NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 L 4.4636 8.0427 122.6973 54.6018 43.3857 175.3369 18 I 4.0924 8.4022 121.7478 59.8749 38.8215 173.1531 19 W 4.9658 9.8123 135.0000 55.8955 34.6058 173.7608 20 G 3.9737 6.7388 109.4248 44.7891 0.0000 171.7858 21 C 4.4406 7.5997 117.0389 55.8041 33.6307 172.0774 22 E 5.1038 8.4478 120.1293 54.4708 31.3957 174.7936 23 L 5.0790 8.6885 127.1942 53.5316 44.7965 175.2987 24 N 5.2108 8.5241 118.9720 52.0594 40.6009 175.0622 25 E 4.1082 8.6287 116.5726 59.5672 29.8802 178.6972 26 Q 4.1247 8.3643 117.5798 58.4788 29.1469 176.6250 27 N 4.9583 9.1527 118.9353 51.1091 38.1423 175.1115 28 K 4.3266 8.1653 121.8770 57.9850 33.8388 176.5495 29 T 5.1701 7.9758 115.9831 61.5516 71.4477 173.4821 30 F 4.7351 9.4891 128.5133 56.5155 42.4430 173.5953 31 E 4.7211 8.5358 126.6807 55.0727 30.0781 175.5646 32 F 4.7938 9.2977 128.7418 57.7737 40.7336 174.2894 33 K 4.3931 7.2548 125.6277 55.7917 35.3688 177.6280 34 V 2.9584 7.8803 127.2067 63.3073 31.5608 171.8093 *38 E 4.1634 8.4264 108.6389 54.4662 30.9195 170.3633 39 E 5.3797 7.0814 122.2068 55.8993 30.5068 177.8572 40 K 4.5221 8.0429 123.8176 54.4330 34.8588 172.0886 41 C 4.1306 9.3329 122.6725 58.7342 25.5962 174.6274 42 E 4.0768 8.0426 111.9928 56.8300 26.7850 176.3296 43 H 4.8021 7.5794 117.0017 56.7075 29.6054 176.0551 44 Q 4.5513 8.8452 122.2492 55.2298 31.0192 174.3677 45 L 4.7454 8.7082 123.4176 53.4382 44.0367 174.8149 46 A 5.0753 8.6262 129.1945 50.2243 20.6885 176.1209 47 L 4.4593 8.5123 123.5353 55.3206 42.2120 176.9627 48 R 4.6443 9.4107 120.6853 57.7332 33.2380 175.7259 49 T 5.1515 7.6664 106.0456 60.6064 72.9943 172.7807 50 V 5.0515 8.5252 121.4324 61.4871 35.2119 173.7749 51 C 5.1461 9.0655 120.7261 57.2190 33.1014 173.0415 52 L 4.5815 8.3163 121.6000 54.0527 42.5627 177.0947 53 G 4.0771 8.3338 109.8162 45.8993 0.0000 174.2641 54 D 4.7003 8.8582 119.5663 54.2161 40.0014 177.0247 55 K 4.3905 7.8008 118.0381 55.9134 32.5288 175.9357 56 A 4.2553 7.5385 121.8704 51.5665 18.6109 178.6846 57 K 4.1398 7.9694 120.9199 56.7944 32.9054 177.3897 58 D 4.7846 8.1845 122.4903 52.5223 38.9919 174.4095 59 E 4.5578 7.5636 119.7481 54.3271 33.9629 175.0394 60 F 4.5628 8.4827 119.0597 57.7454 39.9937 174.8695 61 H 5.0830 9.4425 119.9363 54.0808 32.2628 172.8011 62 I 5.2234 8.7710 123.4710 59.4322 41.1376 174.5327 63 V 5.0661 8.5821 126.5868 59.7687 33.7833 174.5216 64 E 5.3065 9.5829 122.7592 54.4247 33.1838 174.8515 65 I 4.5011 8.4607 122.9680 60.8527 38.6293 174.8045 66 V 4.7450 9.1486 128.8586 61.4866 32.8038 174.4279 67 D 4.8828 8.8589 126.3155 53.0652 45.1474 173.8852 68 Q 4.6133 8.4571 120.4735 54.4475 30.5351 174.7910 *73 E 3.9944 8.4163 119.5694 55.9468 30.5228 174.7178 74 K 4.7273 8.8197 127.4219 54.5969 35.1089 174.9209 75 S 5.2351 8.8468 121.3130 56.5278 66.3830 174.0075 76 V 4.2784 8.4375 121.3731 60.2684 33.1864 172.7103 77 P 4.8988 0.0000 0.0000 63.4371 31.1564 176.3235 78 I 4.6512 8.7252 115.4947 60.6596 39.9990 175.5287 79 A 4.7595 7.8731 123.7361 50.7400 22.7466 174.9285 80 T 5.1010 8.6182 117.8082 61.8454 71.2558 173.4186 81 L 5.0986 9.0990 125.8252 53.1383 46.5670 175.5005 82 K 4.5835 8.8839 119.7154 55.1349 35.4119 174.4393 83 P 4.1610 0.0000 0.0000 65.5543 31.3230 177.1775 84 S 4.6060 7.6562 108.6158 58.2416 63.5829 173.8012 85 I 4.2365 7.4411 119.4707 62.5524 39.2119 176.1468 86 L 4.2643 8.4428 127.8677 53.9264 42.9708 173.4235 87 P 4.6112 0.0000 0.0000 63.2760 32.1020 175.0525 88 M 5.2048 7.4179 114.7998 54.7278 34.3569 173.5604 89 A 4.7511 8.8568 119.8554 50.6391 23.0819 175.3194 90 T 4.6795 8.5455 118.0318 63.1216 69.7324 174.1024 91 M 4.5704 8.6160 126.6037 53.7558 33.9644 175.9308 92 V 4.2367 8.2266 122.4799 62.1755 34.2089 176.2614 93 G 3.9389 9.0369 114.9243 45.3377 0.0000 173.0399 94 I 4.0581 7.2675 120.7310 61.0699 37.8954 174.7911 95 E 5.1560 8.7609 126.7004 54.3914 32.1291 175.6403 96 L 4.8370 8.9490 124.0798 52.8523 45.7752 175.4707 97 D 4.9456 8.5359 121.6546 52.6311 41.3001 175.0063 98 P 4.4777 0.0000 0.0000 62.0975 32.0939 174.2806 99 P 4.8687 0.0000 0.0000 62.3653 32.8981 175.3859 100 V 4.3718 8.7155 121.2667 61.4134 34.9102 174.0627 101 T 5.0174 8.2668 123.4441 61.9209 71.0315 173.0107 102 F 5.3815 8.7521 125.2108 56.3062 41.3743 175.0798 103 R 5.0437 9.1864 122.4577 54.9445 32.6719 173.9374 104 L 4.7996 9.0286 128.8299 53.6375 40.9752 176.4937 105 K 4.4114 8.7564 126.6006 58.8483 33.1522 176.4272 106 A 4.5647 7.9990 118.6232 51.8776 22.8289 176.7892 107 G 4.0033 9.1036 107.3748 45.6739 0.0000 173.5567 108 S 4.2796 8.4818 112.7147 57.4598 63.9672 175.8916 109 G 4.1856 8.0909 110.0855 43.7679 0.0000 170.1355 110 P 4.3846 0.0000 