NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 V 3.9835 8.0393 120.3797 61.7109 32.7394 174.5894 18 P 4.3037 0.0000 0.0000 61.8520 31.8862 172.3135 19 G 4.3880 8.1389 107.1367 44.4730 0.0000 173.4574 20 T 4.7418 8.3968 107.8523 60.9431 68.9422 174.2971 21 L 4.3609 8.0699 121.2029 55.7826 42.6175 176.9543 22 L 4.6715 9.1938 123.0933 52.3904 43.5701 175.0155 23 P 4.4644 0.0000 0.0000 61.9629 31.9781 176.6540 24 R 3.9839 8.3320 120.6357 56.4477 30.5009 176.6391 25 L 4.2684 8.2183 124.2788 53.5888 42.4128 175.2537 26 P 4.4590 0.0000 0.0000 62.5350 31.9034 176.4932 27 S 4.4499 8.4337 114.9774 58.3549 63.6421 173.3302 28 E 4.7326 8.3567 120.9302 53.6955 32.7844 173.5515 29 P 4.4351 0.0000 0.0000 63.7155 31.7336 176.8487 30 G 3.9341 9.0255 110.8457 46.1067 0.0000 172.5709 31 M 5.0693 7.5052 116.3651 52.2796 35.7147 174.9716 32 T 4.9351 8.4609 115.3446 61.8806 72.5146 173.0607 33 L 4.7544 8.4498 125.8452 53.5879 43.5789 175.1982 34 L 4.9898 8.4758 126.0567 53.8326 44.3317 174.7979 35 T 4.9683 8.9587 123.4919 61.9242 71.4214 173.0015 36 I 4.8912 8.8249 128.0156 59.5334 40.0078 174.6214 37 R 4.8487 9.0218 128.3063 55.1661 31.8468 175.1740 38 I 4.1156 8.8194 129.0168 60.6675 37.6896 176.5296 39 E 4.2688 9.3733 128.1413 58.1187 30.2467 177.1128 40 K 5.1854 7.6597 115.8527 56.2912 36.4942 173.3256 41 I 5.1163 8.7079 119.9777 59.3899 41.4140 174.0871 42 G 3.6102 9.2059 117.1175 45.5587 0.0000 173.0243 43 L 4.3103 7.7384 121.0825 53.3905 46.2356 176.5345 44 K 3.8078 8.8160 123.0262 59.2468 32.3728 178.4300 45 D 4.7969 7.6823 117.1856 52.4618 39.6065 178.0324 46 A 3.6927 7.6270 121.4803 57.5639 18.6903 180.0657 47 G 3.9511 8.2830 102.7846 46.1461 0.0000 173.8178 48 Q 4.4194 7.8174 118.0756 56.1968 29.7136 175.9317 49 C 4.4377 8.1001 116.8724 59.4754 28.9979 172.9100 50 I 4.3469 8.5312 124.7023 61.1874 38.8888 175.2796 51 D 4.4492 8.7546 124.5248 54.8363 38.3690 171.8368 52 P 4.8745 0.0000 0.0000 62.8225 33.6538 176.6607 53 Y 5.7037 8.5028 119.6853 56.3072 42.3203 173.2196 54 I 4.9015 9.4700 120.1082 59.8052 40.8848 174.9363 55 T 5.2264 8.8055 122.1893 61.1057 71.1634 173.5720 56 V 5.2026 9.5315 125.9479 60.1769 34.5885 174.4769 57 S 5.0161 8.4575 120.5134 56.8329 67.5077 172.6866 58 V 4.9409 8.2016 118.9080 61.2972 34.1731 174.2102 59 K 5.7713 9.2255 126.2917 53.6286 36.7913 176.3067 60 D 5.1894 8.2887 121.4114 52.0381 41.5857 176.8182 61 L 4.1881 8.4948 117.8999 57.9961 41.5378 177.8861 62 N 4.6782 8.3500 114.0671 52.4136 38.4177 174.8967 63 G 3.9815 8.2223 105.9105 47.3221 0.0000 173.7342 64 I 4.2344 8.2680 120.3440 58.7313 38.7198 175.4514 65 D 4.7088 8.4112 124.4044 55.2050 41.0435 176.4464 66 L 4.6480 8.4845 121.4909 54.0772 42.6571 175.8433 67 T 4.1595 7.0971 107.4455 60.4362 70.5849 170.8634 68 P 4.3831 0.0000 0.0000 62.4202 31.9020 176.2289 69 V 4.1954 8.0148 120.4643 62.4197 32.6103 175.1014 70 Q 4.7619 9.0641 126.3125 54.2028 31.6043 173.9821 71 D 5.6085 8.6071 123.2615 52.7121 43.3187 176.3971 72 T 4.3138 9.2665 114.0937 60.9030 70.0068 172.5691 73 P 4.6256 0.0000 0.0000 61.7525 32.5732 176.4665 74 V 3.8279 8.3581 120.4154 63.2129 31.8398 175.6525 75 A 4.4273 8.0468 128.7200 50.6004 18.7829 175.2962 76 S 4.3725 8.4008 114.1473 58.8682 62.5243 174.1271 77 R 4.3754 7.6926 120.5743 54.3543 29.3772 174.9961 78 K 5.2172 8.2327 123.1876 55.1001 36.1050 175.8032 79 E 5.0073 9.3122 120.1228 55.5217 32.3996 176.5350 80 D 4.3739 8.9599 118.4085 58.1325 41.4005 178.0439 81 T 5.0551 7.6863 106.2254 60.1816 69.2910 172.3471 82 Y 5.6403 7.8743 118.0089 57.7494 42.9667 173.7289 83 V 4.7564 8.6010 122.6797 60.2922 34.2337 173.9362 84 H 5.1381 9.6314 123.5695 55.1152 29.4328 174.0284 85 F 4.5424 9.4639 120.9928 58.6431 40.8125 177.5977 