NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.3155 8.1801 120.6354 54.9936 41.8724 175.8411 23 A 4.0753 8.2658 126.3024 52.4243 19.6706 175.6212 24 D 4.5877 8.1438 114.5108 52.3671 42.6487 174.1260 25 S 4.1464 8.7324 114.0385 62.2124 62.8096 176.5105 26 K 3.9306 8.0897 120.4435 59.4994 31.8581 178.9715 27 A 4.0263 8.3514 121.1023 55.2216 18.3082 180.1175 28 V 3.6921 7.8691 117.5887 64.7317 31.5205 178.3494 29 L 4.1528 8.4542 120.1774 58.0381 41.5524 179.2023 30 N 4.2855 8.3435 116.5988 56.4082 38.7020 176.7727 31 Q 4.2252 8.2582 121.0891 59.1968 29.2183 178.0037 32 A 4.2734 8.7914 122.3149 55.1511 18.4283 179.6330 33 V 3.5531 8.1917 116.6269 66.1961 31.6588 177.7648 34 A 4.3020 8.5598 120.3165 55.7769 18.2978 179.3568 35 D 4.3991 8.6831 117.2906 57.5784 40.9631 179.1048 36 L 4.1829 8.6564 119.8699 57.8474 41.6131 179.7574 37 S 3.8786 7.9452 115.1100 61.5913 62.6817 177.0167 38 V 3.6186 7.8152 120.6846 65.7632 31.2809 177.7483 39 A 4.0198 8.6352 121.0017 55.6155 18.2000 179.1386 40 H 4.0901 8.4299 116.6389 59.3143 29.9042 177.5187 41 S 4.1193 7.9026 114.7119 61.3432 62.2156 176.2401 42 I 3.6977 7.8961 122.6094 64.2151 36.7816 178.3119 43 L 3.9161 7.9368 119.8871 58.1090 41.4403 179.1185 44 H 3.6761 8.0547 118.0788 58.8608 29.5546 177.0699 45 Q 4.1756 7.9514 121.4362 59.2148 28.5909 178.2977 46 V 3.6229 8.3076 119.5380 66.3668 31.3011 177.2235 47 H 4.1617 8.2688 116.8494 59.3610 29.7098 176.8995 48 W 4.7171 8.2009 119.1931 59.6536 29.0549 177.4598 49 Y 4.4055 8.6276 114.6879 57.1187 37.7649 175.2473 50 M 4.4309 7.5054 120.6576 56.1005 32.9142 175.6057 51 R 4.6553 8.8110 123.2197 55.5452 34.5125 173.6530 52 G 4.1714 8.9518 106.3428 43.1622 0.0000 173.4294 53 R 4.1746 8.3213 119.4639 57.5075 30.4808 177.3633 54 G 4.2657 9.5531 110.5935 45.6030 0.0000 175.1091 55 F 4.1146 8.8724 122.4498 62.0865 39.0080 177.0608 56 M 4.3647 8.3332 115.1867 58.0410 32.1566 177.0922 57 I 3.8457 7.6017 118.0783 62.8854 38.6787 177.3077 58 W 4.1369 8.3285 119.9366 59.2478 28.8534 177.8736 59 H 3.9013 8.1793 118.2862 58.9601 29.4258 175.2136 60 P 4.2494 0.0000 0.0000 65.5515 31.1198 177.9069 61 K 3.4629 7.5282 119.4621 59.6608 31.9055 178.3424 62 M 4.0794 7.9126 118.6261 58.5968 31.8153 178.4153 63 D 4.1841 7.7504 118.8293 57.3358 41.0988 178.7409 64 E 3.8742 7.7400 118.4267 59.6258 29.4465 178.8260 65 Y 4.5228 7.7186 116.7023 61.4475 37.9563 178.6829 66 M 4.0908 8.7342 122.4710 59.0034 32.0819 179.1269 67 E 3.9647 8.2342 118.4867 61.1690 29.8375 180.6695 68 E 3.8513 8.0394 120.0061 59.0312 29.6453 179.0004 69 I 3.8111 7.9838 120.0209 64.4768 37.2169 177.8800 70 D 4.4629 8.6464 120.2835 57.5047 40.6852 179.3893 71 G 3.4786 7.8670 105.7723 48.0072 0.0000 175.3456 72 Y 4.3308 7.5821 119.4999 60.5513 37.9010 178.2286 73 L 3.9710 8.3369 121.6967 58.3449 42.1120 178.6903 74 D 4.2680 8.1303 117.6259 57.3267 41.1610 177.6289 75 E 3.8821 8.2339 119.8277 59.7091 29.6070 178.7849 76 M 3.9055 8.4505 119.3342 58.2203 31.9003 178.9476 77 S 4.1527 8.1648 114.5582 61.5642 63.1805 176.4657 78 E 3.9517 8.4370 122.2881 58.8004 29.1994 179.2274 79 R 3.8154 8.2242 119.3744 59.0756 30.0954 178.3576 80 L 3.8980 7.7871 120.2022 58.1135 42.0682 178.6895 81 I 3.6706 7.9255 120.0833 65.1091 36.9146 178.3928 82 T 3.8451 7.8752 114.7675 66.3360 68.3372 175.6040 83 L 4.4086 7.4522 117.6579 54.6203 42.0919 177.4790 84 G 3.8985 8.2431 108.1386 45.0106 0.0000 174.0101 85 G 3.7696 7.7314 108.7205 44.1980 0.0000 173.3849 86 A 4.4675 7.9899 121.1628 49.1394 20.1594 174.1379 87 P 4.5232 0.0000 0.0000 63.0386 32.1294 176.7174 88 F 4.4985 8.2796 120.3873 59.0515 39.3380 176.4862 