NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 R 4.4343 8.2393 121.1178 56.5512 30.2210 173.1564 12 T 4.4057 8.6951 113.5600 59.3477 71.5363 172.5627 13 Y 4.8798 9.4101 123.5570 56.9668 39.2501 176.6244 14 L 4.6420 9.0082 124.1391 55.6894 43.5157 176.2526 15 Y 4.7994 7.7326 118.0413 56.7081 42.3421 173.4498 16 R 5.1849 7.4367 124.2274 53.4500 32.7461 174.4581 17 G 4.2622 8.2665 116.4050 44.2492 0.0000 171.9452 18 R 4.0026 8.8794 119.2685 58.9759 30.3159 178.5029 19 I 4.4143 7.3358 106.9975 59.8077 38.1966 174.3186 20 L 5.3021 7.0667 118.8574 56.5074 43.3391 173.0079 21 N 5.5249 8.6627 116.5713 51.4699 43.0804 172.9350 22 L 5.1965 9.4113 124.3023 53.5269 44.3376 175.1044 23 A 5.1462 9.3814 127.3971 50.0402 23.4138 174.1489 24 L 5.0040 9.0607 118.5315 53.1258 45.3440 175.8569 25 E 4.5586 9.2820 125.5103 53.4367 30.8572 177.1481 26 G 4.0619 8.7806 119.6968 46.3611 0.0000 172.9692 27 R 4.2661 8.5813 120.9176 55.6295 30.0289 175.2474 28 Y 4.4454 7.6847 118.3766 57.3339 38.8104 173.9920 29 E 4.9019 8.8333 124.5662 55.4240 30.9232 175.6573 30 I 4.8470 8.9535 125.7189 59.4378 41.1474 174.6761 31 V 4.8933 8.9623 127.4956 61.2705 33.2301 174.5347 32 E 4.7565 8.9923 128.7791 56.6119 30.7559 175.6397 33 H 5.3159 9.4782 122.9515 54.3478 33.2530 173.3089 34 K 4.2323 8.5941 123.9588 56.0602 32.9019 174.9765 35 P 4.7187 0.0000 0.0000 62.7651 33.0652 174.7958 36 A 5.2183 9.2868 122.4036 50.5932 23.4819 175.1830 37 V 5.1809 8.7651 110.7049 59.9740 36.3795 175.1147 38 A 5.1245 9.0182 122.9884 50.5679 22.9934 175.3144 39 V 4.7469 8.7321 121.6410 61.1828 33.9603 174.8492 40 I 4.3445 8.9748 129.4453 60.0451 38.9373 174.7974 41 A 5.1232 8.3284 127.8426 50.0815 22.4202 174.3539 42 L 5.3214 8.7306 123.6064 53.2121 45.0238 175.8324 43 R 4.4508 9.2540 125.3693 56.2366 33.0096 174.6810 44 E 3.7798 9.8461 125.6974 57.5480 26.7738 175.8803 45 G 4.0167 8.2972 105.1620 45.5957 0.0000 173.4962 46 R 4.7193 7.8541 119.3371 54.7439 32.7529 175.0271 47 M 4.7989 9.0729 122.8709 54.1049 34.6183 175.1286 48 L 3.6213 7.9678 127.5553 54.0764 41.7456 175.8538 49 F 4.9628 8.5734 125.0207 55.9761 42.1011 175.2067 50 V 5.0370 8.8388 112.5437 60.0798 36.2977 175.0102 51 R 5.1689 8.9706 121.1365 54.9121 34.2918 174.2681 52 Q 4.8621 8.2831 117.8750 55.0074 31.9650 173.0126 53 M 4.2679 8.7174 121.5477 55.9945 33.2702 175.6979 54 R 4.4702 8.6011 125.3482 53.8343 30.3101 174.6952 55 P 4.2005 0.0000 0.0000 65.4792 31.6486 179.0679 56 A 4.2329 8.1056 119.6721 54.3450 18.3754 178.1260 57 V 4.2370 7.1080 103.6715 60.2905 33.1920 176.3908 58 G 3.9151 9.0450 107.8500 45.6082 0.0000 172.7961 59 L 4.4205 7.4002 118.3873 54.8953 44.0264 173.5384 60 A 4.8578 8.6782 121.1768 48.7168 19.4038 174.6858 61 P 4.5738 0.0000 0.0000 62.9992 33.3914 175.7772 62 L 4.3258 9.0731 123.6372 54.9294 43.1056 175.4552 63 E 5.5517 9.1415 125.9240 54.6074 33.9714 174.3474 64 I 4.9027 7.7972 111.5357 58.2686 40.9835 173.7685 65 P 4.5056 0.0000 0.0000 63.7194 31.9270 175.3287 66 A 4.9644 8.3189 124.7022 50.9485 23.0163 174.7643 67 G 4.4077 8.0494 105.3329 46.2494 0.0000 172.5302 68 L 4.9381 8.4937 119.7419 53.9539 42.8991 177.1582 69 I 4.0237 8.1100 123.7798 61.2793 37.7802 176.0507 70 E 4.5209 9.3691 127.0675 54.3698 31.3530 174.4296 71 P 4.3451 0.0000 0.0000 64.5229 31.5151 177.0246 72 G 3.8811 8.8717 108.8709 45.4868 0.0000 172.5163 73 E 4.6958 7.8450 120.3205 54.3359 31.6337 175.3217 74 D 4.8479 8.6855 125.0452 50.9420 42.9863 175.7485 75 P 4.2065 0.0000 0.0000 65.8991 31.2299 178.5732 76 L 3.0914 7.9263 118.2057 58.0362 42.0293 178.7528 77 E 3.8631 8.6533 118.4711 59.1954 29.2733 179.1825 78 A 4.1390 8.0343 120.6996 54.9602 18.4077 179.4813 79 A 3.7409 7.8743 119.5556 55.1127 18.3312 