NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4288 8.3231 115.5484 57.9572 64.5450 172.8705 3 G 3.8875 8.8047 108.4461 45.0442 0.0000 171.7094 4 K 4.8332 8.8909 119.8992 54.1259 36.3581 173.3548 5 L 4.7992 9.1609 125.7448 53.6174 44.2916 174.9631 6 T 4.8658 7.9708 123.1712 61.6654 71.1506 173.4825 7 V 4.7098 8.5566 126.2124 61.1700 34.4942 174.0031 8 I 4.9277 8.9730 129.5430 60.2339 39.0120 174.8932 9 T 5.2623 8.6358 120.8996 60.5253 71.4761 173.3204 10 G 4.1535 8.2954 109.7552 44.3746 0.0000 169.7039 11 P 4.6485 0.0000 0.0000 61.4837 32.3999 175.4178 12 M 3.7705 8.1069 117.3671 56.9506 32.0211 176.3255 13 Y 3.9629 7.8579 116.9156 59.4660 35.4014 170.6954 14 S 4.7359 7.7141 112.6102 58.0559 63.6165 174.4292 15 G 3.9475 8.2234 108.9772 46.9263 0.0000 176.0482 16 K 4.0984 8.0947 122.0007 58.8396 32.0311 179.2301 17 T 3.9849 7.8583 110.2214 65.0101 69.1484 176.8967 18 T 3.8719 7.9015 112.5979 64.1612 68.5411 175.8328 19 E 3.8827 8.4494 122.4794 59.0423 29.8086 178.7992 20 L 4.5776 8.0334 119.2067 58.5014 40.5387 179.1068 21 L 3.9118 7.9660 120.4882 57.3154 41.3176 178.6745 22 S 3.9119 7.8296 113.3358 61.6757 61.5852 176.5593 23 F 4.2571 7.4584 118.4657 60.2217 38.7880 177.7556 24 V 2.3528 7.3345 117.9119 65.8905 31.0236 177.7159 25 E 3.8736 8.0444 118.5685 59.2973 29.5035 178.7210 26 I 3.7231 7.5347 119.7452 64.6947 37.0734 178.0239 27 Y 4.0142 8.0012 116.7802 60.7177 37.6869 178.3104 28 K 4.0018 8.2576 119.5164 59.5261 31.9830 179.2928 29 L 4.0815 8.1473 118.5477 57.5686 41.5644 178.9370 30 G 3.8254 7.6053 102.3677 43.6746 0.0000 173.2258 31 K 3.8747 8.0006 120.2568 57.2903 31.1505 174.9985 32 K 4.7322 8.1509 115.5439 54.1400 34.3531 176.3991 33 K 4.3887 8.6030 124.8184 56.2891 33.4349 175.9352 34 V 5.2806 8.5039 118.9484 59.5508 35.8675 174.5983 35 A 4.6194 9.0649 124.0983 50.1463 21.8754 175.1671 36 V 4.8222 7.9114 122.1109 61.1071 34.4415 174.3871 37 F 5.7016 9.3497 125.5885 55.8012 43.4323 173.8425 38 K 5.2409 9.2329 120.3739 54.1843 36.6561 173.9980 39 P 4.9317 0.0000 0.0000 62.4251 31.5901 176.1674 *60 A 3.9612 7.9503 121.2804 53.3139 19.4809 176.7228 61 H 4.4621 8.4225 121.0464 55.6137 30.4560 175.3848 62 V 4.8961 8.3827 116.1721 60.1221 32.3788 175.1040 63 I 4.6589 8.8339 119.2266 59.5238 40.6061 176.3628 64 E 4.3044 9.1877 121.6307 57.8424 30.6521 177.0645 65 R 4.8562 7.8755 117.0974 53.4650 32.8411 175.5334 66 P 3.9306 0.0000 0.0000 65.6478 31.4332 178.1156 67 E 4.1745 7.9969 115.2040 57.8548 29.7615 177.1724 68 E 4.3286 8.1197 118.4893 57.5559 30.3022 178.5812 69 M 3.8208 8.0058 119.3624 58.3287 32.4680 178.8767 70 R 3.7788 7.9105 118.9051 59.2847 30.5445 177.9222 71 K 3.8238 7.4548 116.7765 58.6938 32.0984 176.6802 72 Y 4.6172 8.1108 113.5436 57.4855 39.0073 175.1666 73 I 4.4785 7.8405 121.8931 59.6212 38.7069 174.9456 74 E 4.7771 8.8188 124.8691 53.8680 32.2787 176.8660 75 E 3.9572 8.7538 117.5432 58.9400 29.6520 177.4412 76 D 4.7987 7.9192 116.8332 53.0552 39.7164 175.9971 77 T 4.2612 8.0103 117.8083 64.3773 68.4043 174.4893 78 R 4.6323 9.3025 125.8608 56.3656 32.4324 176.4086 79 G 4.0740 8.0525 105.9808 44.3794 0.0000 171.6696 80 V 5.0334 8.5710 123.9846 60.8288 34.7153 174.1459 81 F 5.4049 9.5940 126.2613 55.8162 42.4319 174.0592 82 I 5.1745 9.2906 124.5839 59.7443 40.4572 174.5647 83 D 5.1257 9.2332 126.9207 52.3400 43.6864 175.0403 84 E 3.7473 8.6478 117.6626 57.0179 27.4984 177.3694 85 V 3.9469 7.9601 119.6554 65.7245 32.0643 177.6209 86 Q 3.7130 7.6338 116.9444 58.8657 27.9602 177.4781 87 F 4.6533 7.4113 114.8357 58.1920 39.3490 175.7400 88 F 4.7520 7.6075 119.3863 56.1594 40.0786 175.1386 89 N 4.5834 8.6819 121.4508 52.9392 39.4330 174.2033 90 P 4.4752 0.0000 0.0000 64.4484 31.4337 178.3951 91 S 4.2868 8.2664 113.4351 60.5090 