NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4634 8.3044 118.1957 55.0740 32.5724 174.2944 1 V 4.2809 8.0156 119.3178 60.6922 34.4915 173.4731 2 L 4.4833 8.2964 126.9309 53.5723 44.0406 176.6882 3 S 4.5727 8.6491 117.2172 57.6273 65.5025 175.1106 4 E 4.3028 8.8349 122.4863 59.3969 29.4202 179.1061 5 G 3.6245 8.0816 105.4790 47.8410 0.0000 175.4409 6 E 3.9440 7.9750 121.0487 58.8566 29.4204 179.4628 7 W 4.3051 8.0871 119.0727 59.8578 29.1129 178.5544 8 Q 4.1636 8.5069 118.1518 59.0587 28.0350 178.9069 9 L 4.0927 7.9490 119.7332 57.6286 41.6367 179.8282 10 V 3.7572 7.9234 118.2309 66.2287 31.6938 178.2507 11 L 4.3004 8.6508 118.8567 57.5934 41.0999 179.0695 12 H 4.2540 8.5199 119.0932 59.2302 29.9055 177.6728 13 V 3.8085 7.8066 121.1674 64.3499 31.3728 178.1734 14 W 3.9336 8.5599 128.8976 60.0893 30.2815 177.8119 15 A 4.0069 7.8719 120.0751 54.7992 18.0147 179.5326 16 K 3.9456 7.2806 117.5187 59.4163 32.1600 179.5266 17 V 2.8185 7.1154 118.3947 65.8841 31.0547 177.7591 18 E 3.8756 7.5524 115.7713 58.2583 29.2796 178.5910 19 A 4.2085 7.4780 120.4099 53.6990 19.8592 177.6018 20 D 4.6555 7.9163 116.7482 51.9473 42.5676 175.4842 21 V 3.4433 7.9230 123.0802 65.6095 32.0643 176.7868 22 A 4.0685 7.9809 120.1557 55.0663 18.2727 179.7142 23 G 3.6851 8.0695 105.1928 47.7993 0.0000 175.7750 24 H 4.2167 8.2471 118.8689 58.3277 28.6595 178.1667 25 G 3.5673 8.2076 107.7093 47.6414 0.0000 175.5551 26 Q 3.7980 7.9468 121.9327 59.0426 29.1601 177.8382 27 D 4.3081 7.8809 119.8457 57.5725 40.7933 179.1478 28 I 3.6408 7.7283 119.9315 64.4377 37.0685 178.6116 29 L 3.4129 7.6741 119.7799 57.4530 41.3007 179.7044 30 I 3.6508 7.6280 119.9093 64.1101 37.0022 178.3286 31 R 3.7655 7.8926 119.5993 59.2280 29.8656 178.1315 32 L 3.8785 7.8075 120.1169 58.4479 41.9552 179.0420 33 F 4.6459 7.8090 117.6146 60.5511 38.5597 177.9348 34 K 4.0477 8.0732 117.5061 59.4225 32.0216 179.3331 35 S 4.2718 7.9902 114.5732 60.4558 64.1621 174.5500 36 H 4.6992 8.4137 119.1268 51.9511 29.4463 171.8924 37 P 4.6270 0.0000 0.0000 64.4108 31.4414 177.5102 38 E 4.1170 8.2414 116.5660 59.5029 29.6420 179.0991 39 T 3.8360 8.0843 110.7266 64.3801 68.7326 176.2653 40 L 3.8164 7.8809 122.9248 57.9462 41.7739 178.7150 41 E 4.1086 7.9706 117.4029 59.0012 29.4401 178.8731 42 K 4.3542 8.0399 116.7966 56.8716 32.3909 176.6908 43 F 4.5710 7.9462 119.1650 55.5181 39.3736 176.1782 44 D 4.4691 8.4984 126.3856 56.5488 40.9865 178.3499 45 R 4.0003 7.6852 117.4622 57.8386 30.4562 177.0457 46 F 5.0125 7.3776 113.9465 57.0219 40.9043 177.2110 47 K 3.9657 8.2329 122.3517 59.7740 32.0534 177.1704 48 H 4.3592 8.3453 112.6839 57.7427 28.9169 175.4590 49 L 3.8256 7.5033 120.4799 55.3118 41.6176 176.9032 50 K 4.2384 9.4872 124.2569 57.6856 33.1065 177.2560 51 T 4.7152 7.4704 107.4071 59.0349 73.0821 174.3247 52 E 3.9346 8.5882 120.6747 59.2009 29.4739 178.4813 53 A 3.9702 7.9152 120.5611 55.1918 18.2813 179.3108 54 E 3.9266 7.7621 115.6977 59.6657 29.8266 179.2162 55 M 4.1500 7.9984 118.8201 58.3978 31.8508 179.0309 56 K 3.9913 8.2284 117.3598 58.8309 32.2414 178.5410 57 A 4.4298 7.5015 119.6013 52.0706 19.0802 177.2424 58 S 4.1521 7.3737 113.2059 58.0116 62.8881 174.5343 59 E 4.0195 8.8552 129.1281 59.2496 29.4524 178.2577 60 D 4.4719 8.0990 118.8257 57.2466 41.0147 178.2424 61 L 3.4173 8.0308 120.9375 57.7268 42.0340 178.9542 62 K 3.9213 7.8406 119.6778 59.3630 32.1257 179.0535 63 K 4.0459 8.1266 118.4801 59.2455 31.9351 179.2050 64 A 4.2350 8.2596 121.4181 55.0688 18.3270 179.8758 65 G 3.5265 8.0977 104.3000 47.9689 0.0000 176.1076 66 V 3.6408 7.6808 120.3029 65.9205 31.6665 178.2274 67 T 3.9013 8.0097 115.5310 66.6231 68.3007 176.7908 68 V 