NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0312 8.0549 120.3913 62.2281 32.4357 175.0052 2 L 3.8937 8.4567 128.2628 52.8415 41.9844 176.4725 3 S 4.4868 9.0620 121.2544 57.3223 66.4607 174.8086 4 A 3.9320 8.3848 122.1930 55.3052 18.0519 179.4931 5 A 3.9359 7.9364 118.8101 55.3706 18.3486 179.4675 6 D 4.6712 7.9161 118.4163 56.9632 40.9136 179.1654 7 K 3.9087 7.8200 119.0457 59.4790 32.1736 179.6611 8 S 4.1536 7.8546 114.5919 61.3061 62.9122 176.3331 9 N 4.3289 8.1281 120.3354 55.9921 38.1720 177.5844 10 V 3.4681 7.7489 119.5438 65.9641 31.7196 178.1896 11 K 3.8588 8.0129 117.9671 59.5018 31.4305 179.1989 12 A 4.0321 7.8767 120.4843 55.2532 18.2578 179.3282 13 C 4.1289 8.2197 117.2726 62.3830 31.6419 175.5728 14 W 4.1354 9.2741 131.1824 60.2909 29.9533 178.2299 15 G 3.6071 8.1208 105.2674 47.5536 0.0000 175.6510 16 K 4.1242 7.4905 118.8001 59.2111 32.3876 179.0459 17 I 3.8534 7.6142 120.1917 62.5475 37.5644 178.1152 18 G 3.7366 8.7039 107.9241 46.7804 0.0000 176.6021 19 S 4.3259 8.7690 119.5831 59.6462 63.3832 174.9696 20 H 4.2356 8.3454 119.9961 56.6695 28.3931 177.0658 21 A 3.8517 7.1415 122.6984 55.2572 18.2831 179.7333 22 G 4.0182 7.9120 104.7492 47.5260 0.0000 175.3991 23 E 4.0866 7.9388 120.1729 59.0279 29.4840 178.8746 24 Y 4.5011 7.5681 116.7935 60.6432 37.9583 178.1039 25 G 3.6429 8.7184 107.0779 47.7454 0.0000 175.1911 26 A 4.0113 7.8255 123.5229 55.1286 18.4131 179.4413 27 E 4.1689 8.4677 118.3074 58.7617 29.7167 178.8233 28 A 3.9840 8.2082 120.9747 54.9542 18.3250 179.5510 29 L 3.4461 8.1885 117.8054 57.8865 41.4073 179.2981 30 E 4.0460 8.3351 118.7455 59.9515 29.5049 179.9895 31 R 3.9267 8.4815 117.9833 59.2268 29.9410 179.1650 32 T 4.0128 7.7032 113.1059 65.2788 67.3923 176.4198 33 F 4.5934 7.9521 120.0821 60.7035 38.6507 177.2595 34 C 4.2021 8.2202 117.7054 62.8459 31.6029 175.6303 35 S 4.0699 8.2978 115.7472 59.6752 63.8442 174.6640 36 F 4.6352 8.1484 120.2681 53.4644 38.9787 173.2938 37 P 4.6254 0.0000 0.0000 64.7606 31.5551 177.7090 38 T 4.1123 8.1015 108.3331 64.6040 68.8411 176.4840 39 T 4.3107 8.3582 113.0442 64.9147 68.6375 176.1974 40 K 4.0899 8.2726 120.8361 58.6369 31.7366 179.0195 41 T 3.8637 7.7178 109.5099 64.6907 68.6035 175.3717 42 Y 4.0623 7.9843 117.6712 58.5746 39.1290 175.3287 43 F 4.7544 7.9065 119.1397 55.8549 39.4348 174.9415 44 P 4.3676 0.0000 0.0000 65.1983 31.6993 176.9956 45 H 4.8964 8.3181 112.9646 55.1161 28.8443 174.0506 46 F 4.9900 7.6697 118.5698 55.7729 40.6475 175.1182 47 D 4.3884 8.2546 123.3292 54.6817 40.3859 175.7124 48 L 4.4990 8.2677 126.0453 54.2457 42.6100 177.3569 49 S 4.2947 7.6043 113.5354 57.8827 63.5239 173.2751 50 H 4.3452 8.6473 121.5681 58.0195 29.8462 175.3997 51 G 3.8390 8.9900 113.9285 46.2719 0.0000 174.0975 52 S 4.2583 7.7923 114.7551 58.0670 64.9630 174.6943 53 A 4.2518 8.3546 124.5280 53.5291 18.6823 179.4910 54 Q 3.7274 7.7054 118.3237 58.5623 29.1887 177.7799 55 V 3.7712 7.4651 119.5338 65.8811 31.5464 177.9867 56 K 3.9026 7.8808 118.1155 59.3992 31.8698 178.7049 57 A 3.9774 7.7502 120.4919 55.8144 18.2371 179.1835 58 H 4.3422 8.7112 116.7877 59.5318 29.9776 177.6729 59 G 3.6519 8.6512 107.9211 47.8073 0.0000 175.4008 60 Q 4.0300 8.1784 121.8220 58.9003 29.0739 178.4563 61 K 3.9991 7.8427 119.3528 59.4140 32.1477 179.3787 62 V 3.5658 7.9563 118.3308 65.9374 31.3877 177.6830 63 A 4.2231 8.3962 120.8076 55.4995 18.2315 179.0438 64 D 4.4189 8.4617 117.2910 57.8967 40.9204 179.3303 65 A 4.1063 8.0729 120.7458 55.0201 18.2265 179.7292 66 L 4.0285 7.8938 117.3447 58.0639 41.8312 179.7023 67 T 3.6956 8.3520 115.8879 66.7666 68.2741 176.4058 68 Q 4.0570 7.9943 119.8122 59.1850 29.2177 178.0257 69 A 4.2146 8.2708 122.1027 55.1234 18.2282 179.6893 70 V 3.0451 7.7020 115.9626 65.9323 31.5094 177.8237 71 A 4.1216 7.7336 119.0762 53.7986 18.5815 177.3725 72 H 4.9252 7.8053 114.9898 55.8343 29.4523 175.6019 73 M 4.3767 8.1704 118.2846 57.0359 32.2083 177.3342 74 D 4.6256 7.9278 118.0502 55.7599 42.1288 