NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5426 8.3349 116.7999 59.0837 64.7178 172.6101 3 T 4.4171 8.0990 128.5259 63.7036 68.0780 174.9580 4 L 3.8345 8.9488 125.7821 59.4494 43.1352 177.8132 5 Y 4.1201 8.1962 119.3492 61.0541 37.0420 178.0596 6 E 3.6253 8.2867 117.4379 59.0121 29.8059 178.8707 7 K 4.2927 7.9688 118.9795 58.7903 32.2117 178.4989 8 L 4.3073 7.7341 117.4786 54.5024 42.2423 177.1747 9 G 3.6675 6.9394 106.6727 45.9558 0.0000 172.9140 10 G 2.8173 8.3789 105.8579 43.7217 0.0000 175.2385 11 T 4.0242 8.8312 114.2190 67.3615 68.2310 176.8053 12 T 3.8551 7.8523 116.4208 66.5855 68.6004 176.5828 13 A 3.9829 7.8543 122.2444 55.0500 18.3506 179.7265 14 V 3.4580 7.8227 116.7834 66.1016 31.6260 177.7624 15 D 4.2878 8.0889 117.8608 57.1211 41.0252 177.8078 16 L 3.9043 8.3486 121.0339 58.1785 42.1219 178.8215 17 A 3.9977 8.0367 120.4778 55.1971 18.2669 179.7468 18 V 3.7004 8.0637 116.9205 66.3519 31.5568 177.9823 19 D 4.4163 8.5864 119.0011 57.3599 40.6422 178.9210 20 K 4.0163 8.3191 119.0663 59.3572 32.0737 179.1620 21 F 4.5084 8.3815 122.1945 61.0481 39.3706 176.3996 22 Y 3.7872 8.2915 119.4111 60.5704 38.3882 177.7812 23 E 3.6378 8.5499 120.4150 59.2044 29.5742 178.7363 24 R 3.8407 7.8306 117.3509 59.5186 30.5094 178.3418 25 V 3.6129 7.6965 118.0146 65.7801 31.2156 177.7464 26 L 3.8326 7.4309 119.2416 57.3297 41.8815 177.9368 27 Q 4.5973 7.3535 115.3962 54.6966 29.4704 175.1134 28 D 4.6477 7.5780 121.7596 52.5879 39.2002 176.5862 29 D 4.4981 8.4970 127.6913 56.7374 41.1884 179.3824 30 R 4.3821 8.0646 117.9950 58.6467 30.3666 177.3941 31 I 4.9855 7.5408 105.5896 59.9032 39.8200 177.0340 32 K 4.1897 8.4950 121.9527 60.1088 32.7360 178.7836 33 H 4.3113 8.1087 114.6076 57.7681 28.5786 177.0493 34 F 3.9112 7.5645 118.2045 59.3347 39.0253 175.8268 35 F 4.6504 8.1191 118.3220 56.9105 39.2749 177.3552 36 A 4.0659 7.9016 125.8245 54.8312 18.2124 178.4773 37 D 4.8756 8.0915 113.1308 52.8870 39.7661 176.2210 38 V 4.5405 7.4791 118.1240 59.5326 34.3650 175.5136 39 D 4.7410 8.3326 121.4042 53.0449 41.8773 177.2456 40 M 4.1584 8.5252 118.4180 58.3371 31.8673 178.8939 41 A 3.9020 7.9651 120.6350 55.1379 18.6770 179.7208 42 K 4.0402 8.7400 117.3330 59.3284 32.1556 179.3470 43 Q 4.0126 8.3465 120.1687 59.3184 28.9316 178.5486 44 R 3.7504 7.9648 119.4549 59.1671 30.0082 178.1579 45 A 3.9957 8.0389 120.7022 55.3613 18.2154 179.1659 46 H 4.0920 8.3582 116.6077 59.7113 30.1008 177.5646 47 Q 3.6656 7.9175 119.6507 58.6015 28.2996 178.9754 48 K 4.0461 8.3333 120.6265 59.3887 32.2110 178.7012 49 A 4.2356 8.1316 122.4101 54.6109 18.2552 179.2270 50 F 3.8733 8.4538 119.4828 61.4127 39.4657 177.0545 51 L 4.2897 8.5352 119.8449 58.6473 41.8780 178.9948 52 T 4.0254 8.3365 115.7773 66.8167 68.4383 175.8529 53 Y 3.9786 8.3330 121.2719 60.8397 38.7174 178.1096 54 A 4.0756 8.4694 121.7586 55.0536 18.2789 179.0311 55 F 4.2286 8.3644 114.3271 57.8101 39.2938 175.6071 56 G 3.5913 7.2854 107.2182 45.2004 0.0000 174.4466 57 G 4.0300 8.5844 110.9553 45.2591 0.0000 176.4179 58 T 3.8287 7.8188 117.8983 66.3847 69.1494 176.7198 59 D 4.3766 8.2091 120.1116 57.5186 40.7466 178.0107 60 K 4.1350 7.0664 114.7228 56.8441 32.8284 176.6729 61 Y 5.1174 7.7674 116.7065 55.4336 38.1189 174.6759 62 D 4.5523 8.2820 119.2700 54.9753 42.9504 176.1823 63 G 4.0718 9.1383 113.2677 48.6905 0.0000 175.7704 64 R 4.0327 8.6862 120.3082 59.1150 30.0747 178.5582 65 Y 4.3921 8.1142 118.9840 60.8811 38.7644 177.6764 66 M 3.9713 8.5095 120.1166 58.3671 31.8719 178.6716 67 R 4.1093 8.0781 117.2184 59.5558 