NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *32 N 4.7412 8.2833 117.7897 52.2696 39.5818 174.3360 33 S 4.3985 8.4881 114.6818 58.4680 62.9405 172.6562 34 L 4.4684 8.3207 122.9849 57.3452 43.8965 177.9693 35 M 4.2486 7.8591 117.9118 58.4201 31.8356 178.6278 36 E 3.9828 8.1066 118.4728 59.0944 29.7167 179.0932 37 R 3.8898 7.8170 118.4018 59.4398 30.2932 178.4007 38 I 3.6801 8.2132 120.0563 64.7420 36.8755 177.6560 39 H 4.1348 8.6415 121.6529 60.0324 29.0298 177.7868 40 E 4.0234 7.9748 119.7401 61.2682 29.5013 181.2060 41 Q 4.2263 7.8678 119.4527 58.6484 29.3157 178.3397 42 I 3.8529 7.7638 121.1710 64.3648 37.2341 178.4721 43 K 4.0339 7.7144 118.8308 58.9593 31.7382 179.1465 44 K 4.0005 7.7095 119.8773 59.3723 31.9087 178.8758 45 G 3.5817 7.9155 105.4198 47.9583 0.0000 175.5307 46 E 3.7360 8.0887 120.8520 58.6760 29.4866 178.8352 47 L 4.1609 8.2031 120.2919 58.2965 42.0513 178.8428 48 A 4.0373 7.9308 120.4311 55.2392 18.2315 179.6565 49 L 3.8584 7.5485 117.3707 57.9789 41.7565 179.5774 50 F 4.3977 8.0677 118.0376 61.0580 38.9171 177.1999 51 Y 4.1016 8.7053 119.4079 60.4346 38.5378 177.7771 52 L 4.1273 8.2977 121.6357 58.3450 42.2958 178.7863 53 Q 3.9959 8.3900 119.5548 59.1715 28.7877 178.2349 54 E 3.9680 7.9458 119.3817 59.2135 29.4135 179.1116 55 Q 3.8701 7.8029 118.0886 59.0262 28.7425 179.0146 56 I 3.7617 7.8766 120.7457 64.3258 37.1926 178.1436 57 N 4.4805 8.1056 117.2538 56.8440 38.4718 176.9025 58 H 4.1198 8.4974 119.6755 59.0803 29.6028 177.0305 59 F 4.1355 8.5669 122.6453 61.5071 39.0952 176.9003 60 E 3.8806 8.4975 117.1305 59.3555 29.2405 178.8468 61 E 4.2546 7.8069 120.6310 58.3163 30.8854 177.7549 62 K 4.4100 7.5810 119.7122 51.4475 32.6498 174.3631 63 P 3.3902 0.0000 0.0000 61.3776 32.2479 176.8995 64 T 4.7311 8.3377 112.4466 59.0424 72.9636 174.6723 65 K 3.9504 8.9106 124.2653 59.8190 32.0314 178.7993 66 E 3.9772 8.2153 118.3072 59.7019 29.4673 178.9285 67 M 4.0384 7.8230 116.8325 58.3650 32.2908 177.8711 68 K 3.2184 8.1706 119.8016 59.7264 32.3303 178.3059 69 D 4.3121 8.0904 118.8475 57.2040 40.6923 178.9351 70 K 3.9238 7.7552 119.8854 59.5159 32.2075 179.0186 71 I 3.6495 8.0216 120.5281 64.3636 36.9213 178.5860 72 V 3.4966 8.0069 119.1748 65.8104 31.3449 177.9057 73 A 3.9509 7.9686 120.4796 55.1822 18.1711 179.4381 74 E 3.8859 8.1713 116.9993 59.8894 29.5953 179.5174 75 M 4.0231 8.1640 118.6887 58.5748 32.0240 178.4404 76 D 4.4292 8.3279 119.1614 57.7292 40.9586 179.2650 77 T 3.8633 7.7794 115.9474 66.6978 68.5373 176.8358 78 I 3.6912 7.9598 121.9657 64.5092 37.0488 178.5351 79 I 3.6549 8.2854 120.6643 64.3719 36.9531 178.2504 80 A 3.9573 8.0485 121.5813 55.4018 18.0378 179.4183 81 M 3.9796 8.0192 116.6891 58.7461 32.2588 178.5354 82 I 3.6750 7.7002 119.9611 64.5012 37.0651 178.0961 83 D 4.4363 8.1499 118.8005 57.2509 40.7192 178.9026 84 G 3.7084 8.1122 106.1502 47.8617 0.0000 175.9465 85 V 3.5880 8.0531 121.5524 65.5488 31.5279 177.8327 86 R 3.9555 8.3027 118.7826 59.4556 29.7824 178.6801 87 G 3.5915 7.8200 105.2924 47.7070 0.0000 175.7850 88 V 3.5684 7.7104 120.3732 65.7702 31.7148 177.8488 89 L 3.9929 8.0425 118.6916 57.9780 41.2013 179.3589 90 D 4.3570 7.9317 117.8304 57.4759 40.7134 178.7545 91 R 4.0719 8.0300 118.5997 59.1356 30.0242 179.1674 92 L 4.0208 8.0014 118.9954 57.9978 41.4123 179.3161 93 M 4.1196 7.8051 117.4599 58.4026 31.8676 178.5277 94 Q 4.0881 7.6432 117.2583 57.6089 29.2490 177.2274 95 R 3.9092 7.3938 120.4509 57.5373 30.9490 177.2874 96 K 4.2917 8.5913 122.1582 56.7447 32.4503 176.0851 97 D 4.6745 7.9548 116.6373 54.7577 40.8032 175.7335 98 L 4.6573 7.5639 119.7010 53.5469 42.9659 176.8569 99 D 4.7760 8.1493 125.2082 52.7791 42.0331 177.6107 