NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Y 4.6332 8.0033 118.3206 57.6802 40.1403 173.9432 4 R 3.9484 8.5682 119.4009 55.4302 31.0431 175.5722 5 L 4.1729 8.7047 122.2200 54.5704 44.6422 176.0648 6 K 4.7018 8.5758 131.0025 56.0700 29.9440 179.3519 7 A 4.3921 7.5294 121.7958 52.0964 17.9320 177.8981 8 Y 4.6102 8.1364 120.7477 58.7674 39.2533 174.5813 9 Y 4.5089 8.7505 119.1207 57.2016 40.1269 175.8029 10 R 4.5822 8.2937 126.7730 55.1074 30.1188 176.1223 11 E 4.0530 9.0211 127.1730 60.3554 30.2761 176.0422 12 G 3.0997 7.4441 105.7739 45.1132 0.0000 172.7829 13 E 4.4153 7.3721 129.7885 56.7273 29.4720 179.6204 14 K 4.2579 8.3382 124.9402 55.4065 31.0588 175.4377 15 P 3.9162 0.0000 0.0000 64.3001 31.5878 177.6725 16 S 4.3755 7.8460 111.3922 59.4209 63.8297 175.5335 17 A 4.3077 8.7305 123.5988 53.6094 18.8488 179.2243 18 L 3.7931 7.6568 117.4731 58.0859 41.6027 179.3190 19 R 4.1755 7.8160 117.8115 57.8313 30.1161 178.2440 20 R 3.8074 7.7649 114.5804 57.9549 29.6020 177.4732 21 A 3.9642 9.0326 125.2936 55.4616 19.1738 177.3579 22 G 3.4265 7.5348 105.6071 44.8227 0.0000 172.9020 23 K 4.3089 7.6014 126.5930 56.2072 35.7149 175.3461 24 L 4.4386 8.4379 127.1913 57.5940 41.3754 174.4814 25 P 4.0001 0.0000 0.0000 58.5026 32.3031 177.0058 26 G 4.5608 8.8245 111.0334 43.9241 0.0000 171.7532 27 V 5.0319 8.1722 119.5966 59.7670 35.1030 174.0847 28 M 5.0535 8.8534 120.8125 54.2509 34.0812 174.2108 29 Y 5.8154 8.8089 118.9660 57.6454 42.4188 172.8071 30 N 5.4169 8.4810 113.2856 53.5963 40.2202 175.4495 31 R 4.2084 9.3720 118.1731 58.3949 30.2387 175.7802 32 H 5.0017 7.7245 115.1368 54.9412 31.0955 173.5306 33 L 4.8685 7.9189 121.9209 53.9819 45.4144 175.2015 34 N 5.4117 8.7549 122.9452 52.3944 41.3118 173.5227 35 R 4.4020 9.3176 126.1079 53.9513 33.8679 175.3400 36 K 4.4817 8.7823 126.3941 57.0095 31.2157 175.9319 37 V 4.8208 7.7733 121.7199 61.4888 35.1503 173.4607 38 Y 4.7933 7.8116 115.3385 57.6900 40.2377 173.0067 39 V 4.7462 8.5589 122.9381 61.3020 32.4656 175.0873 40 D 4.9434 8.5947 120.9428 50.6370 45.7980 174.3960 41 L 4.1053 9.0204 118.5884 57.2290 40.2545 181.2986 42 V 3.4514 8.3900 129.5958 65.1777 32.5428 176.9828 43 E 4.2175 7.8286 120.8659 58.7885 29.4290 178.4635 44 F 3.9771 8.6517 121.2201 61.5409 39.3628 176.6397 45 D 4.7260 8.4303 116.7671 58.1261 40.0349 177.6012 46 K 3.8914 7.6629 117.4272 59.5968 31.7541 179.1420 47 V 3.4446 7.7227 120.1054 63.7678 31.6773 178.1803 48 F 4.0615 9.5927 120.2857 59.6120 38.5870 179.5587 49 R 2.8835 5.8400 113.3342 58.8664 33.2172 176.4135 50 Q 3.9312 7.3573 112.5496 58.9956 28.1444 177.6952 51 A 3.7781 7.6195 121.6453 52.4161 18.8502 178.2772 52 S 3.4894 8.7591 114.3564 59.7452 60.0911 173.0654 53 I 3.3600 8.3471 123.8619 60.9853 36.1383 172.0038 54 H 4.8873 7.6997 122.3613 57.5375 37.7088 174.5576 55 H 5.0820 7.3349 118.2882 55.3902 27.8939 174.7178 56 V 4.6073 8.1396 125.8834 63.1717 34.6726 172.6524 57 I 4.8776 8.1608 123.3693 59.6567 41.6286 174.3454 58 V 5.4385 7.9407 120.3199 61.0469 35.0098 174.0302 59 L 5.1487 8.1995 123.9901 51.9750 45.0169 175.5774 60 E 4.4509 8.8414 124.1746 55.0458 29.6094 176.6124 61 L 4.4535 8.6138 124.6031 52.9065 42.3515 