179.8004 80 R 3.6666 7.6439 117.1221 59.4932 30.1852 178.6528 81 R 3.8074 7.9312 118.3708 59.6227 30.1580 178.3290 82 E 3.9941 8.3863 118.6297 59.2213 29.3874 179.1345 83 L 3.8834 7.8986 120.2505 57.9616 42.0879 179.0028 84 A 4.2139 7.8300 122.0317 54.7948 18.1723 179.5601 85 E 3.9025 8.5422 116.2091 59.3610 29.6059 178.8903 86 E 4.3113 8.3151 117.7543 57.7547 29.4386 177.1910 87 T 4.4350 7.6995 106.0700 59.9335 70.3328 174.9206 88 G 3.7957 8.4887 110.7521 46.4154 0.0000 172.9120 89 L 5.4900 7.2153 115.5629 52.6210 45.4564 175.5753 90 S 4.6555 8.8080 114.3478 57.3417 66.9879 173.1307 91 G 4.3811 8.1286 106.2956 46.1090 0.0000 171.8202 92 D 4.8458 8.8135 120.6108 53.4268 41.7883 176.1864 93 L 5.2785 8.4944 123.7732 53.6042 43.8941 176.3001 94 T 4.7642 8.8651 118.8029 61.6826 72.4184 172.8242 95 Y 3.3974 8.8723 127.8044 57.9132 39.0553 174.1507 96 L 3.9301 6.8216 126.1366 54.3107 42.9910 176.6326 97 F 4.3955 5.4600 110.4435 56.4369 40.7823 171.4795 98 S 5.4056 8.7557 112.8191 57.3054 66.3507 172.6414 99 Y 4.8106 8.0859 116.6935 55.9692 41.4583 173.4597 100 F 4.7516 8.7657 120.3010 56.5451 39.4252 176.3393 101 V 4.0345 8.3264 118.1236 64.8651 31.9068 176.7915 102 S 4.7787 7.4651 109.2527 56.8936 62.5526 173.6829 103 P 4.5234 0.0000 0.0000 63.4316 31.4374 179.2277 104 G 3.7434 8.0163 107.6183 47.5649 0.0000 174.0524 105 F 5.0298 7.7573 111.6976 56.8511 42.0371 173.9253 106 T 5.0635 7.5571 114.7486 59.0771 70.1264 172.9594 107 D 4.9585 8.3718 123.5735 53.0078 40.7410 175.7875 108 E 4.0173 7.9596 122.0649 56.9480 30.7279 175.4255 109 K 4.5958 8.6753 127.5482 54.7022 35.5722 174.3001 110 T 4.8457 8.1081 123.9154 62.0049 71.3351 172.7459 111 H 5.1158 9.3201 124.2560 54.3029 30.8458 173.9398 112 V 4.8562 8.6388 124.4496 61.4159 33.4462 174.6850 113 F 5.0278 9.2740 125.6198 55.4787 43.2573 173.4766 114 L 5.0732 8.8629 122.6026 53.2846 44.4251 174.8340 115 A 5.2401 9.0018 127.7770 50.3002 21.2930 175.1969 116 E 4.6642 8.8217 120.5145 53.8702 34.4504 175.0701 117 N 4.2097 8.6301 115.2787 54.4872 36.0204 175.1918 118 L 4.5380 7.6868 116.1722 55.1041 43.0484 178.6423 119 K 4.6886 9.0798 121.3638 54.5870 36.8249 175.0428 120 E 4.7044 8.8824 124.9225 55.8302 29.6282 176.2331 121 V 4.2999 8.7116 120.1672 61.2445 33.2672 175.9902 122 E 4.6542 7.8608 118.2479 54.1016 32.6975 175.7732 123 A 3.9539 8.6861 125.8216 54.7389 18.7576 178.1383 *130 A 4.3039 7.8378 117.1517 51.2107 20.4949 176.0902 131 I 4.5752 7.6386 115.7153 59.3002 39.8499 174.5133 132 E 4.4592 9.3885 131.2917 55.0366 31.1650 174.8714 133 V 4.0102 8.3826 127.4275 62.4638 32.6795 175.6693 134 V 4.3919 8.8314 128.8346 60.6417 32.7024 173.0333 135 W 5.0325 8.6645 125.7580 56.3825 29.9850 175.2366 136 M 4.9808 9.4579 123.7995 54.0965 36.0247 174.2682 137 R 4.5474 8.7034 124.0012 55.1560 31.0875 176.0089 138 P 4.4975 0.0000 0.0000 65.8967 31.2323 178.7600 139 E 4.1455 8.1589 116.9982 59.3680 29.3215 178.7839 140 E 4.0079 8.3606 119.2943 58.9341 29.7225 178.6669 141 A 3.8589 7.8976 120.5391 54.9675 18.4642 179.1660 142 L 4.1703 8.3341 119.0740 58.2414 42.2116 178.7965 143 E 3.9167 8.1992 119.1585 59.4711 29.5665 178.9001 144 R 3.8780 8.1675 118.3085 59.5611 30.0299 178.5562 145 H 4.2698 8.0436 119.1674 58.8738 29.6031 177.4080 146 Q 3.9515 8.1179 118.7950 58.6357 28.6026 178.1640 147 R 4.2456 7.7880 116.8079 56.0101 30.3512 177.2931 148 G 3.8016 7.7744 107.1009 45.9517 0.0000 174.4886 149 E 4.0905 8.3474 123.1700 57.9654 29.9621 177.0829 150 V 4.5158 7.1592 116.0616 60.0050 35.3043 174.4036 151 E 4.7254 8.5526 120.5784 55.0383 32.3344 174.7371 152 F 5.7278 8.6048 119.6615 56.0253 42.0417 175.3732 153 S 4.8063 8.6761 116.0578 56.9042 65.3409 175.0821 154 A 4.0084 8.7467 122.0841 