NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2990 8.3144 120.1283 56.3682 34.4123 177.1805 3 C 4.7931 7.6759 116.2855 54.9649 43.4589 171.3009 4 M 4.9000 8.5231 119.6443 54.6969 34.9611 175.2679 5 E 4.4488 8.8129 118.5429 55.8799 31.1827 176.1976 6 A 4.3058 8.5143 124.9012 52.1541 18.5404 177.6940 7 L 4.1039 8.4772 122.7021 55.6535 42.2739 176.7163 8 G 3.6292 7.7612 109.8920 43.9823 0.0000 175.4451 9 M 3.7962 7.8335 120.8415 58.5924 32.1548 177.4774 10 E 4.0492 8.2909 119.0070 58.8974 30.3365 178.2676 11 S 4.2392 7.8916 113.0539 59.2463 64.1040 175.4085 12 G 4.0454 8.5712 109.2827 45.4839 0.0000 175.0858 13 E 3.8423 8.1284 119.4354 58.5660 29.5257 176.5195 14 I 4.2473 6.8498 118.2086 59.5501 37.7983 175.4060 15 H 4.5419 9.4246 123.7701 55.4961 29.5203 177.1035 16 S 4.1345 8.7130 117.7487 61.8808 62.7457 176.0997 17 D 4.6159 8.0534 116.2378 54.4723 39.3853 176.5217 18 Q 4.3215 8.1656 119.2803 56.5485 29.5128 174.7196 19 I 5.1012 7.5262 119.8557 59.8042 38.5948 175.2713 20 T 4.8789 9.0096 116.1902 60.1091 72.7438 172.3719 21 A 4.4513 8.1109 122.9206 49.8386 22.2747 176.2813 22 S 3.2510 7.3473 114.3507 61.1615 63.3615 174.4334 23 S 4.4987 7.3506 111.8950 57.9893 64.9542 174.3842 24 Q 4.7334 8.3031 117.0722 54.7067 31.1426 173.9531 25 Y 3.8473 9.1071 123.6943 59.8568 39.0233 176.0387 26 S 4.6918 7.7154 112.3174 57.9277 64.5984 177.5245 27 T 3.6008 8.7034 110.6668 64.5180 68.2127 174.8869 28 N 4.4841 7.8428 118.3569 54.6047 39.0405 175.2276 29 W 5.6121 9.0824 120.2829 55.0403 30.6190 175.2638 30 S 4.9521 8.1101 112.1524 57.4323 64.0698 174.6842 31 A 4.0229 8.7404 123.8321 55.3720 18.0808 179.1923 32 E 4.1123 8.0933 110.3668 57.6980 29.7370 177.2574 33 R 3.0579 7.8792 118.9727 55.9314 30.2994 177.3323 34 S 4.8791 7.7234 112.6052 58.1246 63.8537 174.3149 35 R 3.8698 7.5405 121.9340 55.8858 30.2974 175.5696 36 L 3.9800 7.7643 124.0712 57.2682 42.2463 176.7355 37 N 4.4763 9.3107 121.7594 53.6665 36.4589 173.7679 38 Y 4.0314 8.0468 120.8536 57.5211 39.0381 175.2761 39 P 4.2064 0.0000 0.0000 63.6848 32.0349 175.7735 40 E 4.3517 6.9302 118.5714 55.0742 31.6925 175.9580 41 N 3.7030 8.5977 124.7149 54.0104 37.6046 172.0195 42 G 4.3076 7.4925 105.3948 46.9309 0.0000 171.1508 43 W 5.3483 8.8131 131.2681 56.8703 32.6107 177.0070 44 T 4.0928 8.2926 122.5495 59.4266 71.5440 172.3648 45 P 4.5091 0.0000 0.0000 62.0754 31.9961 177.1492 46 G 3.6119 8.5595 107.2805 46.4772 0.0000 172.9701 47 E 4.4458 6.9838 114.9544 56.0512 32.2701 175.7257 48 D 4.1637 8.3551 120.2321 52.8838 40.5282 175.7442 49 S 3.7265 7.3662 119.6595 57.4659 64.8504 172.8788 50 Y 4.9384 8.3154 114.1363 58.9265 39.7023 176.6110 51 R 4.6010 8.2036 117.8539 56.2455 30.4301 175.6270 52 E 4.7111 7.4277 117.0708 54.6480 31.9506 175.4251 53 W 5.4334 7.8213 116.2420 56.5967 31.9819 173.0052 54 I 4.7739 7.9600 121.4173 59.1778 40.9530 173.8387 55 Q 5.2431 9.4572 125.9858 54.5669 32.7336 173.9595 56 V 5.0167 8.8264 119.0402 60.0355 34.9454 174.2527 57 D 4.2735 8.8094 122.9088 52.2860 41.5858 175.8798 58 L 3.9266 8.6930 127.8551 56.4269 41.6073 178.9554 59 G 3.8328 9.4089 107.7223 44.4269 0.0000 172.6560 60 L 4.3382 6.7469 117.1905 54.7994 42.4873 173.9258 61 L 4.3533 8.5422 119.5593 55.5408 42.1135 176.9928 62 R 4.6504 8.7034 120.3792 54.6489 35.7007 173.9420 63 F 5.0582 8.8378 119.8589 57.1909 40.4044 175.0982 64 V 5.0468 9.4557 124.3616 61.4943 33.7205 175.6597 65 T 4.3323 8.7064 117.0017 61.8672 71.4811 173.3482 66 A 3.7950 6.8599 121.4281 51.2010 22.5567 175.2447 67 V 5.0768 8.3132 111.1977 59.7517 36.4436 175.2193 68 G 4.8569 9.6583 110.9628 44.8306 0.0000 172.2623 69 T 5.5295 8.7374 112.3414 60.1079 73.2284 172.2228 70 Q 4.8655 8.8706 120.0247 