NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 A 4.2886 8.2649 123.5856 51.5068 20.4431 176.1840 7 D 4.5081 7.9218 117.7636 53.6422 41.8652 174.8264 8 N 4.5401 9.4764 122.4614 54.9127 41.1837 174.0035 9 I 4.4908 7.5765 118.4843 59.7803 39.2658 174.8225 10 H 4.9198 9.2655 125.9051 54.0629 30.3972 174.8619 11 A 4.7388 8.8384 127.3336 51.7972 18.8138 177.3467 12 V 3.8739 8.3080 117.8372 63.5944 32.1791 176.1068 13 S 4.5637 7.2000 112.5051 56.6142 65.8392 174.6575 14 S 4.0705 8.5643 114.2670 60.7784 62.6590 174.9126 15 E 4.2653 7.6767 117.4338 55.2818 30.0281 175.0927 16 R 4.3709 6.6024 119.5486 54.4741 33.7186 173.8649 17 W 5.5332 8.9929 125.2276 54.9405 33.1774 174.5128 18 R 4.8373 9.3478 124.6545 54.8768 31.6216 174.7626 19 I 5.1193 8.9078 127.3393 59.4822 40.9676 174.7745 20 H 4.5636 9.2281 124.5066 55.6851 29.0682 176.7452 21 A 3.9391 9.3041 126.7950 55.0719 18.3978 178.8235 22 A 4.1989 7.9149 116.2521 53.3922 18.9620 177.8151 23 T 3.9376 7.8408 114.5786 63.4263 69.2025 173.8185 24 E 4.5574 8.6315 125.5930 56.0864 30.5477 177.9660 25 I 3.7747 8.3882 123.9965 64.7966 37.1669 178.8074 26 E 4.0337 8.1919 118.8017 59.4977 29.2940 178.9938 27 D 4.4391 8.1402 119.1103 57.0600 40.8034 178.7439 28 I 3.8623 7.8327 120.0062 64.5910 37.1606 177.8493 29 N 4.8132 8.3176 118.5077 56.1602 38.1775 177.4831 30 T 3.8425 7.7777 115.6277 66.7181 68.6515 176.1295 31 F 3.9477 8.0795 121.0944 60.6118 39.4989 176.3087 32 F 4.6778 8.3834 114.6134 56.5273 39.7741 176.9223 33 G 3.8399 8.2779 106.8702 45.8032 0.0000 173.7378 34 T 4.1627 7.4353 110.1209 60.8648 69.8573 173.8833 35 E 4.8396 7.6317 118.8929 55.9399 30.6871 176.2156 36 Y 4.5347 7.7965 115.7710 58.6101 38.6568 176.0321 37 S 4.7324 8.2332 115.9480 57.6763 65.9694 173.2708 38 S 4.5488 8.1506 113.3063 57.8688 64.6587 174.4887 39 E 4.4658 8.7652 124.5527 56.6061 29.9449 176.3421 40 E 4.5406 8.0995 116.9442 55.9509 31.2847 175.8212 41 A 4.7384 7.6909 120.3714 50.3492 22.3692 175.2280 42 D 4.9007 8.6577 118.2871 52.8763 41.4239 175.6670 43 T 5.0382 7.3238 109.9398 59.2235 73.1773 174.3711 44 I 3.5621 8.5162 122.0392 63.9480 37.8874 178.3023 45 G 3.6753 8.3588 107.1688 47.8230 0.0000 175.6336 46 G 3.6376 8.1017 108.4486 47.4619 0.0000 175.4518 47 L 3.8270 7.8697 122.7148 57.7542 42.0379 179.1987 48 V 3.3942 7.7126 118.3251 65.9572 31.3750 178.0491 49 I 3.7245 7.8336 119.6766 64.2616 36.6910 178.0767 50 Q 3.9089 7.8791 119.3154 59.3815 28.9745 178.0542 51 E 4.0724 8.0473 118.2396 59.3390 29.5965 178.9583 52 L 4.2608 8.0112 117.5290 55.1248 41.8470 178.2361 53 G 3.9201 8.8269 106.4006 45.3489 0.0000 172.4316 54 H 4.3983 7.2439 112.1717 54.3132 30.3527 173.3792 55 L 3.9453 8.5474 122.8280 54.3348 41.7366 174.9471 56 P 4.7195 0.0000 0.0000 62.0134 33.2054 175.1692 57 V 4.3700 8.8654 111.7731 58.8470 33.8470 175.7106 58 R 4.1689 8.3742 121.2013 58.6412 30.0087 176.5462 59 G 4.0593 9.0715 113.9349 45.1725 0.0000 173.7599 60 E 4.2997 7.9345 119.0928 56.3553 30.6181 176.2508 61 K 5.2106 8.5245 120.8792 54.7419 36.3785 175.8567 62 V 4.4245 8.8468 122.2746 61.3274 34.9008 173.8406 63 L 5.3299 8.6907 128.0808 53.0990 43.3286 176.1172 64 I 4.5697 8.8472 117.0372 60.4495 40.8651 175.1001 65 G 3.9184 9.8021 111.1008 47.0531 0.0000 174.3084 66 G 3.9437 8.4371 103.9319 45.0171 0.0000 172.7007 67 L 5.0113 7.8475 118.6167 52.4885 45.7621 175.1850 68 Q 4.9392 8.9399 123.8996 54.4824 31.3359 173.9978 69 F 5.0638 9.3882 126.1819 56.2749 41.0877 174.9133 70 T 4.9940 8.4238 119.9939 61.4917 71.7081 173.6620 71 V 3.9210 8.9876 126.5797 63.1598 31.8459 176.1361 72 A 4.3283 9.0333 131.0253 53.7822 20.1032 177.6238 73 R 4.6545 7.7209 115.0907 54.9891 33.5837 174.1913 74 A 5.0330 8.5589 127.3663 51.2894 22.6471 175.4139 75 D 5.2062 8.3743 122.8892 52.9580 40.6751 176.3611 76 N 4.6677 8.7852 114.2405 54.4225 39.2711 175.5966 