3.6714 7.9961 120.0361 66.1521 31.5987 178.1290 69 L 4.2434 8.0587 118.7438 58.0973 41.4415 179.6995 70 T 3.9898 8.4142 115.8956 66.6244 68.4996 176.6784 71 A 4.0359 7.9897 122.3512 54.9788 18.3408 179.4763 72 L 3.7458 8.2311 119.1459 58.0895 42.1400 179.3752 73 G 3.3269 8.6194 105.9336 47.7227 0.0000 175.4962 74 A 4.0198 7.8402 122.1529 54.7732 18.6157 179.6555 75 I 3.7799 7.3936 117.8459 64.6090 37.2565 178.5939 76 L 3.9856 7.7160 119.8754 57.7342 41.1799 179.6315 77 K 3.9766 7.6157 116.8210 58.4197 32.3618 178.7882 78 K 3.9544 7.8514 118.5410 56.1526 32.4691 176.7075 79 K 2.0000 8.3342 117.9728 56.5028 29.8024 175.3361 80 G 4.0337 8.0494 106.0921 45.9368 0.0000 174.3882 81 H 4.5507 7.2611 118.5913 54.8820 27.3027 174.6675 82 H 5.1675 7.6172 111.9792 53.9842 29.5278 176.1925 83 E 3.9941 8.5993 120.8039 60.3452 28.7026 178.9114 84 A 4.0238 7.9511 119.8951 54.8778 18.6907 179.0548 85 E 4.1137 8.1734 116.4878 59.3426 29.5892 179.3556 86 L 4.1052 8.1398 119.3017 57.3152 41.6145 179.2436 87 K 3.9113 7.8196 118.5498 59.2522 32.1136 177.5365 88 P 4.3335 0.0000 0.0000 65.5525 31.2417 178.2293 89 L 4.0157 7.5031 117.3882 58.0981 42.0890 178.7859 90 A 4.2155 8.5255 121.2528 55.1033 18.2219 179.4209 91 Q 3.8321 8.1769 118.3787 59.3635 29.1198 178.6635 92 S 3.9480 7.9965 115.2996 61.8380 62.9753 176.1530 93 H 4.1219 8.3755 119.5989 57.9350 27.6793 177.7305 94 A 2.5821 7.8091 122.6845 54.7489 18.1253 179.6806 95 T 3.8035 7.4451 112.6848 65.8206 68.8914 176.4700 96 K 4.0002 7.4766 120.0093 59.1961 32.6313 177.3918 97 H 4.3309 7.9526 114.5837 55.9724 29.5835 175.5533 98 K 3.4045 6.7683 114.6010 57.0860 29.2847 175.1576 99 I 4.3209 7.9201 118.9564 58.8169 38.9535 175.0468 100 P 4.7613 0.0000 0.0000 62.1627 32.3943 177.1648 101 I 3.5515 8.4482 120.7867 64.6023 36.9889 178.2187 102 K 3.5940 7.9957 119.7719 60.0148 31.9108 178.2120 103 Y 4.1986 7.8934 116.4615 60.8631 37.7578 178.3633 104 L 4.2347 7.9986 120.1293 57.4978 41.6949 179.2314 105 E 4.0677 7.9099 118.4589 59.2402 29.6028 179.0148 106 F 4.5303 7.8423 117.5529 60.7905 38.9845 177.5758 107 I 3.8918 8.0375 118.0358 63.8813 37.7453 178.1008 108 S 4.2190 8.1872 116.3834 61.5307 62.6443 176.1965 109 E 4.0233 8.4574 121.8589 59.2620 29.4183 178.7655 110 A 4.0537 8.0041 120.6496 55.0092 18.3840 179.7615 111 I 3.6936 7.9965 118.4370 64.7157 37.2550 178.7347 112 I 3.8678 7.8900 120.6992 64.5419 36.8872 178.0460 113 H 4.1322 8.3281 119.1935 59.3032 29.6634 177.6003 114 V 3.5668 7.8880 120.0618 65.9457 31.2764 177.9906 115 L 3.7611 7.8645 118.8254 57.8508 41.0472 178.9799 116 H 4.2786 7.7648 117.3120 59.2985 29.8866 177.3339 117 S 4.1653 7.6444 115.9739 61.7133 62.8294 176.5343 118 R 4.0409 7.8888 118.9711 57.5821 31.3053 176.4504 119 H 5.0281 8.2449 115.8154 53.7073 29.4770 172.9254 120 P 4.3038 0.0000 0.0000 65.8469 31.6462 179.3421 121 G 3.7156 8.1471 106.7659 47.5930 0.0000 173.7655 122 N 4.9535 8.1020 114.5019 52.9145 39.4232 175.0185 123 F 4.9428 7.7858 117.5696 56.2961 39.4338 174.1055 124 G 3.9357 7.5713 109.6972 43.7031 0.0000 171.5286 125 A 3.8887 8.4377 120.6467 55.4214 18.2650 179.6653 126 D 4.1874 7.9557 116.4398 57.5444 40.9989 178.8171 127 A 3.9534 7.7497 120.7346 55.0219 18.3338 179.3174 128 Q 3.2105 7.8374 118.5060 58.7581 28.9955 178.6324 129 G 3.4565 8.0995 106.7985 47.5624 0.0000 175.5879 130 A 3.8448 7.8923 123.3102 55.0542 18.3891 179.4412 131 M 3.9955 8.1061 116.7705 58.7645 32.2664 177.9335 132 N 4.3229 8.4293 117.5336 56.5434 39.1317 176.7707 133 K 3.8418 8.1721 120.8951 59.3334 32.2607 178.7271 134 A 3.8345 7.9701 121.1293 55.1030 18.2039 179.6745 135 L 4.1314 8.1607 117.5953 57.8437 41.6041 179.5620 136 E 3.9782 