NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.2973 8.3044 120.3553 55.5132 32.1707 172.9752 3 F 4.1956 8.3532 125.3463 55.8304 39.2945 173.9369 4 L 4.1267 7.4346 128.8894 53.9096 43.3385 177.6894 5 R 4.1303 8.2671 119.0237 56.0191 31.3454 177.7185 6 Q 4.1484 8.6614 118.6034 59.7547 28.4853 178.7315 7 E 4.0108 8.2236 119.9171 59.4526 29.5288 179.0117 8 D 4.4351 8.0799 118.2304 57.0037 40.9107 178.4603 9 F 4.2801 8.4716 121.3401 61.0103 39.2305 176.9965 10 A 4.3113 8.5126 120.6637 55.7162 18.0458 179.7378 11 T 3.6102 7.6784 112.7513 66.5497 68.8450 176.7421 12 V 3.6568 7.9724 120.3910 66.0994 31.3795 178.2411 13 V 3.4428 7.5343 116.7489 66.0792 31.4054 177.8730 14 R 3.7537 7.6683 116.8822 58.4184 29.8523 178.1998 15 S 4.6163 7.3892 112.2813 58.1875 64.3023 173.7313 16 T 4.5171 6.7624 113.5948 59.7764 69.9007 170.7620 17 P 4.4777 0.0000 0.0000 62.8244 32.0529 176.1175 18 L 4.3690 8.8493 122.6552 54.4919 43.6202 175.7250 19 V 5.0722 8.3419 120.4392 61.3184 34.3171 174.4955 20 S 5.2988 9.2993 121.2442 56.7472 67.4449 172.4056 21 L 5.4119 8.8207 120.3309 53.1969 43.9758 175.3823 22 D 5.1412 8.9688 123.2974 52.4008 43.9630 175.1210 23 F 5.3688 8.7401 121.6413 56.1102 41.2553 175.6157 24 I 4.1423 8.9781 126.2678 59.9677 37.9067 174.3153 25 V 4.4064 8.2237 127.5139 60.9727 33.3594 173.8024 26 E 4.8469 9.1717 129.8007 54.7986 31.8822 175.3660 27 N 4.8471 7.9527 123.3601 51.7840 39.4495 174.8514 28 S 4.2752 8.1424 113.0288 60.1158 63.2430 174.6807 29 R 4.3578 8.1165 119.0407 55.4403 30.1748 176.1326 30 G 3.8921 8.0598 104.5636 45.8915 0.0000 173.4902 31 E 4.9211 7.8180 117.4461 54.1332 33.3903 174.8961 32 F 5.5767 9.0858 119.7261 55.5998 42.9884 174.2666 33 L 3.9845 8.5994 125.1676 54.5730 42.4118 176.0609 34 L 5.0978 8.9980 125.9691 52.9359 45.9723 175.7163 35 G 3.8889 9.0218 109.3031 44.0268 0.0000 172.2134 36 K 4.1120 7.8013 124.4647 54.6302 33.0006 176.2646 37 R 4.5745 8.7407 128.4988 56.7414 30.6950 177.5862 38 T 4.3108 8.6059 112.8822 61.7039 70.0422 174.3270 39 N 5.0253 7.7778 119.7620 51.2949 41.1697 174.2677 40 R 4.1694 8.1178 119.5735 55.1429 30.6182 174.8950 41 P 4.2689 0.0000 0.0000 62.3457 32.5264 175.5566 42 A 3.5839 8.0957 116.9672 52.8838 15.8510 176.9284 43 Q 4.1282 6.7330 116.5839 58.4155 29.4882 176.6940 44 G 3.8050 8.9698 113.4410 45.5331 0.0000 172.6689 45 Y 4.8014 7.4644 117.4583 55.9557 40.7645 175.1811 46 W 4.6956 9.2263 122.9414 57.0024 30.3845 175.2449 47 F 5.0459 9.3577 125.3479 56.6151 42.8135 174.0168 48 V 4.3663 8.0369 117.3251 60.8232 32.2740 174.5948 49 P 4.6044 0.0000 0.0000 62.4663 32.6297 175.8216 50 G 3.7692 7.8546 109.6621 46.5805 0.0000 171.2566 51 G 4.3123 7.7070 106.3066 45.4175 0.0000 172.9691 52 R 5.0033 8.6484 116.6791 55.4619 31.0013 176.2107 53 V 4.0986 8.8196 121.5868 62.5205 32.6507 175.9984 54 Q 4.4308 9.2199 126.8739 54.0464 30.1437 175.1292 55 K 4.0547 8.4276 120.5801 58.2905 32.4100 175.9968 56 D 4.4382 8.7725 123.5402 55.0358 38.5720 172.5244 57 E 4.5142 7.8574 120.8675 54.7938 30.8406 175.9471 58 T 4.2219 8.2374 116.5545 61.4524 71.1271 175.5499 59 L 4.1069 8.4749 122.2049 57.9404 41.5220 179.6836 60 E 3.9109 8.1934 117.9390 59.4536 29.4589 179.1271 61 A 4.0216 8.2230 120.5357 55.0601 18.4230 179.4960 62 A 4.3210 8.4423 121.1214 54.7413 18.3920 179.6216 63 F 4.0503 8.5484 119.2864 61.4566 39.5675 177.3096 64 E 4.2082 8.0684 119.5830 58.8885 29.2224 179.2537 65 R 3.9019 8.2051 118.8472 59.5399 30.0939 178.6207 66 L 4.1092 8.5008 119.4761 57.8072 41.5851 179.4858 67 T 3.6606 7.9599 110.0159 64.8381 68.5702 176.2508 68 M 