NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3470 0.0000 0.0000 62.6080 32.6255 175.0144 2 Q 4.2741 8.5087 120.7670 53.5018 30.2536 169.5187 3 V 4.2865 8.1860 125.4678 61.2025 33.9513 174.8590 4 T 4.4683 8.3940 117.4663 61.1133 70.6926 174.0314 5 L 4.7338 7.8033 118.1934 54.3407 42.3853 178.9975 6 W 4.0700 8.2577 120.3575 58.7124 29.2440 175.8751 7 Q 4.7814 7.2642 113.9148 53.1750 31.8651 175.2642 8 R 3.9336 8.4906 118.4946 56.3837 30.5534 175.9442 9 P 4.5964 0.0000 0.0000 61.8732 30.9820 173.4825 10 L 5.1882 8.1313 128.6036 54.0640 44.1929 175.1629 11 V 4.6451 8.4446 117.5498 59.8056 36.6075 174.4244 12 T 4.8252 8.4512 119.0332 62.9760 69.3348 174.5199 13 I 4.8398 9.2488 120.2036 58.8499 41.4144 174.1451 14 K 5.0803 9.0349 124.9353 54.7186 34.8923 174.6938 15 I 4.6050 8.5201 127.0955 59.7755 41.7889 175.0696 16 G 3.9682 9.5816 117.6507 46.7496 0.0000 174.5634 17 G 3.8905 8.3185 105.0848 45.6044 0.0000 174.0924 18 Q 4.6402 7.9445 119.0224 54.1181 31.0283 174.0923 19 L 5.2971 8.1426 119.4293 53.2974 43.8583 176.0734 20 K 4.7287 8.8804 120.9432 55.1169 37.0924 174.8747 21 E 5.2546 8.7331 120.5797 54.8916 32.3137 175.3210 22 A 4.8260 8.8458 123.1228 50.2226 23.5838 174.8766 23 L 4.6576 9.2150 123.5302 54.3693 43.5589 175.8994 24 L 4.4820 8.9072 127.7437 54.6273 42.3217 176.2918 25 D 4.8550 9.1546 125.4432 52.3848 42.7437 176.4607 26 T 4.0739 8.7175 116.6984 63.5215 69.2152 176.0205 27 G 3.6285 7.9711 110.3383 46.9542 0.0000 173.2557 28 A 4.6366 7.6137 122.7310 50.4889 20.3104 178.0161 29 D 4.6508 8.8762 122.6662 56.7551 42.0677 175.5550 30 D 5.2423 7.8931 116.3981 52.8825 46.2375 174.1626 31 T 4.8008 8.3182 115.4312 62.3738 70.7614 174.4127 32 V 4.7552 8.4155 125.2119 61.2468 34.5050 174.2874 33 L 5.1010 8.9262 128.1924 52.6707 44.5748 175.9925 34 E 4.5215 9.3143 122.6677 55.4157 31.1647 175.8246 35 E 4.2275 8.5486 122.3695 57.5077 29.7515 176.4622 36 M 4.6256 8.3930 121.8946 54.5676 35.2465 173.3726 37 S 4.7569 8.3989 119.0683 56.5372 64.9540 173.7699 38 L 4.5676 8.1190 126.3443 52.5951 44.8818 173.4113 39 P 4.6348 0.0000 0.0000 62.1024 32.9847 175.7250 40 G 3.9499 7.9693 109.0961 45.0107 0.0000 172.5712 41 R 4.5839 8.1724 123.1125 54.2975 33.4325 174.2295 42 W 5.0608 7.2983 115.6127 55.6896 31.0330 173.3624 43 K 4.9689 8.8441 119.0080 53.9994 35.2246 174.0649 44 P 5.3174 0.0000 0.0000 62.5839 33.0767 174.6519 45 K 4.6868 8.7387 121.2487 55.7262 36.4736 173.9008 46 M 5.3576 8.5742 122.4930 53.5997 35.0038 174.2966 47 I 4.6799 9.1254 119.3404 59.0420 41.0808 174.3886 48 G 4.4989 8.8203 110.9027 44.8188 0.0000 172.9220 49 G 4.5115 8.7997 112.8173 43.3745 0.0000 171.6614 50 I 3.8998 8.2342 120.1834 62.9833 37.4139 175.5730 51 G 4.0225 8.4157 113.2474 44.7411 0.0000 171.8663 52 G 4.0065 7.1281 104.2877 43.7838 0.0000 172.2599 53 F 5.6518 8.1748 115.4146 55.0044 40.9797 174.7728 54 I 4.6555 8.6607 113.0460 59.1290 41.2075 174.0952 55 K 4.9445 8.5864 122.5418 55.6032 33.4364 176.4529 56 V 4.7164 9.1125 117.3870 59.4500 35.9809 174.5333 57 R 5.0189 8.8274 119.6943 54.5260 31.9451 174.9871 58 Q 5.3198 9.5657 120.3354 54.7206 31.7390 173.8069 59 Y 5.0678 9.1353 119.4597 56.4531 41.3531 174.7300 60 D 5.1526 8.9318 122.8068 52.3031 44.0196 175.1599 61 Q 3.4395 8.4252 117.3328 57.3528 27.6558 173.1893 62 I 4.4062 8.0565 117.1081 59.7350 39.3680 175.6927 63 L 4.7726 8.4562 128.6898 54.8770 42.9606 175.8483 64 I 4.8127 8.8037 126.3061 59.5197 41.3747 174.0847 65 E 4.9980 9.1626 125.7030 54.3812 32.1446 176.8110 66 I 4.5087 8.7460 127.6194 61.2125 37.8994 176.8651 *68 G 4.0512 8.0476 106.5921 45.6510 0.0000 172.9825 69 H 4.9096 8.0616 115.9656 53.4470 31.7492 173.5499 70 K 5.0072 8.4961 122.5441 56.0502 33.7331 175.4500 71 A 4.6861 8.4982 122.5144 51.3489 23.3052 175.0766 72 I 5.4215 7.6155 118.9656 58.9529 41.4722 175.1004 73 G 3.9735 7.9549 114.8278 45.9125 0.0000 171.3438 74 T 4.7299 8.5909 116.3462 63.4328 69.4003 174.6891 75 V 4.4691 8.8920 125.7432 61.0950 34.7932 174.1792 76 L 5.2439 8.8262 127.5629 53.4900 44.1221 175.6755 77 V 4.7538 9.1271 121.9523 60.6769 34.8270 175.1937 78 G 3.9071 7.8010 112.2277 45.8887 0.0000 170.5699 79 P 5.6388 0.0000 0.0000 61.0059 29.8932 174.8769 80 T 4.4745 7.4478 118.4468 60.5920 69.1878 172.8816 81 P 4.4449 0.0000 0.0000 64.3838 31.9852 176.4659 82 V 4.4434 7.2628 117.9981 60.9120 34.7629 173.9405 83 N 4.7998 8.6535 123.4826 53.1997 40.0592 173.8543 84 I 4.8595 8.5863 124.3234 59.5285 40.6469 174.5342 85 I 4.3800 9.0825 128.6528 60.1798 38.8149 175.4938 86 G 4.2671 8.1406 115.8533 43.7442 0.0000 173.7695 87 R 4.1360 9.0208 118.3983 58.9239 30.2324 179.0461 88 N 4.3304 7.8641 114.8527 55.3218 