0.0000 62.5995 32.5149 175.4614 111 L 4.8001 8.5017 125.5530 53.3454 45.0060 174.4140 112 Y 5.2090 8.9481 124.1459 56.4499 40.4659 174.6651 113 I 4.9115 8.2487 124.2957 59.3807 40.4492 174.8148 114 S 5.0857 8.5899 120.2564 57.1473 66.6411 173.5305 115 G 4.2687 9.0541 106.7831 46.4492 0.0000 171.7988 116 Q 5.1418 8.7005 117.1699 54.2975 33.6206 174.6454 117 H 4.8298 8.1296 118.9502 56.0558 29.6132 175.3197 118 V 4.4728 8.5766 121.0296 61.0101 35.3056 175.2830 119 A 4.2923 8.5098 128.3917 52.2918 19.1574 176.2758 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 17 L 8.04 4.46 0.00 1.36 1.62 0.92 0.41 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 18 I 8.40 4.09 1.89 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 1.21 1.21 0.92 0.00 0.00 19 W 9.81 4.97 0.00 3.36 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 20 G 6.74 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 21 C 7.60 4.44 0.00 1.45 1.52 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 22 E 8.45 5.10 0.00 2.12 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 0.00 2.12 2.12 0.00 23 L 8.69 5.08 0.00 1.57 1.58 0.99 0.39 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 24 N 8.52 5.21 0.00 2.91 2.85 0.00 0.00 6.67 7.82 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 25 E 8.63 4.11 0.00 2.14 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 0.00 2.30 2.29 0.00 26 Q 8.36 4.12 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.24 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 27 N 9.15 4.96 0.00 2.74 2.83 0.00 0.00 7.10 5.12 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 28 K 8.17 4.33 0.00 1.76 1.91 0.00 1.90 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.66 1.48 7.81 29 T 7.98 5.17 4.31 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 1.29 0.00 0.00 30 F 9.49 4.74 0.00 3.30 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.54 4.72 0.00 1.79 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 0.00 2.27 2.30 0.00 32 F 9.30 4.79 0.00 3.75 3.06 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 33 K 7.25 4.39 0.00 1.56 1.38 0.00 1.79 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.20 1.34 7.81 34 V 7.88 2.96 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 0.72 0.00 0.00 0.85 0.00 0.00 *38 E 8.43 4.16 0.00 2.05 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 2.13 1.88 0.00 39 E 7.08 5.38 0.00 2.12 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 1.99 1.94 0.00 40 K 8.04 4.52 0.00 1.73 1.55 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.25 1.01 7.81 41 C 9.33 4.13 0.00 2.97 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 42 E 8.04 4.08 0.00 2.10 1.85 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 2.14 1.88 0.00 43 H 7.58 4.80 0.00 3.22 3.32 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 8.85 4.55 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 45 L 8.71 4.75 0.00 1.10 1.17 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.63 5.08 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 47 L 8.51 4.46 0.00 1.59 1.63 1.04 0.90 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 48 R 9.41 4.64 0.00 1.65 1.91 0.00 3.29 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 49 T 7.67 5.15 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 1.20 0.00 0.00 50 V 8.53 5.05 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 0.96 0.00 0.00 0.90 0.00 0.00 51 C 9.07 5.15 0.00 3.00 2.97 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 52 L 8.32 4.58 0.00 1.50 1.47 0.76 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.33 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 0.00 0.00 0.00 54 D 8.86 4.70 0.00 2.80 2.81 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 55 K 7.80 4.39 0.00 1.73 1.83 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.35 7.81 56 A 7.54 4.26 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 57 K 7.97 4.14 0.00 1.77 1.74 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.36 7.81 58 D 8.18 4.78 0.00 2.63 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 59 E 7.56 4.56 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 2.27 2.20 0.00 60 F 8.48 4.56 0.00 2.96 3.03 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 61 H 9.44 5.08 0.00 3.07 3.18 0.00 5.75 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.77 5.22 1.91 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 1.33 1.34 1.00 0.00 0.00 63 V 8.58 5.07 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 1.03 0.00 0.00 64 E 9.58 5.31 0.00 2.04 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 0.00 2.44 2.30 0.00 65 I 8.46 4.50 