62.8980 175.9127 92 L 3.8637 8.1299 124.8039 57.8444 41.7137 178.1839 93 F 4.0607 7.9711 121.0886 61.7351 39.2127 177.0476 94 E 4.0025 8.1854 117.0710 58.4931 29.2653 179.2546 95 V 3.4470 7.5996 118.1618 65.9946 31.7091 178.1208 96 V 3.4245 7.9924 118.3817 65.6576 31.3290 177.6378 97 K 3.5999 7.7273 119.4198 59.6690 31.7748 178.1856 98 D 4.2667 7.9321 118.0660 57.1894 41.0758 178.2284 99 L 3.9417 7.5471 119.4711 57.6324 41.6004 179.3755 100 L 4.0323 7.8411 118.8728 58.0695 41.3735 179.4435 101 D 4.5270 7.8256 117.2662 56.8850 40.7681 178.0798 102 R 4.3499 7.5248 116.2898 55.9669 30.3037 177.1920 103 G 3.8871 7.9265 106.8177 45.2625 0.0000 172.8924 104 I 4.3817 7.6903 121.1927 59.6852 38.9735 175.0029 105 D 4.6248 8.5096 127.4457 54.0549 42.3530 175.5341 106 V 4.5660 8.0296 122.1087 60.9231 34.8978 174.0341 107 F 5.1285 9.0252 126.2949 55.7833 42.2086 173.8905 108 C 5.5028 9.1660 120.7725 57.8327 31.7158 172.7726 109 A 5.2391 8.9414 125.4670 50.3719 21.6646 175.4875 110 G 4.2145 8.4867 107.4607 45.3283 0.0000 172.4017 111 L 4.7866 9.0950 121.0429 53.9363 41.9710 177.4828 112 D 4.7051 8.8603 122.1634 55.1399 41.0647 176.3798 113 L 5.1863 7.8055 116.5208 52.5095 45.5726 176.1322 114 T 4.2162 8.3999 112.4595 60.7430 69.6894 175.3902 115 H 5.2891 8.6656 116.3788 57.5088 28.3607 176.1127 116 K 4.4221 7.7763 117.8347 55.7274 32.0979 176.0000 117 Q 3.4735 8.1730 117.1164 57.1152 26.7374 173.1860 118 N 4.8752 7.6540 113.8963 50.6852 40.7179 173.2830 119 P 4.6935 0.0000 0.0000 62.4332 32.2777 176.3324 120 F 4.3554 8.7594 121.7255 56.8486 39.6448 175.8864 121 E 3.9078 9.2802 126.8457 60.0030 29.4881 179.0027 122 T 3.9228 7.9855 114.8729 67.0566 68.5689 176.6460 123 T 3.9143 7.9673 116.9327 66.5172 68.5959 176.5062 124 A 4.0315 8.1008 122.8322 55.0609 18.2567 179.7342 125 L 3.8846 8.1304 117.6406 57.9666 41.5784 179.7558 126 L 4.1989 8.0250 118.4496 57.4374 41.2741 179.5560 127 L 4.0384 7.7611 118.7314 57.8093 41.6516 179.1022 128 S 4.2681 7.8044 113.7713 61.3771 62.8337 175.9810 129 L 4.2217 7.6595 121.3227 55.7055 42.3723 176.9651 130 A 4.0885 6.9083 121.2755 52.4628 18.8879 177.0979 131 D 4.5957 8.6964 121.4392 56.8055 41.9866 177.4902 132 T 4.6291 7.6059 114.3424 61.7105 72.8651 173.0404 133 V 4.7737 8.5435 125.8944 61.1610 33.8720 174.4869 134 I 4.4441 9.0651 129.2223 59.6535 39.2518 174.8645 135 K 4.8732 8.7075 127.6110 55.2333 32.8934 176.4500 136 K 4.5956 9.5443 126.5122 55.1812 34.0556 176.2081 137 K 4.8810 8.6401 121.9502 54.8085 35.0498 175.2136 138 A 4.9058 8.5199 124.2962 49.9260 22.5792 175.7754 139 V 4.3530 8.3529 119.1423 62.8446 32.4574 175.2970 140 C 4.4355 9.3557 129.5860 59.7093 31.6941 173.9037 141 H 4.1187 9.5163 127.6095 58.8411 29.7942 176.1496 142 R 4.2432 8.0676 118.5720 58.2782 30.3697 176.6671 143 C 4.3447 8.0718 109.7407 58.0923 30.4931 174.4836 144 G 3.9632 8.2472 109.2215 45.1278 0.0000 173.4868 145 E 4.2999 7.7458 118.9533 55.9134 31.3763 175.5894 146 Y 4.9405 8.4449 124.1018 55.7544 36.7723 174.7668 147 N 4.5971 7.8315 113.1886 52.8745 40.7819 174.6938 148 A 4.5518 8.3209 124.1873 52.3850 19.0996 178.4013 149 T 4.5130 8.8140 111.4370 61.1983 70.8117 173.7059 150 L 4.9780 8.2299 121.8364 53.2626 46.2022 175.2144 151 T 5.1992 8.4950 116.2014 61.9068 71.6710 173.1906 152 L 5.1742 9.3224 127.0413 53.1396 45.9000 174.8795 153 K 4.5994 8.7497 126.7865 55.7289 33.0381 175.9140 154 V 4.6004 8.8934 119.6645 58.7650 36.4987 174.7523 155 A 4.0418 8.6719 123.7664 52.2488 17.6939 177.9205 156 G 4.0316 8.5489 111.2763 45.3528 0.0000 176.0418 157 G 3.7107 8.1873 110.7992 47.1203 0.0000 174.1784 158 E 4.9004 7.2353 118.1962 54.9788 34.0793 175.4663 159 E 4.2095 7.9733 123.9875 55.9600 34.0314 175.7606 *167 E 4.4237 8.7188 116.2385 55.8025 30.6381 174.5860 