55.5383 18.0499 180.0256 155 T 4.0223 8.0888 108.0371 64.9004 68.9041 176.9056 156 G 3.7695 8.3452 108.6385 47.4919 0.0000 175.5021 157 L 3.0417 7.6968 122.9333 57.4262 42.0048 179.1138 158 V 3.6272 7.9778 118.6039 65.9048 31.4469 178.2112 159 G 3.6907 8.2275 105.4242 47.7950 0.0000 175.8076 160 V 3.8135 7.8270 120.8910 65.8505 31.6001 178.1825 161 L 4.0427 8.2996 119.1307 57.8504 41.3648 178.7703 162 Y 4.1701 8.6171 120.0100 60.8405 38.7351 177.5395 163 Y 4.0778 8.3711 120.3107 61.3013 38.7716 178.0149 164 H 3.8066 8.2271 115.1108 58.2200 28.7551 177.1957 165 A 3.8053 7.3560 121.8937 53.4881 18.7776 177.9230 166 F 4.7410 7.7114 111.8560 56.8964 40.9000 175.5652 167 L 4.6061 7.6564 119.3799 54.5416 41.8110 177.3097 168 R 4.0247 7.4728 117.4743 56.6413 30.6614 176.7113 169 G 3.7470 7.6170 111.6894 46.3310 0.0000 173.2366 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 11 R 8.24 4.43 0.00 1.79 1.93 0.00 3.07 0.00 0.00 3.17 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.36 0.00 12 T 8.70 4.41 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 1.21 0.00 0.00 13 Y 9.41 4.88 0.00 2.92 2.98 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 14 L 9.01 4.64 0.00 1.60 1.80 0.95 0.68 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 15 Y 7.73 4.80 0.00 3.07 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 16 R 7.44 5.18 0.00 1.54 1.59 0.00 3.11 0.00 0.00 3.68 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.42 0.00 17 G 8.27 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 0.00 0.00 0.00 18 R 8.88 4.00 0.00 1.81 1.98 0.00 3.20 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 19 I 7.34 4.41 1.78 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 1.51 0.87 0.91 0.00 0.00 20 L 7.07 5.30 0.00 1.98 1.84 1.21 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.66 5.52 0.00 2.81 3.02 0.00 0.00 6.32 6.74 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 22 L 9.41 5.20 0.00 1.87 1.75 1.01 1.21 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 23 A 9.38 5.15 0.75 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 0.00 0.00 24 L 9.06 5.00 0.00 1.48 1.52 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 25 E 9.28 4.56 0.00 1.96 1.85 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 2.26 2.24 0.00 26 G 8.78 4.06 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 0.00 0.00 0.00 27 R 8.58 4.27 0.00 1.73 1.84 0.00 2.75 0.00 0.00 2.99 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.84 0.00 28 Y 7.68 4.45 0.00 3.26 2.90 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 29 E 8.83 4.90 0.00 1.92 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 2.29 2.35 0.00 30 I 8.95 4.85 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 1.15 0.74 0.91 0.00 0.00 31 V 8.96 4.89 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.25 0.00 0.00 32 E 8.99 4.76 0.00 2.10 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 2.41 2.39 0.00 33 H 9.48 5.32 0.00 3.10 3.07 0.00 5.76 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 34 K 8.59 4.23 0.00 1.65 1.74 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.69 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.45 7.81 35 P 0.00 4.72 0.00 2.09 2.01 0.00 3.55 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 36 A 9.29 5.22 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 37 V 8.77 5.18 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 0.99 0.00 0.00 0.97 0.00 0.00 38 A 9.02 5.12 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.73 4.75 2.04 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 0.79 0.00 0.00 0.93 0.00 0.00 40 I 8.97 4.34 1.80 0.00 0.00 0.65 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 