NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 L 4.3953 8.0433 120.6258 54.1600 43.1261 176.2577 14 L 3.9704 8.2358 123.4256 55.5918 42.0938 175.9416 15 G 3.8691 8.8588 110.6064 45.8150 0.0000 173.3306 16 T 4.3943 7.1729 110.0628 60.8689 71.1853 173.3540 17 H 5.7199 7.9550 118.7244 54.1219 30.1556 176.3852 18 G 3.7260 8.4954 109.4249 45.8785 0.0000 172.6526 *24 G 3.7326 8.3910 107.4103 45.6016 0.0000 172.2615 25 T 4.3640 8.0572 117.2068 61.7126 70.3172 173.7372 26 V 4.7921 8.1020 126.2854 60.9558 34.2018 174.4056 27 F 4.9299 9.5164 126.6060 55.8798 41.5153 174.7797 28 T 5.4471 8.6870 112.6024 60.3750 71.6915 173.0706 29 T 4.8790 8.8068 111.5079 60.3034 73.0064 172.7188 30 V 4.7929 8.3403 121.2996 61.2987 34.3590 174.2585 31 E 4.7220 9.3552 127.3811 54.4145 32.8831 174.5536 32 D 4.6500 8.7696 124.3718 53.7116 41.8926 175.7588 33 L 4.5397 9.0715 125.3568 54.2775 43.7559 176.2331 34 G 4.0257 9.1044 111.4559 44.4755 0.0000 174.9451 35 S 4.4331 9.2050 121.0996 59.3305 65.2288 175.4223 36 K 5.0401 7.7834 119.3746 54.7228 36.7579 174.7873 37 I 4.7115 8.4968 122.8220 59.4175 40.4545 174.3417 38 L 4.6967 9.0970 129.1618 53.5110 43.8351 174.8699 39 L 5.0444 8.5330 127.0908 53.6830 43.8744 175.8456 40 T 5.4265 9.0488 119.0986 62.1312 72.8240 172.3185 41 C 5.8037 9.8728 121.4888 55.4976 41.8765 173.2804 42 S 5.4017 9.4154 118.3944 56.7991 66.3828 172.7334 43 L 4.3544 8.5381 127.6419 54.2461 42.1870 175.9372 44 D 4.4322 9.7686 130.3837 58.0275 41.9004 175.8800 45 D 4.4624 8.1902 119.6989 53.9179 38.7549 177.8180 46 S 5.3474 8.5834 119.7595 57.9904 63.6069 175.4695 47 A 4.2916 7.8459 121.7426 52.9677 19.0131 177.0122 48 T 4.5433 7.4456 112.5077 61.1351 70.3519 173.8629 49 E 4.0431 8.6119 127.0455 55.9766 30.1726 175.4877 50 V 4.4304 8.3765 126.2187 62.0905 32.8711 175.9487 51 T 4.3966 8.7185 116.2289 61.0061 69.9530 173.6594 52 G 4.0341 7.0222 108.5719 44.7365 0.0000 171.3903 53 H 5.3218 8.3592 115.3446 54.2516 33.6547 173.3326 54 R 5.0641 8.4605 118.3077 54.3599 34.8078 174.2065 55 W 5.0132 8.9694 121.3255 54.8382 32.5422 174.5748 56 L 5.3325 9.1800 123.9134 52.8298 44.8648 175.2842 57 K 4.6102 8.7170 122.9478 54.9307 35.3194 176.4374 58 G 3.7447 9.6948 116.6290 46.7547 0.0000 174.6198 59 G 3.8957 8.3064 105.8664 45.1105 0.0000 173.6708 60 V 4.7287 7.3765 120.1965 60.4572 33.4574 174.7162 61 V 4.1444 8.4615 127.6729 63.3634 31.6606 175.9909 62 L 4.7160 8.9799 127.4732 54.6802 44.0521 176.6489 63 K 4.7964 7.7351 119.3470 54.8479 35.7691 174.5048 64 E 5.3094 8.6009 122.7405 55.4253 32.9377 173.2477 65 D 4.8371 9.2608 119.2574 51.8533 43.7235 174.9563 66 A 4.7055 8.3160 119.1276 51.0538 19.7126 176.4607 67 L 4.5850 8.2630 119.7519 54.2204 43.2880 175.5732 68 P 4.9655 0.0000 0.0000 60.8774 32.8573 174.3422 69 G 4.0723 8.6095 105.1490 44.3591 0.0000 174.1448 70 Q 4.4350 8.9834 122.0130 56.7387 29.9971 175.2193 71 K 5.3799 8.1545 120.1290 54.8654 35.1094 174.8924 72 T 4.8638 9.3197 120.2570 60.5708 71.2041 172.2190 73 E 5.3928 8.9230 124.5064 54.7588 34.0064 174.8789 74 F 4.5681 8.6862 124.0972 56.5139 42.7812 173.1156 75 K 4.6479 8.3977 125.4468 54.8253 33.5350 176.1127 76 V 4.0690 7.9884 118.4359 58.7987 34.9217 175.0554 77 D 4.5769 8.3819 123.3097 55.0760 41.1684 177.5439 78 S 3.7712 8.6682 120.0137 61.9764 62.8949 175.3266 79 D 4.4186 8.1530 117.1745 57.1641 40.9763 178.0979 80 D 4.9748 7.1978 117.8411 53.6707 41.7373 177.6800 81 Q 3.8790 7.0010 117.8370 57.8332 29.0487 176.6814 82 W 4.4718 6.2984 117.8833 56.2195 29.5176 176.5232 83 G 3.8837 7.9986 109.2703 44.6900 0.0000 170.2743 84 E 4.7708 8.1626 120.6883 54.6610 31.6888 175.2996 85 Y 5.4350 8.9278 123.7063 56.6184 41.3066 175.1622 86 S 4.9344 9.3124 116.7465 57.0368 67.6084 170.7351 87 C 4.5346 8.4311 116.5297 53.3256 42.3989 173.3085 88 V 4.4727 7.6767 119.2944 61.3247 34.7883 173.7002 89 F 5.0248 9.0076 125.8619 55.7300 41.1115 174.7690 90 L 4.7828 8.7684 124.0017 52.6543 44.0037 175.0036 91 P 5.0053 0.0000 0.0000 60.6635 33.8533 175.2640 92 E 4.1128 8.6790 118.3990 55.9086 29.8785 175.4653 93 P 4.3879 0.0000 0.0000 