NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 57 F 4.9995 8.3201 119.4000 57.4586 40.3832 173.9012 58 A 4.7559 8.4820 126.6969 49.7235 21.8707 174.7253 59 F 4.8609 9.1453 122.4811 57.2537 43.1912 172.2020 60 K 4.2221 7.7113 126.3418 54.4957 35.6421 175.8547 61 R 4.3134 7.8833 120.4137 54.3501 32.6285 177.1685 62 G 3.8518 8.0850 109.8360 46.0773 0.0000 172.6656 63 I 4.4271 7.6603 114.1526 58.2712 40.6056 175.8730 64 S 4.3149 8.1354 115.9533 58.3176 64.2779 175.2694 65 T 3.8135 8.3005 113.6248 64.6960 68.5170 174.8751 66 P 4.2875 0.0000 0.0000 65.1619 31.4987 178.3139 67 D 4.3312 8.0849 117.9775 57.2317 40.7426 178.5733 68 L 3.9419 8.0603 120.6479 57.9548 42.1018 178.7395 69 A 4.0281 8.0623 120.7920 55.0566 18.2159 179.4203 70 L 3.9044 8.0663 118.9212 58.3958 42.2244 179.2993 71 I 3.7671 7.6731 112.6623 64.2904 37.3883 178.3264 72 T 4.0438 8.2154 117.6139 66.3318 68.2570 176.7295 73 R 3.9043 8.1892 120.6723 59.5229 30.1678 178.5964 74 Q 3.9859 8.3985 118.1600 58.9432 28.6529 178.6087 75 L 3.9687 8.3923 121.5126 58.0163 42.1194 178.7871 76 A 3.9943 8.3416 121.0373 55.5124 18.1871 179.7856 77 T 3.8336 8.1195 114.2677 66.7333 68.3078 177.0596 78 L 3.9846 7.7979 119.6811 57.7527 42.0051 179.3419 79 V 3.7378 8.0601 118.4873 66.2485 31.2746 178.1652 80 Q 4.1121 8.0939 116.6363 58.4943 28.6005 178.2518 81 S 4.4431 7.5827 114.1367 58.8326 64.2794 174.3753 82 G 3.7081 7.5733 110.9223 45.8603 0.0000 170.8167 *84 P 4.1660 0.0000 0.0000 61.9552 34.0785 176.1067 85 L 3.9381 8.5037 123.4892 58.6038 41.9136 179.3865 86 E 3.9450 8.1314 116.7476 59.4858 29.5234 178.5828 87 E 3.9554 8.0126 119.7648 58.8994 29.8026 178.3030 88 C 4.1051 8.4165 117.2834 62.9232 28.2867 176.0191 89 L 4.0002 8.1403 120.6616 57.7535 41.0879 179.5162 90 R 3.8746 8.1953 118.3990 59.4547 29.9990 178.4794 91 A 3.9603 8.0434 120.4455 55.1179 18.1733 179.7359 92 V 3.5147 7.6835 115.4109 65.9723 31.8860 177.7829 93 A 4.1327 8.0635 120.3870 55.4448 18.1184 179.5855 94 E 4.0637 8.3278 115.3353 58.6742 29.5814 178.4966 95 Q 4.3822 7.7135 116.1000 54.7931 29.5339 175.4823 96 S 4.3766 7.3992 116.0777 57.9228 63.0055 173.7672 97 E 4.1964 8.7024 125.3879 56.8959 29.8854 176.9856 98 K 4.4009 7.8235 120.1107 53.8303 33.4051 174.4393 99 P 4.1970 0.0000 0.0000 65.8585 31.0932 178.5157 100 R 3.8598 7.8373 115.5893 59.4186 30.1196 178.2075 101 I 3.7733 7.5439 118.3489 64.0691 37.4368 177.7381 102 R 4.0807 8.1745 119.8478 59.7977 29.8719 179.4818 103 T 4.0751 7.7992 112.0556 64.6299 68.3664 175.8589 *105 L 4.2435 7.8988 123.4990 54.8219 43.9386 179.4126 106 V 3.5616 8.0805 117.8376 65.9060 31.4210 178.0214 107 A 4.0379 8.1063 120.5429 55.0814 18.2706 179.6551 108 V 3.6105 7.8395 116.3417 66.2855 31.5526 177.9889 109 R 3.8832 8.2944 118.2876 59.3979 29.6669 178.1316 110 A 4.0394 8.0821 119.7513 55.3152 18.6096 179.5127 111 K 4.2705 8.0698 116.4230 59.5413 32.0620 179.7329 112 V 3.9719 8.0913 120.2411 65.6981 31.2633 178.0548 113 T 3.9809 8.1707 108.1184 63.9275 68.8269 175.6108 114 E 4.2094 7.7150 119.7647 56.5639 29.8472 177.1053 115 G 3.9192 7.9124 106.8587 45.2182 0.0000 174.0273 116 Y 4.3618 7.5450 117.7364 57.4715 38.8010 175.4969 117 T 4.0427 8.3678 112.6634 61.4017 70.9170 175.0081 118 L 3.9225 8.8000 123.9978 58.5269 42.1866 179.3960 119 S 4.1366 8.5912 114.1221 61.8078 62.5843 176.2784 120 D 4.3537 7.8892 121.4503 56.9782 40.8391 178.6472 121 S 4.2735 8.3810 115.8834 61.6589 62.7817 176.7847 122 L 4.0623 8.5134 122.1054 57.4543 41.0150 179.4745 123 G 3.8140 7.7053 104.7606 47.9388 0.0000 174.7024 124 D 4.4520 7.9620 118.9093 55.4864 42.3058 175.8665 125 Y 4.6781 8.1185 117.3385 55.9533 38.2373 174.7187 126 P 4.6165 0.0000 0.0000 64.8129 32.0186 178.0271 127 H 4.4041 8.1945 113.9947 56.9053 29.1740 176.5824 128 V 3.5365 7.4215 118.3499 63.5738 32.4289 175.1695 129 F 4.3268 7.8746 121.4827 55.3685 39.4869 175.3581 130 D 4.6299 8.3908 126.3904 52.5264 41.7241 176.6479 131 E 3.9870 8.7661 118.6274 59.5787 29.0795 179.5181 132 L 3.9299 7.9107 118.8126 