NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 34 T 4.3447 8.0327 117.3792 63.6898 70.8936 175.6277 35 L 3.7606 7.9341 122.3469 57.3366 41.9139 175.2982 36 E 4.0870 9.0130 120.1420 59.4746 30.1041 177.9614 37 D 4.3983 8.0707 118.4553 57.5513 41.0151 178.3583 38 D 4.3921 8.4811 119.7138 57.1951 40.7245 178.8691 39 L 4.1191 8.2327 119.8082 57.4909 41.6482 178.6018 40 N 4.3542 8.6155 117.5350 57.2060 38.8964 176.7971 41 E 4.0000 8.3127 119.5786 59.4432 29.4923 179.4855 42 T 3.6194 7.9829 115.8569 66.7254 68.5321 176.3946 43 N 4.6143 8.6764 118.6627 56.2895 38.5982 177.5245 44 K 3.9454 8.2367 119.9420 59.7164 32.2797 178.5549 45 Y 3.9762 8.0457 119.5486 60.9835 38.6784 177.9212 46 Y 4.2567 7.9750 117.5264 60.9136 37.8954 178.0569 47 L 4.0310 8.4225 121.6402 58.6866 42.0305 178.9370 48 T 3.8031 8.0265 114.6555 66.6790 68.5049 174.8405 49 N 4.5453 7.7551 115.0891 52.2256 38.7679 174.8305 50 Q 3.4188 7.8795 116.7274 57.0602 27.0385 175.0557 51 I 4.0467 8.3049 118.9358 63.5940 38.1191 176.4051 52 A 4.6159 7.3837 117.7487 51.2379 22.2228 176.6940 53 V 4.3322 8.8274 120.1732 60.7991 32.5685 173.2238 54 I 5.2283 8.1675 125.1000 59.4018 40.2140 174.3590 55 H 5.0790 8.9587 122.7842 53.6106 33.1770 172.6239 56 K 3.7092 8.5844 122.8894 55.7580 32.6442 176.8336 57 K 4.1342 8.8115 127.8312 55.5049 32.6674 175.5115 58 P 4.2620 0.0000 0.0000 62.6363 31.9414 176.4292 59 T 4.0107 8.0341 111.8729 60.6845 69.2394 172.6698 60 P 4.3639 0.0000 0.0000 62.6424 32.7498 175.3682 61 V 4.5271 7.9931 122.5442 61.1546 34.5909 174.3502 62 Q 4.4191 9.4214 130.2507 54.8881 29.6318 175.1719 63 I 4.3096 8.3253 129.8766 61.5657 38.6118 176.5499 *76 I 3.9003 8.0199 120.3302 59.8599 36.6041 177.0095 77 K 4.5271 8.4849 128.9326 54.4055 31.6071 176.3196 78 E 4.4812 7.4898 123.8347 55.4049 30.1012 179.5110 79 A 4.4229 7.8725 127.9911 52.0715 22.1595 175.2121 80 Y 4.8506 8.7862 120.3592 56.1537 42.0936 174.9055 81 F 4.7822 9.6091 124.4906 57.4645 39.4695 174.9383 82 K 4.8408 8.2901 122.8880 54.9550 34.8084 175.9494 83 Q 4.3658 8.5324 120.5568 55.1602 29.9286 175.9173 84 S 4.4145 8.3203 115.5114 58.3522 64.0453 173.6541 85 S 4.7210 8.4396 116.3060 58.7816 62.5587 173.8435 86 T 4.4463 7.2758 113.7879 60.0864 70.3258 173.3566 87 T 4.4064 7.9105 115.0399 61.5159 69.7413 174.3195 88 D 4.3724 9.0833 121.8560 56.0884 42.1380 175.9414 89 Y 4.8770 7.6852 116.7396 55.8847 41.3129 174.6141 90 N 5.5928 7.5084 119.8033 51.9635 41.6142 174.0074 91 G 4.1955 6.9962 103.4448 46.1499 0.0000 170.8811 92 I 5.1260 7.6804 119.6092 59.4097 41.3379 174.9687 93 Y 4.8259 8.7400 126.7653 57.2136 41.7575 175.1923 94 K 3.6478 9.3084 128.2349 57.4436 29.5084 176.0603 95 G 4.0052 8.1024 103.8848 45.6714 0.0000 173.1838 96 R 4.7986 7.8419 118.8420 54.5818 33.3176 174.6728 97 Y 4.8915 8.5951 123.0405 57.2406 40.3155 173.9858 98 I 5.0673 8.3911 127.6834 59.7263 40.7066 174.2940 99 D 5.0298 8.6964 124.8066 53.1130 45.0414 173.8901 100 F 5.2657 8.7465 119.4868 56.4504 41.4934 172.4947 101 E 5.1524 8.6640 119.9499 54.5030 32.9604 174.1781 102 A 5.3685 8.7110 124.4626 50.2407 22.1616 175.6254 103 K 4.6869 9.3273 121.2136 54.5134 36.6978 174.9010 104 E 5.0894 8.9714 124.9801 54.7389 31.3534 174.5874 105 T 4.7129 8.6779 122.2679 59.9701 69.5322 173.7394 106 K 4.4337 8.6104 126.4207 56.6158 33.1170 176.2322 107 N 4.5529 7.9930 118.4306 54.1783 39.2593 174.8721 108 K 4.6696 8.6780 122.0842 57.1621 33.7955 176.8972 109 T 4.4829 9.2495 115.1554 64.5731 70.5814 174.3885 110 S 5.3853 8.5304 111.9341 56.5659 66.9930 172.5308 111 F 4.9625 10.6733 121.8020 55.4561 41.0679 172.8251 112 P 4.3961 0.0000 0.0000 62.8322 31.9632 177.0178 113 L 4.2348 7.9698 122.6703 56.1165 41.9357 179.4133 114 Q 4.2256 7.7813 117.2899 57.4052 28.1699 182.6562 115 N 4.3648 7.2631 112.3815 55.4962 38.6851 175.1062 116 F 5.2458 7.6626 116.4953 55.7202 41.3110 175.4098 117 H 4.8453 