NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6189 8.2893 118.1965 55.6417 31.2695 174.7636 2 T 3.7649 8.4434 116.8973 61.9462 69.5324 173.1429 3 M 2.8995 8.5744 123.1283 55.9478 30.5651 174.2006 4 N 4.7260 8.9443 117.9944 51.3292 40.6150 174.0318 5 I 5.3377 8.5958 125.9208 59.0308 38.9050 176.0193 6 T 4.4856 8.3606 118.0141 59.9822 70.7911 173.5141 7 S 4.2264 8.5026 122.6356 58.4709 64.3382 174.2177 8 K 3.9308 8.7137 122.2986 57.2780 31.2593 177.9832 9 Q 4.2232 8.4350 123.8732 57.5524 30.6826 176.2657 10 M 4.1707 7.6646 118.2270 53.4526 30.9100 174.9267 11 E 4.0507 8.3617 124.0349 56.1531 30.0947 176.5201 12 I 4.2193 8.0097 119.8808 60.2870 37.3405 176.7698 13 T 4.3042 8.2744 116.9338 60.3589 71.1295 173.4035 14 P 4.1771 0.0000 0.0000 66.2791 31.1584 178.5776 15 A 4.1084 7.9490 119.7970 55.0190 18.4972 179.5760 16 I 3.9245 7.9005 118.5170 64.4380 37.2375 178.6246 17 R 3.9742 8.7714 117.5706 59.8674 29.0619 178.9610 18 Q 4.0391 8.0621 118.3412 58.7193 28.6768 177.7377 19 H 3.9210 8.1098 119.4767 59.0042 29.8221 177.5316 20 V 3.5776 8.2112 120.3853 64.7382 31.1752 177.8377 21 A 3.9849 8.0625 121.6195 55.2612 18.2426 179.3434 22 D 4.2994 8.0196 116.9578 57.5178 40.8308 179.4446 23 R 3.8830 7.7064 118.0237 59.2617 29.9118 178.9269 24 L 3.9588 8.4266 118.9266 57.8043 42.3944 178.5084 25 A 4.1217 8.3104 121.2912 55.2054 18.4198 179.5665 26 K 3.9475 7.9406 117.3363 59.4694 32.3506 178.6385 27 L 4.4478 8.2441 119.9595 57.2153 41.7667 178.0819 28 E 4.0942 7.8925 117.9114 58.3341 29.4633 176.8205 29 K 4.4956 7.4465 117.8780 55.9197 32.3698 175.9639 30 W 4.1510 8.0471 117.1399 56.1031 29.9486 177.2672 31 Q 4.4755 8.3598 119.5314 55.9294 26.1389 175.2566 32 T 4.6937 7.7548 112.9673 62.0953 73.1491 174.4125 33 H 4.8290 10.1241 135.0000 56.6627 28.0501 176.3347 34 L 3.4590 7.0907 112.0153 55.8108 37.9567 174.0841 35 I 4.0666 8.1384 126.7491 62.6965 38.4756 175.8535 36 N 4.8111 7.7482 121.3080 50.9666 38.1606 170.4579 37 P 4.5085 0.0000 0.0000 62.5720 32.7433 175.8541 38 H 4.9704 9.5218 127.7550 55.1408 30.8842 173.9269 39 I 4.4075 9.2530 129.6626 60.0481 38.7421 175.4307 40 I 4.3927 8.9066 129.9934 58.7915 38.9451 175.0013 41 L 4.9096 8.1928 130.5812 53.6560 42.9421 175.6287 42 S 4.6229 8.7510 122.6095 56.4311 66.7409 173.1391 43 K 4.2835 8.1696 122.2863 54.8069 33.4110 175.0973 44 E 4.7503 8.6186 126.7609 53.7281 32.0006 175.1029 45 P 4.1710 0.0000 0.0000 65.8445 31.6255 178.3560 46 Q 4.4297 7.8359 117.1573 55.8965 29.4205 174.4118 47 G 4.2915 7.7187 103.7335 43.4149 0.0000 173.6821 48 F 4.7037 9.8846 120.8515 57.4122 40.5369 175.2260 49 V 4.5123 8.7773 123.0438 61.4127 32.4957 173.8124 50 A 4.5535 8.6844 129.7312 50.8307 19.2590 174.8895 51 D 4.7467 9.5021 121.9921 53.4825 41.9351 174.9385 52 A 4.9047 8.9613 126.2787 50.7892 20.5809 176.0259 53 T 4.4029 9.4217 120.9678 63.1592 69.8124 173.9718 54 I 4.6250 8.5755 128.3537 59.7702 39.8241 175.1890 55 N 4.8401 8.4943 125.6524 52.8627 38.8822 173.5509 56 T 4.7295 8.3166 121.0594 59.7151 68.9186 173.6993 57 P 4.2068 0.0000 0.0000 65.4186 31.2395 176.7160 58 N 4.7015 7.8956 116.0598 53.7396 40.8241 175.9666 59 G 4.2710 7.3620 108.8933 45.9758 0.0000 175.6214 60 V 4.6077 8.5064 125.3153 61.3716 34.2846 172.7465 61 L 4.5160 9.0933 129.7505 53.2174 42.0985 176.2197 62 V 4.4247 8.2214 124.8716 61.5456 32.2060 175.3000 63 A 4.4298 9.4166 133.0944 51.0139 19.8698 175.8186 64 S 4.9828 8.6582 118.7850 57.5666 64.9621 174.7210 65 G 3.9918 8.9315 112.2951 44.4620 0.0000 170.5020 66 K 5.6916 8.2746 127.8057 54.1027 33.8143 175.0081 67 H 4.5266 8.5074 123.4760 55.4799 32.4277 174.5832 68 E 3.4626 9.0957 122.5311 58.9638 29.8046 177.4617 69 D 4.5188 7.9332 120.4279 52.8276 42.3776 176.7314 70 M 3.6597 8.0033 123.1235 58.8471 31.2042 178.3669 71 Y 4.3105 7.8879 117.3199 60.7570 37.9633 178.2784 72 T 4.0217 7.8829 116.2476 66.2014 68.6321 176.5973 73 A 4.0711 8.1945 123.1131 55.0340 18.5253 179.7854 74 I 3.7125 7.7736 117.9479 64.6248 37.3246 178.3068 75 N 4.2916 8.0215 116.7704 56.5059 38.6108 177.2394 76 E 3.9721 8.4885 120.0766 59.3409 29.6401 179.4799 77 