NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 55 A 4.2609 8.2601 123.5823 52.4081 19.7915 175.7050 56 A 4.5021 8.2313 120.0188 51.9295 19.5962 177.2833 57 N 4.7184 8.6255 120.5484 54.6677 40.9749 173.0287 58 N 4.7008 8.4773 117.3249 53.2246 39.7546 173.6548 59 P 4.4064 0.0000 0.0000 65.4655 31.7367 178.2442 60 A 4.9161 8.2888 123.3879 53.3351 18.4477 179.4066 61 I 3.8194 7.6218 111.2727 64.3016 38.0606 177.7959 62 Q 3.9487 8.0530 122.0944 59.1102 28.9072 178.3927 63 N 4.1184 8.0971 116.7035 56.4901 38.7014 176.6871 64 I 3.6651 8.1523 121.5356 64.5461 37.2627 178.4426 65 R 3.8632 8.1684 119.0137 59.4132 30.0594 178.2216 66 L 3.9334 7.9793 118.3698 58.0970 41.5137 179.2291 67 R 3.8877 7.8486 117.9818 59.7920 29.9122 177.9023 68 H 4.0788 8.0840 117.4316 59.3415 29.8933 176.8053 69 E 3.9383 8.7183 120.6281 59.8105 29.3941 179.0417 70 N 4.2074 8.6678 116.4830 56.3557 38.4875 177.3405 71 K 3.9013 7.7040 120.7292 59.5537 32.1083 178.6965 72 D 4.2653 7.9747 119.0405 57.2955 40.7764 178.4507 73 L 3.9775 8.4659 119.8755 57.9277 41.7070 179.4492 74 K 3.8291 8.0829 118.9174 59.6740 31.8399 178.6194 75 A 3.9857 7.9732 120.0418 55.1184 18.6543 179.4168 76 R 3.9830 9.7092 116.8768 58.9382 30.0050 177.4856 77 L 3.9550 8.9548 119.7089 54.4969 40.8837 180.8796 78 E 3.6643 6.6397 123.0332 58.9628 32.5607 177.1914 79 N 4.9226 9.1168 115.7613 53.2110 38.4319 177.5435 80 A 4.3108 7.3158 121.1793 52.3463 17.8272 179.0299 *82 E 4.2685 8.2932 121.2458 58.0690 31.8922 179.0486 83 V 3.7189 8.0518 111.8070 64.1533 31.8336 178.0024 84 A 4.2151 8.0571 119.1209 53.4827 18.2206 179.2993 85 G 3.6984 7.9426 103.1848 47.8833 0.0000 176.5083 86 R 4.0383 7.8512 121.2619 59.0639 30.1652 179.0963 87 D 4.7046 8.1307 117.7003 57.2394 40.7483 177.6400 88 F 4.0010 8.4289 121.6267 60.7834 39.2305 176.5859 89 K 3.9523 8.3499 116.1287 59.7992 32.1970 178.9883 90 R 3.8832 8.4775 118.7488 60.0947 29.7934 177.5885 91 A 3.8803 8.1568 120.4061 55.1013 17.7760 178.7965 92 E 3.6568 8.6057 117.0056 59.3003 29.6251 179.3297 93 E 3.9184 8.8124 120.0593 59.2435 28.9811 178.7379 94 L 3.9114 8.0336 118.8864 57.8378 41.7528 178.8610 95 E 4.3057 8.2924 119.3932 59.7309 29.3949 178.9193 96 K 3.8744 7.7838 116.7383 59.4519 32.0252 178.8340 97 A 4.0671 8.1022 120.7580 55.8975 18.2827 178.9334 98 K 3.9245 9.8672 118.3014 59.3613 32.0089 178.8809 99 Q 3.5707 8.7996 117.5726 58.9864 29.2146 180.0473 100 A 4.2596 8.5451 123.1903 55.0554 19.1148 179.3999 101 L 4.0545 7.8343 117.3594 57.8208 41.8836 179.0150 102 E 3.8566 8.5631 119.6174 59.7806 29.3894 178.7602 103 D 4.3778 9.1760 118.8604 56.8118 40.9865 176.5584 104 Q 4.4452 8.1343 118.8223 56.4896 29.9644 176.4566 105 R 4.4086 7.6928 119.6431 56.6209 31.7547 176.7464 106 K 3.7638 8.0633 119.0106 59.7160 31.8856 177.4536 107 D 4.4282 7.7137 118.0072 57.6665 41.1035 178.0230 108 L 4.3770 7.6338 116.3016 55.4915 41.8218 178.7287 109 E 4.0373 8.4590 120.3130 60.8460 29.5450 178.5379 110 T 3.6078 7.7170 112.4324 67.2180 68.4716 175.7101 111 K 3.6497 8.2905 120.7597 60.1175 32.4810 178.9178 112 L 3.8938 7.6488 119.0220 57.7712 42.0951 178.3770 113 K 3.7678 9.2584 120.4244 60.7427 31.9004 178.6883 114 E 3.7272 8.6660 117.3461 59.7319 29.6925 179.0139 115 L 3.9312 8.4779 120.2501 58.1266 42.1022 179.1846 116 Q 3.8034 8.7589 119.1971 59.2372 29.1210 179.6684 117 Q 3.9723 8.2470 120.4248 59.4152 29.1215 177.8131 118 D 4.4595 8.5641 119.6019 56.6103 40.7159 177.5562 119 Y 4.1864 7.8032 119.8625 59.9266 39.1955 176.6432 120 D 4.6832 8.6569 119.5835 57.5490 41.4114 178.8551 121 L 4.0394 10.6654 119.9872 58.2157 42.0269 178.4826 122 A 3.8821 8.0559 120.3605 57.0826 18.2620 180.2941 123 K 4.1834 8.2230 115.1879 58.3977 33.0267 177.2491 124 E 3.9088 8.6218 119.0931 59.4195 29.9456 178.9681 125 S 4.1545 8.1551 112.5014 61.9036 62.2141 176.0568 126 T 3.8044 8.6099 115.7012 65.6982 66.8885 175.1809 127 S 4.0142 8.1834 114.4474 61.6662 62.1555 175.6741 128 W 4.3097 8.8503 130.5188 60.8688 30.3807 178.0818 129 D 4.0449 8.3939 118.3159 57.2938 