NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.5264 8.4345 115.5519 58.0180 64.6745 173.6460 1 M 4.2503 8.4416 121.0670 52.7051 31.7110 174.6454 2 P 4.8882 0.0000 0.0000 62.3651 33.1661 174.6282 3 H 5.0904 8.8952 115.8931 54.0859 32.3184 172.1680 4 S 5.2274 8.5696 114.7262 57.1068 64.8835 173.9040 5 V 4.4918 8.7953 122.7731 61.3768 34.8909 174.1649 6 T 4.9570 8.5193 122.7830 61.7207 71.2797 173.1531 7 L 4.7199 8.8654 126.3246 52.9529 44.0590 175.5837 8 R 4.5960 8.8061 124.6726 55.8305 31.1586 176.3888 9 G 4.2822 9.6970 115.5158 44.6889 0.0000 171.0760 10 P 5.0463 0.0000 0.0000 60.9484 32.6585 176.0757 11 S 2.9532 7.3499 115.2913 56.7343 63.2249 172.0985 12 P 3.9987 0.0000 0.0000 62.4285 31.5755 177.1853 13 W 4.6789 8.3653 121.5028 57.8157 29.6761 177.0210 14 G 4.0967 8.7154 106.1757 46.1602 0.0000 172.3768 15 F 5.5066 7.6889 111.7487 54.8701 41.7885 173.5215 16 R 4.5802 9.1542 120.8120 54.7644 31.9163 174.4068 17 L 5.3537 8.5711 127.9926 53.6030 43.9949 175.5504 18 V 4.3786 8.9826 118.7077 60.5712 36.0301 176.7218 19 G 4.2878 7.2160 108.3554 45.4689 0.0000 171.9276 20 G 4.4104 8.4070 103.8966 42.8614 0.0000 175.0396 21 R 3.9252 9.0337 121.6007 59.2752 30.0602 178.4822 22 D 4.3481 8.1214 115.2726 55.1550 39.5806 176.5661 23 F 4.5342 7.9722 117.1370 56.3666 39.4755 175.3599 24 S 3.7684 7.7650 115.1313 58.9944 61.0485 172.0448 25 A 4.9175 7.6500 118.7877 49.4093 22.9120 174.9561 26 P 4.6132 0.0000 0.0000 62.6671 32.9984 175.5805 27 L 4.4326 8.5656 122.4552 55.4987 42.5526 176.0998 28 T 5.0413 8.9648 120.3178 61.7594 73.5003 173.6047 29 I 4.6845 8.8417 126.6494 60.8366 37.3433 176.5586 30 S 3.8914 8.9622 123.2089 59.7903 64.2473 174.7287 31 R 4.6586 7.8527 120.0928 54.7634 33.5991 173.5786 32 V 4.8427 8.2552 125.3131 61.3214 34.0035 174.5863 33 H 4.5894 9.2440 125.7161 55.0184 29.9989 175.1162 34 A 4.1196 8.6855 125.7510 53.9354 18.5422 178.0062 35 G 3.9468 9.0045 110.6184 45.9485 0.0000 174.2089 36 S 4.4996 7.8014 115.5135 57.5509 65.1648 175.1877 37 K 4.0112 8.7418 121.0995 59.5544 31.7411 179.3797 38 A 4.0211 8.5444 120.8809 55.1508 18.3831 179.5111 39 A 3.9520 8.0869 119.2223 55.4761 18.3238 179.9389 40 L 4.0955 8.1538 115.6688 56.9352 41.6958 178.4677 41 A 4.4176 7.5914 118.4093 50.9564 19.3281 176.3257 42 A 3.5857 7.8353 119.4685 53.6204 16.2706 178.4196 43 L 4.5601 7.6663 119.2973 54.9207 43.5485 176.6516 44 C 4.9115 8.9507 118.8621 56.9220 31.9190 172.2092 45 P 4.5274 0.0000 0.0000 64.3641 31.3058 177.1907 46 G 3.9739 9.5796 112.0478 45.0146 0.0000 173.5268 47 D 4.5837 7.8616 120.7448 54.5312 42.1420 175.3111 48 L 4.8681 8.9035 123.6171 53.5121 43.5571 175.7675 49 I 4.3384 8.4950 126.1592 60.9417 37.0784 175.7682 50 Q 4.4111 9.3803 127.3817 57.4481 30.4236 175.9340 51 A 5.0518 7.6782 118.7614 50.5727 23.1043 175.3749 52 I 4.5717 8.5698 121.7298 60.6472 39.6002 176.0414 53 N 4.0955 10.1771 125.0411 54.3302 36.5506 175.5138 54 G 3.9018 8.3641 103.8815 45.2727 0.0000 172.9713 55 E 4.5515 7.9500 121.5725 53.6886 31.2449 175.1624 56 S 4.5462 8.5876 121.0285 58.9473 63.1078 173.7825 57 T 4.3063 8.6570 116.0844 61.6230 69.3747 175.9693 58 E 3.8711 7.9601 124.1940 59.4179 29.4689 177.8840 59 L 4.6872 7.6987 114.1466 54.5429 42.3276 176.1397 60 M 4.4656 8.0031 120.4823 55.1881 32.6455 176.6779 61 T 4.6737 9.0333 114.6154 61.1001 71.2523 175.3528 62 H 4.0718 9.3582 120.7568 59.6385 29.7740 176.8883 63 L 4.0248 8.1068 121.3505 58.2282 41.9303 178.5914 64 E 3.9715 8.2286 118.0409 59.2988 29.3535 179.2562 65 A 3.9481 8.0649 120.7541 55.0746 18.4381 179.2162 66 Q 3.8848 8.3127 118.4995 59.6844 28.9009 178.4139 67 N 4.3563 8.2930 116.1785 56.6289 38.8449 177.3635 68 R 4.1151 8.0674 119.2990 59.1700 29.9284 179.0709 69 I 3.7871 7.9110 119.1036 63.7734 37.0974 177.5158 70 K 4.7049 7.5560 116.7060 56.1778 32.0912 177.9617 71 G 3.7082 8.1265 110.9266 47.9976 0.0000 174.0372 72 C 4.8008 7.9048 121.0539 58.0521 33.9201 173.8281 *73 H 4.4595 8.9773 125.3826 58.4283 28.1483 177.1353 74 D 4.7755 8.2522 121.2885 56.8194 40.7539 177.1944 75 H 5.3439 7.9484 110.0847 55.4990 31.3472 173.1626 76 L 4.5968 8.3908 120.0309 53.6141 45.6947 174.6785 77 T 4.9803 9.2496 122.4503 61.6777 71.7139 172.9670 78 L 5.0817 8.6761 125.5823 52.8767 45.6395 175.2372 79 S 5.0557 8.8270 118.2444 56.9200 