54.1180 33.7419 174.2710 71 G 4.6867 8.2209 108.5524 46.6463 0.0000 173.0253 72 A 4.7910 9.3276 122.3495 51.5061 23.4046 175.6806 73 I 5.2189 8.5320 120.4413 59.3804 40.0498 175.6798 74 S 4.7775 8.9609 121.7055 58.0011 63.5217 175.3047 75 K 3.7979 9.0529 125.2760 59.2425 32.2841 177.7359 76 E 4.2733 8.3898 118.1803 58.0962 30.0042 176.7272 77 T 4.3637 8.7972 106.7735 60.7361 70.0072 175.5491 78 K 4.1099 8.4216 120.2460 56.2278 31.0328 176.4318 79 K 4.1018 7.7185 119.7397 56.3636 33.1791 175.9950 80 K 4.8614 8.3161 123.5176 55.2963 33.6262 175.4897 81 Y 5.1037 8.9899 122.9540 56.4683 41.7458 174.2861 82 Y 5.1400 7.8957 118.3620 56.1740 42.1671 173.4298 83 V 4.4852 8.6039 122.3788 62.9263 32.7649 176.4898 84 K 4.7971 9.8496 128.0913 58.1081 33.4227 176.8808 85 T 5.4519 7.8837 108.2767 60.5110 72.6467 172.4299 86 Y 5.3862 8.4026 118.6206 56.5409 41.8296 173.4040 87 K 5.1133 9.0684 119.8697 55.0000 35.8487 175.2394 88 I 5.2583 8.4243 121.3235 59.8447 40.8749 174.2263 89 D 5.6885 9.2528 126.1615 52.7564 43.8265 175.7351 90 V 5.3792 9.0170 114.6994 59.0205 36.1927 174.5214 91 S 4.7025 8.2450 114.6782 57.0549 65.6570 174.8184 92 S 4.5725 8.6686 119.2016 59.2415 63.8523 174.6793 93 N 4.8637 8.3675 118.4713 52.6023 37.9844 175.5486 94 G 2.1698 7.3426 103.9358 46.0134 0.0000 173.5064 95 E 4.2020 7.4094 117.4138 57.3185 31.2942 175.6599 96 D 4.5958 7.8600 117.9128 53.2151 41.6951 175.8039 97 W 4.9076 8.7460 123.3793 54.9725 31.4388 175.0318 98 I 4.5856 8.8161 126.0446 59.8403 39.3271 175.0246 99 T 5.1126 8.3160 122.5613 61.7056 70.1358 174.5987 100 I 3.7424 8.5226 126.3329 61.9639 37.7781 175.5735 101 K 4.7114 8.5127 126.5414 54.6009 34.0650 176.1686 102 E 4.3428 9.0942 123.5635 55.3445 31.3115 178.2504 103 G 3.9677 9.2996 118.4943 46.6800 0.0000 172.9134 104 N 4.9344 9.4929 114.6346 52.4405 40.3808 172.2256 105 K 4.5188 8.2786 116.8224 53.6599 34.3943 173.7808 106 P 4.3268 0.0000 0.0000 63.1285 31.7947 175.4210 107 V 3.8438 8.0130 122.2915 61.4250 32.5281 175.0250 108 L 4.2928 8.0862 130.4299 53.5226 42.6441 175.6398 109 F 4.4422 8.5252 126.5734 57.2726 40.2762 174.9808 110 Q 4.6318 8.8310 122.2501 54.3485 29.6144 174.5860 111 G 4.4621 9.2611 109.3921 46.8144 0.0000 176.1939 112 N 5.2027 9.2566 122.8085 52.1155 40.1289 174.3992 113 T 4.6320 8.3565 109.1734 61.2018 70.0497 172.6169 114 N 4.2127 6.9867 118.1615 51.3457 40.3725 171.8113 115 P 4.7569 0.0000 0.0000 63.5562 32.3266 177.0919 116 T 4.3514 7.8405 107.5176 62.3345 70.0119 174.7809 117 D 4.6101 8.4875 122.0538 53.6120 41.6745 175.6818 118 V 4.2880 8.1400 121.5679 61.8324 32.8357 175.3567 119 V 4.4096 8.3483 126.6929 61.1689 34.2607 174.1029 120 V 4.6697 8.5860 128.1684 61.7796 32.9523 174.6276 121 A 4.7361 9.1019 130.3555 50.2418 21.1243 175.1308 122 V 4.3461 8.3568 123.0521 61.6619 32.5713 176.0909 123 F 4.9505 8.3365 127.1980 56.9924 39.5414 173.5565 124 P 4.5038 0.0000 0.0000 65.1924 31.3318 176.8288 125 K 4.8144 7.7701 113.9319 53.5350 35.9370 173.9405 126 P 4.7563 0.0000 0.0000 62.7921 32.0428 175.8694 127 L 4.9754 9.3852 123.7889 53.1242 45.2348 175.7820 128 I 4.9697 8.3657 122.6863 59.8523 38.5105 174.3203 129 T 4.5223 7.9664 121.8084 61.4553 70.5979 172.8963 130 R 4.2901 8.7030 116.8141 57.0246 34.1986 175.2453 131 F 5.2398 8.5687 117.8307 55.6139 41.5840 175.1706 132 V 4.8327 8.7752 123.4628 61.1116 34.1634 173.9824 133 R 5.0820 9.4710 128.7745 54.6335 32.9233 174.1170 134 I 4.6984 8.7767 127.7617 60.2631 39.3984 175.1698 135 K 4.5703 9.4368 125.9043 53.3218 34.2686 172.9008 136 P 4.7916 0.0000 0.0000 63.5201 31.2850 175.5185 137 A 5.1179 9.6034 125.9215 53.2939 21.3602 176.3937 138 T 4.0233 7.8634 104.1742 60.4757 72.7385 172.9332 139 