37.4395 176.3522 89 L 4.4398 7.7537 117.4159 55.9070 42.5913 178.5005 90 L 3.9994 7.8395 119.2553 58.0770 41.6159 179.3976 91 T 3.8924 8.0608 115.6134 66.9649 68.2046 176.6147 92 Q 4.0535 7.9087 118.7099 58.5450 28.8926 177.0483 93 I 4.1237 7.8258 108.9574 60.3665 37.8013 175.5289 94 G 3.8058 7.7168 107.6881 46.8966 0.0000 174.2704 95 A 4.3199 8.2779 122.4482 51.4786 19.3217 177.9731 96 T 4.7509 8.0811 109.7703 59.7182 72.0281 173.1712 97 L 4.7058 8.2936 122.0421 53.4762 43.3122 176.1183 98 N 5.1185 8.5492 119.1171 51.5980 42.4679 174.4775 99 F 4.5356 8.3068 116.1533 57.2718 37.8973 174.1097 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 P 0.00 4.35 0.00 2.21 2.14 0.00 3.75 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 1.89 1.98 0.00 2 Q 8.51 4.27 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 3 V 8.19 4.29 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 0.93 0.00 0.00 0.94 0.00 0.00 4 T 8.39 4.47 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 1.35 0.00 0.00 5 L 7.80 4.73 0.00 1.40 1.48 0.82 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.26 4.07 0.00 3.34 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 7 Q 7.26 4.78 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 8 R 8.49 3.93 0.00 1.80 1.88 0.00 3.20 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 9 P 0.00 4.60 0.00 2.11 2.21 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.93 0.00 10 L 8.13 5.19 0.00 1.64 1.57 0.91 0.95 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 11 V 8.44 4.65 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 0.70 0.00 0.00 0.97 0.00 0.00 12 T 8.45 4.83 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 1.21 0.00 0.00 13 I 9.25 4.84 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.87 0.90 0.00 0.00 14 K 9.03 5.08 0.00 1.78 1.66 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.47 7.81 15 I 8.52 4.60 1.84 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 1.10 1.63 0.87 0.00 0.00 16 G 9.58 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 17 G 8.32 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 18 Q 7.94 4.64 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.97 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 19 L 8.14 5.30 0.00 1.49 1.55 0.92 0.81 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 20 K 8.88 4.73 0.00 1.64 1.61 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.39 7.81 21 E 8.73 5.25 0.00 1.81 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 2.31 2.27 0.00 22 A 8.85 4.83 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 23 L 9.21 4.66 0.00 1.73 1.67 0.91 -0.03 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 24 L 8.91 4.48 0.00 1.52 1.60 0.91 0.92 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 25 D 9.15 4.86 0.00 2.77 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.72 4.07 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 1.21 0.00 0.00 27 G 7.97 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 28 A 7.61 4.64 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 29 D 8.88 4.65 0.00 2.62 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.89 5.24 0.00 2.55 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.32 4.80 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 1.22 0.00 0.00 32 V 8.42 4.76 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 0.97 0.00 0.00 0.93 0.00 0.00 33 L 8.93 5.10 0.00 1.47 1.48 0.93 0.62 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 34 E 9.31 4.52 0.00 2.10 1.78 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 2.46 2.26 0.00 35 E 8.55 4.23 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 36 M 8.39 4.63 0.00 1.89 1.82 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 37 S 8.40 4.76 0.00 3.86 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 38 L 8.12 4.57 0.00 1.24 0.94 0.78 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.63 0.00 2.28 2.07 0.00 3.77 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 1.97 0.00 40 G 7.97 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 41 R 8.17 4.58 0.00 1.71 1.68 0.00 3.22 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.46 0.00 42 W 7.30 5.06 0.00 2.89 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 0.00 0.00 0.00 43 K 8.84 4.97 0.00 1.81 1.77 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.34 7.81 44 P 0.00 5.32 0.00 2.19 2.31 0.00 3.88 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 45 K 8.74 4.69 0.00 1.92 1.67 0.00 1.48 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.46 7.81 46 M 8.57 5.36 0.00 2.00 1.90 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 