89 S 4.8054 8.9559 116.6616 58.0503 64.3069 174.5032 90 T 4.5340 6.9721 110.5475 59.5589 72.7704 174.2107 91 L 4.0756 8.2475 122.1290 57.8065 41.7002 179.6185 92 K 3.8002 7.8917 119.0182 59.6089 32.1476 178.4037 93 E 3.5848 7.5757 118.1881 59.2250 29.3380 179.2804 94 F 4.3680 7.2724 117.6260 60.7626 38.8262 177.6710 95 S 4.1126 8.1254 111.3178 61.3934 62.2867 175.5432 96 E 4.0408 8.3173 120.1562 59.7850 29.3918 178.9417 97 N 4.4743 7.7431 114.0369 54.2445 39.1769 175.9972 98 S 4.4936 7.4642 114.8099 58.3454 62.9600 173.8042 99 Q 4.2954 8.6526 124.1883 56.0664 29.0874 176.3294 100 L 4.0072 7.2397 118.4924 53.9980 42.4046 176.2798 101 K 4.5461 8.2369 121.0439 54.6249 34.3025 175.5618 102 E 4.6198 8.4966 122.1878 54.7591 31.4092 175.6049 103 V 4.5046 7.7397 114.2352 58.8366 35.3094 175.5894 104 L 4.0331 8.2181 121.1105 54.4251 42.0233 177.8417 105 G 2.3863 7.9874 110.8252 45.3143 0.0000 172.6952 106 D 4.5360 7.5062 121.2716 52.5262 44.0140 175.7769 107 Y 4.8701 8.6648 123.6970 60.3544 38.1903 176.4781 108 N 4.6460 8.8539 115.9764 54.0570 38.9927 175.7142 109 V 3.8515 7.1945 118.4763 62.8637 32.2988 176.3206 110 T 4.3351 8.6942 117.4824 60.9847 71.1013 175.6320 111 I 3.6624 8.3321 121.7442 64.7136 37.9426 177.9241 112 E 3.8985 8.0475 118.4205 58.9527 29.5243 178.8654 113 E 3.9751 8.0174 118.9028 59.1506 29.5026 179.2837 114 Q 3.9278 8.3472 118.7070 58.9635 28.8208 178.7107 115 L 3.6783 7.8870 119.8183 57.5211 41.4644 179.4165 116 A 3.8925 7.9639 120.8121 55.0913 18.2281 179.6866 117 R 3.7221 7.8003 116.9646 59.3308 30.0992 178.9801 118 V 3.1447 7.4780 118.0656 65.6390 31.4682 177.9459 119 V 3.4282 7.4651 117.9377 66.1081 31.3072 177.6420 120 E 3.9136 8.1461 118.0931 59.5057 29.3003 179.4992 121 V 3.6317 7.7708 118.0313 66.2656 31.5417 178.0432 122 F 4.4701 8.6679 117.6895 60.7957 38.7057 177.9295 123 R 3.9927 8.6818 118.2171 59.1641 29.7291 178.4189 124 Y 3.9114 8.1737 119.4076 60.7994 38.8006 178.3177 125 L 3.3488 8.1062 119.7043 57.2190 41.5975 179.2411 126 A 3.8125 8.1425 121.0790 55.0333 18.3078 179.5843 127 A 3.7660 7.6765 119.1457 54.9644 18.4039 179.3618 128 L 3.6240 7.3322 119.0356 58.5479 42.1010 179.4122 129 F 4.4914 8.0798 117.8262 60.4448 38.7657 177.5250 130 Q 3.9212 8.1841 119.3612 59.1052 28.8117 178.2929 131 K 3.9638 8.0277 119.6324 59.3642 32.0770 179.4140 132 G 2.2685 7.8645 106.1166 47.3007 0.0000 175.2972 133 F 4.0395 8.1716 124.1184 60.9057 39.3278 176.8416 134 D 4.4214 8.6625 118.6988 57.5838 40.7390 179.0706 135 V 3.5708 8.0496 119.2644 65.9409 31.3748 178.2196 136 S 4.3003 8.0469 115.4746 60.6085 62.9926 175.8434 137 D 4.1077 7.7954 121.6750 57.2304 40.7641 178.0677 138 E 3.9661 8.0778 118.0958 58.7474 29.6961 177.6544 139 E 4.3686 7.9187 116.3033 55.4714 29.9863 176.4442 140 G 3.7913 7.5289 106.5463 47.1243 0.0000 175.0163 141 D 4.6444 8.3009 121.7321 52.5007 39.5403 175.8126 142 S 4.0308 8.0189 120.1604 60.6521 63.6021 176.6538 143 V 3.5163 7.6353 121.4608 66.0598 31.4083 177.9891 144 T 3.7114 8.0486 115.4688 66.4968 68.2936 175.7381 145 N 4.3268 8.2329 120.7104 56.3409 38.7571 176.3328 146 D 4.4305 8.0501 118.8053 57.0367 41.3695 178.0769 147 I 3.5397 7.5286 120.2106 64.5552 37.0651 178.4531 148 F 3.9590 8.1102 118.2601 60.1143 38.5861 177.4480 149 N 4.3731 8.2908 117.1733 56.7027 38.4489 177.1221 150 V 3.5628 8.0937 119.7623 65.8877 31.5646 177.9014 151 A 3.2998 7.5812 120.2537 54.5732 18.0356 179.4971 152 K 3.9703 8.1398 118.0959 59.6805 32.3994 178.6379 153 A 3.9932 8.0921 121.1109 55.4789 18.2642 179.6108 154 S 4.0996 7.8696 110.9057 61.3608 62.4428 176.4005 155 I 3.4976 7.8036 122.5844 64.4464 36.8494 