W 5.1785 7.3104 118.1559 56.1519 30.8192 172.6485 140 E 4.3042 8.4643 120.9149 55.9613 30.8935 175.5486 141 T 3.4132 9.7641 128.6130 62.9628 66.8142 171.8967 142 G 3.9550 7.3937 104.8792 45.4754 0.0000 172.0000 143 I 3.8791 7.2648 120.1706 59.7719 37.3445 175.2417 144 S 4.7867 8.1562 119.3749 57.1224 65.5777 172.8262 145 M 5.8196 9.2357 124.3306 53.8313 36.9724 174.1198 146 R 5.4518 8.7192 119.1297 54.9915 35.2792 174.1112 147 F 5.8011 9.5309 117.0355 56.8291 42.1892 172.1740 148 E 4.6387 8.7929 117.5363 54.9722 33.0612 173.6298 149 V 4.7226 8.1418 125.2225 61.4836 34.3635 173.7525 150 Y 5.1637 9.4300 124.8275 55.9996 41.2895 175.8422 151 G 4.5758 8.8408 109.3324 46.7812 0.0000 169.2610 152 C 5.6772 7.7317 114.4008 55.1579 44.2921 173.6284 153 K 4.5950 8.3869 119.6931 56.1561 32.3125 177.1201 154 I 3.8415 7.8063 122.1752 61.9566 37.8780 176.5167 155 T 3.6645 9.3304 120.1276 64.0115 68.0330 171.7324 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 K 8.31 4.30 0.00 1.71 1.88 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.41 7.81 3 C 7.68 4.79 0.00 2.84 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 4 M 8.52 4.90 0.00 1.91 1.96 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 5 E 8.81 4.45 0.00 2.05 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 6 A 8.51 4.31 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 7 L 8.48 4.10 0.00 1.51 1.68 0.94 0.93 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 8 G 7.76 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 M 7.83 3.80 0.00 1.72 2.13 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.24 0.00 10 E 8.29 4.05 0.00 1.92 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 2.30 2.34 0.00 11 S 7.89 4.24 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 12 G 8.57 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.13 3.84 0.00 1.90 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 2.24 2.32 0.00 14 I 6.85 4.25 1.90 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.78 0.85 0.00 0.00 15 H 9.42 4.54 0.00 3.37 3.19 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.71 4.13 0.00 3.88 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 17 D 8.05 4.62 0.00 2.79 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.17 4.32 0.00 2.29 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 19 I 7.53 5.10 1.95 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.54 1.00 0.00 0.00 20 T 9.01 4.88 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 1.31 0.00 0.00 21 A 8.11 4.45 0.81 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 0.00 0.00 22 S 7.35 3.25 0.00 3.41 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.35 4.50 0.00 3.85 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 24 Q 8.30 4.73 0.00 2.41 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.07 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 25 Y 9.11 3.85 0.00 2.80 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 26 S 7.72 4.69 0.00 4.10 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 27 T 8.70 3.60 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 1.23 0.00 0.00 28 N 7.84 4.48 0.00 2.78 2.56 0.00 0.00 6.74 7.53 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 29 W 9.08 5.61 0.00 3.21 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 30 S 8.11 4.95 0.00 4.13 4.04 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 31 A 8.74 4.02 1.25 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 0.00 0.00 0.00 32 E 8.09 4.11 0.00 2.01 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 2.21 2.20 0.00 33 R 7.88 3.06 0.00 1.96 1.52 0.00 2.94 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.24 