168 K 4.6183 9.2475 122.1009 55.4454 36.8606 174.2941 169 Y 5.3540 8.5871 118.4208 56.4716 39.8147 175.2887 170 I 4.9960 9.1355 116.6534 59.1213 41.8318 173.8326 171 A 5.2839 8.7841 124.9531 51.0757 20.9099 176.5870 172 V 4.9313 8.8941 114.9486 59.4585 36.7932 175.3003 173 C 4.6214 8.6131 117.5924 57.5204 31.0153 174.8449 174 R 3.8614 8.6112 119.1573 59.7039 29.7332 177.6804 175 D 4.4484 8.2372 118.2207 58.0795 40.7549 178.8727 176 C 4.2503 8.1045 116.2696 62.5367 28.2317 175.1098 177 Y 3.9788 8.4786 121.8011 61.1035 38.1390 178.3233 178 N 4.5485 8.3755 115.7385 56.3706 38.6441 177.4975 179 T 4.0485 7.6715 116.3066 66.6792 68.7361 176.5016 180 L 4.3013 8.2081 121.8575 56.7482 41.8900 177.8234 *181 K 4.2218 7.9355 124.3943 54.5090 32.7600 179.8435 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 2 S 8.32 4.43 0.00 3.98 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 3 G 8.80 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.89 4.83 0.00 1.58 1.53 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 1.27 7.81 5 L 9.16 4.80 0.00 1.48 1.34 0.74 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 6 T 7.97 4.87 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 1.02 0.00 0.00 7 V 8.56 4.71 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 0.98 0.00 0.00 0.93 0.00 0.00 8 I 8.97 4.93 1.97 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.85 1.01 0.00 0.00 9 T 8.64 5.26 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 10 G 8.30 4.15 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 0.00 0.00 0.00 11 P 0.00 4.65 0.00 2.28 2.19 0.00 3.88 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 12 M 8.11 3.77 0.00 0.78 1.67 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.16 0.00 13 Y 7.86 3.96 0.00 3.24 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 14 S 7.71 4.74 0.00 4.27 4.01 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 15 G 8.22 3.95 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 0.00 0.00 0.00 16 K 8.09 4.10 0.00 1.82 1.90 0.00 1.67 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.51 7.81 17 T 7.86 3.98 4.26 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 1.32 0.00 0.00 18 T 7.90 3.87 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 1.22 0.00 0.00 19 E 8.45 3.88 0.00 2.22 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 0.00 2.53 2.59 0.00 20 L 8.03 4.58 0.00 2.27 2.14 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.97 3.91 0.00 1.85 1.66 0.89 0.63 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 22 S 7.83 3.91 0.00 3.67 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 23 F 7.46 4.26 0.00 3.12 2.33 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 24 V 7.33 2.35 1.71 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 0.59 0.00 0.00 0.11 0.00 0.00 25 E 8.04 3.87 0.00 2.00 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 2.26 2.30 0.00 26 I 7.53 3.72 2.21 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.86 0.92 0.00 0.00 27 Y 8.00 4.01 0.00 3.16 3.13 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 28 K 8.26 4.00 0.00 1.75 1.83 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.55 7.81 29 L 8.15 4.08 0.00 1.82 1.73 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.61 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 0.00 0.00 0.00 31 K 8.00 3.87 0.00 1.89 1.89 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.40 7.81 32 K 8.15 4.73 0.00 1.95 1.88 0.00 1.81 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.49 7.81 33 K 8.60 4.39 0.00 1.94 1.91 0.00 1.59 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.77 1.61 7.81 34 V 8.50 5.28 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 1.02 0.00 0.00 0.86 0.00 0.00 35 A 9.06 