NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 K 4.2683 8.4145 122.1381 53.9723 32.3625 175.9917 21 S 4.1143 8.3787 121.6077 56.5299 62.7972 166.7774 22 V 4.1423 8.2174 120.9136 61.5631 33.8443 174.3400 23 N 4.7355 8.6533 127.0004 51.6990 39.1237 173.1488 24 S 4.6151 8.3103 119.4221 56.4445 64.9120 172.9881 25 V 4.5586 8.7838 126.5401 61.4071 34.7846 173.9629 26 T 5.0103 8.2259 117.8209 60.5687 70.6100 172.7410 27 L 4.9356 9.1652 126.4768 53.5130 46.8542 175.7487 28 V 5.1520 7.1696 120.4976 62.8528 34.4218 173.8631 29 G 4.0738 7.9927 114.6818 45.9083 0.0000 171.0283 30 V 4.2120 7.7029 119.1683 62.4336 33.0019 176.6472 31 V 5.3207 8.0331 126.3824 62.0921 33.5673 174.4244 32 H 4.8126 8.6840 120.9831 55.7748 33.3963 173.9278 33 D 4.3698 7.8824 112.7470 54.6363 37.9648 171.9254 34 I 4.8237 7.5336 123.5773 59.8326 38.4509 175.2587 35 Q 4.6194 8.6205 123.7857 55.0649 31.5765 174.0209 36 S 4.6419 8.4751 115.7654 56.7069 64.5361 174.6614 37 G 4.1176 7.3169 110.8483 46.3150 0.0000 172.2188 38 F 5.5247 8.7226 122.8983 55.6384 42.7914 175.7551 39 V 4.0793 8.3726 124.2723 60.6295 31.3349 175.3054 *40 Y 3.7153 9.2623 131.3182 57.9461 34.0767 168.9843 41 E 3.7839 8.4322 109.1110 57.7492 27.0718 176.4422 42 D 5.0108 8.1478 119.4151 52.8390 43.7558 175.4277 43 A 3.6336 8.8209 126.0383 52.3179 18.0241 176.2833 44 V 4.4827 7.9596 113.8018 60.0927 35.4525 175.1107 45 T 4.9038 7.7773 111.9556 59.6953 68.3674 172.7422 46 Q 4.9009 8.2008 129.9242 57.0264 31.2317 174.7814 47 F 5.5270 7.6250 117.6173 57.5906 41.2890 171.8929 48 T 5.1650 8.7380 114.5980 61.9596 71.7741 173.1241 49 L 5.1433 9.2460 128.2273 53.7577 44.8725 175.2156 50 T 5.6475 9.2828 123.8686 61.2032 69.8823 172.9007 51 T 4.1000 8.2925 117.1456 61.4572 70.3841 174.9967 52 T 4.5219 8.1551 123.8945 62.4978 66.4863 175.9425 53 S 4.4783 8.0367 118.1798 58.7940 61.0521 175.0059 54 I 3.8245 7.8549 127.9369 60.7944 38.3739 176.6830 *63 V 3.7762 8.0940 119.7552 61.7324 31.7860 174.1473 64 V 4.2881 8.1453 123.7029 58.8967 34.2503 171.7920 65 V 4.1793 8.3792 129.1056 59.5338 31.2611 174.7525 66 E 4.4102 8.3935 124.8892 56.0181 30.9060 173.8806 67 K 4.8292 8.5636 124.0556 54.2530 35.2363 175.8077 68 D 4.4411 8.4130 120.6597 53.4727 45.4444 174.3552 69 H 4.8031 8.6355 121.3743 54.7209 29.6382 173.9876 70 H 4.7818 9.2237 121.9312 55.1533 30.4994 175.0172 71 T 4.7383 8.3924 118.5464 62.9187 70.6081 173.9402 72 I 4.5610 8.7882 126.2312 59.6942 40.1402 175.0560 73 R 4.4357 8.7231 127.8778 54.9470 31.3079 176.1246 74 C 5.2214 8.3916 123.7584 58.5576 28.8127 173.7867 75 F 4.4034 9.2620 123.3198 56.9033 40.3765 175.7591 76 G 4.1889 8.8068 106.7151 45.5360 0.0000 174.4030 77 E 3.8916 9.1591 127.1888 59.1950 29.7775 178.4388 78 L 4.2818 7.8705 117.6811 57.2147 42.1778 178.5011 79 F 4.2549 8.3508 120.3862 61.4397 39.2691 177.0873 80 S 4.0778 8.9300 115.0910 60.7663 62.4845 176.1909 81 A 3.8356 7.8834 122.8272 54.8233 18.0539 178.6862 82 E 3.9340 8.3484 117.3997 59.8992 29.5793 180.1908 83 V 3.3713 7.7312 117.9485 65.8269 31.4714 177.9191 84 K 3.8917 8.2296 117.7035 58.4966 31.9284 177.6061 85 Q 4.3220 7.2497 116.1116 57.8760 29.9004 176.8720 86 K 3.9742 7.8196 118.8309 58.3452 32.6669 176.7134 87 V 3.8408 7.5486 119.3026 61.6483 31.9698 175.1133 88 K 4.6004 8.8152 126.5282 53.8495 35.2593 175.4542 89 E 4.0231 8.3681 121.8444 57.6694 30.1414 175.9086 90 G 4.1026 8.3640 113.1518 45.3902 0.0000 174.0441 91 N 4.2388 7.5507 116.0603 53.9530 40.0358 174.5754 92 V 5.1113 8.2228 122.3595 61.1994 33.1804 174.9172 93 V 5.0845 8.2912 120.3505 59.6356 35.9828 174.0520 94 C 5.2081 8.8650 116.7737 57.0303 32.1141 172.8309 95 V 4.6225 8.7910 121.3103 61.4799 34.2867 174.2002 96 N 4.9486 8.3444 125.0562 50.8021 39.9833 172.9386 97 G 4.5140 7.7448 109.7108 44.9245 0.0000 169.2858 98 R 4.5180 8.3029 118.5478 55.9794 31.5316 