30.7583 178.4488 68 E 4.0827 8.2834 118.5805 59.2683 29.4543 178.6685 69 A 3.9769 8.3155 120.2012 54.5368 18.6438 178.2725 70 H 4.6158 7.7198 112.3529 55.4756 29.1996 176.6754 71 K 4.1869 7.6186 124.8861 59.2201 32.0019 178.5950 72 E 4.1118 8.1582 118.2528 59.2069 29.3186 179.0669 73 L 4.0817 7.9122 118.6593 57.9171 41.5280 179.6277 74 V 3.6049 7.6393 116.5667 66.1548 31.5985 177.5529 75 E 4.2281 8.5959 117.2749 58.2223 29.5342 177.2672 76 N 4.8621 8.8367 114.8014 53.6709 40.7819 174.9788 77 H 4.6401 8.3118 112.0228 54.9308 29.7238 174.7912 78 G 3.9351 8.3896 107.0999 45.9890 0.0000 173.5064 79 L 4.1292 8.3413 122.3486 54.9212 42.5540 175.8834 80 N 5.1159 8.8285 122.3720 50.5087 40.7240 174.7178 81 G 3.6219 8.6343 103.2278 48.1018 0.0000 175.1641 82 E 4.0237 8.1165 121.5597 59.5471 29.6323 178.8355 83 H 4.3508 8.1389 115.6956 58.6413 28.9401 177.0957 84 F 3.9637 8.2261 122.4993 61.6791 39.1582 176.9552 85 D 4.5277 8.8608 118.4945 57.3342 40.5604 178.6162 86 A 4.0446 7.9266 120.9611 55.1279 18.3733 179.9444 87 V 3.4559 7.7068 115.9794 65.9323 31.7548 177.9896 88 A 4.1245 7.8541 120.5671 55.3991 18.2292 179.2034 89 E 3.9092 8.5999 118.0965 59.4732 29.6777 178.6842 90 D 4.3579 8.2920 119.0180 57.2630 40.9156 178.4484 91 L 3.1619 7.7242 120.6732 58.0372 41.9001 179.1446 92 L 3.9636 7.7813 118.1887 57.5015 41.5336 179.2951 93 A 3.9753 8.1929 121.0136 55.2933 17.7937 179.7858 94 T 3.8298 7.9591 114.2549 66.9274 68.5219 176.9280 95 L 4.1082 8.0339 120.8428 57.4354 41.4979 179.4773 96 K 3.9630 8.3055 119.9443 59.4927 32.0213 178.2097 97 E 4.2871 8.1638 115.3392 57.7209 29.3960 177.6698 98 M 4.6099 7.5839 117.4805 54.2086 33.2876 176.7905 99 G 3.9167 8.1647 107.6402 44.9344 0.0000 174.3043 100 V 3.5287 7.7543 118.4855 62.8991 31.9600 174.3808 101 P 4.3911 0.0000 0.0000 62.2977 32.8142 177.1322 102 E 3.9294 8.9630 122.6419 59.3801 29.3969 179.0171 103 D 4.3193 7.9965 118.7641 56.5984 39.2736 178.4610 104 L 4.3393 7.6406 121.2136 56.2977 41.6738 179.2827 105 I 3.6678 7.9724 120.1582 64.0323 37.0190 178.1331 106 A 3.9594 7.7159 121.8167 54.9139 18.2192 179.4352 107 E 3.8439 7.9104 116.7366 59.9321 29.5620 180.1910 108 V 3.8101 7.5346 112.7747 63.4449 31.2869 178.5452 109 A 3.9381 8.0277 120.8056 55.1257 17.9842 179.5501 110 A 3.9898 7.9210 118.2442 54.8214 18.6369 179.8198 111 V 3.7188 7.2753 116.1451 65.9171 31.5803 177.8720 112 A 3.9102 8.1149 120.9523 54.8310 18.3027 178.5098 113 G 4.2874 7.7713 101.7367 45.3909 0.0000 174.0750 114 A 4.1773 7.9425 122.7531 50.8770 20.1099 177.2008 115 P 4.0682 0.0000 0.0000 66.0004 31.4805 179.0621 116 A 4.1135 7.9484 118.6875 55.1712 18.2794 179.0941 117 H 4.1187 8.1125 116.4515 59.1425 30.0371 177.1289 118 K 2.7579 8.0399 121.7390 59.1064 31.7745 178.4290 119 R 3.7322 8.1582 119.2195 59.5959 29.7656 178.2056 120 D 4.2570 7.9266 118.3525 57.3810 40.6561 178.8595 121 V 3.4031 7.5901 117.6234 65.8510 31.6433 177.3322 122 L 4.1645 7.8145 115.3832 54.1205 41.8734 176.2809 123 N 4.1725 7.9559 116.1069 54.3306 36.6823 174.4656 124 Q 4.1324 8.2726 121.8481 56.2836 28.7841 176.4152 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 S 8.33 4.54 0.00 3.91 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 3 T 8.10 4.42 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 1.28 0.00 0.00 4 L 8.95 3.83 0.00 1.81 1.70 0.72 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 5 Y 8.20 4.12 0.00 3.08 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 6 E 8.29 3.63 0.00 2.26 2.31 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 