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.87 0.81 0.00 0.00 66 V 9.15 4.75 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 0.72 0.00 0.00 0.96 0.00 0.00 67 D 8.86 4.88 0.00 2.78 2.40 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 68 Q 8.46 4.61 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.31 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 *73 E 8.42 3.99 0.00 1.98 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 2.19 2.31 0.00 74 K 8.82 4.73 0.00 1.84 1.70 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.35 7.81 75 S 8.85 5.24 0.00 4.03 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 76 V 8.44 4.28 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 0.94 0.00 0.00 77 P 0.00 4.90 0.00 1.98 2.02 0.00 3.68 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 2.04 2.13 0.00 78 I 8.73 4.65 1.92 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.77 1.03 0.00 0.00 79 A 7.87 4.76 1.24 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 0.00 0.00 0.00 80 T 8.62 5.10 4.27 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 1.29 0.00 0.00 81 L 9.10 5.10 0.00 1.51 1.68 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.88 4.58 0.00 1.37 1.39 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.09 1.21 7.81 83 P 0.00 4.16 0.00 2.01 2.07 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 84 S 7.66 4.61 0.00 3.94 4.09 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 0.00 0.00 0.00 0.00 85 I 7.44 4.24 1.87 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 1.19 0.98 0.98 0.00 0.00 86 L 8.44 4.26 0.00 1.65 1.54 0.93 0.96 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 87 P 0.00 4.61 0.00 2.23 2.23 0.00 3.77 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 88 M 7.42 5.20 0.00 1.99 2.12 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 2.47 2.54 0.00 89 A 8.86 4.75 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 90 T 8.55 4.68 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 91 M 8.62 4.57 0.00 1.90 2.00 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 2.57 2.62 0.00 92 V 8.23 4.24 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 1.02 0.00 0.00 0.93 0.00 0.00 93 G 9.04 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 94 I 7.27 4.06 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.68 0.94 0.00 0.00 95 E 8.76 5.16 0.00 1.79 1.81 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 2.18 2.29 0.00 96 L 8.95 4.84 0.00 1.45 1.47 0.94 0.78 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 97 D 8.54 4.95 0.00 2.55 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 2.08 2.12 0.00 3.72 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 99 P 0.00 4.87 0.00 2.05 2.00 0.00 3.70 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 100 V 8.72 4.37 1.85 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 0.47 0.00 0.00 0.95 0.00 0.00 101 T 8.27 5.02 4.37 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 1.27 0.00 0.00 102 F 8.75 5.38 0.00 3.45 3.01 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 0.00 0.00 0.00 103 R 9.19 5.04 0.00 1.91 1.77 0.00 3.12 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 104 L 9.03 4.80 0.00 1.84 1.59 1.04 0.69 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 0.00 105 K 8.76 4.41 0.00 1.95 1.95 0.00 2.12 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.54 7.81 106 A 8.00 4.56 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 0.00 107 G 9.10 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 0.00 0.00 0.00 108 S 8.48 4.28 0.00 3.99 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 0.00 109 G 8.09 4.19 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 0.00 110 P 0.00 4.38 0.00 1.49 1.65 0.00 3.42 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 111 L 8.50 4.80 0.00 1.55 1.36 0.91 0.59 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 0.00 112 Y 8.95 5.21 0.00 2.82 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 0.00 113 I 8.25 4.91 1.42 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.52 0.73 0.00 0.00 114 S 8.59 5.09 0.00 3.81 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 0.00 115 G 9.05 4.27 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 0.00 116 Q 8.70 5.14 0.00 1.93 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.95 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 117 H 8.13 4.83 0.00 3.24 3.28 0.00 5.60 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 0.00 118 V 8.58 4.47 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 0.93 0.00 0.00 0.91 0.00 0.00 119 A 8.51 4.29 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.