0.37 0.98 0.00 0.00 41 A 8.33 5.12 1.17 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 0.00 0.00 42 L 8.73 5.32 0.00 1.69 1.65 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 43 R 9.25 4.45 0.00 1.85 1.28 0.00 3.24 0.00 0.00 2.78 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.50 0.00 44 E 9.85 3.78 0.00 1.97 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 2.14 2.13 0.00 45 G 8.30 4.02 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 0.00 0.00 0.00 46 R 7.85 4.72 0.00 1.97 2.14 0.00 3.01 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 47 M 9.07 4.80 0.00 1.60 1.66 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.14 0.00 48 L 7.97 3.62 0.00 0.39 1.07 -0.21 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.57 4.96 0.00 3.25 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 50 V 8.84 5.04 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 0.65 0.00 0.00 0.92 0.00 0.00 51 R 8.97 5.17 0.00 1.86 1.76 0.00 3.14 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.57 0.00 52 Q 8.28 4.86 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.10 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 53 M 8.72 4.27 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 54 R 8.60 4.47 0.00 1.96 1.88 0.00 3.40 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 55 P 0.00 4.20 0.00 2.19 2.13 0.00 3.63 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 2.14 2.12 0.00 56 A 8.11 4.23 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.11 4.24 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 0.76 0.00 0.00 1.02 0.00 0.00 58 G 9.05 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 59 L 7.40 4.42 0.00 1.73 1.76 0.95 0.66 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 60 A 8.68 4.86 1.25 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 0.00 0.00 0.00 61 P 0.00 4.57 0.00 2.16 2.11 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.01 0.00 62 L 9.07 4.33 0.00 1.61 1.65 0.77 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.14 5.55 0.00 2.02 1.91 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 2.31 2.48 0.00 64 I 7.80 4.90 1.98 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.53 0.84 0.00 0.00 65 P 0.00 4.51 0.00 2.02 2.00 0.00 3.70 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 1.97 2.00 0.00 66 A 8.32 4.96 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 67 G 8.05 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 0.00 0.00 0.00 0.00 68 L 8.49 4.94 0.00 1.55 1.61 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 69 I 8.11 4.02 1.86 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 1.21 0.59 0.89 0.00 0.00 70 E 9.37 4.52 0.00 1.95 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 2.28 2.38 0.00 71 P 0.00 4.35 0.00 2.15 2.05 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 72 G 8.87 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 0.00 0.00 0.00 73 E 7.85 4.70 0.00 2.00 1.85 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 2.17 2.17 0.00 74 D 8.69 4.85 0.00 2.91 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 75 P 0.00 4.21 0.00 2.31 2.24 0.00 3.53 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.94 0.00 76 L 7.93 3.09 0.00 1.80 1.76 0.78 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.65 3.86 0.00 2.09 1.91 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 2.27 2.42 0.00 78 A 8.03 4.14 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 79 A 7.87 3.74 0.68 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 0.00 0.00 80 R 7.64 3.67 0.00 1.79 2.02 0.00 3.06 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 81 R 7.93 3.81 0.00 1.87 2.00 0.00 3.23 