2.59 2.42 0.00 7 K 7.97 4.29 0.00 1.74 2.00 0.00 1.79 0.00 0.00 2.00 0.00 0.00 3.11 0.00 0.00 3.47 0.00 0.00 0.00 0.00 1.56 1.74 7.81 8 L 7.73 4.31 0.00 1.53 1.55 0.54 0.68 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 9 G 6.94 3.67 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 0.00 0.00 0.00 10 G 8.38 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 0.00 0.00 0.00 11 T 8.83 4.02 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 12 T 7.85 3.86 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 13 A 7.85 3.98 1.28 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 0.00 0.00 14 V 7.82 3.46 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 1.09 0.00 0.00 0.97 0.00 0.00 15 D 8.09 4.29 0.00 2.81 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 16 L 8.35 3.90 0.00 1.76 1.86 0.93 0.87 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 17 A 8.04 4.00 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 18 V 8.06 3.70 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 1.12 0.00 0.00 1.06 0.00 0.00 19 D 8.59 4.42 0.00 2.78 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 20 K 8.32 4.02 0.00 1.95 1.92 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.50 1.62 7.81 21 F 8.38 4.51 0.00 3.16 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 22 Y 8.29 3.79 0.00 2.91 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 23 E 8.55 3.64 0.00 2.18 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 2.25 2.27 0.00 24 R 7.83 3.84 0.00 1.85 2.14 0.00 3.38 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 25 V 7.70 3.61 1.68 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 0.61 0.00 0.00 0.76 0.00 0.00 26 L 7.43 3.83 0.00 1.10 1.47 0.74 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.35 4.60 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.68 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 28 D 7.58 4.65 0.00 2.88 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 29 D 8.50 4.50 0.00 2.79 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 30 R 8.06 4.38 0.00 2.06 2.12 0.00 3.16 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 31 I 7.54 4.99 2.09 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.92 1.07 0.00 0.00 32 K 8.49 4.19 0.00 1.97 2.33 0.00 1.30 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.40 7.81 33 H 8.11 4.31 0.00 3.22 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 F 7.56 3.91 0.00 2.78 2.59 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 35 F 8.12 4.65 0.00 3.30 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 36 A 7.90 4.07 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 37 D 8.09 4.88 0.00 2.82 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 38 V 7.48 4.54 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 1.02 0.00 0.00 1.00 0.00 0.00 39 D 8.33 4.74 0.00 3.00 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 40 M 8.53 4.16 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.60 0.00 41 A 7.97 3.90 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 42 K 8.74 4.04 0.00 1.98 1.95 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.63 7.81 43 Q 8.35 4.01 0.00 2.17 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.12 1.28 0.00 44 R 7.96 3.75 0.00 0.85 1.68 0.00 2.69 0.00 0.00 2.93 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.21 0.00 45 A 8.04 4.00 1.45 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 0.00 0.00 0.00 46 H 8.36 4.09 0.00 3.41 3.61 0.00 5.60 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 