NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9191 8.3544 109.7386 45.7093 0.0000 172.4093 2 S 4.6531 8.5113 116.6881 56.0544 64.7652 173.6524 3 S 4.6104 8.2604 119.6655 57.2844 62.9179 172.7185 4 G 3.8157 7.4143 112.0232 46.0107 0.0000 171.1549 5 S 4.7617 7.6536 116.7644 55.7342 67.5339 174.1009 6 S 5.0127 8.7378 127.0625 60.7500 62.8042 177.7108 7 G 3.8708 7.8590 105.9450 42.1127 0.0000 170.1304 8 P 4.7371 0.0000 0.0000 62.6457 32.8438 175.0290 9 I 4.1729 9.0531 117.8676 62.1217 39.0701 176.3432 10 K 4.1505 7.2240 119.9422 54.5710 35.2115 174.7975 11 M 5.7566 8.1127 124.9665 53.8139 36.3094 174.3979 12 G 4.5545 9.6684 109.0922 46.0803 0.0000 172.3276 13 W 5.3030 9.4396 121.0838 56.2253 29.4777 176.0220 14 L 4.8380 9.2913 125.2385 52.7914 44.9300 175.8977 15 K 4.9752 8.5964 120.8532 55.1386 33.8251 175.3862 16 K 4.8094 8.7615 127.6626 54.2485 34.1985 175.2882 17 Q 3.8074 8.4361 129.7751 55.8509 29.6011 176.5156 18 R 3.9419 7.5599 124.9190 56.4510 30.4187 176.4416 19 S 4.1657 8.7224 113.6393 61.0189 63.9917 174.8954 20 I 4.6103 7.1726 120.3638 58.7734 37.5935 174.8620 21 V 4.4674 7.0883 117.7800 61.6577 35.0334 173.5970 22 K 4.3459 8.2653 120.9456 56.7401 32.6145 175.7089 23 N 5.1252 7.6554 115.8667 51.5894 42.7669 172.5289 24 W 4.8466 8.7077 120.4710 54.8074 32.4690 175.4956 25 Q 4.5199 8.9892 123.2831 54.0485 30.4476 175.0751 26 Q 4.7591 8.9814 126.7296 56.3101 29.0274 175.0277 27 R 4.2771 9.1957 125.6258 54.0108 34.7133 174.8793 28 Y 4.3960 7.9126 122.4292 56.7725 39.1874 174.2291 29 F 4.9032 9.6505 127.0254 56.7257 40.9833 175.4153 30 V 5.1295 9.1243 121.7716 61.2396 35.5027 173.8966 31 L 5.2044 9.4467 129.5645 53.7105 43.8450 175.3068 32 R 5.0362 8.8050 125.9577 55.2731 33.4644 175.5303 33 A 3.6588 8.5968 126.3794 54.0563 17.7575 178.3910 34 Q 4.5525 8.4348 108.9876 55.3034 26.9581 176.2361 35 Q 4.6057 8.0289 116.6320 54.8621 34.7102 174.8028 36 L 4.6224 8.3601 125.8541 53.7279 44.1036 174.8741 37 Y 5.7699 8.9303 122.7403 55.6492 42.5374 174.1408 38 Y 4.7125 7.2943 116.7035 56.3300 40.9473 173.3287 39 Y 4.5572 9.0600 121.5292 55.7321 41.0745 177.2406 40 K 3.9513 8.8159 121.0710 59.1781 32.3659 176.5215 41 D 5.0158 7.7143 115.2956 52.2295 42.5276 174.0396 42 E 4.9500 8.8610 115.1850 56.9487 30.2736 175.9713 43 E 4.3878 8.3859 118.1632 58.9532 31.7169 175.1695 44 D 4.6158 7.7870 116.4945 54.9401 41.6266 175.4208 45 T 4.6402 8.1205 109.8243 60.7914 69.2236 173.8678 46 K 4.5299 8.1626 122.3918 55.0421 35.0497 173.4858 47 P 3.2783 0.0000 0.0000 62.3086 31.4910 175.8521 48 Q 3.7731 6.6946 122.2464 56.6007 29.4975 175.8513 49 G 4.5364 6.4240 104.4255 44.0180 0.0000 171.2118 50 C 5.1081 8.3818 115.9308 56.4363 32.4249 172.6913 51 M 4.4438 8.5242 124.2446 53.2507 34.3652 174.1212 52 Y 4.5598 8.6795 127.3974 57.3417 38.9692 174.9094 53 L 4.0572 8.4960 128.9988 57.3382 42.4257 177.1131 54 P 4.6435 0.0000 0.0000 60.6274 30.2427 176.1064 55 G 4.7523 6.5242 117.0221 47.5448 0.0000 170.2498 56 C 5.3797 7.4978 115.4900 58.0058 33.3391 174.8642 57 T 4.4646 8.7958 115.6897 62.0165 71.4693 173.9272 58 I 4.6259 8.4831 128.5409 60.6607 37.8961 175.7054 59 K 4.6342 8.9412 127.4111 54.3717 35.0116 175.6077 60 E 4.7221 8.9470 124.8755 56.1703 29.7514 176.2012 61 I 4.4280 8.4881 126.1508 60.0302 38.6301 175.5581 62 A 4.9179 8.3503 128.0910 50.4909 22.2087 177.3104 63 T 4.5701 7.9057 120.8255 62.5464 67.8766 177.2242 64 N 4.5810 8.7432 128.2629 53.5869 38.9337 172.9732 65 P 4.3918 0.0000 0.0000 65.8643 32.0188 177.7210 66 E 4.0154 8.2476 118.6159 58.8470 29.8246 176.7505 67 E 3.9906 8.0937 116.0443 56.8100 30.0696 176.3857 68 A 4.5376 8.1292 123.1769 51.6576 21.9688 175.0738 69 G 3.7322 9.4206 111.5928 45.7090 0.0000 171.9105 70 K 4.1497 7.7342 121.6844 54.8001 36.3251 177.1384 71 F 5.1838 7.9005 121.9185 55.6557 38.6161 173.5606 72 V 4.8130 7.8382 120.7834 60.8503 35.5138 173.9137 73 F 5.6298 9.0621 121.4488 55.6655 41.5474 172.7350 74 E 5.0265 9.3103 120.6158 54.6180 32.3186 174.5756 75 I 4.8477 8.7267 123.0962 59.9532 39.6299 174.4871 76 I 4.5470 8.2903 128.3501 58.7554 38.8989 173.8951 77 P 4.8059 0.0000 0.0000 62.0525 32.3573 175.9295 78 A 4.1340 8.2312 122.6398 52.5691 19.4186 176.5309 79 S 3.4599 8.8325 115.8997 59.2947 60.0632 172.8779 80 W 4.7743 7.9265 132.8941 56.9836 31.3054 171.4170 81 D 