L 3.8985 7.9468 120.3047 58.2998 42.2799 179.0132 78 I 3.6885 7.6110 117.7123 63.6214 37.9043 177.6471 79 N 4.2515 7.8865 117.4226 56.3402 38.5014 177.3492 80 K 3.9242 7.8680 119.4138 59.3751 32.0592 179.1980 81 L 3.8371 7.7112 120.1130 58.0027 41.9286 178.7235 82 E 3.2355 7.8532 118.4388 59.3255 29.4849 179.4981 83 R 3.8936 7.6720 117.3963 59.5416 29.7992 179.0185 84 Q 3.9812 8.0303 119.0049 58.8229 28.9156 178.2303 85 L 3.8885 7.8730 121.8010 58.1391 41.9158 178.4404 86 N 4.5126 8.0901 115.2544 56.3103 38.7650 176.9635 87 K 4.0643 7.9108 120.2805 59.6373 32.1889 178.5903 88 L 3.9760 7.5800 118.5759 58.0698 41.9577 178.3511 89 Q 4.4987 7.8467 116.5454 56.5309 29.0394 174.8638 90 H 4.2264 7.8008 119.4357 56.9902 29.6941 175.7047 91 K 4.4997 8.1908 131.9120 55.0579 31.9296 176.7649 92 G 3.9825 7.4814 107.0850 42.8766 0.0000 171.5505 93 E 4.9514 7.8282 121.4127 55.8088 31.2196 175.1122 94 A 4.7207 7.8034 123.7850 49.1734 20.9141 177.9634 95 R 3.9601 8.3170 120.6504 56.9635 28.7234 176.2210 96 R 4.2021 8.0452 125.6269 55.6270 32.4273 175.1657 97 A 3.5550 8.9463 122.5433 51.8744 17.7203 178.3535 98 A 3.7322 8.0419 121.0427 52.1638 17.3270 178.0710 99 T 4.0319 8.4037 110.7723 65.2862 68.7013 175.0753 100 S 4.7415 7.3259 117.6917 58.6515 63.3827 175.6218 101 V 4.0189 7.7090 121.7986 63.0144 32.8709 176.9939 102 K 4.2766 7.7391 120.6168 54.8024 30.5568 176.8604 103 D 3.9848 7.2369 116.7250 53.0126 41.1250 176.1694 104 A 4.4021 8.3145 127.8160 51.4381 19.5764 178.1326 105 N 4.9381 8.4502 116.4030 53.8377 37.3859 175.2250 106 F 3.8986 8.9437 123.0078 58.6118 37.6886 177.8698 107 V 4.1862 9.1876 127.3927 62.2300 32.2196 173.7256 108 E 4.5562 8.7231 126.5721 55.6012 31.2226 174.3597 109 E 4.4567 8.0715 118.7908 56.4009 31.0325 175.0432 110 V 3.2188 8.1349 125.1213 63.8114 28.4397 170.9212 111 E 4.3067 7.5857 120.3607 56.6748 30.3945 176.4549 112 E 4.6709 7.0822 120.2262 57.5755 35.9318 175.1910 113 E 4.1723 7.9629 123.3017 56.6460 29.6001 176.9180 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 M 8.29 4.62 0.00 2.39 2.20 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 2.47 2.79 0.00 2 T 8.44 3.76 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 1.20 0.00 0.00 3 M 8.57 2.90 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 4 N 8.94 4.73 0.00 2.61 2.39 0.00 0.00 6.76 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 5 I 8.60 5.34 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.33 1.00 0.00 0.00 6 T 8.36 4.49 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 7 S 8.50 4.23 0.00 3.74 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 8 K 8.71 3.93 0.00 1.72 1.60 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.33 7.81 9 Q 8.44 4.22 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.13 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 10 M 7.66 4.17 0.00 1.79 1.91 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.31 0.00 11 E 8.36 4.05 0.00 2.12 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 2.29 2.36 0.00 12 I 8.01 4.22 1.89 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 1.48 0.87 0.95 0.00 0.00 13 T 8.27 4.30 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 1.28 0.00 0.00 14 P 0.00 4.18 0.00 2.32 2.39 0.00 3.73 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 2.10 2.07 0.00 15 A 7.95 4.11 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.90 3.92 2.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.92 1.07 0.00 0.00 17 R 8.77 3.97 0.00 2.02 2.41 0.00 2.80 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.72 0.00 18 Q 8.06 4.04 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 19 H 8.11 3.92 0.00 3.37 3.14 0.00 5.79 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.21 3.58 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.93 0.00 0.00 21 A 8.06 3.98 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 22 D 8.02 4.30 0.00 2.94 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 7.71 3.88 0.00 1.98 1.94 0.00 3.25 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.71 0.00 24 L 8.43 3.96 0.00 1.76 1.70 0.