8.5402 119.0306 59.0700 29.3711 178.9951 137 L 3.9397 8.0659 120.4625 58.0885 42.1809 178.5937 138 F 4.1807 8.3142 120.4479 61.6945 39.2324 177.3306 139 R 3.5128 8.2722 117.6721 58.8405 29.8173 179.0662 140 K 3.8367 8.2111 119.6182 59.6853 32.3862 178.7206 141 D 4.3568 8.1105 119.1489 57.2982 40.6384 178.8902 142 I 3.4979 7.5504 120.2074 64.1201 37.1307 178.2803 143 A 4.1185 8.2273 123.0449 54.6863 18.0250 179.5616 144 A 3.9860 8.0066 119.2609 55.2225 18.3529 180.0736 145 K 4.0298 7.9655 116.7754 59.5514 32.0361 179.0620 146 Y 4.2427 8.3591 117.3396 61.1392 37.9743 178.7516 147 K 3.9675 8.1063 119.9151 59.7230 32.1084 178.7197 148 E 4.0482 7.8432 117.6468 59.1570 29.4733 178.6386 149 L 4.3199 7.9703 116.9780 55.2845 41.8915 177.7551 150 G 3.9028 7.9857 107.0572 45.5673 0.0000 172.7573 151 Y 4.3181 7.4581 116.9662 55.1619 42.0226 175.4743 152 Q 3.5217 7.9327 117.2879 56.9102 27.2897 174.4155 153 G 3.3804 8.4175 108.5698 44.9060 0.0000 171.0626 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 0 M 8.30 4.46 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 1 V 8.02 4.28 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 0.90 0.00 0.00 0.96 0.00 0.00 2 L 8.30 4.48 0.00 1.05 0.80 0.59 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.65 4.57 0.00 4.06 3.98 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 0.00 0.00 0.00 4 E 8.83 4.30 0.00 2.19 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 2.43 2.52 0.00 5 G 8.08 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 6 E 7.98 3.94 0.00 1.85 1.73 0.00 0.00 0.00 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 2.26 0.00 7 W 8.09 4.31 0.00 3.60 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 8 Q 8.51 4.16 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.61 0.00 9 L 7.95 4.09 0.00 1.90 1.74 0.89 0.66 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 10 V 7.92 3.76 2.42 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 1.18 0.00 0.00 0.91 0.00 0.00 11 L 8.65 4.30 0.00 1.82 1.82 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.52 4.25 0.00 3.41 3.56 0.00 5.78 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.81 3.81 2.29 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 1.06 0.00 0.00 0.89 0.00 0.00 14 W 8.56 3.93 0.00 3.68 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 15 A 7.87 4.01 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 16 K 7.28 3.95 0.00 1.63 1.68 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.70 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.45 7.81 17 V 7.12 2.82 1.04 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 -0.05 0.00 0.00 0.45 0.00 0.00 18 E 7.55 3.88 0.00 1.99 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 2.20 2.07 0.00 19 A 7.48 4.21 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 20 D 7.92 4.66 0.00 2.70 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.92 3.44 2.04 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 0.97 0.00 0.00 0.83 0.00 0.00 22 A 7.98 4.07 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 23 G 8.07 3.69 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 0.00 0.00 0.00 24 H 8.25 4.22 0.00 3.11 3.22 0.00 5.82 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 25 G 8.21 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 26 Q 7.95 3.80 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 27 D 7.88 4.31 0.00 2.80 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 28 I 7.73 3.64 1.88 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 1.50 0.66 0.87 0.00 0.00 29 L 7.67 3.41 0.00 1.38 1.01 0.73 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.63 3.65 1.85 