100 I 3.9028 8.3465 121.1573 66.0196 35.2440 174.4228 *101 F 4.3290 8.0434 120.9976 62.1147 37.9657 180.3289 102 E 4.1892 9.0683 119.5613 59.3972 29.4271 179.6287 103 Q 3.9685 8.0047 119.2717 59.1829 29.1638 177.5794 104 Y 4.0773 7.9515 120.0802 60.9268 38.9346 177.5897 105 N 4.1737 8.4297 117.3989 56.3051 38.5095 177.4607 106 L 3.9374 7.6748 120.3424 57.8153 41.7026 179.1954 107 E 3.8850 7.8872 118.1106 59.7305 29.2863 179.5052 108 M 3.8370 7.7585 118.2706 58.3110 31.5978 178.7441 109 A 3.9065 7.9218 120.8182 54.8237 18.5124 179.6316 110 K 3.8915 8.1186 118.6278 59.4173 32.2392 179.0755 111 K 3.9804 8.1790 120.1710 59.3257 32.0043 179.0224 112 S 4.1804 8.3918 116.0980 61.5273 62.6629 176.9347 113 G 3.5444 7.7857 107.8688 47.7836 0.0000 175.4667 114 D 4.3627 8.0077 121.1727 57.1700 40.8463 179.0880 115 I 3.6568 7.9221 120.2835 64.2305 37.0882 178.1634 116 L 3.9020 8.0123 121.3023 58.2648 41.8879 178.7064 117 E 3.8858 8.4949 119.5704 59.1226 29.3207 178.5982 118 R 3.8661 7.9714 118.8757 59.6326 30.1409 178.3052 119 D 4.3677 8.1995 118.6181 57.1015 40.7651 178.6904 120 L 3.9841 8.1324 119.7560 57.8486 41.6048 179.7881 121 K 3.9724 8.2371 118.4256 59.3085 32.0559 179.6340 122 K 3.9662 7.8012 118.7581 59.4538 31.9378 179.0663 123 E 3.9882 8.3509 119.6345 58.9759 29.5218 178.4992 124 E 3.8696 8.4296 119.7410 59.1317 29.5041 178.6514 125 A 4.0206 7.9806 119.9952 54.9511 18.2184 179.3723 126 R 3.9804 7.9307 117.1256 59.5035 30.1988 178.8814 127 V 3.6610 7.9320 118.1311 66.0833 31.3094 178.0971 128 K 4.0426 7.9950 119.4108 59.9597 31.9803 179.5356 129 K 4.3922 7.6035 121.1656 57.0796 31.8190 179.6346 130 I 4.2289 7.2199 119.6731 61.3766 37.2071 175.9031 131 E 4.1531 8.7593 125.8286 56.4850 30.0525 177.5649 132 V 3.9862 8.2719 114.8909 61.5588 32.1431 175.6140 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 *32 N 8.28 4.74 0.00 2.62 2.75 0.00 0.00 6.79 6.82 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 33 S 8.49 4.40 0.00 3.94 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 34 L 8.32 4.47 0.00 1.68 1.60 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 35 M 7.86 4.25 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 36 E 8.11 3.98 0.00 2.07 1.99 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 2.47 2.29 0.00 37 R 7.82 3.89 0.00 1.88 2.12 0.00 3.19 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 38 I 8.21 3.68 2.03 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 1.41 0.75 0.92 0.00 0.00 39 H 8.64 4.13 0.00 3.37 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 7.97 4.02 0.00 1.97 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 2.24 2.18 0.00 41 Q 7.87 4.23 0.00 2.04 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 42 I 7.76 3.85 1.97 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 1.51 1.06 0.88 0.00 0.00 43 K 7.71 4.03 0.00 1.93 1.89 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 44 K 7.71 4.00 0.00 1.90 1.92 0.00 1.52 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.49 7.81 45 G 7.92 3.58 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 0.00 0.00 0.00 46 E 8.09 3.74 0.00 2.27 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 2.31 2.35 0.00 47 L 8.20 4.16 0.00 1.93 1.94 1.01 1.07 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 48 A 7.93 4.04 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 49 L 7.55 3.86 0.00 1.42 1.50 0.76 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.07 4.40 0.00 3.27 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 51 Y 8.71 4.10 0.00 3.17 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 52 L 8.30 4.13 0.00 1.93 1.91 0.91 0.97 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 