8.8774 124.1515 55.5195 31.9682 175.9065 118 D 4.3646 8.2006 124.4207 57.7770 40.6440 178.8084 119 H 4.1477 7.9227 116.2060 58.9318 28.7709 177.6284 120 Q 3.9903 8.0772 119.2721 58.9557 28.6329 178.6629 121 I 3.4315 7.1446 120.5095 64.3932 37.0965 178.0230 122 E 3.7540 8.1487 120.0758 59.4081 29.3383 178.1369 123 H 4.0542 8.3159 118.2759 59.6943 29.8118 176.9835 124 M 4.0821 8.1431 120.2311 58.4342 31.8158 178.8912 125 K 3.9100 7.9761 118.4557 59.5231 32.1824 179.3579 126 Q 3.9444 7.9906 118.2258 58.8891 28.5486 179.1033 127 V 3.5077 7.8677 119.2534 65.7745 31.5837 177.7520 128 K 3.9243 8.3697 119.2684 59.7990 31.9015 178.4948 129 A 4.2240 8.2819 119.6771 55.0435 18.2510 178.6053 130 Q 4.2257 7.8016 114.1130 55.5596 28.9569 175.4829 131 D 4.4949 8.4060 119.2619 55.4630 38.4938 174.3861 132 G 4.1573 8.2686 105.8852 45.7269 0.0000 174.1606 133 I 4.2956 8.3912 121.2056 59.7791 38.5781 174.8687 134 C 5.7902 8.5642 126.7967 56.8499 35.7369 172.6119 135 F 4.7833 7.4937 118.0235 56.7013 40.6395 172.3725 136 V 4.8412 8.3876 110.9342 59.7168 35.7213 175.0689 137 I 4.8526 8.7413 124.8743 59.7371 39.4893 174.5798 138 I 4.6322 9.0637 128.3176 59.5412 40.0309 174.7249 139 S 4.8613 9.2065 123.3940 57.2300 62.9494 172.4468 140 A 4.7067 8.7536 127.9489 50.7856 22.9002 175.4227 141 F 4.0760 8.8060 115.7285 59.8383 36.1439 175.2738 142 D 4.4755 8.5728 114.2473 55.1103 38.8810 173.3372 143 Q 4.4950 8.0505 117.0193 54.0041 32.8603 173.8889 144 V 4.7635 7.6243 117.4999 61.3909 34.4842 173.5854 145 Y 5.3589 9.3253 125.6116 56.2250 41.6308 174.6224 146 F 4.9403 9.8468 126.5811 57.0164 40.8867 174.2995 147 L 5.1123 8.7498 130.5331 53.0991 43.7100 175.3841 148 E 4.4283 9.3656 125.8893 57.0059 30.2520 178.6587 149 A 3.5602 8.8011 126.1316 55.3993 19.0885 179.9289 150 D 4.3620 7.8125 115.4185 57.7648 40.4104 179.7108 151 K 4.1653 7.9083 118.3637 59.2985 32.2670 179.2179 152 L 4.4095 7.9605 120.7550 58.0596 41.9476 179.0414 153 F 4.7145 8.2431 118.2477 60.7006 38.7440 176.5221 154 Y 4.1069 7.8237 117.9605 61.2244 38.3131 178.5701 155 F 4.1327 7.7336 116.5019 60.0895 39.1706 177.3757 156 W 4.2873 8.7125 128.3012 60.6128 30.4144 177.6501 157 D 4.6238 9.1395 120.6175 56.7633 40.6060 178.5430 158 R 4.2828 7.8130 120.7411 58.5401 28.9036 183.1892 159 K 4.2882 7.4770 119.8802 58.0968 34.3818 176.5500 160 E 4.5537 7.2746 115.7484 55.7426 29.9618 175.9608 161 K 4.6920 8.0253 122.6004 57.7838 40.3500 176.1336 162 N 4.8613 7.1670 112.6968 51.1922 37.4024 179.5144 163 G 4.1111 8.3506 108.6311 47.4795 0.0000 172.4924 164 R 4.7602 8.4980 124.8855 55.4486 29.9768 174.8809 165 K 4.7893 8.7895 115.2561 56.2932 36.2914 173.6004 166 S 5.0231 8.4834 119.2594 57.1347 67.4900 172.9048 167 I 4.4642 9.0270 121.9192 59.5941 39.5007 175.2107 168 R 4.8673 7.9096 122.1589 54.8236 31.8687 177.0942 169 K 3.9170 8.8297 127.1187 60.0308 32.6639 178.8301 170 D 4.4976 8.1160 123.6361 58.7981 39.6848 180.7280 171 E 4.2913 8.7481 119.6327 60.9755 29.6972 181.7358 172 L 4.0689 7.8176 123.5291 58.7218 42.1454 179.3801 173 E 3.8902 8.3482 116.9315 60.8892 29.5733 180.0760 174 E 4.3396 7.9623 117.3844 58.5499 29.8769 177.6601 175 T 4.3187 7.4963 108.1368 61.4283 70.1643 174.5684 176 A 4.8388 7.9141 122.7758 50.9860 21.2450 175.9610 177 Y 4.7655 9.0899 117.4449 55.4612 40.2236 174.0793 178 P 4.7654 0.0000 0.0000 63.0014 32.2317 175.6658 179 I 4.3676 8.3997 125.2129 59.8129 38.9881 175.8201 180 S 4.1913 8.6041 122.6886 58.8933 63.6048 173.3616 181 L 4.7500 8.5326 125.4448 54.5216 43.1259 176.5694 182 G 3.9577 8.5797 108.4429 46.2765 0.0000 172.6929 183 Y 3.9242 8.8245 119.9496 59.6331 39.0210 176.4684 184 A 3.7293 7.3041 125.8393 49.8425 20.6568 173.9568 185 P 3.8121 0.0000 0.0000 62.5486 32.5975 177.1540 186 R 4.4017 8.2200 118.4130 58.5114 30.0606 176.7783 187 I 4.4966 7.3087 121.5826 59.2870 38.4135 176.3155 188 D 4.6724 8.3859 129.9055 