47 Q 7.92 3.67 0.00 1.99 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 1.50 1.16 0.00 48 K 8.33 4.05 0.00 1.86 2.03 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.54 7.81 49 A 8.13 4.24 1.37 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 0.00 0.00 0.00 50 F 8.45 3.87 0.00 3.18 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 51 L 8.54 4.29 0.00 2.40 2.02 1.08 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.34 4.03 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 1.44 0.00 0.00 53 Y 8.33 3.98 0.00 2.77 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 54 A 8.47 4.08 1.45 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 0.00 0.00 0.00 55 F 8.36 4.23 0.00 3.17 3.14 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 0.00 0.00 0.00 0.00 56 G 7.29 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 0.00 0.00 0.00 57 G 8.58 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 0.00 0.00 0.00 0.00 58 T 7.82 3.83 4.08 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 0.00 0.00 1.22 0.00 0.00 59 D 8.21 4.38 0.00 2.61 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 60 K 7.07 4.14 0.00 1.19 1.32 0.00 1.50 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.25 7.81 61 Y 7.77 5.12 0.00 3.53 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 62 D 8.28 4.55 0.00 2.80 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 63 G 9.14 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 0.00 0.00 0.00 64 R 8.69 4.03 0.00 2.04 2.06 0.00 3.17 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 65 Y 8.11 4.39 0.00 3.01 3.25 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 66 M 8.51 3.97 0.00 2.00 2.27 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 3.04 0.00 67 R 8.08 4.11 0.00 1.96 2.02 0.00 3.18 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.84 0.00 68 E 8.28 4.08 0.00 2.17 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 2.39 2.44 0.00 69 A 8.32 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 H 7.72 4.62 0.00 3.24 3.26 0.00 5.83 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 K 7.62 4.19 0.00 2.01 1.91 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.47 7.81 72 E 8.16 4.11 0.00 2.07 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 2.42 2.42 0.00 73 L 7.91 4.08 0.00 1.78 1.69 0.69 0.72 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 74 V 7.64 3.60 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 0.89 0.00 0.00 1.00 0.00 0.00 75 E 8.60 4.23 0.00 2.03 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 2.35 2.47 0.00 76 N 8.84 4.86 0.00 2.89 2.79 0.00 0.00 6.91 8.82 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 77 H 8.31 4.64 0.00 3.54 3.27 0.00 5.77 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 78 G 8.39 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.34 4.13 0.00 1.54 1.65 -0.03 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.83 5.12 0.00 2.93 2.94 0.00 0.00 6.14 6.93 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 81 G 8.63 3.62 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 0.00 0.00 0.00 82 E 8.12 4.02 0.00 1.97 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 2.29 2.37 0.00 83 H 8.14 4.35 0.00 3.30 3.16 0.00 5.71 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.23 3.96 0.00 3.06 3.17 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 85 D 8.86 4.53 0.00 2.97 2.78 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 0.00 0.00 0.00 86 A 7.93 4.04 1.45 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 