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 82 E 8.39 3.99 0.00 1.95 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 2.45 2.51 0.00 83 L 7.90 3.88 0.00 1.81 1.77 0.86 1.20 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 84 A 7.83 4.21 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 85 E 8.54 3.90 0.00 1.88 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 2.56 0.00 86 E 8.32 4.31 0.00 1.98 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 2.30 2.51 0.00 87 T 7.70 4.43 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 1.08 0.00 0.00 88 G 8.49 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 0.00 0.00 0.00 89 L 7.22 5.49 0.00 1.62 1.59 1.09 0.82 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 90 S 8.81 4.66 0.00 3.81 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 91 G 8.13 4.38 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 0.00 92 D 8.81 4.85 0.00 2.65 2.63 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 0.00 0.00 0.00 0.00 93 L 8.49 5.28 0.00 1.52 1.63 0.71 0.89 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 94 T 8.87 4.76 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 95 Y 8.87 3.40 0.00 2.65 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 96 L 6.82 3.93 0.00 0.27 0.13 -0.29 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 97 F 5.46 4.40 0.00 2.84 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 98 S 8.76 5.41 0.00 3.64 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 99 Y 8.09 4.81 0.00 2.99 2.98 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 0.00 100 F 8.77 4.75 0.00 2.98 2.99 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 0.00 101 V 8.33 4.03 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 0.64 0.00 0.00 0.96 0.00 0.00 102 S 7.47 4.78 0.00 3.94 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.52 0.00 2.10 2.10 0.00 3.98 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 104 G 8.02 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 0.00 0.00 0.00 105 F 7.76 5.03 0.00 3.43 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 7.56 5.06 3.22 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 0.55 0.00 0.00 107 D 8.37 4.96 0.00 2.77 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 0.00 108 E 7.96 4.02 0.00 1.84 1.76 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 2.18 2.34 0.00 109 K 8.68 4.60 0.00 1.54 1.38 0.00 1.18 0.00 0.00 1.56 0.00 0.00 2.48 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.76 0.21 7.81 110 T 8.11 4.85 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 1.14 0.00 0.00 111 H 9.32 5.12 0.00 3.32 3.44 0.00 5.79 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.64 4.86 1.67 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 0.94 0.00 0.00 1.26 0.00 0.00 113 F 9.27 5.03 0.00 2.93 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 0.00 114 L 8.86 5.07 0.00 1.50 1.41 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 115 A 9.00 5.24 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 0.00 116 E 8.82 4.66 0.00 1.91 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 2.26 2.29 0.00 117 N 8.63 4.21 0.00 2.85 2.86 0.00 0.00 6.94 7.85 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 0.00 118 L 7.69 4.54 0.00 1.63 1.71 1.22 0.95 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 0.00 119 K 9.08 4.69 0.00 1.65 1.64 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.53 7.81 120 E 8.88 4.70 0.00 2.02 1.89 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 2.29 2.50 0.00 121 V 8.71 4.30 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 0.76 0.00 0.00 0.97 0.00 0.00 122 E 7.86 4.65 0.00 1.90 1.80 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 