53.5192 37.5375 176.0299 189 Y 4.3161 7.6492 121.5368 59.9344 38.7120 178.1330 190 I 3.1713 6.8933 121.4124 63.7551 36.9085 178.1813 191 S 3.9311 7.4334 112.8354 61.4068 62.2420 176.3007 192 I 3.2546 7.3604 121.8742 64.0859 36.6396 178.1623 193 I 3.7663 7.4150 120.5838 64.4958 36.9809 177.9671 194 E 4.1439 8.2795 119.6116 59.7801 29.1149 179.6260 195 Q 3.9100 7.5571 116.0394 59.0672 28.8953 178.6857 196 L 3.8147 7.4855 118.3243 57.0733 41.7774 177.6669 197 Y 4.6102 8.2181 112.9986 57.7114 39.4706 175.9395 198 F 4.6629 8.1666 116.2255 58.9493 41.5649 176.4256 199 S 4.7829 7.9331 113.3772 57.2199 65.6878 173.1671 200 P 4.3819 0.0000 0.0000 62.7950 31.0457 177.3372 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 34 T 8.03 4.34 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 35 L 7.93 3.76 0.00 1.85 1.70 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 36 E 9.01 4.09 0.00 2.16 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 2.48 2.54 0.00 37 D 8.07 4.40 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 38 D 8.48 4.39 0.00 2.88 2.70 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 39 L 8.23 4.12 0.00 2.02 1.80 0.74 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 40 N 8.62 4.35 0.00 2.90 3.11 0.00 0.00 7.23 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 41 E 8.31 4.00 0.00 1.97 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 0.00 2.50 2.45 0.00 42 T 7.98 3.62 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 43 N 8.68 4.61 0.00 2.98 3.22 0.00 0.00 7.10 7.28 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 44 K 8.24 3.95 0.00 1.98 1.90 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.51 1.66 7.81 45 Y 8.05 3.98 0.00 2.99 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 46 Y 7.97 4.26 0.00 3.23 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 47 L 8.42 4.03 0.00 1.87 1.86 0.98 0.81 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 48 T 8.03 3.80 4.11 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 0.00 0.00 1.17 0.00 0.00 49 N 7.76 4.55 0.00 2.42 2.63 0.00 0.00 7.21 7.31 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 50 Q 7.88 3.42 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.65 6.88 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 51 I 8.30 4.05 1.98 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.67 0.79 0.00 0.00 52 A 7.38 4.62 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.83 4.33 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 1.09 0.00 0.00 0.98 0.00 0.00 54 I 8.17 5.23 2.18 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.94 1.25 0.00 0.00 55 H 8.96 5.08 0.00 3.11 3.14 0.00 5.81 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 56 K 8.58 3.71 0.00 1.19 1.50 0.00 1.53 0.00 0.00 1.56 0.00 0.00 2.55 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.07 0.77 7.81 57 K 8.81 4.13 0.00 1.46 1.61 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.31 7.81 58 P 0.00 4.26 0.00 1.95 1.90 0.00 3.59 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 1.96 2.01 0.00 59 T 8.03 4.01 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 1.14 0.00 0.00 60 P 0.00 4.36 0.00 2.17 1.95 0.00 3.45 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.02 0.00 61 V 7.99 4.53 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 0.69 0.00 0.00 0.49 0.00 0.00 62 Q 9.42 4.42 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.65 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 63 I 8.33 4.31 1.88 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 1.17 0.63 0.93 0.00 0.00 *76 I 8.02 3.90 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 1.30 0.63 0.91 0.00 0.00 77 K 8.48 4.53 0.00 1.97 1.77 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.03 7.81 78 E 7.49 4.48 0.00 1.83 1.12 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 2.15 2.13 0.00 