178.3203 156 E 4.0355 8.3110 119.3953 59.2196 29.3609 179.3507 157 K 4.3358 8.0772 119.3780 59.7929 32.2449 178.7216 158 H 4.4696 8.2937 116.6840 58.7997 28.5552 177.5563 159 I 3.8046 8.2689 122.1186 64.3369 36.9624 177.8703 160 W 4.4677 8.3034 128.9314 61.2691 30.4777 177.9320 161 M 3.2867 7.7700 117.7593 57.8998 31.4117 178.8345 162 L 4.1022 8.5477 119.7472 57.8326 41.8137 179.5264 163 Q 3.9893 8.5251 118.2081 58.6594 28.5471 178.4501 164 A 4.0025 8.1817 121.9963 55.3903 18.2474 179.0753 165 E 3.9371 8.0057 116.1497 59.4311 29.7315 178.2449 166 L 4.3883 7.5821 115.6239 54.5370 41.9480 177.3653 167 G 3.9423 8.3780 107.5198 45.6914 0.0000 173.2849 168 Q 4.6685 8.1510 116.7936 53.1034 32.2304 175.4551 169 A 4.3502 8.3295 122.2769 51.4437 19.2098 176.2313 170 P 4.4071 0.0000 0.0000 64.3797 31.6664 177.5986 171 K 3.8654 8.0847 114.4776 57.2616 29.2218 175.4504 172 L 4.1749 8.0386 122.6611 55.2176 41.4939 177.5632 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 22 L 8.18 4.32 0.00 1.67 1.75 0.96 0.70 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 23 A 8.27 4.08 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 24 D 8.14 4.59 0.00 3.15 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 25 S 8.73 4.15 0.00 3.95 4.01 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 26 K 8.09 3.93 0.00 1.93 1.84 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.51 7.81 27 A 8.35 4.03 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 28 V 7.87 3.69 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 1.05 0.00 0.00 0.81 0.00 0.00 29 L 8.45 4.15 0.00 1.92 1.80 0.91 0.25 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 30 N 8.34 4.29 0.00 2.82 2.53 0.00 0.00 6.90 6.49 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 31 Q 8.26 4.23 0.00 2.39 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.76 0.00 32 A 8.79 4.27 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 0.00 0.00 0.00 0.00 0.00 33 V 8.19 3.55 2.48 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 1.31 0.00 0.00 1.03 0.00 0.00 34 A 8.56 4.30 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 0.00 0.00 0.00 0.00 0.00 35 D 8.68 4.40 0.00 2.90 2.98 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 36 L 8.66 4.18 0.00 1.79 1.83 1.20 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.95 3.88 0.00 3.49 3.11 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 38 V 7.82 3.62 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 0.99 0.00 0.00 0.97 0.00 0.00 39 A 8.64 4.02 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.43 4.09 0.00 3.33 3.46 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.90 4.12 0.00 3.97 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 42 I 7.90 3.70 1.97 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 1.47 0.62 0.83 0.00 0.00 43 L 7.94 3.92 0.00 1.77 1.63 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.05 3.68 0.00 2.97 2.42 0.00 5.61 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 45 Q 7.95 4.18 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.55 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 46 V 8.31 3.62 2.20 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 0.95 0.00 0.00 1.00 0.00 0.00 47 H 8.27 4.16 0.00 3.04 3.30 0.00 6.00 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 48 W 8.20 4.72 0.00 3.75 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 49 Y 8.63 4.41 0.00 3.11 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 50 M 7.51 4.43 0.00 2.32 2.37 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.91 0.00 51 R 8.81 4.66 0.00 1.89 1.78 0.00 