NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 D 4.4596 8.3649 120.5264 53.9503 42.5862 173.9103 *27 K 4.1352 8.0639 117.6164 56.6496 33.6190 175.1575 28 D 4.8011 8.6723 123.3543 53.8285 42.3481 175.0660 29 L 4.6584 8.7898 128.0829 53.4251 43.4633 175.6600 30 R 4.3556 8.7250 126.8148 56.3179 31.3111 175.6164 31 G 3.7660 8.6617 110.3951 46.5298 0.0000 173.5034 32 V 3.9433 7.6723 120.0290 61.8319 32.1084 176.2043 33 E 4.1611 8.7516 127.3937 58.8207 30.7772 176.3658 34 E 5.2596 7.3850 115.5500 55.4419 32.5267 175.5122 35 V 4.4311 8.3614 126.4364 60.9899 34.4957 174.1168 36 V 4.8134 8.4027 126.9246 61.1612 33.9695 174.3212 37 I 4.4247 9.0591 129.2164 59.6551 39.1789 174.5387 38 K 4.8164 8.6552 126.8068 54.6889 33.8445 175.7945 39 L 4.8438 8.3982 124.3097 52.2801 45.2309 176.5434 40 K 4.0674 8.7359 119.7124 59.5509 32.0734 177.7146 41 R 4.4429 7.6636 115.4574 56.0420 31.2386 175.1789 42 K 4.7775 7.1848 115.6745 56.3498 35.6860 173.7401 43 E 5.1747 9.0460 119.7699 54.6511 33.7468 174.9660 44 I 4.9198 8.9274 123.5415 59.6520 40.0380 174.6121 45 I 4.8561 8.8120 127.6023 59.5154 40.3714 174.4412 46 I 4.9058 8.6726 128.2255 58.6964 39.1379 175.0820 47 K 4.3178 8.7757 127.0065 56.2470 33.0461 177.1877 48 N 4.3350 8.5870 120.4754 52.6365 36.4785 172.2133 49 P 4.7027 0.0000 0.0000 62.5688 33.4124 177.5320 50 K 4.4539 8.9870 120.8145 55.8286 33.8045 176.3453 51 V 4.9535 8.2737 123.0673 61.4103 34.9494 173.6110 52 N 5.6442 9.3101 125.1138 51.6118 41.9638 173.9424 53 V 4.8543 8.3879 120.5058 58.6209 35.1091 174.1221 *55 E 4.2168 8.5557 119.7540 56.4283 30.6104 175.8037 56 F 4.9405 8.9953 129.9995 57.1649 39.6547 175.7314 *58 G 3.8935 7.9998 108.9204 44.8293 0.0000 172.8126 59 Q 4.6605 7.8541 118.9991 54.0150 30.7976 174.7644 60 K 4.6048 8.4162 120.4981 55.5233 33.6812 176.0906 61 T 4.6343 8.1361 118.8354 62.0825 71.0431 172.4841 62 Y 4.8582 8.8051 124.2510 56.3991 40.1173 175.0480 63 Q 4.5980 9.1204 124.0212 54.3529 30.8843 174.7108 64 V 4.7826 8.4986 124.0577 61.3772 33.9745 174.5852 65 T 4.6156 9.5160 124.8719 61.3074 71.7735 174.0062 66 G 3.9861 8.0653 111.4776 46.2503 0.0000 171.6048 67 K 4.4895 8.0024 118.9041 55.8736 33.1788 176.6335 68 A 5.1046 8.5705 126.2372 50.6145 21.4452 176.0715 69 R 4.6896 8.9952 117.8950 54.3850 34.9318 173.8438 70 E 4.8582 8.7904 122.6485 54.6106 31.5977 175.1608 71 R 4.5620 8.9840 128.8431 54.3420 31.2586 174.8659 72 S 4.5201 8.4817 121.5607 58.2578 63.5969 174.3861 73 L 4.3171 8.1466 122.4194 54.9852 41.8189 176.5053 74 E 4.3316 7.9435 117.6902 55.0658 30.7854 175.4908 75 A 4.8855 8.4140 124.9802 50.3332 22.3892 175.7361 76 E 4.6839 8.2572 120.9505 55.6886 31.2729 175.4219 *78 E 4.1790 8.5313 122.7514 57.3413 30.7733 175.0849 79 I 4.6095 7.9140 120.9114 58.2062 40.8127 174.4506 80 P 4.4155 0.0000 0.0000 62.1342 33.0898 177.1626 81 E 3.9629 8.8631 121.7840 60.0129 29.4280 179.5090 82 D 4.3984 8.1013 118.0372 57.4676 40.8797 178.6448 83 D 4.3103 7.9618 118.7837 57.3070 40.7973 178.4154 84 I 3.6966 7.4710 118.9558 64.6342 37.2456 177.9346 85 E 4.0971 8.5176 117.9482 59.2343 29.6083 178.7910 86 L 4.1486 8.0538 120.3935 58.1535 42.1180 180.4450 87 V 3.6937 7.6675 115.9591 63.5423 31.1535 177.1931 *89 N 4.7057 8.1520 116.1671 52.5891 40.3431 175.6729 90 Q 4.3040 8.1299 115.8631 56.9223 29.2939 176.4409 91 T 4.3723 7.7680 105.5948 60.2953 70.2731 174.9991 92 G 3.8102 8.3007 109.1456 46.1578 0.0000 173.3755 93 A 4.3545 7.4282 121.9708 50.7948 19.5949 179.0703 94 S 4.4107 8.2474 115.3544 57.8622 65.2556 175.5529 95 R 3.8327 8.4053 121.8049 59.4547 29.7707 177.8072 96 E 3.9026 8.1950 118.5679 59.7660 29.5498 178.5062 97 D 4.3383 8.2246 118.3836 57.2342 40.8876 178.7985 98 A 3.9814 8.3340 121.6255 55.3003 18.3869 179.8493 99 T 3.7860 8.0810 114.3450 66.7253 68.6019 176.7570 100 R 3.8526 8.1201 120.3616 59.4940 30.1009 178.1997 101 A 4.0162 8.2242 120.6717 55.4150 18.2772 179.6838 102 L 4.0170 8.0717 117.2776 57.7547 41.7209 179.8263 103 Q 3.9345 8.2478 118.2922 58.9562 28.4752 178.1748 104 E 4.0263 8.5710 119.7292 58.7193 29.8139 177.9487 105 T 4.5539 7.9066 108.3921 60.5434 69.1607 174.9426 106 G 4.1123 8.8045 107.7532 47.2654 0.0000 175.3993 107 G 3.7836 