53 Q 8.39 4.00 0.00 2.24 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.60 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 54 E 7.95 3.97 0.00 2.05 1.80 0.00 0.00 0.00 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 2.48 0.00 55 Q 7.80 3.87 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.18 1.89 0.00 56 I 7.88 3.76 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.77 1.03 0.00 0.00 57 N 8.11 4.48 0.00 2.95 2.88 0.00 0.00 6.68 8.17 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 58 H 8.50 4.12 0.00 3.23 3.46 0.00 5.79 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 59 F 8.57 4.14 0.00 3.22 3.30 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 60 E 8.50 3.88 0.00 2.13 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 2.45 2.71 0.00 61 E 7.81 4.25 0.00 1.91 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 0.00 2.23 2.25 0.00 62 K 7.58 4.41 0.00 1.76 1.53 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.28 1.25 7.81 63 P 0.00 3.39 0.00 1.76 1.31 0.00 3.48 0.00 0.00 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.64 0.00 64 T 8.34 4.73 4.30 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 1.25 0.00 0.00 65 K 8.91 3.95 0.00 1.89 1.90 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.69 1.58 7.81 66 E 8.22 3.98 0.00 2.14 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 0.00 2.43 2.46 0.00 67 M 7.82 4.04 0.00 2.53 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.82 0.00 68 K 8.17 3.22 0.00 1.73 1.81 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.22 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.33 1.26 7.81 69 D 8.09 4.31 0.00 2.91 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 70 K 7.76 3.92 0.00 1.96 1.97 0.00 1.53 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.68 7.81 71 I 8.02 3.65 1.74 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.50 0.80 0.00 0.00 72 V 8.01 3.50 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 1.16 0.00 0.00 0.88 0.00 0.00 73 A 7.97 3.95 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 74 E 8.17 3.89 0.00 2.19 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 0.00 2.35 2.59 0.00 75 M 8.16 4.02 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.56 0.00 76 D 8.33 4.43 0.00 2.88 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 77 T 7.78 3.86 4.39 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 1.20 0.00 0.00 78 I 7.96 3.69 1.97 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 1.51 1.01 0.88 0.00 0.00 79 I 8.29 3.65 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.81 0.93 0.00 0.00 80 A 8.05 3.96 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 81 M 8.02 3.98 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 82 I 7.70 3.68 1.99 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 1.50 0.65 0.99 0.00 0.00 83 D 8.15 4.44 0.00 2.78 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 84 G 8.11 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 85 V 8.05 3.59 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 0.96 0.00 0.00 1.00 0.00 0.00 86 R 8.30 3.96 0.00 1.97 2.09 0.00 3.14 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.64 0.00 87 G 7.82 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 7.71 3.57 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 1.05 0.00 0.00 0.92 0.00 0.00 89 L 8.04 3.99 0.00 1.86 1.68 0.89 0.91 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 90 D 7.93 4.36 0.00 2.82 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 91 R 8.03 4.07 0.00 2.02 1.97 0.00 3.12 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.89 0.00 92 L 8.00 4.02 