63.2598 31.8209 176.5791 94 M 4.3017 8.4522 116.9103 55.1045 31.9385 176.5406 95 G 4.1793 7.1646 108.1464 45.7684 0.0000 172.5968 96 T 4.7003 8.3325 112.1642 60.0229 72.0508 172.7048 97 A 4.6803 8.1700 123.3384 51.0433 22.2074 175.2935 98 N 5.0295 8.5035 116.7747 51.4148 41.0472 174.7741 99 I 4.4503 8.1103 121.5202 59.6328 39.9462 174.8680 100 Q 4.3783 8.6626 124.8172 54.3999 29.6911 175.5201 101 L 4.5490 8.1071 122.6989 53.7658 43.8408 176.3403 102 H 4.4966 8.2324 115.8857 56.3930 29.7957 173.6849 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 13 L 8.04 4.40 0.00 1.71 1.65 0.91 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.24 3.97 0.00 1.71 1.60 0.92 0.64 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 15 G 8.86 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 16 T 7.17 4.39 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 1.24 0.00 0.00 17 H 7.95 5.72 0.00 3.06 3.22 0.00 5.75 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.50 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 *24 G 8.39 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 25 T 8.06 4.36 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 1.06 0.00 0.00 26 V 8.10 4.79 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 0.99 0.00 0.00 0.81 0.00 0.00 27 F 9.52 4.93 0.00 3.04 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 28 T 8.69 5.45 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 1.29 0.00 0.00 29 T 8.81 4.88 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 1.29 0.00 0.00 30 V 8.34 4.79 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 0.80 0.00 0.00 0.96 0.00 0.00 31 E 9.36 4.72 0.00 1.82 1.76 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 2.20 2.20 0.00 32 D 8.77 4.65 0.00 2.65 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 33 L 9.07 4.54 0.00 1.67 1.60 0.84 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 34 G 9.10 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 35 S 9.20 4.43 0.00 3.87 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 0.00 36 K 7.78 5.04 0.00 1.52 1.52 0.00 1.48 0.00 0.00 1.68 0.00 0.00 2.73 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.29 7.81 37 I 8.50 4.71 1.58 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.87 0.74 0.00 0.00 38 L 9.10 4.70 0.00 1.61 1.44 0.81 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.53 5.04 0.00 1.04 1.58 0.20 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.05 5.43 4.35 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 1.40 0.00 0.00 41 C 9.87 5.80 0.00 2.85 3.20 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 0.00 42 S 9.42 5.40 0.00 3.83 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 43 L 8.54 4.35 0.00 0.27 0.92 0.57 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 44 D 9.77 4.43 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 45 D 8.19 4.46 0.00 2.73 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.58 5.35 0.00 3.84 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 47 A 7.85 4.29 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 48 T 7.45 4.54 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 49 E 8.61 4.04 0.00 2.00 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 2.38 2.31 0.00 50 V 8.38 4.43 2.16 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 1.07 0.00 0.00 1.05 0.00 0.00 51 T 8.72 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 1.21 0.00 0.00 52 G 7.02 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 53 H 8.36 5.32 0.00 3.17 2.80 0.00 5.76 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.46 5.06 0.00 1.59 1.67 0.00 3.02 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 55 W 8.97 5.01 0.00 2.56 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 56 L 9.18 5.33 0.00 1.61 1.56 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.72 4.61 0.00 1.80 1.58 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.97 0.21 7.81 58 G 9.69 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 0.00 0.00 0.00 59 G 8.31 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 