177.0456 62 P 4.2304 0.0000 0.0000 64.8710 31.2525 176.3600 63 D 4.6332 7.6283 119.3346 54.4074 40.5903 176.8856 64 G 3.9082 6.6726 107.1202 45.3335 0.0000 173.8138 65 Q 3.3253 6.3891 110.7312 50.7444 30.0199 177.2582 66 S 5.3778 8.2284 117.9987 56.7138 65.2380 173.1662 67 L 4.7729 7.9489 119.4804 52.6995 46.4083 174.3774 68 P 4.6343 0.0000 0.0000 62.2271 30.5747 174.8619 69 T 4.7039 8.4171 118.3665 60.9374 71.9881 173.8575 70 L 4.8990 7.8866 121.9146 53.5490 46.5751 175.7957 71 V 4.3535 8.8288 117.1316 62.0666 31.9836 175.3567 72 R 4.5767 8.4057 121.2201 57.4035 32.7188 175.6628 73 Q 4.5113 9.3088 119.5533 54.5013 33.0526 174.1026 74 V 5.1861 8.1655 123.9971 60.0016 32.4931 174.2534 75 N 4.6369 8.5774 124.3568 53.3273 40.0447 173.5835 76 L 4.8110 8.0286 118.7961 52.5598 45.9490 177.1888 77 D 4.5444 8.8411 123.2089 57.5129 39.4530 178.4625 78 K 4.5522 6.5660 122.3410 58.8075 33.9029 178.0978 79 R 4.2835 7.4790 115.5406 55.9143 29.6174 176.4227 80 R 4.4661 8.3669 115.9161 58.1488 34.3009 176.8927 81 R 3.3807 7.4026 112.0249 57.7207 27.8713 175.3954 82 R 4.6060 7.6063 127.4346 55.0519 32.4328 171.6782 83 P 4.7452 0.0000 0.0000 62.9729 31.8068 175.7230 84 E 4.5774 7.8149 116.1440 56.0085 31.4834 174.8506 85 H 4.7490 7.6075 118.2834 56.4994 33.4712 172.6362 86 V 4.8236 6.9281 120.6130 61.5349 34.9404 172.4161 87 D 5.1553 8.5666 125.6291 51.6726 42.3772 175.1520 88 F 5.4426 9.1631 120.2934 55.9303 41.3657 174.6320 89 F 5.6611 9.1548 127.8758 56.8350 38.5704 172.7883 90 V 4.1286 8.2688 122.0046 62.2900 31.7467 175.0526 91 L 3.8512 9.0147 129.9119 55.3834 41.8520 177.8905 92 S 4.9634 8.2666 118.7103 57.6430 64.5469 173.4111 93 D 4.5868 8.5853 116.7149 54.7168 40.2426 176.8619 94 E 4.1137 7.6374 120.4756 55.1823 29.9739 174.6426 95 P 5.2054 0.0000 0.0000 62.6792 31.8595 176.0073 96 V 4.5113 8.3535 123.7572 59.7865 34.7512 174.3963 97 E 5.0609 8.6029 120.5100 55.9521 31.3654 176.1011 98 M 4.4824 9.2600 115.5101 54.7213 34.9951 173.9393 99 Y 4.5844 9.9019 122.2284 58.6797 38.5271 176.2094 100 V 4.6432 8.7777 116.8342 58.6008 35.0277 173.3069 101 P 4.1744 0.0000 0.0000 63.2209 32.4839 175.2238 102 L 4.7674 8.1867 122.3388 53.2911 45.2302 176.2323 103 R 4.3294 7.8422 117.7339 54.9024 34.1486 176.7420 104 F 4.4038 9.0567 120.2724 58.5537 38.3692 173.3057 105 V 4.0497 7.5930 125.8377 59.6663 30.6067 173.4604 106 G 4.0185 7.7927 113.8895 44.4949 0.0000 170.6555 107 T 4.5245 7.8169 113.7627 59.1963 72.1444 173.2377 108 P 4.6014 0.0000 0.0000 62.5997 30.3085 178.6120 109 A 4.3755 9.1831 112.1244 51.8965 21.6828 173.4420 110 G 4.4485 9.2086 115.9324 44.6897 0.0000 174.5144 111 V 4.5842 8.2002 126.3084 61.4806 33.5439 176.8619 112 R 4.0669 8.5708 118.6815 57.6649 29.5856 177.7137 113 A 4.0464 9.3755 126.5823 53.7805 19.4481 178.9249 114 G 4.0464 7.2349 99.6350 45.9797 0.0000 172.0687 115 G 4.6118 8.5282 106.3680 45.0151 0.0000 174.0774 116 V 4.1818 7.6639 121.6176 60.8947 33.3062 174.3066 117 L 4.4754 7.8049 134.0384 54.1655 40.4222 176.9794 118 Q 4.3009 7.4219 120.8377 56.6065 29.6496 174.8931 119 E 5.4162 8.3812 114.0583 56.8856 30.6699 175.8913 120 I 3.6229 8.5038 125.8599 63.7169 37.5335 176.0320 121 H 4.7465 7.4510 117.0083 