86 N 4.3147 7.9160 113.0246 54.4108 36.8787 174.4087 87 V 4.6202 7.7885 115.2487 60.1078 34.6465 174.1838 88 D 5.4969 8.7562 122.9696 52.9393 42.5478 175.7271 89 I 4.6862 9.0448 116.3246 59.1629 40.8338 173.9739 90 E 4.9265 8.6132 123.5242 54.4138 31.3976 175.5046 91 L 4.1195 8.6840 127.3564 54.6075 42.9088 176.8159 92 Q 4.4357 8.3342 125.7967 55.5319 29.3000 175.9389 93 K 4.1865 7.4551 113.5262 55.7701 35.3801 173.9191 94 H 4.3128 8.6097 123.8526 55.7605 29.4168 175.9475 95 V 3.6526 8.3706 125.0520 66.4202 31.4592 177.5128 96 E 4.1058 8.3452 117.7322 58.3152 29.7598 177.5723 97 K 4.5961 8.3792 119.9386 55.9986 32.1734 176.5270 98 L 4.7966 7.5226 117.5741 52.4882 45.2285 177.2999 99 T 3.8863 8.6162 113.0930 61.7901 68.9140 174.8020 100 K 4.0221 8.7074 125.9296 59.1022 32.2275 177.0163 101 G 4.0728 7.8922 104.7929 44.9254 0.0000 173.0213 102 A 4.6462 8.2801 121.3756 51.9718 19.3891 177.7695 103 A 4.8989 9.1283 120.2822 50.4893 23.4594 175.3533 104 I 4.7411 8.8891 122.0563 60.0254 39.1622 175.2425 105 F 5.4251 9.2214 126.3037 56.2834 41.9318 175.4663 106 F 5.0085 9.7217 119.5530 56.2452 42.8159 173.5590 107 E 5.2955 9.5648 124.8332 54.4936 31.9207 175.2082 108 F 4.8972 8.9640 127.7082 57.6022 40.8784 174.5327 109 K 5.1750 8.1774 124.9652 55.0038 36.6491 174.7475 110 H 5.3879 8.6678 116.7268 54.6323 32.9200 171.1221 111 Y 4.8793 9.1976 120.8457 56.5294 39.6325 175.0184 112 K 4.0960 8.6245 127.5999 54.7867 32.5182 175.7729 113 P 4.0092 0.0000 0.0000 65.6896 31.2420 178.4109 114 K 4.0057 7.5945 115.5174 59.2294 32.3699 178.5535 115 K 3.4647 7.5414 117.8278 57.8026 32.3376 177.0511 116 R 3.5456 8.3732 115.2481 55.8927 26.9676 174.5641 117 F 5.0019 6.7484 110.8681 56.7682 41.5170 173.6466 118 T 5.6284 9.0193 115.9849 62.0630 69.8290 174.8006 119 S 4.7046 8.4213 118.6645 56.8100 67.0980 172.7787 120 T 4.6982 8.3787 118.3799 62.9130 68.4312 174.7056 121 K 4.4005 9.2882 129.4222 59.4383 33.7338 175.9823 122 C 5.0861 8.0135 112.5079 57.7762 33.1416 171.9027 123 F 5.7874 9.2207 113.2925 55.9521 41.4801 173.1201 124 A 5.1903 9.4671 119.9386 50.7840 22.7498 175.1462 125 F 6.1427 8.5102 113.3384 55.8746 41.0259 173.3985 126 M 4.8749 8.6634 117.1623 53.5868 34.5656 175.1653 127 E 4.6898 10.5809 121.7444 55.8178 31.0626 177.9468 128 M 4.0480 8.7856 119.8436 58.9677 31.9981 179.1504 129 D 4.6669 8.1506 112.3782 54.0594 38.8867 176.3347 130 E 4.4067 7.7673 119.4433 56.9776 31.1881 176.0464 131 I 3.9690 7.8275 119.8347 61.4927 36.6095 175.4327 132 K 4.6482 8.7879 124.4130 53.9780 35.5595 174.6461 133 P 4.1485 0.0000 0.0000 64.1728 31.7525 175.0019 134 G 3.6563 8.3232 106.6003 43.1706 0.0000 171.1726 135 P 4.7740 0.0000 0.0000 62.8143 32.4576 175.7205 136 I 4.5048 8.5785 120.4748 59.7553 41.9341 173.7395 137 V 4.6749 8.1978 121.6205 59.6777 33.9283 174.9550 138 I 4.5195 8.2647 126.5290 59.2280 40.0556 175.4215 139 E 4.5406 8.5078 122.9660 55.9756 31.2919 175.3248 140 L 4.5294 7.7114 119.1213 53.0400 44.6027 175.3757 141 Y 5.0198 8.1898 121.0251 55.7991 40.7410 175.6034 142 K 4.6417 8.9858 122.4232 56.2943 32.8867 177.3038 143 K 4.6510 8.2688 121.9320 55.5918 33.7590 175.0762 144 P 4.4036 0.0000 0.0000 62.7342 31.9087 176.2011 145 T 2.6481 7.8474 116.5449 63.0428 68.9190 174.5996 146 D 4.4166 6.8246 125.6201 52.0384 40.7646 176.4098 147 F 3.5905 7.7991 124.3484 58.8645 39.1443 176.9875 148 K 4.3259 8.0351 118.1270 55.8868 33.0455 176.4753 149 R 3.6209 7.7890 117.4698 57.3397 27.6459 175.7753 150 K 4.4096 10.7555 115.8779 56.3083 34.6410 177.6018 151 K 4.5458 8.1822 117.0124 54.3645 34.8776 175.3760 152 L 4.6804 8.4435 123.1748 52.7828 44.9187 175.7698 153 Q 4.6330 8.5216 121.8240 53.6241 31.1522 174.7288 154 L 4.3156 8.7927 126.7528 55.6308 42.1071 