3.9466 7.9257 120.5495 58.3814 32.1089 178.1453 69 A 4.0403 8.0883 119.7367 54.9162 18.5906 178.8497 70 E 4.3613 8.5573 116.3406 57.9944 30.3729 177.8942 71 L 4.6560 8.3939 117.0440 53.3505 43.0141 178.1234 72 G 4.0444 8.1837 105.9483 45.8210 0.0000 173.1108 73 L 4.5643 7.4570 120.2666 52.7799 44.5573 175.6074 74 R 4.1434 8.6164 126.8200 55.7780 30.6830 175.2809 75 L 4.8062 8.4991 124.9244 52.0849 45.1686 174.4915 76 P 4.5770 0.0000 0.0000 61.8503 32.6571 177.1145 77 I 2.0000 7.8755 119.5562 63.4027 37.9256 178.0627 78 T 3.8322 7.5017 108.9025 63.7914 68.6858 175.1632 79 A 4.0403 7.6896 124.9928 54.0232 18.6781 177.5953 80 G 4.3630 7.2896 103.0630 45.3832 0.0000 173.4466 81 Q 4.8170 9.3641 125.3844 53.9891 30.6287 174.6378 82 F 4.3251 9.2684 129.4529 58.3989 39.9363 174.3249 83 Y 4.6746 7.7489 127.8545 56.8719 37.9561 175.7080 84 G 3.4067 6.1388 103.9443 45.1380 0.0000 171.6936 85 V 4.8638 7.4269 118.1788 60.8791 33.2933 174.6348 86 W 5.0255 9.4906 126.7296 54.9755 33.8074 174.1328 87 Q 4.9042 8.7156 118.5984 54.7312 31.9604 174.5171 88 H 4.7905 9.0089 121.1179 53.8426 31.8524 172.7511 89 F 5.2917 8.4423 121.6000 55.8376 41.5093 174.3144 90 Y 5.0094 9.1331 120.9713 56.3814 41.4165 176.4219 91 D 4.6507 9.1871 121.0879 55.3191 41.5602 175.2700 92 D 5.0874 7.8137 118.0124 51.4061 42.5736 173.5907 93 N 5.2537 8.6081 114.7846 50.6349 40.3746 174.9459 94 F 4.4647 9.3141 112.8676 58.6767 37.4952 176.2597 95 S 4.3924 7.7030 112.9129 56.1844 63.6137 174.0332 96 G 3.6883 6.3588 108.6622 46.8382 0.0000 174.2316 97 T 4.6202 8.1665 111.4822 61.3220 68.9994 174.1161 98 D 4.6563 7.5953 120.3637 54.2082 40.2598 175.5099 99 F 5.0604 6.8715 113.3918 56.1577 40.4830 173.7759 100 T 4.6382 8.6930 110.4124 61.6899 70.4937 173.7568 101 T 4.8185 8.8909 118.2751 62.0499 72.3287 172.7793 102 H 5.3673 8.6830 124.1128 54.6765 33.2670 171.3551 103 Y 5.1827 9.2349 123.2811 56.1901 41.5383 174.5904 104 V 4.6232 8.8397 123.8227 61.3303 33.7349 174.5114 105 V 4.9778 9.1062 128.0791 61.1265 34.7407 173.9291 106 L 5.2361 9.3288 128.3264 53.2721 43.5721 175.9846 107 G 4.3082 8.9557 112.2197 45.5845 0.0000 172.3494 108 F 5.6102 9.2993 120.7001 55.6760 43.6402 173.5384 109 R 5.2343 9.3457 124.3790 54.7874 32.4194 174.6139 110 F 5.2728 8.4964 118.8766 56.1325 41.6414 172.5332 111 R 5.1268 8.8101 120.4195 55.0447 31.7459 175.2986 112 V 4.7468 8.7079 117.8276 59.5470 36.4803 174.6626 113 A 4.3808 8.3118 124.4311 50.7714 20.0584 178.0808 114 E 3.9199 8.6842 123.1826 59.6617 29.6030 178.7571 115 E 4.1566 8.0421 116.2450 57.6342 29.7726 176.4609 116 E 4.4585 8.0734 116.2700 56.9867 30.3213 175.7579 117 L 4.5597 7.5516 119.0299 53.7484 43.5951 176.9750 118 L 4.7351 8.4991 120.2296 52.4274 42.6564 174.0539 119 L 4.0271 8.0324 120.2948 53.9341 42.1316 175.4154 120 P 4.6076 0.0000 0.0000 62.5068 32.3652 175.6445 121 D 5.2266 7.7576 116.4383 52.4845 39.8792 177.3565 122 E 4.0964 8.4006 120.4709 59.4138 29.7063 177.5034 123 Q 4.5491 8.0087 114.8266 56.0282 30.5992 175.1937 124 H 5.2192 7.8454 116.1414 54.0524 33.0341 173.3425 125 D 4.7833 8.3450 120.8372 53.3914 40.1878 175.4135 126 D 4.6514 6.9542 117.0915 54.1152 44.6176 173.5202 127 Y 5.4748 8.7247 119.3631 56.6334 42.0024 174.8686 128 R 4.7635 9.2875 120.6994 54.4267 35.2756 174.2169 129 W 5.0016 8.8672 121.6456 55.4278 30.3821 175.4764 130 L 4.9212 8.9304 125.8515 52.7177 44.5919 176.8819 131 T 4.4539 8.3023 111.9657 60.6343 70.1069 173.5950 132 P 3.9447 0.0000 0.0000 66.1000 31.2127 178.6252 133 D 4.3167 8.0933 116.6422 57.3716 40.5762 178.6315 134 A 3.9620 7.6905 