2.71 2.48 0.00 47 I 9.13 4.68 1.90 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 1.19 0.84 0.94 0.00 0.00 48 G 8.82 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 0.00 0.00 0.00 0.00 49 G 8.80 4.51 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 0.00 50 I 8.23 3.90 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.58 0.91 0.00 0.00 51 G 8.42 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 52 G 7.13 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 0.00 0.00 0.00 53 F 8.17 5.65 0.00 3.13 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 54 I 8.66 4.66 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.28 0.83 0.00 0.00 55 K 8.59 4.94 0.00 1.67 1.80 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.57 7.81 56 V 9.11 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 0.78 0.00 0.00 0.98 0.00 0.00 57 R 8.83 5.02 0.00 0.70 0.85 0.00 2.49 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.57 0.00 58 Q 9.57 5.32 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 59 Y 9.14 5.07 0.00 2.95 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 60 D 8.93 5.15 0.00 2.59 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 61 Q 8.43 3.44 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 62 I 8.06 4.41 1.99 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.00 0.87 0.00 0.00 63 L 8.46 4.77 0.00 1.66 1.57 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.80 4.81 1.87 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 0.37 0.90 0.00 0.00 65 E 9.16 5.00 0.00 1.88 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 0.00 2.23 2.25 0.00 66 I 8.75 4.51 1.84 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 1.22 1.09 0.88 0.00 0.00 *68 G 8.05 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 69 H 8.06 4.91 0.00 3.26 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.50 5.01 0.00 1.65 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.45 7.81 71 A 8.50 4.69 1.22 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 0.00 0.00 0.00 72 I 7.62 5.42 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.40 0.93 0.00 0.00 73 G 7.95 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 74 T 8.59 4.73 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 1.31 0.00 0.00 75 V 8.89 4.47 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 0.89 0.00 0.00 0.92 0.00 0.00 76 L 8.83 5.24 0.00 1.90 1.56 0.97 0.73 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 77 V 9.13 4.75 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 0.85 0.00 0.00 0.72 0.00 0.00 78 G 7.80 3.91 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 0.00 0.00 0.00 79 P 0.00 5.64 0.00 2.14 2.05 0.00 3.32 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.85 0.00 80 T 7.45 4.47 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 1.28 0.00 0.00 81 P 0.00 4.44 0.00 2.20 2.14 0.00 3.75 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 82 V 7.26 4.44 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 0.80 0.00 0.00 0.92 0.00 0.00 83 N 8.65 4.80 0.00 2.81 2.70 0.00 0.00 6.82 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 84 I 8.59 4.86 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.26 0.93 0.00 0.00 85 I 9.08 4.38 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.05 0.90 0.00 0.00 86 G 8.14 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 9.02 4.14 0.00 1.84 2.00 0.00 3.15 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 88 N 7.86 4.33 0.00 2.81 3.20 0.00 0.00 6.96 9.24 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 89 L 7.75 4.44 0.00 1.70 1.74 0.92 0.68 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 90 L 7.84 4.00 0.00 1.70 1.72 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.06 3.89 4.48 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 1.22 0.00 0.00 92 Q 7.91 4.05 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 7.35 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 93 I 7.83 4.12 1.83 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 1.33 0.52 0.95 0.00 0.00 94 G 7.72 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 95 A 8.28 4.32 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 96 T 8.08 4.75 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 1.22 0.00 0.00 97 L 8.29 4.71 0.00 1.72 1.75 0.96 0.97 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 98 N 8.55 5.12 0.00 2.69 2.68 0.00 0.00 6.79 7.59 0.00 0.00 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 8.31 4.54 0.00 3.10 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 * Residues marked with a * may have inaccurate shift predictions.