3.30 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.79 0.00 52 G 8.95 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.32 4.17 0.00 1.87 1.95 0.00 3.37 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.55 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 0.00 0.00 0.00 0.00 55 F 8.87 4.11 0.00 3.33 3.12 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 0.00 0.00 0.00 0.00 56 M 8.33 4.36 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.71 0.00 57 I 7.60 3.85 1.67 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.06 0.88 0.00 0.00 58 W 8.33 4.14 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 59 H 8.18 3.90 0.00 1.71 2.72 0.00 5.95 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.25 0.00 2.17 2.23 0.00 3.82 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 2.07 1.96 0.00 61 K 7.53 3.46 0.00 1.47 1.82 0.00 1.04 0.00 0.00 1.02 0.00 0.00 2.63 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.88 0.83 7.81 62 M 7.91 4.08 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 3.08 0.00 63 D 7.75 4.18 0.00 2.85 2.60 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 64 E 7.74 3.87 0.00 1.85 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 2.28 2.22 0.00 65 Y 7.72 4.52 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 66 M 8.73 4.09 0.00 1.82 2.12 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.28 0.00 67 E 8.23 3.96 0.00 1.98 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 2.25 2.20 0.00 68 E 8.04 3.85 0.00 2.03 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 1.95 1.88 0.00 69 I 7.98 3.81 2.08 0.00 0.00 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 1.92 0.96 1.05 0.00 0.00 70 D 8.65 4.46 0.00 2.83 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 71 G 7.87 3.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.58 4.33 0.00 3.20 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 73 L 8.34 3.97 0.00 1.82 1.98 0.88 0.88 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 74 D 8.13 4.27 0.00 2.83 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 75 E 8.23 3.88 0.00 2.07 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 2.20 2.29 0.00 76 M 8.45 3.91 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.96 0.00 77 S 8.16 4.15 0.00 4.10 4.17 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 0.00 0.00 0.00 78 E 8.44 3.95 0.00 2.15 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 2.32 2.31 0.00 79 R 8.22 3.82 0.00 1.93 1.99 0.00 3.09 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 80 L 7.79 3.90 0.00 1.88 1.87 0.93 1.04 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 81 I 7.93 3.67 2.03 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 1.52 0.56 0.90 0.00 0.00 82 T 7.88 3.85 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 1.19 0.00 0.00 83 L 7.45 4.41 0.00 1.78 1.68 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.24 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 85 G 7.73 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 0.00 0.00 0.00 86 A 7.99 4.47 1.19 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 0.00 0.00 87 P 0.00 4.52 0.00 2.26 2.07 0.00 3.79 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 2.02 2.00 0.00 88 F 8.28 4.50 0.00 3.34 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 89 S 8.96 4.81 0.00 4.02 4.07 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 90 T 6.97 4.53 4.10 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 1.14 0.00 0.00 91 L 8.25 4.08 0.00 1.72 1.84 1.