176.3395 75 D 4.7228 7.7013 118.1753 51.7863 41.2508 175.1431 76 L 4.2150 8.0405 123.8063 56.4535 41.9364 176.5332 77 P 4.2380 0.0000 0.0000 65.6272 31.3556 178.5309 78 T 4.0225 7.7572 113.9215 66.5230 68.5053 176.3044 79 A 4.2498 7.3994 118.0255 53.4186 18.6956 177.6328 80 M 4.6552 7.4472 115.9481 54.5296 33.2341 177.7641 81 S 3.6101 7.9039 117.1241 61.5067 62.6523 176.4518 82 A 4.0419 7.8955 123.9553 54.8797 18.2623 179.3966 83 L 4.0671 7.8291 117.1517 57.6511 41.7269 179.1437 84 S 3.9953 8.8520 114.3983 61.5490 62.2683 175.9219 85 D 4.2867 7.9288 120.1445 57.2342 41.0239 177.7677 86 L 4.0394 7.8066 120.9776 58.2004 41.9793 178.1394 87 H 4.8131 8.4656 114.7428 56.5055 29.2872 176.4760 88 A 3.8020 7.7252 121.6592 51.8220 19.6970 176.8274 89 Y 4.2908 7.6386 114.6783 59.2934 40.1669 176.3914 90 K 3.8251 7.9247 117.7392 59.2497 32.7462 177.9952 91 L 4.0897 8.8940 121.0719 55.4806 42.4945 175.5427 92 R 4.0504 7.8141 121.1090 56.4774 27.3537 173.5164 93 V 3.8179 8.6027 121.8648 60.4010 32.7685 175.4475 94 D 4.4608 8.9037 127.3103 54.0490 41.8180 175.2701 95 P 4.3633 0.0000 0.0000 66.2046 31.3846 178.8169 96 V 3.4209 8.0049 110.7143 64.1820 31.4373 178.2241 97 N 4.1938 8.2870 116.4109 55.6893 38.2123 177.5128 98 F 3.9933 7.9785 119.2220 60.2603 39.0205 177.6676 99 K 3.9256 7.9602 117.6686 59.4573 31.8359 179.0173 100 F 3.8917 7.3677 117.3253 60.4875 38.7393 177.5297 101 L 3.8658 7.7422 119.2990 58.1358 41.9443 178.7466 102 S 3.9114 8.2943 115.6356 62.0628 62.7801 176.2010 103 H 4.2589 8.3071 120.3323 59.8741 29.6201 177.1091 104 C 4.1219 8.1569 118.0754 62.5363 27.7589 176.2044 105 L 3.9571 8.1223 121.1257 57.6914 41.1699 179.3636 106 L 4.1452 7.9631 118.5244 57.7082 41.5720 179.6391 107 V 3.3560 7.9028 118.2874 66.2736 31.4455 178.0589 108 T 3.7248 7.8360 115.2158 66.8269 68.2803 176.6475 109 L 3.6473 8.0611 120.6387 57.5074 41.3027 179.5714 110 A 3.4019 7.1243 120.1778 54.9099 18.2260 179.2000 111 C 4.0942 7.6082 114.4430 63.0010 28.2736 175.4049 112 H 4.3702 7.8907 116.2598 56.8406 30.3342 175.5545 113 H 5.0239 7.9932 116.7516 53.3849 28.9088 172.4072 114 P 4.2957 0.0000 0.0000 65.7102 31.8170 178.6151 115 A 4.1986 7.9548 120.7190 54.6674 18.6606 178.2880 116 E 4.1392 8.1720 114.5963 59.1584 30.4153 177.6107 117 F 4.5950 7.9402 122.0776 57.7423 38.1657 175.5028 118 T 4.1180 7.3503 113.5865 60.7296 71.3337 173.0422 119 P 4.0487 0.0000 0.0000 66.1365 31.4382 178.7739 120 A 3.9587 7.8650 118.5932 54.8906 18.2138 179.7573 121 V 3.4716 7.7384 116.8175 66.1643 31.7206 177.4242 122 H 3.7779 8.0831 118.3871 59.3795 29.5864 176.5275 123 A 3.9035 7.7830 122.0200 55.4957 18.3434 179.8605 124 S 4.3993 7.8411 114.7416 61.2239 62.7672 177.0017 125 L 3.8388 8.2298 122.0192 57.3169 41.2902 178.9396 126 D 4.4208 8.0743 118.1358 57.4062 41.2468 178.3655 127 K 3.9305 7.8846 118.6221 59.5644 32.0596 179.1391 128 F 4.2094 8.3247 120.7825 61.4028 39.3529 177.3049 129 F 4.2888 8.2330 118.0180 60.1673 38.6825 177.3089 130 S 4.3601 8.3662 112.8212 60.0278 62.7482 176.2223 131 A 3.9653 7.8847 125.0546 54.7819 18.1020 179.7823 132 V 3.4043 7.5173 117.0883 66.2287 31.3759 178.5092 133 S 3.8134 7.7415 113.7585 61.5807 62.7416 176.6054 134 T 3.8385 7.8668 118.5179 66.4230 67.9813 176.6224 135 V 3.4492 6.9582 117.9670 66.2768 31.6262 177.7209 136 L 3.9428 7.4805 117.1016 57.0324 42.0248 178.4267 137 T 4.2187 6.9538 110.2234 61.4739 68.6499 175.5434 138 S 4.2797 7.3842 117.2105 61.1610 64.6493 175.4399 139 K 4.4389 7.4095 118.6289 55.6326 31.9881 178.4142 140 Y 4.6855 6.8020 119.6332 60.9624 38.0421 177.1713 141 R 4.3206 7.8724 122.4771 56.7449 31.5828 174.5340 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 1 V 8.05 4.03 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 0.98 0.00 0.00 0.92 0.00 0.00 2 L 8.46 3.89 0.00 1.77 1.61 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.06 4.49 0.00 4.08 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 4 A 8.38 3.93 