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.31 4.12 1.41 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 26 K 7.94 3.95 0.00 1.84 1.87 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.61 7.81 27 L 8.24 4.45 0.00 2.03 1.67 0.79 0.64 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 28 E 7.89 4.09 0.00 2.16 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 2.35 2.39 0.00 29 K 7.45 4.50 0.00 1.75 1.74 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.35 7.81 30 W 8.05 4.15 0.00 3.55 3.15 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 31 Q 8.36 4.48 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.62 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 32 T 7.75 4.69 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 33 H 10.12 4.83 0.00 3.29 3.48 0.00 5.73 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.09 3.46 0.00 1.74 1.97 1.09 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.14 4.07 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 1.22 1.04 0.91 0.00 0.00 36 N 7.75 4.81 0.00 2.62 2.74 0.00 0.00 6.75 8.04 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 37 P 0.00 4.51 0.00 2.10 2.23 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 2.12 1.95 0.00 38 H 9.52 4.97 0.00 3.31 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 9.25 4.41 1.88 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 0.80 0.92 0.00 0.00 40 I 8.91 4.39 1.97 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 1.06 1.17 0.89 0.00 0.00 41 L 8.19 4.91 0.00 1.63 1.56 1.12 0.83 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 42 S 8.75 4.62 0.00 3.65 3.59 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 0.00 0.00 0.00 0.00 43 K 8.17 4.28 0.00 1.46 1.59 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.75 7.81 44 E 8.62 4.75 0.00 2.23 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 2.22 2.22 0.00 45 P 0.00 4.17 0.00 2.06 2.16 0.00 3.93 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 46 Q 7.84 4.43 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.43 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 47 G 7.72 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 0.00 0.00 0.00 0.00 48 F 9.88 4.70 0.00 3.11 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 49 V 8.78 4.51 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 1.21 0.00 0.00 0.91 0.00 0.00 50 A 8.68 4.55 1.35 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 0.00 0.00 51 D 9.50 4.75 0.00 2.61 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 52 A 8.96 4.90 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.42 4.40 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 1.20 0.00 0.00 54 I 8.58 4.62 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.81 0.90 0.00 0.00 55 N 8.49 4.84 0.00 2.95 2.73 0.00 0.00 6.62 8.57 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 56 T 8.32 4.73 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 1.29 0.00 0.00 57 P 0.00 4.21 0.00 2.25 2.21 0.00 3.86 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 2.06 2.19 0.00 58 N 7.90 4.70 0.00 2.68 2.89 0.00 0.00 7.04 9.28 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 59 G 7.36 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 60 V 8.51 4.61 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 0.75 0.00 0.00 0.93 0.00 0.00 61 L 9.09 4.52 0.00 1.56 1.54 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 62 V 8.22 4.42 2.06 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 0.83 0.00 0.00 0.91 0.00 0.00 63 A 9.42 4.43 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 64 S 8.66 4.98 0.00 3.75 3.80 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 65 G 8.93 3.99 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 0.00 66 K 8.27 5.69 0.00 1.79 1.75 0.00 1.57 0.00 0.00 2.32 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.47 7.81 67 H 8.51 4.53 0.00 3.28 3.10 0.00 5.93 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 9.10 3.46 0.00 2.06 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 2.20 2.30 0.00 69 D 7.93 