8.9596 106.7283 45.4926 0.0000 174.5000 108 D 4.4937 7.8178 119.6406 53.3568 41.5868 176.7431 109 L 3.9565 8.4610 127.7948 57.8600 41.6564 179.1143 110 A 3.9697 7.9812 118.8763 55.3193 18.4112 178.8475 111 E 4.0183 8.5143 116.4556 59.0281 29.7634 178.3914 112 A 4.2043 7.9050 120.2515 55.1457 18.8135 180.2283 113 I 3.6651 7.8022 114.7017 62.5007 36.7490 177.9485 *115 R 4.2382 7.9257 121.6252 55.6901 31.7294 175.2381 116 L 4.2893 7.6035 121.3908 54.7651 41.7442 176.0683 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 25 D 8.36 4.46 0.00 2.67 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 *27 K 8.06 4.14 0.00 1.72 1.76 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.43 7.81 28 D 8.67 4.80 0.00 2.67 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.79 4.66 0.00 1.69 1.71 0.98 0.95 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 30 R 8.73 4.36 0.00 1.82 1.81 0.00 3.37 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 31 G 8.66 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 0.00 0.00 0.00 32 V 7.67 3.94 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 0.99 0.00 0.00 0.95 0.00 0.00 33 E 8.75 4.16 0.00 1.96 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 0.00 2.39 2.30 0.00 34 E 7.39 5.26 0.00 1.91 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 0.00 2.05 2.15 0.00 35 V 8.36 4.43 2.07 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 0.92 0.00 0.00 0.90 0.00 0.00 36 V 8.40 4.81 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 0.86 0.00 0.00 0.91 0.00 0.00 37 I 9.06 4.42 1.87 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 1.22 0.48 0.91 0.00 0.00 38 K 8.66 4.82 0.00 1.61 1.71 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.43 7.81 39 L 8.40 4.84 0.00 1.69 1.57 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.74 4.07 0.00 1.71 1.83 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.46 7.81 41 R 7.66 4.44 0.00 1.90 1.93 0.00 3.21 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 42 K 7.18 4.78 0.00 1.88 1.85 0.00 1.44 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.33 1.40 7.81 43 E 9.05 5.17 0.00 1.87 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 2.20 2.24 0.00 44 I 8.93 4.92 1.87 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 1.23 0.94 0.91 0.00 0.00 45 I 8.81 4.86 1.87 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 1.22 0.70 0.94 0.00 0.00 46 I 8.67 4.91 1.87 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 1.24 0.97 0.96 0.00 0.00 47 K 8.78 4.32 0.00 1.64 1.73 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.46 7.81 48 N 8.59 4.34 0.00 2.79 2.85 0.00 0.00 6.99 7.54 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 49 P 0.00 4.70 0.00 2.08 2.05 0.00 3.94 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 50 K 8.99 4.45 0.00 1.71 1.77 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.39 7.81 51 V 8.27 4.95 2.14 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 1.24 0.00 0.00 0.96 0.00 0.00 52 N 9.31 5.64 0.00 2.68 2.65 0.00 0.00 6.12 8.45 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 53 V 8.39 4.85 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 0.99 0.00 0.00 0.48 0.00 0.00 *55 E 8.56 4.22 0.00 1.95 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 2.20 2.30 0.00 56 F 9.00 4.94 0.00 2.97 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 *58 G 8.00 3.89 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 0.00 0.00 0.00 59 Q 7.85 4.66 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 60 K 8.42 4.60 0.00 1.82 1.40 0.00 1.81 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.43 7.81 61 T 8.14 4.63 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 1.22 0.00 0.00 62 Y 8.81 4.86 0.00 2.83 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 63 Q 9.12 4.60 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 64 V 8.50 4.78 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 0.83 0.00 0.00 0.98 0.00 0.00 65 T 9.52 4.62 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 1.22 0.00 0.00 66 G 8.07 3.99 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 0.00 0.00 0.00 67 K 8.00 4.49 0.00 1.73 1.74 0.00 1.65 