2.20 2.27 0.00 123 A 8.69 3.95 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 *130 A 7.84 4.30 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 7.64 4.58 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.10 0.96 0.00 0.00 132 E 9.39 4.46 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 2.26 0.00 133 V 8.38 4.01 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 0.65 0.00 0.00 0.89 0.00 0.00 134 V 8.83 4.39 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.96 0.00 0.00 135 W 8.66 5.03 0.00 3.24 3.08 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 0.00 0.00 0.00 136 M 9.46 4.98 0.00 2.29 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 137 R 8.70 4.55 0.00 1.96 2.04 0.00 3.50 0.00 0.00 3.32 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.66 0.00 138 P 0.00 4.50 0.00 1.58 2.07 0.00 2.99 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 1.91 0.00 139 E 8.16 4.15 0.00 2.13 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 2.54 2.66 0.00 140 E 8.36 4.01 0.00 2.13 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 2.33 2.37 0.00 141 A 7.90 3.86 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.33 4.17 0.00 2.02 1.96 1.08 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.20 3.92 0.00 2.20 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 2.30 2.36 0.00 144 R 8.17 3.88 0.00 1.89 2.02 0.00 3.05 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.95 0.00 145 H 8.04 4.27 0.00 2.47 3.33 0.00 5.63 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 0.00 146 Q 8.12 3.95 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.70 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 147 R 7.79 4.25 0.00 1.92 1.93 0.00 3.21 0.00 0.00 3.20 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 148 G 7.77 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 0.00 0.00 0.00 149 E 8.35 4.09 0.00 1.86 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 2.27 2.34 0.00 150 V 7.16 4.52 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 0.49 0.00 0.00 0.77 0.00 0.00 151 E 8.55 4.73 0.00 1.88 1.89 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 2.27 2.25 0.00 152 F 8.60 5.73 0.00 2.85 2.75 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 0.00 153 S 8.68 4.81 0.00 4.03 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 0.00 154 A 8.75 4.01 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 0.00 155 T 8.09 4.02 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 156 G 8.35 3.77 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 0.00 0.00 0.00 157 L 7.70 3.04 0.00 1.32 1.58 0.61 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 158 V 7.98 3.63 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.63 0.00 0.00 159 G 8.23 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 V 7.83 3.81 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 1.18 0.00 0.00 1.17 0.00 0.00 161 L 8.30 4.04 0.00 1.72 1.68 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 162 Y 8.62 4.17 0.00 3.40 3.34 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 0.00 163 Y 8.37 4.08 0.00 3.23 3.29 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 0.00 164 H 8.23 3.81 0.00 3.28 3.28 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 A 7.36 3.81 0.45 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 0.00 0.00 166 F 7.71 4.74 0.00 2.33 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 0.00 167 L 7.66 4.61 0.00 1.69 1.77 1.28 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 168 R 7.47 4.02 0.00 1.55 1.81 0.00 3.14 0.00 0.00 3.01 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.90 0.00 169 G 7.62 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.