40.3745 178.3676 130 R 3.7924 8.1010 119.4262 59.7859 30.0631 178.0460 131 Q 3.8765 9.3919 117.3612 59.2487 28.8220 179.1081 132 R 3.4973 8.0376 120.2686 59.0519 29.9315 178.3375 133 L 3.7657 8.4480 120.9758 58.1993 42.1561 178.3596 134 E 3.9515 8.1235 119.1707 59.3067 29.3665 179.0776 135 K 3.8577 7.7179 117.9590 59.4188 32.1814 178.8997 136 E 3.8831 7.8898 118.5045 59.6966 29.2435 179.2866 137 L 4.0569 8.0191 117.6567 58.9077 41.9504 178.6869 138 E 3.9883 8.5756 118.7813 57.2780 29.0731 179.4973 139 E 3.8060 8.3360 118.9776 59.5337 29.8609 179.8632 140 K 3.9405 8.2718 118.7227 59.3223 32.4961 178.6802 141 K 4.1066 8.5060 119.3652 59.6712 31.9188 178.4292 142 E 3.9129 8.1989 118.9743 58.9858 29.4518 177.9780 143 A 4.1187 8.6087 120.7983 53.8076 18.9345 178.6455 144 L 4.2483 7.8758 118.2793 57.0683 42.3982 178.4091 145 E 3.9294 8.0462 118.4020 60.1210 29.4973 179.2771 146 L 3.9213 8.1862 117.7331 57.5831 41.6976 179.3138 147 A 3.9307 7.7478 119.7189 55.3934 18.2340 179.5428 148 I 3.6143 8.0915 118.5743 64.7837 37.0635 178.5117 149 D 4.2941 8.2789 119.2657 56.8347 40.8442 177.3137 150 Q 4.0619 9.2304 121.9833 57.2432 28.5464 178.1390 151 A 3.5591 8.8266 117.7957 54.0631 18.9116 180.7786 152 S 3.6242 7.9821 109.8636 60.7598 64.0883 176.2833 153 R 3.8661 8.4231 123.3063 58.7430 29.7187 177.8236 154 D 4.4166 8.0897 117.2894 57.8267 41.0254 178.3927 155 Y 4.0207 9.7509 119.3507 61.4514 38.6908 178.2978 156 H 4.4116 8.8057 117.1205 58.6541 28.6260 177.8044 157 R 3.8266 8.5279 120.9542 59.2190 30.0038 177.9853 158 A 4.1484 8.2934 120.9593 55.7556 18.0803 179.5285 159 T 3.6234 8.0120 113.8498 66.9584 68.6717 176.7381 160 A 3.9789 8.2065 122.5873 54.8360 18.3066 179.3878 161 L 3.8576 8.8165 120.2847 58.3452 42.0914 178.6020 162 E 3.9563 8.5858 119.6443 59.3996 29.2451 178.7507 163 K 3.9122 7.6933 119.4654 59.1092 32.3030 178.0462 164 E 4.5116 8.0044 120.6061 58.6577 29.4861 178.5839 165 L 4.0179 8.2476 120.3267 58.5422 42.2511 178.7384 166 E 4.0368 8.4427 119.1753 59.0385 29.5986 178.6192 167 E 3.9226 9.0251 119.9861 59.3814 29.6285 179.0562 168 K 3.8925 8.7191 120.3354 59.4703 32.1627 178.6766 169 K 3.8991 8.3801 119.1327 59.3585 31.9976 179.1944 170 K 3.8515 7.8753 118.9134 59.4126 32.1904 178.2843 171 A 3.9236 7.6995 120.6840 55.5346 18.2618 179.0278 172 L 3.8231 7.9664 118.2819 58.6093 41.9817 178.9091 173 E 3.8663 8.0379 118.6846 59.4855 29.7314 178.9147 174 L 4.1648 8.0098 118.7118 57.3945 41.5768 179.4763 175 A 3.9401 8.6438 121.3068 55.3270 17.9107 179.5834 176 I 3.6790 8.2207 117.1656 64.6774 38.0659 176.4967 177 D 4.3918 9.1005 120.3864 56.0338 40.7011 178.5484 178 Q 3.4943 8.8289 120.6285 58.9345 30.3239 180.2889 179 A 3.8276 8.2998 120.2675 54.9908 18.8295 179.6232 180 S 4.1669 8.0289 112.3138 61.3059 63.1275 176.0938 181 Q 4.2367 7.8935 120.7697 57.7724 28.9699 176.7379 182 D 4.7382 8.0561 118.8658 56.6817 41.8008 177.3941 183 Y 4.0675 7.6808 120.1892 60.7732 38.5648 177.8051 184 N 4.2960 8.1893 116.1911 54.5072 38.0505 176.9657 185 R 3.8474 8.0618 121.4418 59.2053 29.8832 178.2192 186 A 3.9010 7.4300 120.3069 55.2023 18.4160 179.4187 187 N 4.2833 7.9546 114.4288 56.4298 38.4993 177.2102 188 V 3.5160 7.7609 118.6047 66.5987 31.5749 177.7780 189 L 4.1130 7.9316 117.3891 57.8194 41.6561 179.1241 190 E 4.0566 8.8278 118.4557 58.7967 29.4642 178.3415 191 K 3.9796 8.1918 118.5413 58.1444 31.9450 176.8435 192 E 4.1311 8.6113 125.8941 57.2305 29.3190 177.0925 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 55 A 8.26 4.26 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 56 A 8.23 4.50 1.29 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 0.00 0.00 0.00 57 N 8.63 4.72 0.00 2.73 2.80 0.00 0.00 7.14 8.00 0.00 0.00 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 N 8.48 4.70 0.00 2.71 2.74 0.00 0.00 6.77 8.02 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 59 P 0.00 4.41 0.00 2.26 2.25 0.00 3.72 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 2.05 2.02 0.00 60 A 8.29 4.92 