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.89 3.80 0.00 1.75 1.71 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.49 7.81 93 E 7.58 3.58 0.00 1.76 1.45 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 2.19 2.21 0.00 94 F 7.27 4.37 0.00 3.21 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 95 S 8.13 4.11 0.00 3.99 3.88 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 96 E 8.32 4.04 0.00 1.96 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 2.29 2.42 0.00 97 N 7.74 4.47 0.00 2.44 2.88 0.00 0.00 7.11 6.97 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 98 S 7.46 4.49 0.00 3.97 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 99 Q 8.65 4.30 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 100 L 7.24 4.01 0.00 1.55 1.43 0.94 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.24 4.55 0.00 1.64 1.64 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.34 7.81 102 E 8.50 4.62 0.00 1.92 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 2.20 2.28 0.00 103 V 7.74 4.50 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 0.70 0.00 0.00 0.84 0.00 0.00 104 L 8.22 4.03 0.00 1.54 1.51 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.99 2.39 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 0.00 106 D 7.51 4.54 0.00 2.58 2.36 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 0.00 107 Y 8.66 4.87 0.00 3.14 3.02 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 0.00 108 N 8.85 4.65 0.00 2.85 2.91 0.00 0.00 6.93 7.22 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 0.00 109 V 7.19 3.85 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 0.81 0.00 0.00 0.96 0.00 0.00 110 T 8.69 4.34 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 1.27 0.00 0.00 111 I 8.33 3.66 1.94 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.15 0.95 0.00 0.00 112 E 8.05 3.90 0.00 2.01 1.91 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 2.32 2.35 0.00 113 E 8.02 3.98 0.00 2.27 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 2.29 2.32 0.00 114 Q 8.35 3.93 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.63 2.59 0.00 115 L 7.89 3.68 0.00 1.37 1.27 -0.35 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.96 3.89 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 0.00 117 R 7.80 3.72 0.00 1.89 1.99 0.00 3.06 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 118 V 7.48 3.14 1.84 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 -0.18 0.00 0.00 0.80 0.00 0.00 119 V 7.47 3.43 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 0.97 0.00 0.00 0.88 0.00 0.00 120 E 8.15 3.91 0.00 2.19 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 2.31 2.40 0.00 121 V 7.77 3.63 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 1.21 0.00 0.00 0.91 0.00 0.00 122 F 8.67 4.47 0.00 3.09 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 0.00 123 R 8.68 3.99 0.00 2.00 1.99 0.00 3.14 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 124 Y 8.17 3.91 0.00 3.13 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 0.00 125 L 8.11 3.35 0.00 1.61 0.83 1.04 0.91 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 0.00 126 A 8.14 3.81 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 0.00 127 A 7.68 3.77 1.16 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 0.00 0.00 128 L 7.33 3.62 0.00 1.20 1.36 1.08 1.35 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 0.00 129 F 8.08 4.49 0.00 3.11 3.18 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 0.00 130 Q 8.18 3.92 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 131 K 8.03 3.96 0.00 1.87 1.76 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.62 7.81 132 G 7.86 2.27 