3.8989 8.0530 127.5980 54.2205 46.2776 177.4507 82 Q 4.5148 7.8701 115.6880 56.2749 29.0998 175.9230 83 N 4.8252 7.6251 117.0039 52.9536 39.2475 173.6132 84 R 4.5115 7.9446 127.8809 56.2649 30.2375 176.5717 85 M 4.5239 7.1776 115.0272 55.0025 35.4687 176.4836 86 G 3.9165 7.5276 114.2557 46.0949 0.0000 172.8704 87 Q 4.7007 8.3007 123.7500 55.3240 30.5244 172.0923 88 D 4.9396 8.0572 121.0304 51.6063 43.1597 176.4897 89 S 4.2244 8.2595 117.2176 59.2780 63.7750 173.8316 90 Y 4.4671 9.5759 118.7762 56.3002 38.0480 174.6903 91 V 3.7736 7.9134 123.4205 62.7772 32.4348 174.0774 92 L 5.0334 8.1711 128.3292 52.9424 44.8265 175.5705 93 M 5.0107 8.8289 121.1267 53.8816 35.6396 173.7289 94 A 5.0005 8.1952 125.8965 50.4358 21.2463 177.0991 95 S 4.1220 9.0173 114.7740 61.1460 63.1289 175.2904 96 S 5.0434 7.7353 115.2475 56.5986 66.2729 174.9886 97 Q 2.9137 7.9489 123.2543 59.1055 28.7134 178.0079 98 A 3.3679 7.8148 121.3055 55.2549 18.1261 179.1998 99 E 3.9150 7.9824 117.1759 59.7542 29.9278 178.4264 100 M 4.1281 7.8500 118.0011 58.5499 32.2018 178.0141 101 E 3.8296 8.9065 120.0440 59.2721 29.5481 178.7887 102 E 3.8880 7.9235 119.2868 59.2969 29.6970 178.2650 103 W 4.5377 8.3348 118.7156 60.2687 28.8229 178.3349 104 V 3.5740 8.0374 117.5296 66.3698 30.8708 177.5975 105 K 3.6800 8.4435 118.8941 60.0967 31.8323 178.1378 106 F 4.1947 9.1063 117.7822 60.8575 38.9351 177.2603 107 L 4.0712 9.0441 119.3348 58.4120 41.5408 179.5767 108 R 3.8781 9.2950 118.6993 60.2240 30.0707 177.7685 109 R 3.7427 8.7837 118.5180 59.7032 29.9208 178.0265 110 V 3.6604 8.7052 117.1579 66.3945 31.5616 178.2197 111 A 4.6306 7.5882 120.4793 54.5427 18.1406 179.3127 112 G 4.0376 8.1497 104.8584 46.0749 0.0000 174.0969 113 S 4.1030 7.3826 116.4401 58.0300 62.5497 173.3427 114 G 4.0942 8.0553 115.8679 44.1365 0.0000 171.2734 115 P 4.4860 0.0000 0.0000 61.7396 29.6838 174.3506 116 S 4.3361 7.7587 119.6693 58.7090 65.6494 175.7052 117 S 4.4596 8.8871 120.1979 58.1524 63.3883 174.5709 118 G 3.6368 7.1536 114.7485 46.4703 0.0000 172.3253 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 G 8.35 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 2 S 8.51 4.65 0.00 3.91 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 3 S 8.26 4.61 0.00 3.84 3.73 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 4 G 7.41 3.82 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 5 S 7.65 4.76 0.00 3.81 3.71 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 6 S 8.74 5.01 0.00 3.99 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 7 G 7.86 3.87 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 0.00 0.00 0.00 8 P 0.00 4.74 0.00 2.18 2.13 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 9 I 9.05 4.17 1.65 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 1.22 0.53 0.54 0.00 0.00 10 K 7.22 4.15 0.00 0.79 0.74 0.00 1.11 0.00 0.00 1.26 0.00 0.00 2.25 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.30 0.21 7.81 11 M 8.11 5.76 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.67 0.00 12 G 9.67 4.55 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 0.00 13 W 9.44 5.30 0.00 3.21 3.35 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 14 L 9.29 4.84 0.00 0.66 0.89 -0.82 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.60 4.98 0.00 1.76 1.89 0.00 1.51 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.63 1.47 7.81 16 K 8.76 4.81 0.00 1.74 1.43 0.00 0.68 0.00 0.00 0.96 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 0.69 7.81 17 Q 8.44 3.81 0.00 1.10 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.30 0.00 0.00 0.00 0.00 0.00 1.78 1.46 0.00 18 R 7.56 3.94 0.00 1.54 1.81 0.00 3.15 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 19 S 8.72 4.17 0.00 3.95 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 20 I 7.17 4.61 1.84 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 1.27 0.65 0.88 0.00 0.00 21 V 7.09 4.47 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 0.83 0.00 0.00 0.87 0.00 0.00 22 K 8.27 4.35 0.00 1.71 1.77 0.00 1.55 0.00 0.00 1.58 0.00 0.00 2.73 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.35 1.40 7.81 23 N 7.66 5.13 0.00 2.69 2.57 0.00 0.00 6.87 8.01 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 24 W 8.71 4.85 0.00 3.11 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 