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.62 3.82 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 1.52 1.01 0.91 0.00 0.00 62 Q 8.05 3.95 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 63 N 8.10 4.12 0.00 2.98 2.87 0.00 0.00 7.10 7.22 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 64 I 8.15 3.67 1.90 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 1.65 1.30 0.91 0.00 0.00 65 R 8.17 3.86 0.00 1.85 2.04 0.00 3.28 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 1.70 1.82 0.00 66 L 7.98 3.93 0.00 1.73 1.73 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 67 R 7.85 3.89 0.00 2.13 1.96 0.00 3.10 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 68 H 8.08 4.08 0.00 3.33 3.41 0.00 5.85 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 69 E 8.72 3.94 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 2.36 2.58 0.00 70 N 8.67 4.21 0.00 2.81 2.88 0.00 0.00 6.72 7.25 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 71 K 7.70 3.90 0.00 1.71 1.82 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.45 7.81 72 D 7.97 4.27 0.00 2.82 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.47 3.98 0.00 1.67 1.72 0.92 1.04 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 74 K 8.08 3.83 0.00 1.82 2.03 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 75 A 7.97 3.99 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.71 3.98 0.00 2.15 1.93 0.00 3.09 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 77 L 8.95 3.96 0.00 1.93 1.46 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 78 E 6.64 3.66 0.00 2.19 2.36 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 2.28 2.47 0.00 79 N 9.12 4.92 0.00 2.87 3.04 0.00 0.00 6.44 6.93 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 80 A 7.32 4.31 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 *82 E 8.29 4.27 0.00 2.20 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 2.29 2.46 0.00 83 V 8.05 3.72 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 0.68 0.00 0.00 1.00 0.00 0.00 84 A 8.06 4.22 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.94 3.70 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 0.00 0.00 0.00 86 R 7.85 4.04 0.00 1.92 2.01 0.00 3.15 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 87 D 8.13 4.70 0.00 2.81 2.74 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 0.00 0.00 0.00 88 F 8.43 4.00 0.00 3.32 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 89 K 8.35 3.95 0.00 1.94 1.95 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.74 1.68 7.81 90 R 8.48 3.88 0.00 1.87 2.10 0.00 3.26 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 1.63 1.83 0.00 91 A 8.16 3.88 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 92 E 8.61 3.66 0.00 1.76 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 2.28 2.27 0.00 93 E 8.81 3.92 0.00 2.21 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 2.31 2.39 0.00 94 L 8.03 3.91 0.00 1.89 1.67 0.99 0.66 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 95 E 8.29 4.31 0.00 1.95 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 2.28 2.35 0.00 96 K 7.78 3.87 0.00 2.13 1.81 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.60 7.81 97 A 8.10 4.07 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 98 K 9.87 3.92 0.00 1.89 1.90 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.43 7.81 99 Q 8.80 3.57 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.31 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 100 A 8.55 4.26 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.83 4.05 0.00 1.64 1.71 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.56 3.86 0.00 2.15 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 2.31 2.36 0.00 103 D 9.18 4.38 0.00 3.