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 0.00 133 F 8.17 4.04 0.00 3.22 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 0.00 134 D 8.66 4.42 0.00 2.84 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 0.00 135 V 8.05 3.57 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 1.07 0.00 0.00 0.90 0.00 0.00 136 S 8.05 4.30 0.00 4.31 4.16 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 0.00 137 D 7.80 4.11 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 0.00 138 E 8.08 3.97 0.00 2.06 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 0.00 2.31 2.34 0.00 139 E 7.92 4.37 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 2.29 2.50 0.00 140 G 7.53 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.30 4.64 0.00 2.64 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.02 4.03 0.00 4.04 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 0.00 143 V 7.64 3.52 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 8.05 3.71 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 145 N 8.23 4.33 0.00 2.68 2.90 0.00 0.00 6.39 8.96 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 0.00 146 D 8.05 4.43 0.00 2.86 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 0.00 147 I 7.53 3.54 1.69 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 1.52 1.07 0.47 0.00 0.00 148 F 8.11 3.96 0.00 3.25 3.17 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 0.00 0.00 0.00 149 N 8.29 4.37 0.00 3.37 3.04 0.00 0.00 6.72 7.87 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 0.00 150 V 8.09 3.56 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 1.01 0.00 0.00 1.00 0.00 0.00 151 A 7.58 3.30 0.18 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 0.00 152 K 8.14 3.97 0.00 2.09 1.92 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.56 1.51 7.81 153 A 8.09 3.99 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 0.00 154 S 7.87 4.10 0.00 4.02 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 0.00 155 I 7.80 3.50 1.84 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.78 0.68 0.00 0.00 156 E 8.31 4.04 0.00 2.04 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 0.00 2.33 2.48 0.00 157 K 8.08 4.34 0.00 2.04 2.01 0.00 1.73 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.67 2.00 7.81 158 H 8.29 4.47 0.00 3.31 3.45 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.27 3.80 2.16 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 1.61 1.09 1.00 0.00 0.00 160 W 8.30 4.47 0.00 3.40 3.48 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 0.00 0.00 0.00 0.00 161 M 7.77 3.29 0.00 1.88 2.11 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.84 0.00 162 L 8.55 4.10 0.00 1.68 1.63 0.83 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.53 3.99 0.00 2.35 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.51 2.74 0.00 164 A 8.18 4.00 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 0.00 165 E 8.01 3.94 0.00 2.23 2.26 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 2.32 2.45 0.00 166 L 7.58 4.39 0.00 1.79 1.64 0.81 0.84 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 0.00 167 G 8.38 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 0.00 168 Q 8.15 4.67 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 169 A 8.33 4.35 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 0.00 170 P 0.00 4.41 0.00 2.13 2.30 0.00 3.89 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 2.10 2.43 0.00 171 K 8.08 3.87 0.00 1.93 1.91 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.66 7.81 172 L 8.04 4.17 0.00 1.63 1.58 0.92 0.94 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