64.1953 173.2754 80 V 5.0674 8.7755 120.2154 59.6603 36.0022 174.5938 81 S 4.9907 8.8953 116.8480 56.9101 66.9952 173.0266 82 R 4.8652 8.6166 119.7087 53.8676 31.5121 175.2551 83 P 4.3880 0.0000 0.0000 62.5658 31.9240 176.3094 84 E 3.9914 8.4429 119.6408 57.9385 29.9118 177.1606 85 G 3.9015 8.8996 108.9364 45.9283 0.0000 172.7635 86 E 4.7177 7.9419 118.3668 54.0304 32.5009 175.0980 87 S 4.6732 8.3994 120.0172 56.9027 66.9706 172.9081 88 D 4.8832 8.6271 123.4206 52.6879 42.1936 176.6512 89 L 4.3521 8.3837 123.0709 54.8914 42.3552 176.3172 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 0 S 8.43 4.53 0.00 3.89 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 1 M 8.44 4.25 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.17 0.00 2 P 0.00 4.89 0.00 2.03 2.05 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 3 H 8.90 5.09 0.00 3.17 3.36 0.00 5.24 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.57 5.23 0.00 3.74 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 5 V 8.80 4.49 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 1.01 0.00 0.00 0.96 0.00 0.00 6 T 8.52 4.96 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 1.25 0.00 0.00 7 L 8.87 4.72 0.00 1.04 1.64 0.74 0.66 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 8 R 8.81 4.60 0.00 2.16 1.92 0.00 3.34 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.20 0.00 9 G 9.70 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 0.00 0.00 0.00 0.00 10 P 0.00 5.05 0.00 1.90 1.97 0.00 3.35 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.73 0.00 11 S 7.35 2.95 0.00 3.07 2.63 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 12 P 0.00 4.00 0.00 1.95 1.88 0.00 3.51 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.96 0.00 13 W 8.37 4.68 0.00 3.33 3.41 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 14 G 8.72 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 0.00 0.00 0.00 15 F 7.69 5.51 0.00 3.12 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 16 R 9.15 4.58 0.00 1.95 1.88 0.00 3.07 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 17 L 8.57 5.35 0.00 1.86 1.58 1.08 0.86 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 18 V 8.98 4.38 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 0.63 0.00 0.00 0.94 0.00 0.00 19 G 7.22 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 20 G 8.41 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 0.00 0.00 0.00 0.00 21 R 9.03 3.93 0.00 1.93 1.97 0.00 3.10 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 22 D 8.12 4.35 0.00 2.46 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.97 4.53 0.00 3.12 3.13 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 0.00 0.00 0.00 0.00 24 S 7.76 3.77 0.00 3.98 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 25 A 7.65 4.92 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 26 P 0.00 4.61 0.00 2.14 2.21 0.00 3.73 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 2.08 2.01 0.00 27 L 8.57 4.43 0.00 1.64 1.68 0.95 0.76 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 28 T 8.96 5.04 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 1.23 0.00 0.00 29 I 8.84 4.68 1.79 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.80 0.91 0.00 0.00 30 S 8.96 3.89 0.00 3.89 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 31 R 7.85 4.66 0.00 1.90 1.74 0.00 3.12 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.48 0.00 32 V 8.26 4.84 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 0.99 0.00 0.00 0.97 0.00 0.00 33 H 9.24 4.59 0.00 3.18 3.23 0.00 5.68 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 34 A 8.69 4.12 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 35 G 9.00 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 36 S 7.80 4.50 0.00 4.41 4.14 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 37 K 8.74 4.01 0.00 2.16 2.21 0.00 1.85 0.00 0.00 2.26 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.66 1.62 7.81 38 A 8.54 4.02 1.54 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 39 A 8.09 3.95 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 40 L 8.15 4.10 0.00 1.67 1.78 0.96 0.96 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 41 A 7.59 4.42 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 42 A 