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.13 4.45 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.51 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 105 R 7.69 4.41 0.00 1.84 2.10 0.00 3.17 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 106 K 8.06 3.76 0.00 1.85 1.99 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.52 7.81 107 D 7.71 4.43 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.63 4.38 0.00 1.77 1.67 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.46 4.04 0.00 2.18 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 2.45 0.00 110 T 7.72 3.61 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 1.21 0.00 0.00 111 K 8.29 3.65 0.00 1.74 1.89 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.47 1.67 7.81 112 L 7.65 3.89 0.00 1.88 1.90 0.90 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 113 K 9.26 3.77 0.00 1.75 2.02 0.00 1.72 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 1.45 1.51 7.81 114 E 8.67 3.73 0.00 2.13 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 2.46 2.52 0.00 115 L 8.48 3.93 0.00 2.00 1.74 0.94 0.79 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 0.00 116 Q 8.76 3.80 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 117 Q 8.25 3.97 0.00 2.33 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 118 D 8.56 4.46 0.00 2.95 2.74 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 0.00 0.00 0.00 119 Y 7.80 4.19 0.00 3.09 3.10 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 0.00 120 D 8.66 4.68 0.00 2.94 2.82 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 0.00 0.00 0.00 121 L 10.67 4.04 0.00 1.91 1.76 0.91 1.27 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 0.00 122 A 8.06 3.88 1.20 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 0.00 0.00 123 K 8.22 4.18 0.00 1.68 2.17 0.00 1.53 0.00 0.00 1.63 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.57 7.81 124 E 8.62 3.91 0.00 2.13 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 2.34 2.36 0.00 125 S 8.16 4.15 0.00 3.92 4.05 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 0.00 0.00 0.00 126 T 8.61 3.80 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 1.26 0.00 0.00 127 S 8.18 4.01 0.00 3.96 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 0.00 128 W 8.85 4.31 0.00 3.37 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.39 4.04 0.00 2.87 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 0.00 130 R 8.10 3.79 0.00 1.87 2.23 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 131 Q 9.39 3.88 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.66 2.55 0.00 132 R 8.04 3.50 0.00 0.67 1.26 0.00 2.84 0.00 0.00 2.63 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.33 0.00 133 L 8.45 3.77 0.00 1.63 1.74 0.87 -0.07 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 0.00 134 E 8.12 3.95 0.00 2.17 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 2.27 2.37 0.00 135 K 7.72 3.86 0.00 1.96 1.76 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.36 7.81 136 E 7.89 3.88 0.00 2.05 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 2.27 2.46 0.00 137 L 8.02 4.06 0.00 1.77 1.73 0.94 0.92 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 0.00 138 E 8.58 3.99 0.00 2.21 1.78 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 2.30 2.37 0.00 139 E 8.34 3.81 0.00 2.01 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 2.35 2.42 0.00 140 K 8.27 3.94 0.00 1.67 1.96 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.47 7.81 141 K 8.51 4.11 0.00 1.87 1.82 0.00 1.86 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.75 7.81 142 E 8.20 3.91 0.00 2.02 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 2.37 2.37 0.00 143 A 8.61 4.12 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 0.00 144 L 7.88 4.25 0.00 1.90 1.69 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.05 3.93 0.00 2.12 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 2.33 2.38 0.00 146 L 8.19 3.92 0.00 1.72 1.67 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.75 3.93 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 0.00 148 I 8.09 3.61 2.06 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 1.76 1.07 0.88 0.00 0.00 149 D 8.28 4.29 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 