55.3844 33.1496 173.5955 122 R 4.2119 8.6326 122.0810 56.9985 30.1142 174.8039 123 D 4.9573 7.2803 116.8058 52.7722 42.7477 174.2355 124 I 4.5115 8.0777 118.0717 58.9816 41.0226 175.3943 125 L 4.3417 7.8725 127.9463 55.5895 43.2718 175.8712 126 V 4.9133 8.1759 115.5045 60.4661 36.7907 172.6320 127 K 5.6312 9.0027 125.0994 54.5215 34.9098 175.2499 128 V 4.6214 7.9772 122.9304 60.7849 34.5140 171.7411 129 S 4.4070 8.4434 116.1244 58.0703 62.8751 173.7033 130 P 4.2799 0.0000 0.0000 64.8744 31.1629 177.0315 131 R 4.1313 7.7179 114.9172 57.9110 30.3320 176.3881 132 N 4.3962 7.9233 119.0251 53.1305 38.4980 174.6148 133 I 4.4633 7.8225 126.6137 58.3970 38.4087 172.6431 134 P 4.4287 0.0000 0.0000 62.1683 29.3886 177.1263 135 E 3.8329 7.6337 122.8803 58.8084 29.8939 177.9485 136 F 4.8831 6.6600 109.6167 56.7769 40.9438 173.5069 137 I 4.7659 7.8219 121.3898 62.9101 37.6076 175.1587 138 E 3.8679 7.6615 118.8413 53.4521 31.2981 178.0836 139 V 4.4936 7.8344 114.2451 60.0607 35.0092 174.6084 140 D 5.1020 9.0758 125.5381 51.6472 41.2420 176.0266 141 V 4.5691 8.2213 119.7234 60.1487 32.8756 175.8236 142 S 4.2385 9.0346 119.7608 59.2292 63.6967 174.2239 143 G 4.5512 7.0842 106.8964 44.9424 0.0000 172.6158 144 L 4.5765 8.4093 128.3148 52.5406 42.9251 174.5344 145 E 4.3970 8.0321 125.2077 54.7886 32.6665 176.3497 146 I 3.6681 7.0694 116.2228 62.8505 36.9591 175.9025 147 G 4.5086 7.6200 119.3597 46.5853 0.0000 174.3156 148 D 4.7769 8.6009 132.2401 53.3035 39.1643 174.4474 149 S 4.6313 7.3813 112.6450 58.4251 66.1051 176.1970 150 L 4.5802 7.5795 120.2862 54.6412 43.0970 174.1339 151 H 5.1431 8.8540 115.8392 55.8303 32.8964 174.9372 152 A 3.9694 10.2029 115.9864 54.2369 18.0939 181.6543 153 S 4.4952 9.3007 114.2408 58.5650 61.6610 174.3651 154 D 4.9533 7.5081 119.2836 51.8084 41.2148 175.4980 155 L 4.6015 7.5453 119.1484 53.4627 46.0510 175.7435 156 K 4.0563 8.3649 120.9518 57.0461 32.4147 177.7419 157 L 3.3742 7.3925 112.1725 54.9913 38.0862 172.9455 158 P 4.3145 0.0000 0.0000 63.1040 31.3007 173.5519 159 P 4.1586 0.0000 0.0000 60.3992 29.3880 175.5261 160 G 4.5374 7.1383 120.1432 45.7936 0.0000 169.7114 161 V 4.8440 7.1278 119.2944 60.7854 35.5605 174.2718 162 E 4.8358 8.9540 121.2962 54.0324 32.3919 175.2513 163 L 4.5388 8.7687 124.0951 55.5285 41.5110 176.2636 164 A 4.5679 8.6689 121.4459 52.2155 19.8425 177.2636 165 V 3.9298 7.9916 117.2459 65.0848 32.5871 175.6621 166 S 4.6893 7.3687 116.5957 58.8198 70.0800 173.9120 167 P 4.5197 0.0000 0.0000 62.6107 32.1449 174.3726 168 E 4.5894 8.6421 121.2794 57.6212 34.2903 174.8969 169 E 3.9662 8.1525 117.7187 56.6092 30.0385 176.5235 170 T 4.5005 8.0865 119.4435 63.2410 70.2314 174.2393 171 I 4.4875 8.2942 118.3259 63.0817 41.5262 175.0109 172 A 5.2139 7.7292 120.1495 51.2680 20.2778 174.3813 173 A 4.6500 8.3247 121.3780 49.9742 19.6681 176.3987 174 V 4.4155 8.2939 120.3651 63.9263 32.7069 174.9782 175 V 4.7395 8.0975 116.6867 58.8004 36.4782 172.8308 176 P 4.8646 0.0000 0.0000 62.4644 32.4222 174.1485 177 P 4.6432 0.0000 0.0000 61.5364 33.7763 175.7798 178 E 4.3955 8.3618 119.7658 55.4724 28.6944 176.7313 *179 D 4.4415 7.8784 120.3034 53.2930 40.5731 176.7008 