.34 4.72 0.00 2.52 2.24 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 2.46 2.27 0.00 84 I 7.42 3.22 1.54 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.47 0.00 0.00 85 P 0.00 4.53 0.00 2.08 2.05 0.00 3.47 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 86 E 9.04 3.92 0.00 2.01 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 2.48 2.47 0.00 87 A 8.00 3.97 1.30 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 88 A 7.88 4.07 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 89 K 8.28 3.90 0.00 1.95 1.86 0.00 1.83 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.50 7.81 90 E 8.38 3.93 0.00 2.08 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 0.00 2.31 2.49 0.00 91 I 7.88 3.77 2.21 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 1.60 1.02 1.03 0.00 0.00 92 M 8.23 3.71 0.00 1.91 2.14 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.35 0.00 93 R 8.04 3.97 0.00 2.01 1.97 0.00 3.12 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 94 E 8.06 4.05 0.00 2.11 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 0.00 2.33 2.65 0.00 95 M 7.49 4.37 0.00 1.81 1.85 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.70 0.00 96 G 7.69 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 0.00 0.00 0.00 97 I 7.64 4.28 1.63 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 1.07 0.54 0.52 0.00 0.00 98 N 8.62 4.71 0.00 2.79 2.77 0.00 0.00 7.21 7.71 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 99 P 0.00 4.41 0.00 2.24 2.07 0.00 3.67 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 2.11 2.22 0.00 100 E 8.37 4.07 0.00 2.01 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 0.00 2.35 2.28 0.00 101 T 7.67 4.54 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 1.26 0.00 0.00 102 W 7.97 4.41 0.00 3.60 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 0.00 103 E 7.84 4.42 0.00 1.64 1.64 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 2.09 2.25 0.00 104 Y 7.86 4.44 0.00 3.31 3.33 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