9.23 4.06 0.00 2.13 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 151 A 8.83 3.56 1.26 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 0.00 0.00 152 S 7.98 3.62 0.00 3.80 3.96 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 0.00 0.00 0.00 153 R 8.42 3.87 0.00 2.08 2.05 0.00 3.14 0.00 0.00 3.18 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 154 D 8.09 4.42 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 Y 9.75 4.02 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.81 4.41 0.00 3.35 3.36 0.00 5.69 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 0.00 157 R 8.53 3.83 0.00 1.91 2.12 0.00 3.18 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 158 A 8.29 4.15 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 0.00 159 T 8.01 3.62 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 1.15 0.00 0.00 160 A 8.21 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.82 3.86 0.00 1.70 1.83 0.91 0.78 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 0.00 162 E 8.59 3.96 0.00 2.22 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 2.28 2.30 0.00 163 K 7.69 3.91 0.00 1.83 1.88 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.43 7.81 164 E 8.00 4.51 0.00 2.10 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 2.31 2.20 0.00 165 L 8.25 4.02 0.00 1.99 1.78 0.91 0.77 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 0.00 166 E 8.44 4.04 0.00 2.26 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 2.30 2.39 0.00 167 E 9.03 3.92 0.00 2.15 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 2.32 2.43 0.00 168 K 8.72 3.89 0.00 1.89 2.01 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.53 7.81 169 K 8.38 3.90 0.00 1.94 1.84 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.65 1.59 7.81 170 K 7.88 3.85 0.00 1.85 1.91 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.45 7.81 171 A 7.70 3.92 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 0.00 172 L 7.97 3.82 0.00 2.02 1.93 0.92 0.72 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 0.00 173 E 8.04 3.87 0.00 2.10 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 0.00 2.30 2.34 0.00 174 L 8.01 4.16 0.00 1.75 1.70 0.92 0.86 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 0.00 175 A 8.64 3.94 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 0.00 176 I 8.22 3.68 2.02 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 1.39 1.18 0.95 0.00 0.00 177 D 9.10 4.39 0.00 2.87 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 0.00 178 Q 8.83 3.49 0.00 2.11 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.43 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 179 A 8.30 3.83 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 0.00 180 S 8.03 4.17 0.00 4.23 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 0.00 181 Q 7.89 4.24 0.00 2.13 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 182 D 8.06 4.74 0.00 3.01 2.69 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 0.00 183 Y 7.68 4.07 0.00 3.03 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 0.00 184 N 8.19 4.30 0.00 3.07 3.15 0.00 0.00 5.89 7.66 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 0.00 185 R 8.06 3.85 0.00 1.91 2.17 0.00 3.09 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 186 A 7.43 3.90 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 0.00 187 N 7.95 4.28 0.00 2.87 2.85 0.00 0.00 6.65 7.68 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 0.00 188 V 7.76 3.52 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 0.82 0.00 0.00 0.99 0.00 0.00 189 L 7.93 4.11 0.00 1.74 1.69 0.91 0.89 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 0.00 190 E 8.83 4.06 0.00 1.90 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 2.30 2.61 0.00 191 K 8.19 3.98 0.00 1.86 1.64 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.75 1.55 7.81 192 E 8.61 4.13 0.00 1.93 1.87 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 2.31 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.