58.0066 42.3801 178.1606 133 F 4.1400 8.5897 119.4875 61.6636 39.5775 177.0976 134 R 4.3106 8.5648 117.6878 59.1143 29.6992 179.6139 135 S 4.3366 8.3833 112.4217 59.1428 62.5062 176.3476 *137 V 3.8440 7.7543 122.6705 62.9508 33.1095 177.1796 138 A 3.9684 8.2876 121.4244 55.1955 18.0314 179.2627 139 A 4.0211 8.3985 119.6258 55.2994 18.4166 180.0026 140 G 3.5814 8.0124 103.4792 48.1407 0.0000 175.5042 141 E 3.9860 8.3927 121.8927 58.9436 29.2778 179.5251 142 K 4.0942 8.3446 119.0748 58.5349 32.3536 177.9689 143 S 4.6772 7.8022 111.6339 57.3625 63.5740 174.5429 144 G 3.8626 7.6591 109.1304 46.9677 0.0000 173.5816 145 H 5.0504 8.3918 116.0712 54.3859 29.9263 176.1584 146 L 3.9683 8.2888 123.2026 58.2491 41.8772 177.3087 147 D 4.3401 8.0343 118.7886 56.6940 39.4002 178.6611 148 S 4.2251 8.0079 115.4940 60.6759 63.2923 176.6122 149 V 3.6229 7.8977 116.2706 64.0450 31.1591 178.4104 150 L 3.9375 8.0933 119.0155 57.5821 41.3661 178.9451 151 E 3.9047 8.1010 119.2637 59.3783 29.4679 178.8582 152 R 3.8665 7.9293 118.4627 59.6051 30.1087 178.4654 153 L 3.9665 8.3566 118.8440 57.5569 41.4846 179.5017 154 A 4.0544 8.4133 121.1950 55.3133 18.3514 179.3246 155 D 4.3421 8.3436 117.6541 57.6298 40.8057 178.4847 156 Y 4.0906 8.4565 120.0005 60.7998 38.8472 177.9900 157 A 3.6514 8.4807 122.0395 55.1201 18.4681 179.5242 158 E 3.8799 8.3332 117.1301 59.4657 29.3295 179.0060 159 N 4.2770 8.0691 116.2562 56.5003 39.0578 176.5611 160 R 3.8811 7.7825 119.5354 59.3321 30.4379 177.7879 161 Q 4.1962 7.9597 120.6575 58.3990 28.8919 178.8570 162 K 3.7544 7.7636 116.2112 57.5045 31.7028 177.9142 *164 R 4.1674 7.8732 119.5653 56.0854 32.0000 177.4900 165 S 4.0773 8.0543 111.8620 61.1909 62.0988 175.8609 166 K 3.8798 8.0703 121.5316 59.3692 31.9570 178.0454 167 L 4.0779 7.8262 118.8560 58.4023 42.4226 178.4152 168 Q 4.2339 7.8303 117.0311 56.5356 29.0392 176.2724 169 Q 4.1450 7.4912 119.1430 57.2158 29.0768 176.7853 170 A 3.8383 8.8186 123.8941 52.1064 16.8247 177.9389 171 S 4.3002 7.8937 115.5832 58.4428 63.0414 174.1651 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 57 F 8.32 5.00 0.00 3.09 2.94 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 58 A 8.48 4.76 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 59 F 9.15 4.86 0.00 2.90 2.95 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 0.00 0.00 0.00 60 K 7.71 4.22 0.00 1.23 1.29 0.00 1.42 0.00 0.00 1.50 0.00 0.00 2.71 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.16 1.23 7.81 61 R 7.88 4.31 0.00 1.66 1.77 0.00 3.21 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.38 0.00 62 G 8.08 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 0.00 0.00 0.00 63 I 7.66 4.43 1.75 0.00 0.00 0.66 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 0.61 0.73 0.00 0.00 64 S 8.14 4.31 0.00 4.03 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 65 T 8.30 3.81 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 1.17 0.00 0.00 66 P 0.00 4.29 0.00 2.16 2.26 0.00 3.52 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 67 D 8.08 4.33 0.00 2.88 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.06 3.94 0.00 1.66 1.63 0.78 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.06 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.07 3.90 0.00 1.78 1.67 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 71 I 7.67 3.77 1.93 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.16 0.93 0.00 0.00 72 T 8.22 4.04 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 73 R 8.19 3.90 0.00 2.09 2.17 0.00 3.16 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 74 Q 8.40 3.99 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 75 L 8.39 3.97 0.00 1.84 1.76 0.93 1.06 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 76 A 8.34 3.99 1.41 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 0.00 0.00 0.00 77 T 8.12 3.83 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 1.22 0.00 0.00 78 L 7.80 3.98 0.00 1.64 1.73 1.01 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 