176.8345 155 L 4.1290 8.7186 128.7824 58.3438 42.4968 176.7687 156 T 4.2665 7.2641 108.7120 61.4423 69.7460 172.7242 157 K 4.1888 8.4165 124.0700 57.0431 32.8749 177.7648 158 K 3.9404 7.4487 118.6448 56.0386 32.9323 175.6041 159 P 4.4488 0.0000 0.0000 62.1827 29.9094 177.1706 160 L 4.5455 6.8157 117.4719 53.8745 44.0532 176.7041 161 Y 4.6588 8.4806 121.3331 55.8251 42.2761 173.9330 162 L 4.7212 8.9852 122.6463 54.3474 43.8513 174.7766 163 H 5.0524 9.4573 124.5608 54.4203 30.4915 174.0857 164 L 5.8194 8.7406 122.9598 52.2990 46.0665 175.1171 165 H 5.0943 8.4234 118.5385 55.1086 33.3562 171.8174 166 Q 5.0100 9.2719 124.8476 54.6078 31.5179 174.8787 167 S 4.8847 8.7543 117.4956 56.9056 67.0265 172.8273 168 L 5.0173 8.6452 124.4626 53.2154 43.7558 175.4483 169 H 4.9105 8.7046 120.8683 54.8472 31.6186 175.2543 170 K 4.1601 8.7538 120.3601 57.1206 32.1685 175.0679 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 17 V 8.04 3.98 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 0.96 0.00 0.00 0.88 0.00 0.00 18 P 0.00 4.30 0.00 2.28 2.07 0.00 3.72 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 1.95 2.00 0.00 19 G 8.14 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 0.00 0.00 0.00 0.00 20 T 8.40 4.74 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 1.20 0.00 0.00 21 L 8.07 4.36 0.00 1.70 1.67 0.99 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 22 L 9.19 4.67 0.00 1.59 1.59 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.46 0.00 2.05 1.99 0.00 3.70 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 24 R 8.33 3.98 0.00 1.78 1.84 0.00 3.21 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 25 L 8.22 4.27 0.00 1.61 1.59 0.84 1.07 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 26 P 0.00 4.46 0.00 2.20 2.07 0.00 3.80 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 2.04 1.98 0.00 27 S 8.43 4.45 0.00 4.04 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 28 E 8.36 4.73 0.00 1.80 1.74 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 2.24 2.17 0.00 29 P 0.00 4.44 0.00 2.03 1.99 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 30 G 9.03 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 0.00 0.00 0.00 31 M 7.51 5.07 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.68 0.00 32 T 8.46 4.94 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 33 L 8.45 4.75 0.00 1.72 1.67 0.97 0.80 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 34 L 8.48 4.99 0.00 1.77 1.54 0.93 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 35 T 8.96 4.97 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 36 I 8.82 4.89 2.02 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.71 1.08 0.00 0.00 37 R 9.02 4.85 0.00 2.06 2.00 0.00 3.42 0.00 0.00 3.15 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 38 I 8.82 4.12 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 1.26 1.08 0.68 0.00 0.00 39 E 9.37 4.27 0.00 2.04 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 2.40 0.00 40 K 7.66 5.19 0.00 1.68 1.74 0.00 0.91 0.00 0.00 1.49 0.00 0.00 2.31 0.00 0.00 2.16 0.00 0.00 0.00 0.00 1.31 1.36 7.81 41 I 8.71 5.12 1.98 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.39 1.12 0.00 0.00 42 G 9.21 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.74 4.31 0.00 1.33 1.27 0.02 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.82 3.81 0.00 1.65 1.80 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.30 7.81 45 D 7.68 4.80 0.00 2.79 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 46 A 7.63 3.69 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 47 G 8.28 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 7.82 4.42 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 