NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.7160 8.1648 122.9863 51.8671 20.8373 177.1515 3 R 4.6585 7.7655 113.2520 54.8543 32.9650 173.2941 4 R 4.7106 9.4535 123.2167 56.4140 31.3434 174.9821 5 I 4.8249 8.6512 129.0192 59.4426 39.4742 174.8764 6 L 4.6643 8.9325 131.0803 54.3734 43.4757 175.5082 7 V 4.3240 9.3681 128.6369 61.5547 33.2558 174.8356 8 V 4.6666 8.5939 130.6023 61.4829 32.0701 173.6546 9 E 4.8638 8.5611 127.8911 54.7801 32.0720 174.7324 10 D 4.3614 8.9155 127.0899 55.7920 40.2864 176.6034 11 E 4.0378 8.4245 121.0631 55.4104 30.1529 176.4468 12 A 3.9911 8.7662 129.3945 55.1110 18.3680 177.1112 13 P 4.2663 0.0000 0.0000 66.0967 31.1683 178.5561 14 I 3.7565 7.6930 118.9211 64.2643 37.2132 178.0418 15 R 3.8454 8.3587 119.8744 59.6994 29.7131 178.3806 16 E 4.0642 8.7296 118.6679 59.4699 29.4707 179.0052 17 M 4.1994 8.4250 119.2383 58.5386 32.1136 179.0058 18 V 3.2104 8.0383 118.3182 66.1603 31.6930 177.9331 19 C 4.1922 8.1745 116.5317 62.5273 27.8443 175.8607 20 F 4.1191 8.7491 122.7636 61.4021 38.9302 177.2607 21 V 3.6669 8.1651 117.8588 66.0112 31.2597 177.9903 22 L 4.0710 8.0497 118.4936 57.9184 41.5654 179.2308 23 E 4.2476 8.5691 120.0470 59.1765 29.2483 179.6310 24 Q 3.9344 8.0108 116.7276 58.2902 28.6394 177.5998 25 N 4.8519 7.6176 115.8312 52.7267 38.7882 175.7502 26 G 3.7416 7.9596 108.0545 45.5571 0.0000 173.7260 27 F 4.6961 8.2652 118.4729 56.2301 41.8626 175.1892 28 Q 4.7909 9.1736 120.7301 53.3257 29.3282 173.4286 29 P 4.9029 0.0000 0.0000 62.6402 32.7229 176.0930 30 V 4.4636 8.9768 121.2599 61.4038 34.7154 174.1170 31 E 5.0298 8.8852 126.4225 55.2302 31.8221 175.2258 32 A 4.7145 8.7052 122.9757 50.9028 22.6512 176.7672 33 E 4.6350 8.8638 119.5687 56.5047 31.1062 175.5004 34 D 4.5542 8.0073 118.4196 51.2223 43.5417 175.2182 35 Y 3.9039 8.5117 119.8308 61.4178 38.5851 178.0963 36 D 4.6729 8.3391 119.2159 57.3878 40.7962 178.8114 37 S 4.2212 8.8022 114.3027 60.9603 63.3120 176.2533 38 A 4.1026 8.1907 124.6650 55.2107 18.3013 179.6656 39 V 3.6342 8.1153 116.8158 66.3028 31.3102 177.5284 40 N 4.5820 8.0351 114.3689 54.9397 38.5023 176.1430 41 Q 4.4717 8.0693 118.6370 55.3449 30.5456 176.6286 42 L 4.4598 7.3699 121.4918 52.5495 39.9462 175.2864 43 N 3.1400 6.9101 117.6560 50.5682 39.7638 175.0748 44 E 3.4379 7.2419 117.6862 55.3259 30.0340 174.9094 45 P 4.3748 0.0000 0.0000 61.8930 32.3772 176.0440 46 W 4.4954 8.5697 122.0353 55.5378 29.8692 174.5394 47 P 4.5407 0.0000 0.0000 63.2349 31.3747 176.2676 48 D 4.7378 9.2819 121.3765 55.7826 42.1903 175.9201 49 L 4.6616 7.4959 118.0821 54.1011 45.6765 173.1058 50 I 4.8889 8.4072 125.8496 59.5245 40.3265 174.4286 51 L 4.7629 9.1191 127.7836 53.2314 43.1098 175.2755 52 L 4.6277 8.7292 128.0419 52.9455 44.2063 174.8873 53 D 5.1631 8.5533 127.6515 53.6404 41.5394 176.7153 54 W 4.4138 9.0242 135.0000 60.7336 30.8332 176.1766 55 M 4.2840 8.0989 115.6412 54.6379 31.6055 175.8819 56 L 3.9873 7.5384 119.7503 55.3858 41.0775 175.5164 57 P 4.3096 0.0000 0.0000 63.4136 31.9446 177.3940 58 G 3.9402 8.9184 108.8121 44.5737 0.0000 173.6706 59 G 3.4140 6.7991 104.8463 44.9585 0.0000 171.6891 60 S 4.6470 7.6711 113.1038 56.5879 64.5638 175.9096 61 G 3.7363 8.2177 115.2346 47.4432 0.0000 176.0374 62 I 3.9542 7.6894 122.4232 64.7872 37.1929 178.4495 63 Q 4.1024 8.2354 118.4154 58.6853 28.3417 178.3240 64 F 4.0218 8.2151 122.4370 60.7346 39.7545 176.9952 65 I 3.9647 7.8439 119.0784 64.5578 36.5486 178.7280 66 K 4.0449 8.3860 119.3857 59.6345 31.7141 178.8229 67 H 4.2672 8.7137 118.6564 58.6234 29.5862 177.2809 68 L 3.9355 7.6597 