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 5 A 7.94 3.94 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 6 D 7.92 4.67 0.00 2.89 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 7 K 7.82 3.91 0.00 1.72 1.80 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.40 7.81 8 S 7.85 4.15 0.00 3.97 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 0.00 9 N 8.13 4.33 0.00 2.95 2.87 0.00 0.00 6.55 7.76 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 10 V 7.75 3.47 1.86 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 0.22 0.00 0.00 0.72 0.00 0.00 11 K 8.01 3.86 0.00 1.91 1.83 0.00 1.80 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.32 7.81 12 A 7.88 4.03 1.44 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 0.00 0.00 13 C 8.22 4.13 0.00 3.19 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 14 W 9.27 4.14 0.00 3.50 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 15 G 8.12 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 16 K 7.49 4.12 0.00 1.81 1.81 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.74 1.62 7.81 17 I 7.61 3.85 1.61 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.47 0.58 0.00 0.00 18 G 8.70 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 0.00 0.00 0.00 19 S 8.77 4.33 0.00 3.90 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 20 H 8.35 4.24 0.00 2.96 2.21 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.14 3.85 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 22 G 7.91 4.02 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 0.00 0.00 0.00 23 E 7.94 4.09 0.00 1.93 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 2.27 2.23 0.00 24 Y 7.57 4.50 0.00 3.07 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 G 8.72 3.64 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 0.00 26 A 7.83 4.01 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 27 E 8.47 4.17 0.00 2.14 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 2.31 2.21 0.00 28 A 8.21 3.98 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 29 L 8.19 3.45 0.00 1.85 1.47 1.03 0.32 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 30 E 8.34 4.05 0.00 2.20 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 0.00 2.45 2.45 0.00 31 R 8.48 3.93 0.00 1.95 1.97 0.00 3.09 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 32 T 7.70 4.01 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 0.72 0.00 0.00 33 F 7.95 4.59 0.00 3.23 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 34 C 8.22 4.20 0.00 3.07 3.05 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 35 S 8.30 4.07 0.00 3.69 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 36 F 8.15 4.64 0.00 2.81 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.63 0.00 2.18 2.16 0.00 3.83 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 2.10 2.01 0.00 38 T 8.10 4.11 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 39 T 8.36 4.31 4.62 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 1.60 0.00 0.00 40 K 8.27 4.09 0.00 1.87 1.78 0.00 1.54 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.13 1.67 7.81 41 T 7.72 3.86 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 1.22 0.00 0.00 42 Y 7.98 4.06 0.00 3.06 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 43 F 7.91 4.75 0.00 2.69 2.46 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 44 P 0.00 4.37 0.00 2.19 2.17 0.00 3.84 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 2.03 1.91 0.00 45 H 8.32 4.90 0.00 3.38 3.48 0.00 5.69 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.67 4.99 0.00 3.00 2.91 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 0.00 0.00 0.00 47 D 8.25 4.39 0.00 2.63 2.53 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 48 L 8.27 4.50 0.00 1.57 1.50 0.68 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.60 4.29 0.00 4.07 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.65 4.35 0.00 3.09 3.29 0.00 5.99 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.99 