49 C 8.10 4.44 0.00 3.17 3.04 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 0.00 0.00 0.00 0.00 50 I 8.53 4.35 2.27 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 1.54 0.62 1.07 0.00 0.00 51 D 8.75 4.45 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 52 P 0.00 4.87 0.00 2.16 2.28 0.00 3.74 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.06 0.00 53 Y 8.50 5.70 0.00 3.31 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 9.47 4.90 1.63 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 1.28 0.58 1.03 0.00 0.00 55 T 8.81 5.23 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 1.29 0.00 0.00 56 V 9.53 5.20 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 1.03 0.00 0.00 0.92 0.00 0.00 57 S 8.46 5.02 0.00 3.83 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 58 V 8.20 4.94 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 1.05 0.00 0.00 0.93 0.00 0.00 59 K 9.23 5.77 0.00 1.78 1.54 0.00 0.77 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.18 0.90 7.81 60 D 8.29 5.19 0.00 2.91 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 61 L 8.49 4.19 0.00 1.67 1.81 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 62 N 8.35 4.68 0.00 2.82 2.81 0.00 0.00 6.87 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.22 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 0.00 0.00 0.00 64 I 8.27 4.23 2.12 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.77 0.84 0.00 0.00 65 D 8.41 4.71 0.00 2.53 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 66 L 8.48 4.65 0.00 1.70 1.63 0.93 0.85 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 67 T 7.10 4.16 4.36 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 1.21 0.00 0.00 68 P 0.00 4.38 0.00 2.05 2.01 0.00 3.65 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 2.01 2.05 0.00 69 V 8.01 4.20 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 0.77 0.00 0.00 0.86 0.00 0.00 70 Q 9.06 4.76 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.55 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 71 D 8.61 5.61 0.00 2.70 2.74 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 72 T 9.27 4.31 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 73 P 0.00 4.63 0.00 2.03 2.06 0.00 3.82 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 2.09 2.12 0.00 74 V 8.36 3.83 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 0.84 0.00 0.00 0.90 0.00 0.00 75 A 8.05 4.43 0.54 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 0.00 0.00 76 S 8.40 4.37 0.00 3.83 3.84 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 77 R 7.69 4.38 0.00 1.85 1.79 0.00 3.11 0.00 0.00 3.36 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 78 K 8.23 5.22 0.00 1.89 1.75 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.46 7.81 79 E 9.31 5.01 0.00 2.09 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 2.24 2.35 0.00 80 D 8.96 4.37 0.00 2.72 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 81 T 7.69 5.06 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 82 Y 7.87 5.64 0.00 3.09 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 83 V 8.60 4.76 2.21 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 1.16 0.00 0.00 0.80 0.00 0.00 84 H 9.63 5.14 0.00 3.09 3.47 0.00 5.81 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 85 F 9.46 4.54 0.00 3.11 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 86 N 7.92 4.31 0.00 2.91 2.92 0.00 0.00 6.98 7.41 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 87 V 7.79 4.62 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 1.15 0.00 0.00 1.03 0.00 0.00 88 D 8.76 5.50 0.00 2.62 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.04 4.69 1.92 