121.1361 57.4208 41.2056 178.7209 69 K 4.2243 7.4257 114.4779 57.7270 31.9445 178.3836 70 R 4.2123 7.4806 118.5454 56.1292 30.9295 176.0118 71 E 4.7095 7.1674 118.0459 53.9122 32.8719 176.7135 72 S 3.9435 8.6429 116.3243 61.9750 62.3852 175.9782 73 M 3.7026 7.4879 115.7750 56.0644 31.8933 176.6354 74 T 4.4235 7.1395 107.8657 61.0944 70.5313 176.3253 75 R 3.8967 7.9711 118.2253 58.4474 29.4029 177.0633 76 D 4.7489 7.7634 115.9611 53.8345 41.2627 175.6483 77 I 4.1457 7.3901 121.5991 60.1361 37.5688 174.3664 78 P 4.6898 0.0000 0.0000 62.7790 32.8955 175.3206 79 V 4.8164 9.3588 122.1700 61.1467 34.7148 174.0605 80 V 4.5639 8.5555 128.0705 61.1636 33.8070 174.0839 81 M 4.7439 8.5369 128.8754 55.3313 33.6412 174.7879 82 L 5.0088 9.7568 127.6775 54.4730 43.2679 176.0429 83 T 5.3052 9.3530 119.7693 61.4653 73.4459 173.2179 84 A 4.5284 8.9684 125.8986 51.4715 19.7763 177.3013 85 R 3.9456 8.3046 122.4041 56.8978 30.8742 176.7546 86 G 3.9952 9.0427 111.3136 44.6601 0.0000 174.9044 87 E 3.7719 8.9157 121.8393 59.6389 29.1214 177.9995 88 E 3.8427 8.1874 118.1513 59.4513 29.6698 178.2221 89 E 3.9825 7.6659 117.7220 59.5885 29.4819 178.4552 90 D 4.2287 7.9883 117.9956 57.2471 41.1786 178.8167 91 R 3.8865 8.1738 119.4115 59.5533 30.2043 178.8703 92 V 3.0520 8.1963 119.0038 65.5907 31.0768 177.8943 93 R 3.3798 7.5225 118.0783 58.7479 29.9124 177.9936 94 G 3.7491 7.5484 103.1521 44.7576 0.0000 173.7251 95 L 4.3861 6.8404 120.9697 54.1070 42.7946 177.1907 96 E 4.4282 8.3675 122.5509 55.2214 27.8914 175.0364 97 T 4.3303 8.0969 112.0909 60.8747 70.3453 177.2020 98 G 3.9077 8.4254 108.4116 45.0312 0.0000 173.3371 99 A 4.0672 7.5000 122.3057 52.2845 18.7945 177.8923 100 D 4.4659 8.6600 122.1051 57.0718 41.9267 175.4611 101 D 4.2179 7.0268 115.9962 53.9772 44.7324 173.4858 102 Y 5.4106 8.4280 115.8280 56.4679 42.3210 175.2685 103 I 4.8507 8.7651 121.7954 59.9698 41.2905 174.5715 104 T 5.1139 8.6402 116.2590 60.6086 71.3864 173.5989 105 K 5.0401 9.2178 123.5744 53.6746 35.3965 174.1720 106 P 4.6214 0.0000 0.0000 62.7663 31.6936 176.4208 107 F 4.6493 8.8300 117.0452 55.9071 38.9955 174.9520 108 S 4.4843 8.4788 116.1669 56.2713 63.9651 172.9216 109 P 4.4733 0.0000 0.0000 65.8064 31.1585 178.4855 110 K 3.9986 8.0105 117.7962 59.5533 32.2035 178.3784 111 E 3.9874 8.3925 119.6656 58.9213 29.6520 178.4494 112 L 3.9415 8.3197 120.7472 58.2775 42.1311 179.2787 113 V 3.6324 7.8162 117.4972 65.7116 31.5018 177.7220 114 A 4.0222 8.1676 120.5816 55.5177 18.2332 179.9481 115 R 4.0220 8.1815 116.5029 59.2919 30.0808 179.5019 116 I 3.6778 7.6659 119.3114 64.1331 37.0749 178.5439 117 K 4.0250 8.4158 119.3788 59.6217 32.0230 179.3162 118 A 4.0256 8.5193 121.3293 55.1563 18.3614 179.8900 119 V 3.5805 8.2358 117.2591 66.3327 31.3540 178.2846 120 M 4.1227 7.9610 117.7845 58.2969 31.8914 178.4228 121 R 4.0878 7.7927 117.4881 59.7233 30.3490 178.0146 122 R 3.9820 7.9948 117.6019 58.1145 29.8190 176.2443 123 I 3.8639 7.1191 124.5146 61.7644 37.0706 176.1164 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 2 A 8.16 4.72 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 3 R 7.77 4.66 0.00 1.84 1.98 0.00 3.06 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 4 R 9.45 4.71 0.00 1.97 2.03 0.00 3.10 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 5 I 8.65 4.82 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.45 0.76 0.00 0.00 6 L 8.93 4.66 0.00 1.78 1.56 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 7 V 9.37 4.32 2.03 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 0.78 0.00 0.00 0.90 0.00 0.00 