79 V 8.06 3.74 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 1.03 0.00 0.00 0.95 0.00 0.00 80 Q 8.09 4.11 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 81 S 7.58 4.44 0.00 3.97 4.13 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 82 G 7.57 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 *84 P 0.00 4.17 0.00 2.19 2.01 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.14 0.00 85 L 8.50 3.94 0.00 1.75 1.69 0.92 0.90 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 86 E 8.13 3.95 0.00 2.28 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 0.00 2.36 2.43 0.00 87 E 8.01 3.96 0.00 2.06 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 2.38 2.40 0.00 88 C 8.42 4.11 0.00 3.18 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 89 L 8.14 4.00 0.00 1.83 1.72 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.20 3.87 0.00 1.88 2.12 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 1.73 0.00 91 A 8.04 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.51 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 0.90 0.00 0.00 1.03 0.00 0.00 93 A 8.06 4.13 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.33 4.06 0.00 2.02 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 2.47 0.00 95 Q 7.71 4.38 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 96 S 7.40 4.38 0.00 3.98 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 97 E 8.70 4.20 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 2.28 2.32 0.00 98 K 7.82 4.40 0.00 1.73 1.71 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.34 1.69 7.81 99 P 0.00 4.20 0.00 2.14 2.12 0.00 3.59 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 100 R 7.84 3.86 0.00 1.78 1.92 0.00 3.22 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 101 I 7.54 3.77 1.97 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.87 0.88 0.00 0.00 102 R 8.17 4.08 0.00 1.85 2.09 0.00 3.18 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 103 T 7.80 4.08 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 1.25 0.00 0.00 *105 L 7.90 4.24 0.00 1.84 1.74 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 106 V 8.08 3.56 2.24 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 1.11 0.00 0.00 0.96 0.00 0.00 107 A 8.11 4.04 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.84 3.61 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 0.99 0.00 0.00 0.97 0.00 0.00 109 R 8.29 3.88 0.00 1.98 2.12 0.00 3.31 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 110 A 8.08 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.07 4.27 0.00 2.04 2.01 0.00 1.52 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.73 7.81 112 V 8.09 3.97 2.24 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 1.22 0.00 0.00 1.00 0.00 0.00 113 T 8.17 3.98 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 1.28 0.00 0.00 114 E 7.72 4.21 0.00 2.20 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 2.65 2.60 0.00 115 G 7.91 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 0.00 0.00 0.00 116 Y 7.55 4.36 0.00 3.19 2.86 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 0.00 117 T 8.37 4.04 4.66 0.00 0.00 0.00 0.00 0.00 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 0.00 118 L 8.80 3.92 0.00 1.77 1.83 0.87 0.80 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 0.00 119 S 8.59 4.14 0.00 4.18 4.20 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 0.00 120 D 7.89 4.35 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 0.00 121 S 8.38 4.27 0.00 4.02 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 0.00 122 L 8.51 4.06 0.00 1.72 1.43 0.80 -0.10 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 0.00 123 G 7.71 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 0.00 124 D 7.96 4.45 0.00 2.78 2.37 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 0.00 125 Y 8.12 4.68 0.00 3.19 2.77 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 0.00 126 P 0.00 4.62 0.00 2.21 2.21 0.00 3.39 