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 1.57 1.17 1.00 0.00 0.00 90 E 8.61 4.93 0.00 1.87 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 2.34 0.00 91 L 8.68 4.12 0.00 1.77 1.57 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.33 4.44 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 93 K 7.46 4.19 0.00 1.63 1.64 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.43 7.81 94 H 8.61 4.31 0.00 3.30 3.25 0.00 5.91 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.37 3.65 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 0.77 0.00 0.00 1.02 0.00 0.00 96 E 8.35 4.11 0.00 2.13 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 2.42 2.42 0.00 97 K 8.38 4.60 0.00 1.88 1.80 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.39 7.81 98 L 7.52 4.80 0.00 1.60 1.56 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.62 3.89 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 100 K 8.71 4.02 0.00 2.00 1.95 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.06 7.81 101 G 7.89 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 0.00 0.00 0.00 102 A 8.28 4.65 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 0.00 103 A 9.13 4.90 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 0.00 104 I 8.89 4.74 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 1.27 0.77 0.74 0.00 0.00 105 F 9.22 5.43 0.00 3.14 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 0.00 106 F 9.72 5.01 0.00 3.00 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 0.00 107 E 9.56 5.30 0.00 1.93 1.94 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 2.39 2.45 0.00 108 F 8.96 4.90 0.00 3.25 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 0.00 109 K 8.18 5.17 0.00 0.79 1.44 0.00 1.34 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.22 1.19 7.81 110 H 8.67 5.39 0.00 3.51 3.34 0.00 5.44 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 Y 9.20 4.88 0.00 2.97 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 0.00 112 K 8.62 4.10 0.00 1.77 1.53 0.00 2.18 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.41 7.81 113 P 0.00 4.01 0.00 1.99 2.16 0.00 3.59 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 2.05 2.20 0.00 114 K 7.59 4.01 0.00 1.63 1.73 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.41 7.81 115 K 7.54 3.46 0.00 0.84 0.74 0.00 1.71 0.00 0.00 1.52 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.26 1.33 7.81 116 R 8.37 3.55 0.00 1.82 2.08 0.00 3.18 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 117 F 6.75 5.00 0.00 2.96 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 0.00 118 T 9.02 5.63 4.37 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 1.44 0.00 0.00 119 S 8.42 4.70 0.00 3.82 3.92 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 0.00 120 T 8.38 4.70 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 1.39 0.00 0.00 121 K 9.29 4.40 0.00 2.26 2.06 0.00 1.72 0.00 0.00 1.62 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.54 7.81 122 C 8.01 5.09 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.22 5.79 0.00 3.29 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 0.00 124 A 9.47 5.19 1.24 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 0.00 0.00 125 F 8.51 6.14 0.00 2.38 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 0.00 0.00 0.00 126 M 8.66 4.87 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.83 0.00 127 E 10.58 4.69 0.00 2.20 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 2.56 2.50 0.00 128 M 8.79 4.05 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.71 0.00 129 D 8.15 4.67 0.00 2.77 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 0.00 130 E 7.77 4.41 0.00 2.15 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 