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 1.38 0.67 0.87 0.00 0.00 31 R 7.89 3.77 0.00 1.91 2.10 0.00 3.00 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 32 L 7.81 3.88 0.00 1.70 1.37 1.05 1.25 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 33 F 7.81 4.65 0.00 3.05 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 34 K 8.07 4.05 0.00 1.69 1.83 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.66 7.81 35 S 7.99 4.27 0.00 3.86 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 36 H 8.41 4.70 0.00 2.91 2.97 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.63 0.00 2.16 2.12 0.00 3.85 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.26 0.00 38 E 8.24 4.12 0.00 2.30 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 2.34 2.56 0.00 39 T 8.08 3.84 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 0.80 0.00 0.00 40 L 7.88 3.82 0.00 1.56 1.82 0.12 0.66 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 41 E 7.97 4.11 0.00 2.20 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 2.38 2.40 0.00 42 K 8.04 4.35 0.00 1.89 1.59 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.71 1.94 7.81 43 F 7.95 4.57 0.00 3.23 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 44 D 8.50 4.47 0.00 2.61 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 45 R 7.69 4.00 0.00 0.77 1.44 0.00 3.06 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 1.49 1.45 0.00 46 F 7.38 5.01 0.00 2.84 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 47 K 8.23 3.97 0.00 1.98 1.92 0.00 1.82 0.00 0.00 1.91 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.46 7.81 48 H 8.35 4.36 0.00 3.33 3.43 0.00 5.60 0.00 0.00 0.00 0.00 7.01 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 3.83 0.00 1.60 1.60 0.86 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.49 4.24 0.00 1.77 1.84 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.56 7.81 51 T 7.47 4.72 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 52 E 8.59 3.93 0.00 2.04 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 2.35 2.35 0.00 53 A 7.92 3.97 1.31 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 0.00 0.00 0.00 0.00 0.00 54 E 7.76 3.93 0.00 2.12 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 2.34 2.34 0.00 55 M 8.00 4.15 0.00 2.05 2.24 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 2.77 2.55 0.00 56 K 8.23 3.99 0.00 1.81 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.53 7.81 57 A 7.50 4.43 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 58 S 7.37 4.15 0.00 3.87 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 59 E 8.86 4.02 0.00 2.13 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 2.39 2.47 0.00 60 D 8.10 4.47 0.00 3.04 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 61 L 8.03 3.42 0.00 1.26 1.58 0.67 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.84 3.92 0.00 1.77 1.92 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.44 7.81 63 K 8.13 4.05 0.00 2.07 1.89 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.78 7.81 64 A 8.26 4.24 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.10 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 0.00 0.00 0.00 66 V 7.68 3.64 2.25 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 1.14 0.00 0.00 0.96 0.00 0.00 67 T 8.01 3.90 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 68 V 8.00 3.67 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 1.10 0.00 0.00 1.12 0.00 0.00 69 L 8.06 4.24 0.00 1.80 1.82 0.88 0.82 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 70 T 8.41 3.99 4.32 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 1.26 0.00 0.00 71 A 7.99 4.04 