120.3077 54.9519 18.2225 179.3686 135 L 3.9587 7.8927 118.4260 58.8626 40.3684 179.5191 136 L 4.0385 7.9382 118.7724 56.8322 41.5989 178.2037 137 A 4.4776 7.3955 118.1478 50.9992 19.2893 176.5238 138 S 4.6337 7.2761 113.3156 56.3756 64.2866 174.6717 139 E 4.2957 8.8309 126.8056 58.3662 29.6422 177.4666 140 N 4.5643 8.2173 116.0788 54.4483 39.0472 174.6976 141 V 4.6825 7.4643 118.9948 61.6962 32.5087 175.7117 142 H 4.1945 9.0815 126.8094 55.9590 31.6538 175.7364 143 A 3.9037 8.3300 128.6057 55.7335 17.9235 179.8549 144 N 4.1603 8.3066 112.8522 55.6119 38.9517 176.9294 145 S 4.0059 7.2303 116.0689 60.5152 63.4567 176.2742 146 R 4.0259 7.9685 120.9390 59.5320 29.5993 179.4574 147 V 3.6594 7.5847 111.6686 64.1718 31.2099 178.0400 148 Y 3.8770 6.9800 115.2077 59.6978 37.5838 177.1548 149 F 4.7567 7.9643 118.6611 57.4230 39.9333 175.9422 150 N 4.5789 7.7803 121.4217 52.7191 37.3734 179.7572 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 M 8.30 4.30 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 3 F 8.35 4.20 0.00 2.98 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 4 L 7.43 4.13 0.00 1.40 1.49 0.96 0.96 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 5 R 8.27 4.13 0.00 2.05 2.07 0.00 3.09 0.00 0.00 3.40 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 6 Q 8.66 4.15 0.00 2.58 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.94 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 7 E 8.22 4.01 0.00 2.11 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 2.43 2.51 0.00 8 D 8.08 4.44 0.00 2.70 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 9 F 8.47 4.28 0.00 2.73 2.79 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 10 A 8.51 4.31 1.58 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 11 T 7.68 3.61 4.20 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 1.15 0.00 0.00 12 V 7.97 3.66 2.28 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 0.98 0.00 0.00 1.00 0.00 0.00 13 V 7.53 3.44 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.13 0.00 0.00 14 R 7.67 3.75 0.00 1.64 1.64 0.00 2.81 0.00 0.00 2.62 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 15 S 7.39 4.62 0.00 3.82 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 16 T 6.76 4.52 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 1.25 0.00 0.00 17 P 0.00 4.48 0.00 1.94 1.48 0.00 3.80 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 1.95 0.00 18 L 8.85 4.37 0.00 1.20 1.56 0.54 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.34 5.07 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 1.14 0.00 0.00 0.97 0.00 0.00 20 S 9.30 5.30 0.00 4.03 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 21 L 8.82 5.41 0.00 1.40 1.81 1.16 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.97 5.14 0.00 2.60 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 8.74 5.37 0.00 2.91 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 24 I 8.98 4.14 1.62 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.21 0.60 0.00 0.00 25 V 8.22 4.41 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 1.11 0.00 0.00 0.67 0.00 0.00 26 E 9.17 4.85 0.00 1.97 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.47 0.00 27 N 7.95 4.85 0.00 1.98 1.42 0.00 0.00 6.97 7.13 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 28 S 8.14 4.28 0.00 3.71 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 29 R 8.12 4.36 0.00 1.85 1.81 0.00 3.11 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.38 0.00 30 G 8.06 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 