8 V 8.59 4.67 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 0.66 0.00 0.00 0.75 0.00 0.00 9 E 8.56 4.86 0.00 1.94 1.71 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 2.27 2.29 0.00 10 D 8.92 4.36 0.00 2.81 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 11 E 8.42 4.04 0.00 2.15 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 2.32 2.38 0.00 12 A 8.77 3.99 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 13 P 0.00 4.27 0.00 2.29 2.33 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 14 I 7.69 3.76 2.04 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.58 1.02 0.00 0.00 15 R 8.36 3.85 0.00 2.00 2.09 0.00 3.07 0.00 0.00 3.47 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 16 E 8.73 4.06 0.00 2.17 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 0.00 2.35 2.57 0.00 17 M 8.43 4.20 0.00 2.54 2.57 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.59 0.00 18 V 8.04 3.21 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 0.78 0.00 0.00 0.27 0.00 0.00 19 C 8.17 4.19 0.00 3.21 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 20 F 8.75 4.12 0.00 3.20 3.30 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 21 V 8.17 3.67 2.44 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 1.15 0.00 0.00 1.41 0.00 0.00 22 L 8.05 4.07 0.00 1.91 1.72 0.78 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.57 4.25 0.00 1.98 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 2.35 2.36 0.00 24 Q 8.01 3.93 0.00 1.75 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.19 0.00 0.00 0.00 0.00 0.00 1.52 1.36 0.00 25 N 7.62 4.85 0.00 3.10 3.02 0.00 0.00 7.12 7.81 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 26 G 7.96 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 27 F 8.27 4.70 0.00 3.02 2.90 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 28 Q 9.17 4.79 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.97 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 29 P 0.00 4.90 0.00 2.07 2.04 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.17 0.00 30 V 8.98 4.46 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 0.96 0.00 0.00 0.94 0.00 0.00 31 E 8.89 5.03 0.00 1.88 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 2.23 2.29 0.00 32 A 8.71 4.71 1.18 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 0.00 0.00 33 E 8.86 4.63 0.00 1.94 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 0.00 2.21 2.25 0.00 34 D 8.01 4.55 0.00 3.11 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 35 Y 8.51 3.90 0.00 3.24 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 36 D 8.34 4.67 0.00 2.81 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 37 S 8.80 4.22 0.00 3.99 4.03 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 38 A 8.19 4.10 1.29 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 0.00 0.00 0.00 39 V 8.12 3.63 2.33 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 1.05 0.00 0.00 0.99 0.00 0.00 40 N 8.04 4.58 0.00 2.96 2.86 0.00 0.00 6.99 7.82 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 41 Q 8.07 4.47 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 7.37 0.00 0.00 0.00 0.00 0.00 2.71 2.53 0.00 42 L 7.37 4.46 0.00 1.85 1.89 0.78 0.99 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 43 N 6.91 3.14 0.00 2.27 2.36 0.00 0.00 6.36 7.66 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 44 E 7.24 3.44 0.00 1.98 1.81 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 2.06 2.14 0.00 45 P 0.00 4.37 0.00 2.21 2.08 0.00 3.64 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 