79 A 7.87 4.42 1.15 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 80 Y 8.79 4.85 0.00 2.95 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 81 F 9.61 4.78 0.00 2.79 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 82 K 8.29 4.84 0.00 1.78 1.81 0.00 1.59 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.34 7.81 83 Q 8.53 4.37 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.10 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 84 S 8.32 4.41 0.00 3.97 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 85 S 8.44 4.72 0.00 3.89 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 86 T 7.28 4.45 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 1.10 0.00 0.00 87 T 7.91 4.41 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 1.21 0.00 0.00 88 D 9.08 4.37 0.00 2.66 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 0.00 0.00 0.00 0.00 89 Y 7.69 4.88 0.00 1.43 1.56 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 90 N 7.51 5.59 0.00 2.36 2.87 0.00 0.00 6.63 7.03 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 91 G 7.00 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 0.00 0.00 0.00 92 I 7.68 5.13 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.75 0.98 0.00 0.00 93 Y 8.74 4.83 0.00 2.95 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 94 K 9.31 3.65 0.00 0.87 1.55 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.48 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.89 0.27 7.81 95 G 8.10 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 0.00 0.00 0.00 96 R 7.84 4.80 0.00 2.01 1.97 0.00 3.32 0.00 0.00 3.01 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 97 Y 8.60 4.89 0.00 3.15 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 98 I 8.39 5.07 1.98 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.04 1.29 0.00 0.00 99 D 8.70 5.03 0.00 2.56 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 0.00 100 F 8.75 5.27 0.00 2.17 1.45 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.66 5.15 0.00 2.10 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 0.00 2.63 2.71 0.00 102 A 8.71 5.37 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 0.00 103 K 9.33 4.69 0.00 1.77 1.78 0.00 1.53 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.48 0.92 7.81 104 E 8.97 5.09 0.00 1.97 1.84 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 2.32 2.22 0.00 105 T 8.68 4.71 4.36 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 1.33 0.00 0.00 106 K 8.61 4.43 0.00 1.93 1.90 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.43 7.81 107 N 7.99 4.55 0.00 2.78 3.05 0.00 0.00 7.00 6.84 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 0.00 108 K 8.68 4.67 0.00 1.82 1.88 0.00 1.86 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.61 7.81 109 T 9.25 4.48 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 1.19 0.00 0.00 110 S 8.53 5.39 0.00 3.95 3.88 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 0.00 111 F 10.67 4.96 0.00 3.05 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 0.00 112 P 0.00 4.40 0.00 2.03 2.03 0.00 3.50 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 1.72 1.85 0.00 113 L 7.97 4.23 0.00 2.01 1.97 1.12 1.34 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 Q 7.78 4.23 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 7.11 0.00 0.00 0.00 0.00 0.00 2.28 1.96 0.00 115 N 7.26 4.36 0.00 2.09 2.43 0.00 0.00 6.79 7.33 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 0.00 116 F 7.66 5.25 0.00 3.08 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 0.00 117 H 8.88 4.85 0.00 3.26 3.23 0.00 5.59 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 0.00 118 D 8.20 4.36 0.00 2.76 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 0.00 119 H 7.92 4.15 0.00 3.36 3.41 0.00 5.82 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 0.00 120 Q 8.08 3.99 