0.00 0.00 0.00 87 V 7.71 3.46 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 0.49 0.00 0.00 0.93 0.00 0.00 88 A 7.85 4.12 1.46 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 89 E 8.60 3.91 0.00 2.03 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 2.32 2.36 0.00 90 D 8.29 4.36 0.00 3.02 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 91 L 7.72 3.16 0.00 0.64 1.60 0.45 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.78 3.96 0.00 1.74 1.66 0.92 0.52 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 93 A 8.19 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 94 T 7.96 3.83 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 1.26 0.00 0.00 95 L 8.03 4.11 0.00 1.82 1.76 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.31 3.96 0.00 1.97 1.91 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.33 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.70 7.81 97 E 8.16 4.29 0.00 2.22 1.99 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 2.35 2.48 0.00 98 M 7.58 4.61 0.00 1.96 2.30 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 2.54 2.51 0.00 99 G 8.16 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 0.00 0.00 0.00 100 V 7.75 3.53 2.23 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 0.92 0.00 0.00 1.05 0.00 0.00 101 P 0.00 4.39 0.00 2.20 1.96 0.00 3.69 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 2.12 2.14 0.00 102 E 8.96 3.93 0.00 2.07 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 2.38 2.44 0.00 103 D 8.00 4.32 0.00 2.93 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 0.00 104 L 7.64 4.34 0.00 1.81 1.76 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.97 3.67 1.98 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 1.44 0.74 0.87 0.00 0.00 106 A 7.72 3.96 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 0.00 107 E 7.91 3.84 0.00 2.16 1.91 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 2.29 2.36 0.00 108 V 7.53 3.81 1.63 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 -0.07 0.00 0.00 0.61 0.00 0.00 109 A 8.03 3.94 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 0.00 110 A 7.92 3.99 1.37 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 0.00 0.00 0.00 111 V 7.28 3.72 2.30 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 0.87 0.00 0.00 0.93 0.00 0.00 112 A 8.11 3.91 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 0.00 113 G 7.77 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 0.00 114 A 7.94 4.18 1.46 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 0.00 115 P 0.00 4.07 0.00 2.14 2.10 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 116 A 7.95 4.11 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 0.00 117 H 8.11 4.12 0.00 3.31 3.47 0.00 5.88 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.04 2.76 0.00 1.00 1.36 0.00 1.03 0.00 0.00 1.22 0.00 0.00 2.67 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.87 0.21 7.81 119 R 8.16 3.73 0.00 1.77 2.13 0.00 3.12 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.80 0.00 120 D 7.93 4.26 0.00 2.82 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 0.00 121 V 7.59 3.40 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 0.71 0.00 0.00 0.58 0.00 0.00 122 L 7.81 4.16 0.00 1.57 1.60 0.75 1.29 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 0.00 123 N 7.96 4.17 0.00 2.95 2.87 0.00 0.00 6.97 7.49 0.00 0.00 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 Q 8.27 4.13 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00