0.00 34 S 7.72 4.88 0.00 4.36 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 0.00 35 R 7.54 3.87 0.00 1.97 1.96 0.00 3.23 0.00 0.00 3.45 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 36 L 7.76 3.98 0.00 1.66 1.59 1.06 1.21 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 37 N 9.31 4.48 0.00 3.07 2.99 0.00 0.00 6.99 7.07 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 38 Y 8.05 4.03 0.00 3.21 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 39 P 0.00 4.21 0.00 2.04 1.99 0.00 2.20 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 40 E 6.93 4.35 0.00 2.04 1.82 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 2.10 2.01 0.00 41 N 8.60 3.70 0.00 2.12 1.42 0.00 0.00 6.92 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 42 G 7.49 4.31 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 0.00 43 W 8.81 5.35 0.00 3.47 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.29 4.09 3.54 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 0.36 0.00 0.00 45 P 0.00 4.51 0.00 2.01 1.89 0.00 2.85 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.28 0.00 46 G 8.56 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 47 E 6.98 4.45 0.00 1.95 1.77 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 1.97 2.14 0.00 48 D 8.36 4.16 0.00 2.60 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 0.00 0.00 0.00 0.00 49 S 7.37 3.73 0.00 3.74 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 50 Y 8.32 4.94 0.00 3.22 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 51 R 8.20 4.60 0.00 1.91 2.06 0.00 3.28 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.89 0.00 52 E 7.43 4.71 0.00 1.89 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 2.15 2.28 0.00 53 W 7.82 5.43 0.00 3.29 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 54 I 7.96 4.77 0.56 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.66 0.17 0.00 0.00 55 Q 9.46 5.24 0.00 2.46 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.49 0.00 0.00 0.00 0.00 0.00 2.80 2.59 0.00 56 V 8.83 5.02 2.34 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 0.83 0.00 0.00 0.95 0.00 0.00 57 D 8.81 4.27 0.00 2.59 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 58 L 8.69 3.93 0.00 1.49 1.65 0.93 1.01 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 59 G 9.41 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 6.75 4.34 0.00 1.55 1.56 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.54 4.35 0.00 1.46 1.54 0.86 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 62 R 8.70 4.65 0.00 1.68 1.78 0.00 3.28 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.71 0.00 63 F 8.84 5.06 0.00 3.27 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 V 9.46 5.05 2.38 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 1.37 0.00 0.00 1.06 0.00 0.00 65 T 8.71 4.33 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 1.21 0.00 0.00 66 A 6.86 3.80 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 67 V 8.31 5.08 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 0.98 0.00 0.00 1.11 0.00 0.00 68 G 9.66 4.86 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 0.00 0.00 0.00 69 T 8.74 5.53 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 1.15 0.00 0.00 70 Q 8.87 4.87 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.51 2.25 0.00 71 G 8.22 4.69 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 72 A 9.33 4.79 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 73 I 8.53 5.22 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.82 1.02 0.00 0.00 74 S 8.96 4.78 0.00 4.43 4.53 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 75 K 9.05 3.80 0.00 1.71 1.93 