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.89 0.00 0.00 0.00 0.00 0.00 2.65 2.53 0.00 121 I 7.14 3.43 1.43 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.36 0.33 0.00 0.00 122 E 8.15 3.75 0.00 1.98 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 2.30 0.00 123 H 8.32 4.05 0.00 3.40 3.47 0.00 5.65 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 0.00 124 M 8.14 4.08 0.00 2.33 2.46 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.59 0.00 125 K 7.98 3.91 0.00 1.73 1.63 0.00 1.47 0.00 0.00 1.31 0.00 0.00 2.34 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.34 0.28 7.81 126 Q 7.99 3.94 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 127 V 7.87 3.51 2.25 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 1.29 0.00 0.00 0.89 0.00 0.00 128 K 8.37 3.92 0.00 2.13 2.24 0.00 1.70 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.70 1.66 7.81 129 A 8.28 4.22 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 0.00 130 Q 7.80 4.23 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.56 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 131 D 8.41 4.49 0.00 2.81 2.83 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 0.00 132 G 8.27 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 I 8.39 4.30 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.94 0.57 0.00 0.00 134 C 8.56 5.79 0.00 3.01 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 0.00 135 F 7.49 4.78 0.00 2.66 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 0.00 136 V 8.39 4.84 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 0.39 0.00 0.00 0.99 0.00 0.00 137 I 8.74 4.85 1.80 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.49 0.88 0.00 0.00 138 I 9.06 4.63 1.80 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.89 0.46 0.00 0.00 139 S 9.21 4.86 0.00 3.82 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.75 4.71 0.39 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 0.00 141 F 8.81 4.08 0.00 3.43 3.14 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 0.00 142 D 8.57 4.48 0.00 2.85 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 0.00 143 Q 8.05 4.49 0.00 1.90 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.76 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 144 V 7.62 4.76 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 1.07 0.00 0.00 0.85 0.00 0.00 145 Y 9.33 5.36 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 0.00 146 F 9.85 4.94 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 0.00 147 L 8.75 5.11 0.00 1.86 1.57 1.11 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 148 E 9.37 4.43 0.00 2.13 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 2.74 2.76 0.00 149 A 8.80 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 D 7.81 4.36 0.00 2.82 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 0.00 151 K 7.91 4.17 0.00 2.14 2.08 0.00 1.62 0.00 0.00 2.00 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.57 7.81 152 L 7.96 4.41 0.00 1.82 1.63 1.17 0.53 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 0.00 153 F 8.24 4.71 0.00 3.28 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 0.00 154 Y 7.82 4.11 0.00 3.08 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 0.00 155 F 7.73 4.13 0.00 3.35 3.19 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 0.00 156 W 8.71 4.29 0.00 3.77 3.40 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 0.00 157 D 9.14 4.62 0.00 2.84 2.70 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 0.00 158 R 7.81 4.28 0.00 1.81 1.89 0.00 3.20 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 159 K 7.48 4.29 0.00 1.39 1.59 0.00 1.41 0.00 0.00 1.27 0.00 0.00 2.50 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.15 1.19 7.81 160 E 7.27 4.55 0.00 1.98 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 2.29 2.38 0.00 161 K 8.03 4.69 