176.5433 99 L 4.4152 8.1893 125.2319 54.2486 42.2360 175.9023 100 R 4.4860 7.4134 124.8344 54.5654 33.5878 175.8426 101 L 5.3229 7.9062 120.6839 56.9358 41.6798 175.4981 102 S 4.0848 9.1835 124.3251 58.4000 62.9140 169.6002 103 P 2.9700 0.0000 0.0000 60.9910 31.6678 174.1557 104 Q 3.9483 8.0922 125.4283 55.7070 28.4425 176.6564 105 L 4.6467 8.0922 123.8336 51.3464 42.1692 174.5326 106 E 4.2761 8.1680 121.5321 54.4806 30.5532 175.9920 107 P 4.3896 0.0000 0.0000 67.4396 31.5027 177.9065 108 S 4.7692 7.1811 109.8333 57.3163 66.9679 178.7840 109 C 4.8474 8.1428 122.2283 57.6818 29.6778 177.1730 110 N 3.9901 9.1056 116.0676 55.0003 37.3821 173.5777 111 K 4.0725 7.5033 120.6573 56.0087 31.7702 181.8434 *112 H 4.6524 8.8703 124.6491 53.3365 28.6847 171.8372 *113 F 5.0389 8.4313 122.3214 54.0704 41.6610 170.3554 114 Y 4.9542 8.6699 121.2259 56.0647 40.4667 175.3197 115 F 4.8644 9.3872 125.0291 56.2749 40.8981 173.1699 116 P 4.8358 0.0000 0.0000 62.2265 31.3407 174.8510 117 Y 4.6933 7.7286 124.6185 55.5092 42.1710 174.0968 118 I 4.6113 8.3008 119.7174 58.5913 40.6714 174.7751 119 Q 4.8170 8.6544 129.6697 56.4343 30.1908 174.6911 120 V 4.5967 8.7640 127.6729 61.2743 34.4700 174.2564 121 Q 4.2465 8.2993 123.3916 54.7364 32.1027 171.5879 122 P 4.4075 0.0000 0.0000 62.4365 31.8594 174.5252 123 P 4.4409 0.0000 0.0000 63.6027 31.6215 177.4068 124 H 4.3813 7.7807 116.2918 58.4764 29.0866 176.0605 125 G 4.4009 7.9478 105.0469 46.6019 0.0000 172.1769 126 Q 4.7430 8.0813 116.5114 55.2129 32.3057 172.6393 127 V 4.9699 9.0783 125.3013 60.2756 34.9503 174.6759 128 A 4.5695 8.2805 127.6083 50.9546 22.1920 175.5808 129 V 4.0885 8.4926 123.0889 62.6171 32.8212 175.0961 130 I 4.4637 8.1281 126.6570 60.0542 39.2571 174.7461 131 H 4.9395 8.5815 122.0890 53.1926 32.3714 174.0273 132 G 3.9652 8.9968 108.1027 46.3749 0.0000 173.9590 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 20 K 8.41 4.27 0.00 1.79 1.73 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 21 S 8.38 4.11 0.00 3.70 3.69 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 0.00 0.00 0.00 0.00 22 V 8.22 4.14 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 0.94 0.00 0.00 0.96 0.00 0.00 23 N 8.65 4.74 0.00 2.61 2.66 0.00 0.00 6.91 7.63 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 24 S 8.31 4.62 0.00 3.83 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 25 V 8.78 4.56 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 0.82 0.00 0.00 0.90 0.00 0.00 26 T 8.23 5.01 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 27 L 9.17 4.94 0.00 1.57 1.51 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.17 5.15 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 0.98 0.00 0.00 0.95 0.00 0.00 29 G 7.99 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 30 V 7.70 4.21 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 0.85 0.00 0.00 0.93 0.00 0.00 31 V 8.03 5.32 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 0.87 0.00 0.00 0.88 0.00 0.00 32 H 8.68 4.81 0.00 3.11 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.88 4.37 0.00 2.86 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 34 I 7.53 4.82 1.83 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.75 0.84 0.00 0.00 35 Q 8.62 4.62 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 36 S 8.48 4.64 0.00 3.81 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 37 G 7.32 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 8.72 5.52 0.00 2.93 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 39 V 8.37 4.08 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 0.77 0.00 0.00 0.93 0.00 0.00 *40 Y 9.26 3.72 0.00 2.46 2.23 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 41 E 8.43 3.78 0.00 2.17 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 2.10 1.88 0.00 42 D 8.15 5.01 0.00 2.99 2.88 