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 72 L 8.23 3.75 0.00 1.71 1.79 0.25 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.62 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 0.00 0.00 0.00 74 A 7.84 4.02 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 75 I 7.39 3.78 1.85 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 1.55 0.58 0.90 0.00 0.00 76 L 7.72 3.99 0.00 1.20 1.55 -0.24 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.62 3.98 0.00 1.66 1.80 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.46 1.47 7.81 78 K 7.85 3.95 0.00 1.84 1.82 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.65 1.60 7.81 79 K 8.33 2.00 0.00 1.21 0.74 0.00 1.46 0.00 0.00 1.42 0.00 0.00 2.69 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.46 0.97 7.81 80 G 8.05 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 0.00 0.00 0.00 81 H 7.26 4.55 0.00 3.18 3.23 0.00 5.80 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 82 H 7.62 5.17 0.00 3.31 3.46 0.00 5.67 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 83 E 8.60 3.99 0.00 2.21 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 2.39 2.37 0.00 84 A 7.95 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 85 E 8.17 4.11 0.00 2.27 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 0.00 2.41 2.48 0.00 86 L 8.14 4.11 0.00 2.06 1.74 0.96 0.70 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 87 K 7.82 3.91 0.00 1.83 1.89 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.49 7.81 88 P 0.00 4.33 0.00 2.30 2.33 0.00 3.93 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.05 0.00 89 L 7.50 4.02 0.00 1.95 1.98 1.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.53 4.22 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.18 3.83 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 92 S 8.00 3.95 0.00 3.96 4.06 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 93 H 8.38 4.12 0.00 3.53 3.56 0.00 5.80 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 94 A 7.81 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.45 3.80 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 1.12 0.00 0.00 96 K 7.48 4.00 0.00 1.52 1.58 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.29 1.36 7.81 97 H 7.95 4.33 0.00 3.06 3.17 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 6.77 3.40 0.00 1.84 1.82 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.36 7.81 99 I 7.92 4.32 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.00 1.12 0.00 0.00 100 P 0.00 4.76 0.00 2.00 2.04 0.00 3.15 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 0.84 1.21 0.00 101 I 8.45 3.55 1.80 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.94 0.79 0.00 0.00 102 K 8.00 3.59 0.00 1.71 1.64 0.00 1.33 0.00 0.00 1.73 0.00 0.00 3.18 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.45 0.82 7.81 103 Y 7.89 4.20 0.00 3.24 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 0.00 104 L 8.00 4.23 0.00 1.81 1.78 0.71 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.91 4.07 0.00 2.06 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 2.39 2.50 0.00 106 F 7.84 4.53 0.00 3.21 2.84 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 0.00 0.00 0.00 107 I 8.04 3.89 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.37 1.08 0.00 0.00 108 S 8.19 4.22 0.00 4.24 3.99 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 0.00 109 E 8.46 4.02 0.00 2.26 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 2.38 2.41 0.00 110 A 8.00 4.05 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 0.00 111 I 8.00 3.69 2.12 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.84 1.05 0.00 0.00 112 I 