4.62 1.19 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 36 V 7.91 4.82 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 1.04 0.00 0.00 0.77 0.00 0.00 37 F 9.35 5.70 0.00 2.96 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 38 K 9.23 5.24 0.00 1.84 1.93 0.00 1.33 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.42 7.81 39 P 0.00 4.93 0.00 1.90 1.20 0.00 3.14 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.46 0.00 *60 A 7.95 3.96 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 61 H 8.42 4.46 0.00 2.75 2.64 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 62 V 8.38 4.90 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 0.73 0.00 0.00 0.96 0.00 0.00 63 I 8.83 4.66 2.10 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 1.08 0.00 0.00 64 E 9.19 4.30 0.00 2.25 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 2.31 0.00 65 R 7.88 4.86 0.00 2.08 1.83 0.00 3.17 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 66 P 0.00 3.93 0.00 2.08 1.88 0.00 3.62 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 2.11 2.01 0.00 67 E 8.00 4.17 0.00 1.95 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 2.29 2.30 0.00 68 E 8.12 4.33 0.00 2.29 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 2.32 0.00 69 M 8.01 3.82 0.00 1.34 1.76 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.19 0.00 70 R 7.91 3.78 0.00 1.86 2.07 0.00 3.22 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 71 K 7.45 3.82 0.00 1.70 1.69 0.00 1.59 0.00 0.00 1.24 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 1.00 7.81 72 Y 8.11 4.62 0.00 3.33 2.89 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 0.00 0.00 0.00 73 I 7.84 4.48 1.96 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 1.54 1.01 0.98 0.00 0.00 74 E 8.82 4.78 0.00 2.07 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 2.24 2.27 0.00 75 E 8.75 3.96 0.00 2.09 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 2.29 2.32 0.00 76 D 7.92 4.80 0.00 2.83 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 77 T 8.01 4.26 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 1.31 0.00 0.00 78 R 9.30 4.63 0.00 1.96 2.19 0.00 3.21 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 79 G 8.05 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 80 V 8.57 5.03 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 1.11 0.00 0.00 1.02 0.00 0.00 81 F 9.59 5.40 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 82 I 9.29 5.17 1.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.86 0.99 0.00 0.00 83 D 9.23 5.13 0.00 2.77 2.64 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 84 E 8.65 3.75 0.00 2.22 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 2.27 2.27 0.00 85 V 7.96 3.95 2.17 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 0.98 0.00 0.00 1.04 0.00 0.00 86 Q 7.63 3.71 0.00 0.93 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 87 F 7.41 4.65 0.00 2.76 2.80 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 88 F 7.61 4.75 0.00 3.23 2.89 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 0.00 0.00 0.00 89 N 8.68 4.58 0.00 2.81 2.76 0.00 0.00 6.96 7.71 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 90 P 0.00 4.48 0.00 2.21 2.09 0.00 3.70 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 2.24 2.20 0.00 91 S 8.27 4.29 0.00 4.08 4.26 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 92 L 8.13 3.86 0.00 1.83 1.73 0.59 0.61 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 93 F 7.97 4.06 0.00 3.09 3.13 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 94 E 8.19 4.00 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 2.51 2.53 0.00 95 V 7.60 3.45 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 0.86 0.00 0.00 0.87 