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 43 A 8.82 3.63 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 44 V 7.96 4.48 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 0.64 0.00 0.00 45 T 7.78 4.90 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 1.15 0.00 0.00 46 Q 8.20 4.90 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.57 0.00 0.00 0.00 0.00 0.00 2.43 2.16 0.00 47 F 7.63 5.53 0.00 3.24 3.12 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 0.00 0.00 0.00 0.00 48 T 8.74 5.17 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 1.32 0.00 0.00 49 L 9.25 5.14 0.00 1.88 1.60 1.10 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 50 T 9.28 5.65 4.34 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 1.38 0.00 0.00 51 T 8.29 4.10 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 1.30 0.00 0.00 52 T 8.16 4.52 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 53 S 8.04 4.48 0.00 3.89 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 54 I 7.85 3.82 1.87 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 1.28 0.71 0.95 0.00 0.00 *63 V 8.09 3.78 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 0.71 0.00 0.00 0.93 0.00 0.00 64 V 8.15 4.29 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 0.89 0.00 0.00 0.93 0.00 0.00 65 V 8.38 4.18 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 0.87 0.00 0.00 0.94 0.00 0.00 66 E 8.39 4.41 0.00 1.68 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 2.28 1.90 0.00 67 K 8.56 4.83 0.00 1.58 1.67 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.45 7.81 68 D 8.41 4.44 0.00 2.43 2.28 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 69 H 8.64 4.80 0.00 3.04 3.26 0.00 5.69 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 H 9.22 4.78 0.00 3.11 3.16 0.00 5.60 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 T 8.39 4.74 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 1.29 0.00 0.00 72 I 8.79 4.56 0.56 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.85 0.73 0.00 0.00 73 R 8.72 4.44 0.00 1.89 1.59 0.00 2.38 0.00 0.00 2.85 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.48 0.00 74 C 8.39 5.22 0.00 2.91 3.23 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 75 F 9.26 4.40 0.00 2.98 3.09 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 76 G 8.81 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 77 E 9.16 3.89 0.00 2.05 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 0.00 2.36 2.50 0.00 78 L 7.87 4.28 0.00 1.82 1.73 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 79 F 8.35 4.25 0.00 3.12 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 80 S 8.93 4.08 0.00 3.99 4.32 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 81 A 7.88 3.84 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 82 E 8.35 3.93 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 2.39 2.57 0.00 83 V 7.73 3.37 1.90 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 0.89 0.00 0.00 0.13 0.00 0.00 84 K 8.23 3.89 0.00 1.73 1.74 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.42 7.81 85 Q 7.25 4.32 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 86 K 7.82 3.97 0.00 1.66 1.77 0.00 1.63 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.45 7.81 87 V 7.55 3.84 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 0.31 0.00 0.00 0.77 0.00 0.00 88 K 8.82 4.60 0.00 1.85 1.58 0.00 1.69 0.00 0.00 1.51 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.27 1.43 7.81 89 E 8.37 4.02 0.00 1.88 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 2.28 2.43 0.00 90 G 8.36 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 91 N 7.55 4.24 0.00 2.67 2.68 0.00 0.00 6.46 8.19 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 92 V 8.22 5.11 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 0.92 0.00 0.00 93 V 