77 R 4.5403 8.1618 115.8060 56.6772 32.8526 176.1520 78 R 4.5778 8.5876 115.2067 54.2345 34.2450 173.2808 79 L 4.6638 8.2995 122.7864 54.6959 42.6901 175.2297 80 H 4.7842 9.3646 123.5326 57.5464 30.9609 175.2819 81 T 5.0655 7.6932 113.2381 62.0733 72.8795 172.9497 82 L 5.6161 8.9886 125.8566 53.2317 45.7919 175.0852 *84 A 4.5840 8.4869 123.4108 53.1976 20.4309 176.2109 85 T 5.1847 8.3762 109.7463 59.9365 72.9785 173.1626 86 R 4.6582 8.7062 121.2820 55.8142 31.3086 177.1401 87 V 3.9030 8.0930 115.2974 61.6970 31.2295 176.1620 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 6 A 8.26 4.29 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 7 D 7.92 4.51 0.00 2.67 2.52 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 0.00 8 N 9.48 4.54 0.00 2.63 2.83 0.00 0.00 6.93 7.22 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 9 I 7.58 4.49 1.17 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.40 -0.07 0.00 0.00 10 H 9.27 4.92 0.00 3.22 3.25 0.00 5.61 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 11 A 8.84 4.74 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 12 V 8.31 3.87 2.04 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 0.72 0.00 0.00 0.88 0.00 0.00 13 S 7.20 4.56 0.00 3.84 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 14 S 8.56 4.07 0.00 4.00 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 15 E 7.68 4.27 0.00 1.78 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 2.19 2.19 0.00 16 R 6.60 4.37 0.00 1.52 1.42 0.00 2.95 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.67 0.00 17 W 8.99 5.53 0.00 3.56 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 18 R 9.35 4.84 0.00 1.89 1.87 0.00 3.02 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 19 I 8.91 5.12 2.03 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.77 0.99 0.00 0.00 20 H 9.23 4.56 0.00 3.19 3.26 0.00 5.63 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 21 A 9.30 3.94 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 22 A 7.91 4.20 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 23 T 7.84 3.94 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 1.21 0.00 0.00 24 E 8.63 4.56 0.00 2.21 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 0.00 2.39 2.33 0.00 25 I 8.39 3.77 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.64 1.05 0.00 0.00 26 E 8.19 4.03 0.00 2.07 2.02 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 2.42 2.49 0.00 27 D 8.14 4.44 0.00 2.87 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 28 I 7.83 3.86 2.28 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 1.90 0.94 1.40 0.00 0.00 29 N 8.32 4.81 0.00 2.94 2.96 0.00 0.00 6.56 6.59 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 30 T 7.78 3.84 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 1.20 0.00 0.00 31 F 8.08 3.95 0.00 2.90 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 32 F 8.38 4.68 0.00 3.18 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 33 G 8.28 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 0.00 0.00 0.00 34 T 7.44 4.16 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 0.98 0.00 0.00 35 E 7.63 4.84 0.00 1.85 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 2.12 2.19 0.00 36 Y 7.80 4.53 0.00 3.00 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 37 S 8.23 4.73 0.00 3.95 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 38 S 8.15 4.55 0.00 3.78 3.85 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 39 E 8.77 4.47 0.00 1.99 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 2.25 2.26 0.00 40 E 8.10 4.54 0.00 1.92 1.94 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 2.23 2.34 0.00 41 A 7.69 4.74 1.13 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 0.00 0.00 42 D 8.66 4.90 0.00 2.82 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 