7.84 3.59 1.39 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 0.00 0.00 43 L 7.67 4.56 0.00 1.71 1.43 0.60 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 44 C 8.95 4.91 0.00 3.04 2.74 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 45 P 0.00 4.53 0.00 2.03 1.99 0.00 3.67 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 2.02 2.09 0.00 46 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 47 D 7.86 4.58 0.00 2.62 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 48 L 8.90 4.87 0.00 1.63 1.57 0.92 0.58 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 49 I 8.49 4.34 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.42 0.86 0.00 0.00 50 Q 9.38 4.41 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 51 A 7.68 5.05 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 52 I 8.57 4.57 1.86 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 1.28 0.73 0.88 0.00 0.00 53 N 10.18 4.10 0.00 2.72 2.82 0.00 0.00 7.18 7.55 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 54 G 8.36 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 0.00 0.00 0.00 55 E 7.95 4.55 0.00 1.98 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 2.21 2.21 0.00 56 S 8.59 4.55 0.00 3.86 3.75 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 57 T 8.66 4.31 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 1.24 0.00 0.00 58 E 7.96 3.87 0.00 1.97 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 2.34 2.32 0.00 59 L 7.70 4.69 0.00 1.65 1.64 0.92 0.91 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 60 M 8.00 4.47 0.00 2.11 2.13 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 2.62 2.49 0.00 61 T 9.03 4.67 4.58 0.00 0.00 0.00 0.00 0.00 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 62 H 9.36 4.07 0.00 3.63 3.62 0.00 5.79 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.11 4.02 0.00 1.89 1.71 1.01 1.00 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 64 E 8.23 3.97 0.00 2.34 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 2.35 2.35 0.00 65 A 8.06 3.95 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 66 Q 8.31 3.88 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 67 N 8.29 4.36 0.00 2.92 2.90 0.00 0.00 7.18 7.26 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 68 R 8.07 4.12 0.00 2.12 1.98 0.00 3.25 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 69 I 7.91 3.79 2.11 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.64 1.10 0.00 0.00 70 K 7.56 4.70 0.00 1.87 1.87 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.64 7.81 71 G 8.13 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 0.00 0.00 0.00 72 C 7.90 4.80 0.00 2.90 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 *73 H 8.98 4.46 0.00 2.88 3.04 0.00 7.24 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.25 4.78 0.00 2.36 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 H 7.95 5.34 0.00 3.27 3.34 0.00 5.45 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.39 4.60 0.00 0.65 0.13 0.74 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 77 T 9.25 4.98 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 1.16 0.00 0.00 78 L 8.68 5.08 0.00 1.36 1.34 0.52 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.83 5.06 0.00 3.83 3.75 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 80 V 8.78 5.07 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 0.61 0.00 0.00 0.75 0.00 0.00 81 S 8.90 4.99 0.00 3.95 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 82 R 8.62 4.87 0.00 1.70 2.01 0.00 3.42 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 83 P 0.00 4.39 0.00 2.17 2.05 0.00 3.76 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 1.98 1.99 0.00 84 E 8.44 3.99 0.00 1.98 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 2.31 2.25 0.00 85 G 8.90 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 0.00 0.00 0.00 86 E 7.94 4.72 0.00 1.88 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 2.17 2.28 0.00 87 S 8.40 4.67 0.00 3.82 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 88 D 8.63 4.88 0.00 2.64 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 4.35 0.00 1.58 1.50 0.92 0.88 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 * Residues marked with a * may have inaccurate shift predictions.