0.00 0.00 0.00 0.00 31 E 7.82 4.92 0.00 2.07 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 2.29 2.42 0.00 32 F 9.09 5.58 0.00 2.76 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 33 L 8.60 3.98 0.00 0.27 1.21 -0.04 0.51 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 34 L 9.00 5.10 0.00 1.68 1.76 0.90 0.90 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 35 G 9.02 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 0.00 0.00 0.00 0.00 36 K 7.80 4.11 0.00 0.79 1.02 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.70 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.90 0.73 7.81 37 R 8.74 4.57 0.00 1.88 1.72 0.00 2.79 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 38 T 8.61 4.31 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 1.10 0.00 0.00 39 N 7.78 5.03 0.00 2.70 2.74 0.00 0.00 7.16 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.12 4.17 0.00 1.92 1.78 0.00 3.10 0.00 0.00 3.45 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.56 0.00 41 P 0.00 4.27 0.00 1.04 2.09 0.00 3.81 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.95 0.00 42 A 8.10 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 6.73 4.13 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.57 0.00 0.00 0.00 0.00 0.00 2.32 2.23 0.00 44 G 8.97 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.46 4.80 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 46 W 9.23 4.70 0.00 3.36 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 47 F 9.36 5.05 0.00 3.19 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.04 4.37 2.35 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 0.80 0.00 0.00 1.03 0.00 0.00 49 P 0.00 4.60 0.00 2.37 2.27 0.00 4.01 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 50 G 7.85 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 51 G 7.71 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 52 R 8.65 5.00 0.00 2.09 2.13 0.00 3.15 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 53 V 8.82 4.10 2.16 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 0.83 0.00 0.00 1.04 0.00 0.00 54 Q 9.22 4.43 0.00 2.27 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 55 K 8.43 4.05 0.00 1.70 1.74 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.55 7.81 56 D 8.77 4.44 0.00 2.88 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 7.86 4.51 0.00 2.06 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 2.28 2.26 0.00 58 T 8.24 4.22 4.45 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 0.00 0.00 1.23 0.00 0.00 59 L 8.47 4.11 0.00 1.78 1.90 1.03 1.02 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 60 E 8.19 3.91 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 61 A 8.22 4.02 1.34 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 0.00 0.00 0.00 62 A 8.44 4.32 1.51 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 0.00 0.00 63 F 8.55 4.05 0.00 3.21 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 64 E 8.07 4.21 0.00 2.19 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 2.58 2.39 0.00 65 R 8.21 3.90 0.00 1.89 2.09 0.00 3.09 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 66 L 8.50 4.11 0.00 1.98 1.91 1.00 0.63 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 67 T 7.96 3.66 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 -0.03 0.00 0.00 68 M 7.93 3.95 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 69 A 8.09 4.04 1.34 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 0.00 0.00 0.00 70 E 8.56 4.36 0.00 2.25 2.22 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 