0.00 1.91 1.83 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 0.98 7.81 162 N 7.17 4.86 0.00 2.75 1.95 0.00 0.00 6.46 7.51 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 0.00 163 G 8.35 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 164 R 8.50 4.76 0.00 1.82 1.16 0.00 3.27 0.00 0.00 3.15 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 0.00 165 K 8.79 4.79 0.00 1.75 1.57 0.00 1.68 0.00 0.00 1.93 0.00 0.00 3.21 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.53 7.81 166 S 8.48 5.02 0.00 3.74 3.74 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 0.00 167 I 9.03 4.46 1.91 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 0.87 1.05 0.32 0.00 0.00 168 R 7.91 4.87 0.00 1.84 2.02 0.00 3.00 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 169 K 8.83 3.92 0.00 1.01 1.48 0.00 1.34 0.00 0.00 1.09 0.00 0.00 2.13 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.21 1.31 7.81 170 D 8.12 4.50 0.00 2.72 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 0.00 171 E 8.75 4.29 0.00 1.92 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 2.24 2.19 0.00 172 L 7.82 4.07 0.00 1.62 1.66 0.72 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 173 E 8.35 3.89 0.00 2.05 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 2.26 2.20 0.00 174 E 7.96 4.34 0.00 2.22 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 2.28 2.45 0.00 175 T 7.50 4.32 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 1.30 0.00 0.00 176 A 7.91 4.84 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 0.00 177 Y 9.09 4.77 0.00 2.87 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 0.00 178 P 0.00 4.77 0.00 2.07 2.10 0.00 3.88 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 179 I 8.40 4.37 1.88 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.86 0.98 0.00 0.00 180 S 8.60 4.19 0.00 3.74 3.78 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 0.00 0.00 0.00 181 L 8.53 4.75 0.00 1.49 1.55 0.88 0.88 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 0.00 182 G 8.58 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 0.00 183 Y 8.82 3.92 0.00 2.92 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 0.00 184 A 7.30 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 P 0.00 3.81 0.00 1.73 1.30 0.00 3.48 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.84 0.00 186 R 8.22 4.40 0.00 1.92 1.92 0.00 3.34 0.00 0.00 3.21 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.40 0.00 187 I 7.31 4.50 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 1.17 0.60 1.00 0.00 0.00 188 D 8.39 4.67 0.00 2.71 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 0.00 189 Y 7.65 4.32 0.00 3.29 3.19 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 0.00 190 I 6.89 3.17 1.11 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.11 -0.36 0.07 0.00 0.00 191 S 7.43 3.93 0.00 4.03 3.90 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 0.00 0.00 0.00 0.00 192 I 7.36 3.25 0.83 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.75 -0.58 0.00 0.00 193 I 7.42 3.77 1.80 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.86 1.15 0.00 0.00 194 E 8.28 4.14 0.00 2.15 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 2.34 2.50 0.00 195 Q 7.56 3.91 0.00 1.77 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.97 0.00 0.00 0.00 0.00 0.00 2.45 2.20 0.00 196 L 7.49 3.81 0.00 1.00 0.80 0.19 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 197 Y 8.22 4.61 0.00 2.90 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 0.00 198 F 8.17 4.66 0.00 3.31 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 0.00 199 S 7.93 4.78 0.00 3.90 3.79 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 0.00 200 P 0.00 4.38 0.00 2.14 2.09 0.00 3.79 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 * Residues marked with a * may have inaccurate shift predictions.