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.47 7.81 76 E 8.39 4.27 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 77 T 8.80 4.36 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 1.27 0.00 0.00 78 K 8.42 4.11 0.00 1.96 2.07 0.00 1.63 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.46 7.81 79 K 7.72 4.10 0.00 1.66 1.24 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.77 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.40 7.81 80 K 8.32 4.86 0.00 1.66 1.89 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 81 Y 8.99 5.10 0.00 2.97 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 82 Y 7.90 5.14 0.00 3.05 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 83 V 8.60 4.49 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 1.41 0.00 0.00 1.09 0.00 0.00 84 K 9.85 4.80 0.00 1.84 1.97 0.00 1.82 0.00 0.00 1.97 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.94 1.32 7.81 85 T 7.88 5.45 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 86 Y 8.40 5.39 0.00 3.30 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 87 K 9.07 5.11 0.00 1.84 1.80 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.48 7.81 88 I 8.42 5.26 2.04 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 1.61 1.46 0.98 0.00 0.00 89 D 9.25 5.69 0.00 2.44 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 90 V 9.02 5.38 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 1.17 0.00 0.00 0.97 0.00 0.00 91 S 8.24 4.70 0.00 2.83 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.67 4.57 0.00 3.98 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 93 N 8.37 4.86 0.00 2.77 2.91 0.00 0.00 6.77 6.71 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 94 G 7.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 7.41 4.20 0.00 1.75 1.90 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 2.09 2.16 0.00 96 D 7.86 4.60 0.00 2.40 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 0.00 0.00 0.00 0.00 97 W 8.75 4.91 0.00 3.03 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 98 I 8.82 4.59 1.90 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 1.21 1.04 0.93 0.00 0.00 99 T 8.32 5.11 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 1.30 0.00 0.00 100 I 8.52 3.74 1.94 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.73 0.89 0.00 0.00 101 K 8.51 4.71 0.00 1.87 1.79 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.34 7.81 102 E 9.09 4.34 0.00 1.96 1.79 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 2.23 2.28 0.00 103 G 9.30 3.97 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 0.00 0.00 0.00 104 N 9.49 4.93 0.00 2.62 2.74 0.00 0.00 6.65 6.68 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 0.00 105 K 8.28 4.52 0.00 1.88 1.85 0.00 1.37 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.35 7.81 106 P 0.00 4.33 0.00 2.01 2.02 0.00 3.63 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 107 V 8.01 3.84 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 -0.48 0.00 0.00 0.79 0.00 0.00 108 L 8.09 4.29 0.00 1.57 1.47 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 109 F 8.53 4.44 0.00 2.19 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 0.00 110 Q 8.83 4.63 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 111 G 9.26 4.46 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 0.00 112 N 9.26 5.20 0.00 3.17 2.90 0.00 0.00 6.88 6.33 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 0.00 113 T 8.36 4.63 4.22 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 1.26 0.00 0.00 114 N 6.99 4.21 0.00 2.63 2.63 0.00 0.00 6.06 7.75 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 0.00 115 P 0.00 4.76 0.00 2.38 2.59 0.00 3.65 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 2.07 2.04 0.00 116 T 7.84 4.35 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 1.25 0.00 0.00 117 D 8.49 4.61 0.00 2.81 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 0.00 118 V 8.14 4.