2.54 2.67 0.00 71 L 8.39 4.66 0.00 1.75 1.69 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.18 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 0.00 0.00 0.00 73 L 7.46 4.56 0.00 1.66 1.51 0.91 0.97 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 74 R 8.62 4.14 0.00 1.79 1.80 0.00 3.41 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 75 L 8.50 4.81 0.00 1.54 1.37 0.55 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.58 0.00 2.10 2.10 0.00 3.62 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 1.95 1.88 0.00 77 I 7.88 2.00 1.43 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 1.01 0.02 0.71 0.00 0.00 78 T 7.50 3.83 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 1.13 0.00 0.00 79 A 7.69 4.04 1.17 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 80 G 7.29 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 0.00 0.00 0.00 0.00 81 Q 9.36 4.82 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 82 F 9.27 4.33 0.00 3.02 3.03 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 83 Y 7.75 4.67 0.00 2.76 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 84 G 6.14 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.43 4.86 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 0.89 0.00 0.00 1.12 0.00 0.00 86 W 9.49 5.03 0.00 3.23 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 87 Q 8.72 4.90 0.00 1.90 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 88 H 9.01 4.79 0.00 3.09 2.86 0.00 5.57 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.44 5.29 0.00 2.80 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 9.13 5.01 0.00 2.95 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 91 D 9.19 4.65 0.00 2.74 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 92 D 7.81 5.09 0.00 2.85 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 93 N 8.61 5.25 0.00 2.82 2.76 0.00 0.00 6.65 7.64 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 94 F 9.31 4.46 0.00 3.28 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 95 S 7.70 4.39 0.00 3.60 3.36 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 96 G 6.36 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 97 T 8.17 4.62 4.18 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 1.14 0.00 0.00 98 D 7.60 4.66 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 99 F 6.87 5.06 0.00 2.95 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 0.00 100 T 8.69 4.64 4.52 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 1.29 0.00 0.00 101 T 8.89 4.82 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 102 H 8.68 5.37 0.00 3.31 3.11 0.00 5.62 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 9.23 5.18 0.00 2.76 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 0.00 104 V 8.84 4.62 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.94 0.00 0.00 105 V 9.11 4.98 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 1.09 0.00 0.00 0.71 0.00 0.00 106 L 9.33 5.24 0.00 1.98 1.89 1.17 0.91 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 0.00 107 G 8.96 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 0.00 108 F 9.30 5.61 0.00 3.65 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 0.00 109 R 9.35 5.23 0.00 1.61 1.75 0.00 2.82 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 110 F 8.50 5.27 0.00 3.26 3.34 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 0.00 111 R 8.81 5.13 0.00 1.86 1.89 0.00 3.13 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.75 0.00 112 V 8.71 4.75 2.19 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 