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 3 Y 8.00 4.63 0.00 2.93 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 4 R 8.57 3.95 0.00 1.92 1.87 0.00 3.48 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 5 L 8.70 4.17 0.00 1.63 1.50 0.98 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 6 K 8.58 4.70 0.00 1.93 1.80 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.51 7.81 7 A 7.53 4.39 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 8 Y 8.14 4.61 0.00 1.43 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 9 Y 8.75 4.51 0.00 2.77 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 10 R 8.29 4.58 0.00 2.20 2.11 0.00 3.28 0.00 0.00 3.17 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 11 E 9.02 4.05 0.00 2.03 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 0.00 2.40 2.49 0.00 12 G 7.44 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 0.00 0.00 0.00 13 E 7.37 4.42 0.00 1.90 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 0.00 2.61 2.25 0.00 14 K 8.34 4.26 0.00 1.84 1.73 0.00 1.54 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 15 P 0.00 3.92 0.00 1.99 2.08 0.00 3.62 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 16 S 7.85 4.38 0.00 3.93 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.73 4.31 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 18 L 7.66 3.79 0.00 1.52 1.45 0.39 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 19 R 7.82 4.18 0.00 1.71 1.97 0.00 3.24 0.00 0.00 2.32 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 20 R 7.76 3.81 0.00 1.99 1.72 0.00 3.16 0.00 0.00 3.19 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 21 A 9.03 3.96 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 22 G 7.53 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.60 4.31 0.00 1.50 1.34 0.00 2.25 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.08 0.55 7.81 24 L 8.44 4.44 0.00 1.41 1.39 0.06 0.23 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 25 P 0.00 4.00 0.00 2.08 1.85 0.00 3.50 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 1.98 1.95 0.00 26 G 8.82 4.56 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 0.00 0.00 0.00 27 V 8.17 5.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.07 0.00 0.00 28 M 8.85 5.05 0.00 2.20 2.26 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 2.51 2.61 0.00 29 Y 8.81 5.82 0.00 3.01 3.12 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 30 N 8.48 5.42 0.00 3.09 3.38 0.00 0.00 5.92 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 31 R 9.37 4.21 0.00 2.00 2.25 0.00 3.35 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 32 H 7.72 5.00 0.00 3.29 3.33 0.00 5.50 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.92 4.87 0.00 1.76 1.65 0.96 0.34 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 34 N 8.75 5.41 0.00 2.74 2.70 0.00 0.00 6.82 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 9.32 4.40 0.00 1.66 1.67 0.00 2.97 0.00 0.00 2.98 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 36 K 8.78 4.48 0.00 1.83 1.84 0.00 1.69 0.00 0.00 1.99 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.62 1.49 7.81 37 V 7.77 4.82 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 