43 T 7.32 5.04 4.45 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 1.23 0.00 0.00 44 I 8.52 3.56 1.78 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.89 0.94 0.00 0.00 45 G 8.36 3.68 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 0.00 0.00 0.00 46 G 8.10 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 47 L 7.87 3.83 0.00 1.60 1.55 0.84 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.71 3.39 2.04 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 0.90 0.00 0.00 0.61 0.00 0.00 49 I 7.83 3.72 1.94 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 1.34 0.43 0.87 0.00 0.00 50 Q 7.88 3.91 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 51 E 8.05 4.07 0.00 2.01 1.95 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 2.40 2.37 0.00 52 L 8.01 4.26 0.00 1.57 1.59 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.83 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 54 H 7.24 4.40 0.00 3.21 3.21 0.00 5.53 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.55 3.95 0.00 1.59 1.65 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.72 0.00 2.18 1.91 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.90 0.00 57 V 8.87 4.37 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 0.87 0.00 0.00 1.04 0.00 0.00 58 R 8.37 4.17 0.00 1.77 1.87 0.00 3.21 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 59 G 9.07 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 7.93 4.30 0.00 1.99 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 2.35 2.48 0.00 61 K 8.52 5.21 0.00 1.60 1.69 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.59 7.81 62 V 8.85 4.42 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 0.91 0.00 0.00 63 L 8.69 5.33 0.00 1.58 1.61 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.85 4.57 1.98 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 1.39 0.38 0.91 0.00 0.00 65 G 9.80 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 66 G 8.44 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 67 L 7.85 5.01 0.00 1.60 0.79 -0.04 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 8.94 4.94 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 69 F 9.39 5.06 0.00 2.88 2.92 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 70 T 8.42 4.99 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 71 V 8.99 3.92 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 1.00 0.00 0.00 0.98 0.00 0.00 72 A 9.03 4.33 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 73 R 7.72 4.65 0.00 1.85 1.75 0.00 3.17 0.00 0.00 3.32 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 74 A 8.56 5.03 1.26 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 0.00 0.00 0.00 75 D 8.37 5.21 0.00 2.78 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 76 N 8.79 4.67 0.00 2.74 2.90 0.00 0.00 6.56 7.66 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 77 R 8.16 4.54 0.00 1.76 1.93 0.00 3.17 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 78 R 8.59 4.58 0.00 1.59 1.54 0.00 3.05 0.00 0.00 3.07 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 79 L 8.30 4.66 0.00 1.59 1.51 0.97 0.96 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 80 H 9.36 4.78 0.00 3.27 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 T 7.69 5.07 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 1.27 0.00 0.00 82 L 8.99 5.62 0.00 1.73 1.71 0.83 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 *84 A 8.49 4.58 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.38 5.18 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 1.19 0.00 0.00 86 R 8.71 4.66 0.00 1.85 1.96 0.00 3.40 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.97 0.00 87 V 8.09 3.90 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 0.59 0.00 0.00 0.96 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.