8.29 5.08 2.21 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 0.79 0.00 0.00 0.99 0.00 0.00 94 C 8.86 5.21 0.00 3.10 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 95 V 8.79 4.62 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 1.00 0.00 0.00 1.08 0.00 0.00 96 N 8.34 4.95 0.00 2.84 2.64 0.00 0.00 6.75 9.24 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 97 G 7.74 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.30 4.52 0.00 1.68 1.77 0.00 3.05 0.00 0.00 3.02 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.53 0.00 99 L 8.19 4.42 0.00 1.48 1.71 0.78 0.80 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 0.00 100 R 7.41 4.49 0.00 0.67 1.52 0.00 3.26 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.53 0.00 101 L 7.91 5.32 0.00 1.79 1.63 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 102 S 9.18 4.08 0.00 3.44 3.80 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 0.00 0.00 0.00 103 P 0.00 2.97 0.00 1.87 1.64 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 104 Q 8.09 3.95 0.00 2.26 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.15 0.00 0.00 0.00 0.00 0.00 2.15 1.91 0.00 105 L 8.09 4.65 0.00 1.60 1.45 0.92 0.81 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 0.00 106 E 8.17 4.28 0.00 1.89 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 2.32 1.91 0.00 107 P 0.00 4.39 0.00 2.02 2.16 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 108 S 7.18 4.77 0.00 3.67 3.56 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 0.00 109 C 8.14 4.85 0.00 3.04 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 0.00 110 N 9.11 3.99 0.00 2.76 2.79 0.00 0.00 6.39 7.44 0.00 0.00 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 K 7.50 4.07 0.00 1.67 1.66 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.39 1.26 7.81 *112 H 8.87 4.65 0.00 2.92 2.89 0.00 7.11 0.00 0.00 0.00 0.00 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *113 F 8.43 5.04 0.00 2.23 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 0.00 0.00 0.00 114 Y 8.67 4.95 0.00 2.83 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 0.00 115 F 9.39 4.86 0.00 3.11 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 0.00 116 P 0.00 4.84 0.00 1.86 1.91 0.00 3.54 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 117 Y 7.73 4.69 0.00 2.79 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.30 4.61 1.98 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 2.15 0.98 0.00 0.00 119 Q 8.65 4.82 0.00 2.42 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.87 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 120 V 8.76 4.60 2.34 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 1.16 0.00 0.00 1.06 0.00 0.00 121 Q 8.30 4.25 0.00 2.23 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.18 2.40 0.00 122 P 0.00 4.41 0.00 1.87 1.79 0.00 2.97 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.35 0.00 123 P 0.00 4.44 0.00 1.88 1.98 0.00 3.12 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.99 0.00 124 H 7.78 4.38 0.00 3.11 3.31 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 G 7.95 4.40 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 0.00 126 Q 8.08 4.74 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 127 V 9.08 4.97 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 1.15 0.00 0.00 1.21 0.00 0.00 128 A 8.28 4.57 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 0.00 129 V 8.49 4.09 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 0.73 0.00 0.00 0.87 0.00 0.00 130 I 8.13 4.46 1.93 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 1.21 0.83 0.89 0.00 0.00 131 H 8.58 4.94 0.00 3.09 3.20 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 9.00 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 * Residues marked with a * may have inaccurate shift predictions.