7.89 3.87 2.00 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 0.98 1.13 0.00 0.00 113 H 8.33 4.13 0.00 3.36 3.47 0.00 5.78 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 0.00 114 V 7.89 3.57 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 0.99 0.00 0.00 0.99 0.00 0.00 115 L 7.86 3.76 0.00 0.54 0.55 0.82 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.76 4.28 0.00 3.48 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.64 4.17 0.00 3.90 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 0.00 118 R 7.89 4.04 0.00 1.56 1.60 0.00 3.09 0.00 0.00 2.94 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 119 H 8.24 5.03 0.00 3.17 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.30 0.00 2.20 2.26 0.00 3.73 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 121 G 8.15 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 0.00 0.00 0.00 122 N 8.10 4.95 0.00 2.84 2.97 0.00 0.00 6.69 6.82 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 0.00 123 F 7.79 4.94 0.00 3.02 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 0.00 124 G 7.57 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 0.00 125 A 8.44 3.89 1.28 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 0.00 0.00 126 D 7.96 4.19 0.00 2.65 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 0.00 127 A 7.75 3.95 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 0.00 128 Q 7.84 3.21 0.00 1.30 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 129 G 8.10 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.89 3.84 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 0.00 131 M 8.11 4.00 0.00 2.35 2.34 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.92 0.00 132 N 8.43 4.32 0.00 2.87 2.96 0.00 0.00 6.86 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 0.00 133 K 8.17 3.84 0.00 1.95 1.76 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.37 7.81 134 A 7.97 3.83 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 0.00 135 L 8.16 4.13 0.00 1.77 1.82 1.00 0.74 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 0.00 136 E 8.54 3.98 0.00 2.14 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 2.34 2.59 0.00 137 L 8.07 3.94 0.00 1.88 2.00 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.31 4.18 0.00 3.14 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 0.00 139 R 8.27 3.51 0.00 1.96 1.84 0.00 3.16 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.98 0.00 140 K 8.21 3.84 0.00 1.88 1.94 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.45 7.81 141 D 8.11 4.36 0.00 2.70 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 0.00 142 I 7.55 3.50 1.42 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 -0.36 0.28 0.00 0.00 143 A 8.23 4.12 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 0.00 144 A 8.01 3.99 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 0.00 145 K 7.97 4.03 0.00 2.13 1.94 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.55 7.81 146 Y 8.36 4.24 0.00 3.32 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 0.00 147 K 8.11 3.97 0.00 2.04 1.96 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 148 E 7.84 4.05 0.00 2.10 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 2.36 2.59 0.00 149 L 7.97 4.32 0.00 1.73 1.68 0.91 0.95 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 0.00 150 G 7.99 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 0.00 151 Y 7.46 4.32 0.00 2.66 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 7.93 3.52 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.64 0.00 0.00 0.00 0.00 0.00 2.66 2.30 0.00 153 G 8.42 3.38 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 0.00