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.99 0.00 0.00 119 V 8.35 4.41 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 1.02 0.00 0.00 0.98 0.00 0.00 120 V 8.59 4.67 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 0.63 0.00 0.00 0.77 0.00 0.00 121 A 9.10 4.74 1.20 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 0.00 0.00 122 V 8.36 4.35 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 0.79 0.00 0.00 0.87 0.00 0.00 123 F 8.34 4.95 0.00 3.40 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 0.00 124 P 0.00 4.50 0.00 2.12 2.42 0.00 3.88 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 125 K 7.77 4.81 0.00 1.79 1.74 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.48 7.81 126 P 0.00 4.76 0.00 1.93 1.92 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.08 0.00 127 L 9.39 4.98 0.00 1.82 1.68 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 128 I 8.37 4.97 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.75 0.77 0.00 0.00 129 T 7.97 4.52 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 130 R 8.70 4.29 0.00 1.79 1.93 0.00 3.10 0.00 0.00 3.37 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.38 0.00 131 F 8.57 5.24 0.00 2.78 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 0.00 132 V 8.78 4.83 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.11 0.00 0.00 133 R 9.47 5.08 0.00 1.54 1.58 0.00 2.21 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.38 0.00 134 I 8.78 4.70 1.53 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.69 0.55 0.00 0.00 135 K 9.44 4.57 0.00 1.83 1.85 0.00 1.69 0.00 0.00 1.47 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.40 7.81 136 P 0.00 4.79 0.00 2.01 2.20 0.00 4.01 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 137 A 9.60 5.12 1.43 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 0.00 0.00 0.00 138 T 7.86 4.02 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 1.08 0.00 0.00 139 W 7.31 5.18 0.00 3.42 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 0.00 140 E 8.46 4.30 0.00 1.57 1.12 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 2.06 2.04 0.00 141 T 9.76 3.41 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 0.76 0.00 0.00 142 G 7.39 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 0.00 143 I 7.26 3.88 1.15 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 -0.29 -0.36 0.46 0.00 0.00 144 S 8.16 4.79 0.00 3.42 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 0.00 145 M 9.24 5.82 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.48 0.00 146 R 8.72 5.45 0.00 1.84 1.85 0.00 3.36 0.00 0.00 3.74 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.77 0.00 147 F 9.53 5.80 0.00 3.14 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 0.00 148 E 8.79 4.64 0.00 1.91 1.60 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 1.68 1.47 0.00 149 V 8.14 4.72 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 1.04 0.00 0.00 1.12 0.00 0.00 150 Y 9.43 5.16 0.00 2.83 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 0.00 151 G 8.84 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.73 5.68 0.00 3.15 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 K 8.39 4.60 0.00 1.81 1.80 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.48 7.81 154 I 7.81 3.84 1.68 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.16 0.48 0.00 0.00 155 T 9.33 3.66 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 1.25 0.00 0.00