46 W 8.57 4.50 0.00 3.30 3.22 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 47 P 0.00 4.54 0.00 2.13 2.05 0.00 3.94 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 48 D 9.28 4.74 0.00 2.70 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 49 L 7.50 4.66 0.00 1.67 1.41 0.88 0.86 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 50 I 8.41 4.89 1.93 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.70 0.90 0.00 0.00 51 L 9.12 4.76 0.00 1.43 1.49 0.73 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.73 4.63 0.00 1.59 1.49 0.22 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.55 5.16 0.00 2.94 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 W 9.02 4.41 0.00 3.44 3.27 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 55 M 8.10 4.28 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.74 0.00 56 L 7.54 3.99 0.00 1.68 1.75 0.67 0.68 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 57 P 0.00 4.31 0.00 2.19 1.98 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 58 G 8.92 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 59 G 6.80 3.41 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 0.00 60 S 7.67 4.65 0.00 3.84 3.76 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 61 G 8.22 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 62 I 7.69 3.95 2.03 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.03 1.08 0.00 0.00 63 Q 8.24 4.10 0.00 2.29 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.89 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 64 F 8.22 4.02 0.00 2.87 3.20 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 0.00 0.00 0.00 65 I 7.84 3.96 2.24 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 1.71 1.14 1.01 0.00 0.00 66 K 8.39 4.04 0.00 1.82 1.90 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.78 1.66 7.81 67 H 8.71 4.27 0.00 3.35 3.17 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.66 3.94 0.00 1.85 1.78 0.95 0.43 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 69 K 7.43 4.22 0.00 1.73 1.82 0.00 1.68 0.00 0.00 1.67 0.00 0.00 3.20 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.73 1.61 7.81 70 R 7.48 4.21 0.00 1.67 1.88 0.00 2.74 0.00 0.00 3.11 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 71 E 7.17 4.71 0.00 1.79 1.69 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 2.16 2.34 0.00 72 S 8.64 3.94 0.00 3.76 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 73 M 7.49 3.70 0.00 0.51 0.74 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.13 0.00 74 T 7.14 4.42 4.15 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 0.00 0.00 1.17 0.00 0.00 75 R 7.97 3.90 0.00 1.89 2.04 0.00 2.97 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.53 0.00 76 D 7.76 4.75 0.00 2.60 2.66 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 I 7.39 4.15 1.98 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 1.38 0.40 1.00 0.00 0.00 78 P 0.00 4.69 0.00 2.09 2.16 0.00 3.80 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 79 V 9.36 4.82 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 1.11 0.00 0.00 1.06 0.00 0.00 80 V 8.56 4.56 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 0.87 0.00 0.00 0.85 0.00 0.00 81 M 8.54 4.74 0.00 2.40 1.96 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.74 0.00 82 L 9.76 5.01 0.00 1.51 1.60 0.84 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 83 T 9.35 5.31 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 1.21 0.00 0.00 84 A 8.97 4.53 1.29 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 0.00 0.00 0.00 85 R 8.30 3.95 0.00 2.05 1.85 0.00 3.26 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 1.64 1.61 0.00 86 G 9.