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.44 7.81 68 A 8.57 5.10 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 69 R 9.00 4.69 0.00 1.69 1.76 0.00 3.09 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 70 E 8.79 4.86 0.00 1.95 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 2.19 2.27 0.00 71 R 8.98 4.56 0.00 1.87 1.93 0.00 3.27 0.00 0.00 3.21 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 72 S 8.48 4.52 0.00 3.91 3.86 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 73 L 8.15 4.32 0.00 1.76 1.74 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 74 E 7.94 4.33 0.00 2.07 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 2.24 2.29 0.00 75 A 8.41 4.89 1.22 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 0.00 0.00 0.00 76 E 8.26 4.68 0.00 1.92 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 0.00 2.19 2.22 0.00 *78 E 8.53 4.18 0.00 1.98 1.92 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 2.21 2.34 0.00 79 I 7.91 4.61 1.87 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 1.41 0.87 0.91 0.00 0.00 80 P 0.00 4.42 0.00 2.15 1.96 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 81 E 8.86 3.96 0.00 1.97 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 2.41 2.36 0.00 82 D 8.10 4.40 0.00 2.76 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 83 D 7.96 4.31 0.00 2.85 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 84 I 7.47 3.70 2.01 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 1.52 0.60 0.91 0.00 0.00 85 E 8.52 4.10 0.00 1.95 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 2.42 0.00 86 L 8.05 4.15 0.00 1.89 1.88 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.67 3.69 2.20 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 0.98 0.00 0.00 1.01 0.00 0.00 *89 N 8.15 4.71 0.00 2.95 2.91 0.00 0.00 7.11 7.69 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 90 Q 8.13 4.30 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.72 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 91 T 7.77 4.37 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 1.26 0.00 0.00 92 G 8.30 3.81 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 0.00 0.00 0.00 93 A 7.43 4.35 1.23 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 0.00 0.00 0.00 94 S 8.25 4.41 0.00 4.06 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 95 R 8.41 3.83 0.00 1.90 1.96 0.00 3.19 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 96 E 8.20 3.90 0.00 2.07 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 2.38 2.41 0.00 97 D 8.22 4.34 0.00 2.82 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 98 A 8.33 3.98 1.31 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 0.00 0.00 0.00 0.00 0.00 99 T 8.08 3.79 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 1.21 0.00 0.00 100 R 8.12 3.85 0.00 2.07 1.93 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 101 A 8.22 4.02 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 0.00 102 L 8.07 4.02 0.00 1.87 1.73 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 103 Q 8.25 3.93 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 104 E 8.57 4.03 0.00 2.04 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 2.32 2.32 0.00 105 T 7.91 4.55 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 1.26 0.00 0.00 106 G 8.80 4.11 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 0.00 107 G 8.96 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 0.00 0.00 0.00 108 D 7.82 4.49 0.00 2.76 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 8.46 3.96 0.00 1.77 1.69 1.02 0.96 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 0.00 110 A 7.98 3.97 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 0.00 111 E 8.51 4.02 0.00 1.96 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 2.32 2.36 0.00 112 A 7.90 4.20 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 0.00 113 I 7.80 3.67 2.12 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 1.41 1.22 0.91 0.00 0.00 *115 R 7.93 4.24 0.00 1.83 2.30 0.00 3.22 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 116 L 7.60 4.29 0.00 1.71 1.55 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.