25 Q 8.99 4.52 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 26 Q 8.98 4.76 0.00 2.27 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 6.85 0.00 0.00 0.00 0.00 0.00 2.85 2.62 0.00 27 R 9.20 4.28 0.00 1.60 1.91 0.00 3.37 0.00 0.00 3.02 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 28 Y 7.91 4.40 0.00 1.90 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 29 F 9.65 4.90 0.00 3.04 2.50 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 30 V 9.12 5.13 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 1.05 0.00 0.00 0.49 0.00 0.00 31 L 9.45 5.20 0.00 2.15 1.58 1.24 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.80 5.04 0.00 2.10 2.00 0.00 3.31 0.00 0.00 3.02 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 33 A 8.60 3.66 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 34 Q 8.43 4.55 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.64 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 35 Q 8.03 4.61 0.00 2.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 36 L 8.36 4.62 0.00 1.71 1.47 1.19 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 8.93 5.77 0.00 2.86 2.39 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.29 4.71 0.00 1.43 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 0.00 0.00 0.00 39 Y 9.06 4.56 0.00 2.86 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 40 K 8.82 3.95 0.00 1.80 1.94 0.00 1.76 0.00 0.00 1.82 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.46 7.81 41 D 7.71 5.02 0.00 2.91 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 42 E 8.86 4.95 0.00 2.33 2.18 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 2.31 2.49 0.00 43 E 8.39 4.39 0.00 1.97 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 2.20 2.29 0.00 44 D 7.79 4.62 0.00 2.88 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 45 T 8.12 4.64 4.21 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 1.23 0.00 0.00 46 K 8.16 4.53 0.00 1.65 1.66 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.42 7.81 47 P 0.00 3.28 0.00 2.00 1.48 0.00 3.74 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 1.85 1.73 0.00 48 Q 6.69 3.77 0.00 0.93 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 49 G 6.42 4.54 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 0.00 0.00 0.00 50 C 8.38 5.11 0.00 3.01 2.94 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 51 M 8.52 4.44 0.00 2.00 1.60 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 52 Y 8.68 4.56 0.00 2.79 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 53 L 8.50 4.06 0.00 1.63 1.66 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.64 0.00 1.72 1.94 0.00 2.77 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.40 0.00 55 G 6.52 4.75 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 0.00 0.00 0.00 56 C 7.50 5.38 0.00 2.89 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 57 T 8.80 4.46 4.21 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 1.20 0.00 0.00 58 I 8.48 4.63 1.91 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 1.48 0.47 0.98 0.00 0.00 59 K 8.94 4.63 0.00 1.68 1.70 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.70 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.48 7.81 60 E 8.95 4.72 0.00 1.91 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 2.40 2.39 0.00 61 I 8.49 4.43 1.94 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 1.39 0.95 0.95 0.00 0.00 62 A 8.35 4.92 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 63 T 7.91 4.57 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 1.22 0.00 0.00 64 N 8.74 4.58 0.00 2.68 2.86 0.00 0.00 7.09 8.02 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 65 P 0.00 4.39 0.00 2.18 2.18 0.00 3.77 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 1.99 1.95 0.00 66 E 8.25 4.02 0.00 1.93 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 2.29 2.39 0.00 67 E 8.09 3.99 0.00 1.95 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 0.00 2.30 2.37 0.00 68 A 8.13 4.54 1.18 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 0.00 0.00 0.00 69 G 9.42 3.73 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 0.00 0.00 0.00 70 K 7.73 4.15 0.00 1.62 1.51 0.00 1.44 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.26 1.36 7.81 71 F 7.90 5.18 