0.00 0.00 96 V 7.99 3.42 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 0.76 0.00 0.00 0.81 0.00 0.00 97 K 7.73 3.60 0.00 1.41 1.56 0.00 1.59 0.00 0.00 1.37 0.00 0.00 2.48 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.29 7.81 98 D 7.93 4.27 0.00 2.78 2.80 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 99 L 7.55 3.94 0.00 1.73 1.62 0.83 0.96 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 0.00 100 L 7.84 4.03 0.00 1.77 1.61 0.75 0.75 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 0.00 101 D 7.83 4.53 0.00 2.76 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 0.00 102 R 7.52 4.35 0.00 1.86 1.94 0.00 3.15 0.00 0.00 3.48 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 103 G 7.93 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 104 I 7.69 4.38 1.97 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 1.40 1.21 0.90 0.00 0.00 105 D 8.51 4.62 0.00 2.68 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 0.00 106 V 8.03 4.57 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 0.82 0.00 0.00 0.77 0.00 0.00 107 F 9.03 5.13 0.00 2.69 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 0.00 108 C 9.17 5.50 0.00 2.81 2.80 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 0.00 109 A 8.94 5.24 1.31 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 0.00 0.00 0.00 110 G 8.49 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 0.00 0.00 0.00 0.00 111 L 9.09 4.79 0.00 1.13 1.64 0.66 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 112 D 8.86 4.71 0.00 2.82 2.93 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 0.00 0.00 0.00 113 L 7.81 5.19 0.00 1.59 1.49 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.40 4.22 3.99 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 0.00 0.00 0.15 0.00 0.00 115 H 8.67 5.29 0.00 3.61 3.79 0.00 5.12 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.78 4.42 0.00 1.67 1.85 0.00 1.87 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.12 7.81 117 Q 8.17 3.47 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.65 6.70 0.00 0.00 0.00 0.00 0.00 2.05 1.89 0.00 118 N 7.65 4.88 0.00 2.60 2.57 0.00 0.00 7.08 7.43 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 0.00 119 P 0.00 4.69 0.00 2.00 1.95 0.00 3.58 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 1.98 2.05 0.00 120 F 8.76 4.36 0.00 3.18 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 0.00 121 E 9.28 3.91 0.00 2.05 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 2.37 2.40 0.00 122 T 7.99 3.92 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 1.34 0.00 0.00 123 T 7.97 3.91 4.41 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 1.25 0.00 0.00 124 A 8.10 4.03 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 0.00 125 L 8.13 3.88 0.00 1.89 1.71 0.76 0.32 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 0.00 126 L 8.02 4.20 0.00 1.89 1.73 0.94 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 127 L 7.76 4.04 0.00 1.82 1.73 0.93 0.92 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 0.00 128 S 7.80 4.27 0.00 4.06 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 0.00 129 L 7.66 4.22 0.00 1.90 1.77 0.47 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 130 A 6.91 4.09 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 0.00 131 D 8.70 4.60 0.00 2.55 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 0.00 132 T 7.61 4.63 4.14 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 0.00 0.00 0.00 1.22 0.00 0.00 133 V 8.54 4.77 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 0.82 0.00 0.00 0.93 0.00 0.00 134 I 9.07 4.44 1.98 0.00 0.00 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 1.34 0.56 1.02 0.00 0.00 135 K 8.71 4.87 0.00 1.65 1.77 