0.00 1.86 1.71 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 93 M 7.81 4.12 0.00 2.02 2.28 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.58 0.00 94 Q 7.64 4.09 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.59 0.00 95 R 7.39 3.91 0.00 1.96 1.90 0.00 3.15 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 96 K 8.59 4.29 0.00 1.68 1.80 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.02 7.81 97 D 7.95 4.67 0.00 2.66 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 98 L 7.56 4.66 0.00 1.67 1.60 1.02 1.05 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 99 D 8.15 4.78 0.00 2.65 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 0.00 100 I 8.35 3.90 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 1.50 0.70 0.91 0.00 0.00 *101 F 8.04 4.33 0.00 2.28 2.30 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 0.00 102 E 9.07 4.19 0.00 2.07 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 2.35 2.45 0.00 103 Q 8.00 3.97 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 104 Y 7.95 4.08 0.00 3.18 3.18 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 0.00 105 N 8.43 4.17 0.00 2.93 2.85 0.00 0.00 7.10 6.30 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 0.00 106 L 7.67 3.94 0.00 1.78 1.68 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 107 E 7.89 3.88 0.00 2.04 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 2.31 2.55 0.00 108 M 7.76 3.84 0.00 1.82 1.90 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 109 A 7.92 3.91 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 0.00 110 K 8.12 3.89 0.00 1.87 1.95 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.41 7.81 111 K 8.18 3.98 0.00 1.89 1.86 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.45 7.81 112 S 8.39 4.18 0.00 4.00 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 0.00 113 G 7.79 3.54 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 0.00 114 D 8.01 4.36 0.00 2.89 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 0.00 115 I 7.92 3.66 1.98 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 1.39 1.01 0.90 0.00 0.00 116 L 8.01 3.90 0.00 1.79 1.81 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.49 3.89 0.00 2.09 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 2.29 2.29 0.00 118 R 7.97 3.87 0.00 2.01 2.10 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 119 D 8.20 4.37 0.00 2.85 2.68 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 0.00 120 L 8.13 3.98 0.00 1.86 1.69 0.89 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.24 3.97 0.00 1.79 1.84 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.44 1.68 7.81 122 K 7.80 3.97 0.00 1.94 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.67 7.81 123 E 8.35 3.99 0.00 2.16 2.08 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 2.29 2.34 0.00 124 E 8.43 3.87 0.00 2.13 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 2.28 2.28 0.00 125 A 7.98 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 R 7.93 3.98 0.00 2.06 2.10 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 127 V 7.93 3.66 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.95 0.00 0.00 128 K 8.00 4.04 0.00 1.92 1.86 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.64 7.81 129 K 7.60 4.39 0.00 1.88 1.72 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 1.35 7.81 130 I 7.22 4.23 2.31 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 1.37 1.29 0.92 0.00 0.00 131 E 8.76 4.15 0.00 1.95 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 2.33 2.35 0.00 132 V 8.27 3.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.99 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.