60 V 7.38 4.73 2.19 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 1.02 0.00 0.00 0.96 0.00 0.00 61 V 8.46 4.14 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 0.97 0.00 0.00 0.91 0.00 0.00 62 L 8.98 4.72 0.00 1.55 1.77 1.11 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.74 4.80 0.00 1.52 1.31 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.50 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.41 7.81 64 E 8.60 5.31 0.00 2.01 1.82 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 2.17 2.30 0.00 65 D 9.26 4.84 0.00 2.78 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 66 A 8.32 4.71 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 67 L 8.26 4.58 0.00 1.90 1.64 0.95 1.10 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 68 P 0.00 4.97 0.00 2.22 2.12 0.00 3.39 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 69 G 8.61 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 70 Q 8.98 4.44 0.00 2.05 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.48 2.32 0.00 71 K 8.15 5.38 0.00 1.82 1.73 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.52 7.81 72 T 9.32 4.86 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 0.86 0.00 0.00 73 E 8.92 5.39 0.00 1.83 1.72 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 2.25 2.34 0.00 74 F 8.69 4.57 0.00 1.51 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 75 K 8.40 4.65 0.00 1.46 1.49 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.66 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.20 1.32 7.81 76 V 7.99 4.07 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 -0.25 0.00 0.00 0.50 0.00 0.00 77 D 8.38 4.58 0.00 2.50 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 78 S 8.67 3.77 0.00 3.68 3.83 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 0.00 0.00 0.00 79 D 8.15 4.42 0.00 2.59 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 80 D 7.20 4.97 0.00 2.54 2.54 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 81 Q 7.00 3.88 0.00 1.78 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.54 6.60 0.00 0.00 0.00 0.00 0.00 1.16 1.41 0.00 82 W 6.30 4.47 0.00 3.38 3.26 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 83 G 8.00 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.16 4.77 0.00 2.07 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 2.33 2.38 0.00 85 Y 8.93 5.44 0.00 3.10 3.28 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 86 S 9.31 4.93 0.00 3.72 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 87 C 8.43 4.53 0.00 1.60 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 88 V 7.68 4.47 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 0.90 0.00 0.00 0.81 0.00 0.00 89 F 9.01 5.02 0.00 2.84 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 90 L 8.77 4.78 0.00 1.60 1.53 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 P 0.00 5.01 0.00 2.07 2.09 0.00 3.38 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.83 0.00 92 E 8.68 4.11 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 2.32 2.34 0.00 93 P 0.00 4.39 0.00 2.03 1.99 0.00 3.66 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 2.03 2.08 0.00 94 M 8.45 4.30 0.00 2.12 2.17 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 2.53 2.52 0.00 95 G 7.16 4.18 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 0.00 96 T 8.33 4.70 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 1.21 0.00 0.00 97 A 8.17 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.50 5.03 0.00 2.69 2.71 0.00 0.00 6.73 7.45 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 99 I 8.11 4.45 1.86 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 1.41 0.60 0.89 0.00 0.00 100 Q 8.66 4.38 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.86 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 101 L 8.11 4.55 0.00 1.58 1.55 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 102 H 8.23 4.50 0.00 3.09 3.09 0.00 5.73 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 * Residues marked with a * may have inaccurate shift predictions.