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.92 0.00 127 H 8.19 4.40 0.00 3.24 3.52 0.00 5.41 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 0.00 128 V 7.42 3.54 1.63 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 -0.29 0.00 0.00 0.67 0.00 0.00 129 F 7.87 4.33 0.00 3.03 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 D 8.39 4.63 0.00 3.01 2.87 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 0.00 131 E 8.77 3.99 0.00 2.07 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 0.00 2.44 2.42 0.00 132 L 7.91 3.93 0.00 1.64 1.91 0.87 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.59 4.14 0.00 3.29 3.27 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 0.00 134 R 8.56 4.31 0.00 1.99 2.04 0.00 3.25 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.02 0.00 135 S 8.38 4.34 0.00 4.03 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 *137 V 7.75 3.84 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 1.12 0.00 0.00 0.90 0.00 0.00 138 A 8.29 3.97 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 0.00 139 A 8.40 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 0.00 140 G 8.01 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 0.00 141 E 8.39 3.99 0.00 2.13 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 2.33 2.49 0.00 142 K 8.34 4.09 0.00 1.82 1.84 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.45 7.81 143 S 7.80 4.68 0.00 4.13 3.98 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 0.00 144 G 7.66 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 0.00 0.00 0.00 145 H 8.39 5.05 0.00 3.10 3.23 0.00 5.64 0.00 0.00 0.00 0.00 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.29 3.97 0.00 1.74 1.66 0.90 1.13 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 0.00 147 D 8.03 4.34 0.00 2.91 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 0.00 148 S 8.01 4.23 0.00 4.06 4.17 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 0.00 149 V 7.90 3.62 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 0.76 0.00 0.00 0.94 0.00 0.00 150 L 8.09 3.94 0.00 1.88 1.71 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 151 E 8.10 3.90 0.00 2.23 2.15 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 2.31 2.38 0.00 152 R 7.93 3.87 0.00 2.06 2.06 0.00 3.20 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 153 L 8.36 3.97 0.00 1.64 1.40 0.27 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 154 A 8.41 4.05 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 D 8.34 4.34 0.00 2.90 2.77 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 0.00 156 Y 8.46 4.09 0.00 3.03 3.21 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 0.00 157 A 8.48 3.65 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 E 8.33 3.88 0.00 2.23 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 2.33 2.44 0.00 159 N 8.07 4.28 0.00 2.76 2.97 0.00 0.00 7.21 7.18 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 0.00 160 R 7.78 3.88 0.00 1.39 1.79 0.00 3.04 0.00 0.00 2.86 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 161 Q 7.96 4.20 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.21 0.00 162 K 7.76 3.75 0.00 1.97 1.86 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 *164 R 7.87 4.17 0.00 1.98 2.14 0.00 3.27 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 165 S 8.05 4.08 0.00 4.01 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 0.00 166 K 8.07 3.88 0.00 1.74 1.82 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.50 7.81 167 L 7.83 4.08 0.00 1.65 1.89 0.92 0.71 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 0.00 168 Q 7.83 4.23 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 169 Q 7.49 4.14 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.72 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 170 A 8.82 3.84 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 0.00 171 S 7.89 4.30 0.00 4.01 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 * Residues marked with a * may have inaccurate shift predictions.