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.92 3.77 0.00 2.00 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 2.37 2.35 0.00 88 E 8.19 3.84 0.00 2.10 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 0.00 2.29 2.34 0.00 89 E 7.67 3.98 0.00 2.29 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 0.00 2.15 2.27 0.00 90 D 7.99 4.23 0.00 2.60 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 91 R 8.17 3.89 0.00 1.93 1.93 0.00 3.10 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 92 V 8.20 3.05 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 0.24 0.00 0.00 -0.39 0.00 0.00 93 R 7.52 3.38 0.00 1.67 1.74 0.00 3.02 0.00 0.00 2.74 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.50 0.00 94 G 7.55 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 95 L 6.84 4.39 0.00 1.67 1.63 0.70 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 96 E 8.37 4.43 0.00 1.96 1.92 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 2.26 2.26 0.00 97 T 8.10 4.33 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 1.27 0.00 0.00 98 G 8.43 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 99 A 7.50 4.07 0.99 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 0.00 0.00 100 D 8.66 4.47 0.00 2.61 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 0.00 101 D 7.03 4.22 0.00 2.65 2.37 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 0.00 102 Y 8.43 5.41 0.00 2.81 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 0.00 103 I 8.77 4.85 1.88 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 1.33 0.84 0.96 0.00 0.00 104 T 8.64 5.11 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 1.26 0.00 0.00 105 K 9.22 5.04 0.00 1.74 1.85 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.49 7.81 106 P 0.00 4.62 0.00 2.15 2.08 0.00 3.78 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 107 F 8.83 4.65 0.00 3.23 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 S 8.48 4.48 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 0.00 109 P 0.00 4.47 0.00 2.23 2.21 0.00 3.56 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 110 K 8.01 4.00 0.00 1.85 1.83 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.53 7.81 111 E 8.39 3.99 0.00 2.14 2.14 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 2.36 2.36 0.00 112 L 8.32 3.94 0.00 2.13 2.00 0.71 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.82 3.63 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 1.19 0.00 0.00 1.09 0.00 0.00 114 A 8.17 4.02 1.44 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 0.00 0.00 0.00 115 R 8.18 4.02 0.00 2.06 1.98 0.00 3.16 0.00 0.00 3.45 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 116 I 7.67 3.68 1.78 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.66 0.00 0.00 117 K 8.42 4.03 0.00 2.11 1.91 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.71 7.81 118 A 8.52 4.03 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 0.00 119 V 8.24 3.58 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 1.00 0.00 0.00 0.94 0.00 0.00 120 M 7.96 4.12 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.60 0.00 121 R 7.79 4.09 0.00 2.07 2.02 0.00 3.17 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 1.69 1.76 0.00 122 R 7.99 3.98 0.00 2.01 1.75 0.00 3.27 0.00 0.00 3.22 8.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 123 I 7.12 3.86 1.93 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 1.14 0.51 0.93 0.00 0.00