4.52 0.00 2.81 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 70 M 8.00 3.66 0.00 1.22 2.36 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 71 Y 7.89 4.31 0.00 2.90 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 72 T 7.88 4.02 4.44 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 0.98 0.00 0.00 73 A 8.19 4.07 1.65 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 74 I 7.77 3.71 1.92 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.29 0.93 0.00 0.00 75 N 8.02 4.29 0.00 2.87 2.85 0.00 0.00 7.15 8.16 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 76 E 8.49 3.97 0.00 2.13 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 0.00 2.27 2.41 0.00 77 L 7.95 3.90 0.00 1.91 1.90 1.01 0.76 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 78 I 7.61 3.69 1.82 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 1.70 1.17 0.95 0.00 0.00 79 N 7.89 4.25 0.00 2.99 2.82 0.00 0.00 7.14 6.26 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 80 K 7.87 3.92 0.00 1.77 1.83 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.71 1.73 7.81 81 L 7.71 3.84 0.00 1.78 1.47 0.69 0.75 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 82 E 7.85 3.24 0.00 2.28 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 2.51 1.70 0.00 83 R 7.67 3.89 0.00 1.99 1.97 0.00 3.13 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 84 Q 8.03 3.98 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 85 L 7.87 3.89 0.00 1.58 1.24 0.41 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.09 4.51 0.00 2.96 2.98 0.00 0.00 7.18 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 87 K 7.91 4.06 0.00 1.81 1.98 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.46 1.61 7.81 88 L 7.58 3.98 0.00 1.88 1.73 0.97 1.01 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 89 Q 7.85 4.50 0.00 2.40 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.74 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 90 H 7.80 4.23 0.00 3.32 3.35 0.00 5.79 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.19 4.50 0.00 1.71 1.70 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.44 7.81 92 G 7.48 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 E 7.83 4.95 0.00 1.81 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 2.06 2.21 0.00 94 A 7.80 4.72 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 95 R 8.32 3.96 0.00 1.78 1.90 0.00 3.39 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 96 R 8.05 4.20 0.00 1.81 1.85 0.00 3.43 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 97 A 8.95 3.56 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 98 A 8.04 3.73 1.35 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 0.00 0.00 99 T 8.40 4.03 4.23 0.00 0.00 0.00 0.00 0.00 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 0.00 100 S 7.33 4.74 0.00 3.68 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 0.00 101 V 7.71 4.02 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 0.72 0.00 0.00 0.92 0.00 0.00 102 K 7.74 4.28 0.00 1.85 1.87 0.00 1.55 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.37 7.81 103 D 7.24 3.98 0.00 2.52 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 0.00 104 A 8.31 4.40 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.45 4.94 0.00 2.77 2.85 0.00 0.00 6.88 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 F 8.94 3.90 0.00 2.90 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 0.00 107 V 9.19 4.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.02 0.00 0.00 108 E 8.72 4.56 0.00 2.07 1.87 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 2.27 2.32 0.00 109 E 8.07 4.46 0.00 1.97 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 2.24 2.29 0.00 110 V 8.13 3.22 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 0.91 0.00 0.00 0.94 0.00 0.00 111 E 7.59 4.31 0.00 1.98 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 2.35 0.00 112 E 7.08 4.67 0.00 1.87 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 2.19 2.33 0.00 113 E 7.96 4.17 0.00 2.00 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 2.31 2.25 0.00