1.02 0.00 0.00 1.13 0.00 0.00 113 A 8.31 4.38 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 0.00 114 E 8.68 3.92 0.00 1.84 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 1.47 1.57 0.00 115 E 8.04 4.16 0.00 1.87 1.93 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 2.27 2.38 0.00 116 E 8.07 4.46 0.00 2.14 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 2.26 2.24 0.00 117 L 7.55 4.56 0.00 1.62 1.76 1.20 0.99 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 0.00 118 L 8.50 4.74 0.00 1.54 1.53 0.97 0.56 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 0.00 119 L 8.03 4.03 0.00 1.21 0.57 0.55 0.72 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 0.00 120 P 0.00 4.61 0.00 2.37 2.08 0.00 3.77 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 121 D 7.76 5.23 0.00 2.67 2.86 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 0.00 122 E 8.40 4.10 0.00 1.97 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 2.30 2.39 0.00 123 Q 8.01 4.55 0.00 1.83 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 124 H 7.85 5.22 0.00 2.45 2.62 0.00 5.80 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.35 4.78 0.00 2.59 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 0.00 126 D 6.95 4.65 0.00 2.71 2.32 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 0.00 127 Y 8.72 5.47 0.00 2.85 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 0.00 128 R 9.29 4.76 0.00 1.27 1.55 0.00 2.21 0.00 0.00 2.78 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 129 W 8.87 5.00 0.00 3.12 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 0.00 130 L 8.93 4.92 0.00 1.39 1.38 0.55 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 131 T 8.30 4.45 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 1.21 0.00 0.00 132 P 0.00 3.94 0.00 2.22 2.21 0.00 3.70 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 133 D 8.09 4.32 0.00 2.67 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 0.00 134 A 7.69 3.96 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 7.89 3.96 0.00 1.75 1.70 0.70 -0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 136 L 7.94 4.04 0.00 1.67 1.78 0.96 0.76 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 0.00 137 A 7.40 4.48 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 0.00 138 S 7.28 4.63 0.00 3.78 3.65 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 0.00 0.00 0.00 0.00 139 E 8.83 4.30 0.00 2.04 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 2.35 2.35 0.00 140 N 8.22 4.56 0.00 2.96 3.16 0.00 0.00 6.45 7.00 0.00 0.00 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 V 7.46 4.68 2.35 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 0.79 0.00 0.00 0.96 0.00 0.00 142 H 9.08 4.19 0.00 3.30 3.21 0.00 5.66 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 0.00 143 A 8.33 3.90 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 0.00 144 N 8.31 4.16 0.00 2.77 2.43 0.00 0.00 6.87 7.57 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 0.00 145 S 7.23 4.01 0.00 3.57 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 0.00 146 R 7.97 4.03 0.00 1.93 1.98 0.00 3.33 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 147 V 7.58 3.66 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.52 0.00 0.00 148 Y 6.98 3.88 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 F 7.96 4.76 0.00 3.06 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 0.00 150 N 7.78 4.58 0.00 2.73 2.60 0.00 0.00 6.79 7.34 0.00 0.00 0.00 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