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 0.00 0.00 0.00 52 S 7.79 4.26 0.00 4.45 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 0.00 53 A 8.35 4.25 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 54 Q 7.71 3.73 0.00 1.80 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.85 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 55 V 7.47 3.77 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.10 0.00 0.00 56 K 7.88 3.90 0.00 1.89 1.84 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.60 7.81 57 A 7.75 3.98 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 58 H 8.71 4.34 0.00 3.75 3.60 0.00 5.79 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 59 G 8.65 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 0.00 0.00 0.00 60 Q 8.18 4.03 0.00 2.21 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 61 K 7.84 4.00 0.00 2.01 1.88 0.00 1.82 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.52 1.66 7.81 62 V 7.96 3.57 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 1.01 0.00 0.00 0.93 0.00 0.00 63 A 8.40 4.22 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.46 4.42 0.00 3.04 2.81 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 65 A 8.07 4.11 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.03 0.00 2.16 1.78 1.04 0.93 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 67 T 8.35 3.70 4.41 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 1.47 0.00 0.00 68 Q 7.99 4.06 0.00 2.32 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 69 A 8.27 4.21 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.70 3.05 1.85 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 0.59 0.00 0.00 -0.32 0.00 0.00 71 A 7.73 4.12 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 72 H 7.81 4.93 0.00 3.22 3.28 0.00 5.82 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 M 8.17 4.38 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.66 0.00 74 D 7.93 4.63 0.00 2.66 2.71 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 0.00 0.00 0.00 0.00 75 D 7.70 4.72 0.00 2.67 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 76 L 8.04 4.22 0.00 1.72 1.67 0.97 1.14 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 77 P 0.00 4.24 0.00 1.99 2.08 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 2.00 2.14 0.00 78 T 7.76 4.02 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 1.19 0.00 0.00 79 A 7.40 4.25 1.15 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 0.00 0.00 80 M 7.45 4.66 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 81 S 7.90 3.61 0.00 3.96 4.24 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 82 A 7.90 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 83 L 7.83 4.07 0.00 1.83 1.74 0.94 0.88 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 84 S 8.85 4.00 0.00 3.94 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 85 D 7.93 4.29 0.00 2.79 2.65 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 86 L 7.81 4.04 0.00 1.87 2.01 0.92 1.18 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 87 H 8.47 4.81 0.00 3.50 3.53 0.00 5.83 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 88 A 7.73 3.80 0.68 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 0.00 0.00 89 Y 7.64 4.29 0.00 2.80 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 90 K 7.92 3.83 0.00 1.94 1.77 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.53 7.81 91 L 8.89 4.09 0.00 1.54 1.72 0.75 0.88 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 92 R 7.81 4.05 0.00 2.06 2.08 0.00 3.49 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.73 0.00 93 V 8.60 3.82 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 -0.00 0.00 0.00 0.40 0.00 0.00 94 D 8.90 4.46 0.00 2.84 2.61 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 95 P 0.00 4.36 0.00 2.18 2.10 0.00 3.63 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.31 0.00 96 V 8.00 3.42 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.89 