2.23 2.35 0.00 131 I 7.83 3.97 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.63 0.93 0.00 0.00 132 K 8.79 4.65 0.00 1.80 1.70 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.54 1.33 7.81 133 P 0.00 4.15 0.00 2.19 2.10 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 134 G 8.32 3.66 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 0.00 0.00 0.00 135 P 0.00 4.77 0.00 2.03 2.03 0.00 3.66 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.92 0.00 136 I 8.58 4.50 1.78 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.38 0.82 0.00 0.00 137 V 8.20 4.67 1.66 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 0.47 0.00 0.00 0.54 0.00 0.00 138 I 8.26 4.52 1.67 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 1.11 0.45 0.72 0.00 0.00 139 E 8.51 4.54 0.00 1.64 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 1.47 1.88 0.00 140 L 7.71 4.53 0.00 1.29 1.33 0.76 0.59 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 0.00 141 Y 8.19 5.02 0.00 1.43 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.99 4.64 0.00 1.71 1.83 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.56 7.81 143 K 8.27 4.65 0.00 1.83 1.95 0.00 1.55 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.80 1.69 7.81 144 P 0.00 4.40 0.00 2.10 2.05 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 145 T 7.85 2.65 3.14 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 0.00 0.00 -0.47 0.00 0.00 146 D 6.82 4.42 0.00 2.59 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 0.00 0.00 0.00 0.00 147 F 7.80 3.59 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 0.00 148 K 8.04 4.33 0.00 1.85 1.83 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.43 7.81 149 R 7.79 3.62 0.00 1.58 1.32 0.00 3.00 0.00 0.00 2.82 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.72 0.00 150 K 10.76 4.41 0.00 1.70 1.81 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.50 7.81 151 K 8.18 4.55 0.00 1.67 1.67 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.41 7.81 152 L 8.44 4.68 0.00 1.22 0.73 0.51 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.52 4.63 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.05 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 154 L 8.79 4.32 0.00 1.74 1.62 0.80 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.72 4.13 0.00 1.58 1.55 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 156 T 7.26 4.27 4.11 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 1.03 0.00 0.00 157 K 8.42 4.19 0.00 1.73 1.80 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.42 7.81 158 K 7.45 3.94 0.00 1.61 1.64 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.32 7.81 159 P 0.00 4.45 0.00 2.32 2.19 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 160 L 6.82 4.55 0.00 1.19 1.34 0.70 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 161 Y 8.48 4.66 0.00 2.77 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 L 8.99 4.72 0.00 1.62 1.53 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 163 H 9.46 5.05 0.00 3.23 3.39 0.00 5.80 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 L 8.74 5.82 0.00 1.39 1.44 0.19 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 165 H 8.42 5.09 0.00 3.30 3.07 0.00 5.65 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 Q 9.27 5.01 0.00 2.26 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 167 S 8.75 4.88 0.00 3.90 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 0.00 168 L 8.65 5.02 0.00 1.45 1.54 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 169 H 8.70 4.91 0.00 3.11 3.18 0.00 5.77 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 K 8.75 4.16 0.00 1.92 1.79 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.44 7.81