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.41 7.81 136 K 9.54 4.60 0.00 1.65 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.62 7.81 137 K 8.64 4.88 0.00 0.99 1.29 0.00 1.33 0.00 0.00 1.52 0.00 0.00 2.38 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.19 1.22 7.81 138 A 8.52 4.91 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 V 8.35 4.35 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 0.82 0.00 0.00 1.05 0.00 0.00 140 C 9.36 4.44 0.00 3.23 2.85 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 0.00 141 H 9.52 4.12 0.00 3.28 3.38 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 8.07 4.24 0.00 1.86 1.96 0.00 3.30 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 143 C 8.07 4.34 0.00 3.13 3.05 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 0.00 144 G 8.25 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 0.00 0.00 0.00 145 E 7.75 4.30 0.00 2.10 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 2.42 2.28 0.00 146 Y 8.44 4.94 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 0.00 147 N 7.83 4.60 0.00 2.66 2.79 0.00 0.00 6.33 7.26 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 0.00 148 A 8.32 4.55 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 0.00 149 T 8.81 4.51 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 1.22 0.00 0.00 150 L 8.23 4.98 0.00 1.72 1.59 0.57 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 151 T 8.49 5.20 4.35 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 1.37 0.00 0.00 152 L 9.32 5.17 0.00 1.69 1.47 0.27 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 153 K 8.75 4.60 0.00 1.60 1.54 0.00 1.42 0.00 0.00 1.53 0.00 0.00 2.65 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.01 0.60 7.81 154 V 8.89 4.60 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 0.67 0.00 0.00 0.86 0.00 0.00 155 A 8.67 4.04 1.19 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 0.00 156 G 8.55 4.03 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 0.00 0.00 0.00 157 G 8.19 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 0.00 158 E 7.24 4.90 0.00 2.08 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 2.22 2.20 0.00 159 E 7.97 4.21 0.00 1.88 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 2.18 2.30 0.00 *167 E 8.72 4.42 0.00 1.78 1.69 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 2.14 2.18 0.00 168 K 9.25 4.62 0.00 1.72 1.80 0.00 1.27 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.34 7.81 169 Y 8.59 5.35 0.00 3.02 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 0.00 170 I 9.14 5.00 1.82 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 1.26 1.17 0.67 0.00 0.00 171 A 8.78 5.28 1.53 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 0.00 0.00 172 V 8.89 4.93 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 0.82 0.00 0.00 1.20 0.00 0.00 173 C 8.61 4.62 0.00 3.12 3.39 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 0.00 174 R 8.61 3.86 0.00 1.87 1.96 0.00 3.18 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 175 D 8.24 4.45 0.00 2.75 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 0.00 176 C 8.10 4.25 0.00 3.04 3.02 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 0.00 177 Y 8.48 3.98 0.00 3.23 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 0.00 178 N 8.38 4.55 0.00 2.94 2.93 0.00 0.00 7.15 7.12 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 0.00 179 T 7.67 4.05 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 1.22 0.00 0.00 180 L 8.21 4.30 0.00 1.49 1.64 0.92 0.76 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 *181 K 7.94 4.22 0.00 1.72 1.49 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.27 1.21 7.81 * Residues marked with a * may have inaccurate shift predictions.