0.00 0.00 97 N 8.29 4.19 0.00 2.47 2.68 0.00 0.00 6.89 8.99 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 98 F 7.98 3.99 0.00 3.14 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 99 K 7.96 3.93 0.00 1.66 1.76 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.48 7.81 100 F 7.37 3.89 0.00 2.97 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 0.00 101 L 7.74 3.87 0.00 1.67 1.53 0.78 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.29 3.91 0.00 4.16 4.09 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 0.00 103 H 8.31 4.26 0.00 3.36 3.66 0.00 5.78 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 0.00 104 C 8.16 4.12 0.00 3.18 3.05 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 0.00 105 L 8.12 3.96 0.00 1.61 1.58 0.35 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.96 4.15 0.00 2.04 1.91 1.21 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.90 3.36 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 0.94 0.00 0.00 0.80 0.00 0.00 108 T 7.84 3.72 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 1.17 0.00 0.00 109 L 8.06 3.65 0.00 1.60 1.70 1.29 0.74 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 0.00 110 A 7.12 3.40 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.61 4.09 0.00 3.00 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 0.00 112 H 7.89 4.37 0.00 2.55 2.92 0.00 5.60 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 7.99 5.02 0.00 3.27 3.18 0.00 5.82 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.30 0.00 2.20 2.19 0.00 3.84 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 1.99 1.95 0.00 115 A 7.95 4.20 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.17 4.14 0.00 2.17 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 2.29 2.37 0.00 117 F 7.94 4.60 0.00 3.07 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 0.00 118 T 7.35 4.12 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 1.26 0.00 0.00 119 P 0.00 4.05 0.00 2.12 2.12 0.00 3.55 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 120 A 7.87 3.96 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.74 3.47 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.91 0.00 0.00 122 H 8.08 3.78 0.00 1.96 3.14 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 7.78 3.90 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 0.00 124 S 7.84 4.40 0.00 3.87 4.02 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 0.00 125 L 8.23 3.84 0.00 1.69 1.34 1.16 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.07 4.42 0.00 2.91 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 0.00 127 K 7.88 3.93 0.00 2.07 1.87 0.00 1.93 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.63 7.81 128 F 8.32 4.21 0.00 2.97 2.91 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 0.00 0.00 0.00 129 F 8.23 4.29 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 0.00 130 S 8.37 4.36 0.00 4.05 4.15 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 0.00 131 A 7.88 3.97 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 7.52 3.40 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 0.90 0.00 0.00 0.47 0.00 0.00 133 S 7.74 3.81 0.00 3.81 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 0.00 134 T 7.87 3.84 4.15 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 1.14 0.00 0.00 135 V 6.96 3.45 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 0.93 0.00 0.00 136 L 7.48 3.94 0.00 1.30 1.52 0.98 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 137 T 6.95 4.22 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 0.74 0.00 0.00 138 S 7.38 4.28 0.00 3.91 4.15 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 0.00 139 K 7.41 4.44 0.00 1.78 1.74 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.34 7.81 140 Y 6.80 4.69 0.00 2.98 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 0.00 141 R 7.87 4.32 0.00 1.79 1.83 0.00 3.23 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00