0.00 2.93 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 72 V 7.84 4.81 2.39 0.00 0.00 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 0.87 0.00 0.00 73 F 9.06 5.63 0.00 3.19 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 74 E 9.31 5.03 0.00 2.00 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 2.15 2.17 0.00 75 I 8.73 4.85 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.00 0.94 0.00 0.00 76 I 8.29 4.55 1.72 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.48 0.50 0.00 0.00 77 P 0.00 4.81 0.00 2.06 1.97 0.00 3.61 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.87 0.00 78 A 8.23 4.13 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 79 S 8.83 3.46 0.00 4.05 3.96 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 0.00 0.00 0.00 80 W 7.93 4.77 0.00 3.16 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 81 D 8.05 3.90 0.00 2.48 2.44 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 82 Q 7.87 4.51 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 83 N 7.63 4.83 0.00 2.62 2.72 0.00 0.00 7.31 7.67 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 84 R 7.94 4.51 0.00 1.79 1.88 0.00 3.33 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 85 M 7.18 4.52 0.00 1.95 1.92 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 2.47 2.49 0.00 86 G 7.53 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 87 Q 8.30 4.70 0.00 2.08 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 88 D 8.06 4.94 0.00 2.69 2.55 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 89 S 8.26 4.22 0.00 3.84 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 90 Y 9.58 4.47 0.00 2.80 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 91 V 7.91 3.77 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 0.80 0.00 0.00 0.83 0.00 0.00 92 L 8.17 5.03 0.00 0.27 0.74 0.60 0.07 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 93 M 8.83 5.01 0.00 1.17 1.18 0.00 0.00 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.09 0.00 94 A 8.20 5.00 1.48 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 0.00 0.00 95 S 9.02 4.12 0.00 3.89 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 96 S 7.74 5.04 0.00 3.92 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 97 Q 7.95 2.91 0.00 0.93 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.70 0.00 0.00 0.00 0.00 0.00 2.05 1.76 0.00 98 A 7.81 3.37 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 99 E 7.98 3.91 0.00 2.13 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 2.70 2.63 0.00 100 M 7.85 4.13 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.40 0.00 101 E 8.91 3.83 0.00 1.96 1.89 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 2.20 2.36 0.00 102 E 7.92 3.89 0.00 2.21 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 2.36 2.58 0.00 103 W 8.33 4.54 0.00 3.49 3.10 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 0.00 104 V 8.04 3.57 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 0.86 0.00 0.00 -0.02 0.00 0.00 105 K 8.44 3.68 0.00 1.77 1.73 0.00 0.91 0.00 0.00 1.12 0.00 0.00 2.72 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.25 1.46 7.81 106 F 9.11 4.19 0.00 3.33 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 0.00 107 L 9.04 4.07 0.00 1.89 1.86 1.22 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 108 R 9.29 3.88 0.00 1.88 1.91 0.00 3.10 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 109 R 8.78 3.74 0.00 1.87 1.94 0.00 3.34 0.00 0.00 3.13 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 110 V 8.71 3.66 2.13 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 0.89 0.00 0.00 1.08 0.00 0.00 111 A 7.59 4.63 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 0.00 112 G 8.15 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 0.00 113 S 7.38 4.10 0.00 3.87 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 0.00 114 G 8.06 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 0.00 0.00 0.00 115 P 0.00 4.49 0.00 2.21 2.13 0.00 3.82 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 2.01 2.02 0.00 116 S 7.76 4.34 0.00 3.86 3.78 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 0.00 117 S 8.89 4.46 0.00 3.98 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 0.00 118 G 7.15 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