0.62 0.00 0.00 1.08 0.00 0.00 38 Y 7.81 4.79 0.00 3.02 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 39 V 8.56 4.75 2.43 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 1.10 0.00 0.00 1.08 0.00 0.00 40 D 8.59 4.94 0.00 2.78 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.02 4.11 0.00 1.79 0.95 0.88 0.75 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 42 V 8.39 3.45 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 0.98 0.00 0.00 0.97 0.00 0.00 43 E 7.83 4.22 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 44 F 8.65 3.98 0.00 3.28 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 45 D 8.43 4.73 0.00 2.93 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 46 K 7.66 3.89 0.00 1.94 1.78 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.69 7.81 47 V 7.72 3.44 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 0.71 0.00 0.00 0.78 0.00 0.00 48 F 9.59 4.06 0.00 2.49 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 49 R 5.84 2.88 0.00 2.08 2.03 0.00 3.30 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 1.54 1.53 0.00 50 Q 7.36 3.93 0.00 1.82 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.21 0.00 51 A 7.62 3.78 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 52 S 8.76 3.49 0.00 3.59 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.35 3.36 1.73 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.65 0.98 0.00 0.00 54 H 7.70 4.89 0.00 3.16 3.19 0.00 5.68 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 H 7.33 5.08 0.00 3.17 3.11 0.00 5.68 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 8.14 4.61 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 0.78 0.00 0.00 0.95 0.00 0.00 57 I 8.16 4.88 1.75 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.61 0.91 0.00 0.00 58 V 7.94 5.44 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 0.86 0.00 0.00 0.87 0.00 0.00 59 L 8.20 5.15 0.00 1.54 1.59 0.79 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.84 4.45 0.00 1.81 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 0.00 2.25 2.30 0.00 61 L 8.61 4.45 0.00 1.66 1.57 1.15 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.23 0.00 1.97 1.83 0.00 3.60 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 63 D 7.63 4.63 0.00 2.51 2.56 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 64 G 6.67 3.91 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 0.00 0.00 0.00 65 Q 6.39 3.33 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.23 6.75 0.00 0.00 0.00 0.00 0.00 2.61 2.42 0.00 66 S 8.23 5.38 0.00 3.73 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 67 L 7.95 4.77 0.00 1.50 1.43 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.63 0.00 2.04 2.16 0.00 3.63 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 2.04 1.98 0.00 69 T 8.42 4.70 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 0.82 0.00 0.00 70 L 7.89 4.90 0.00 2.02 1.71 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.83 4.35 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 0.84 0.00 0.00 1.27 0.00 0.00 72 R 8.41 4.58 0.00 1.83 1.93 0.00 3.29 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.65 0.00 73 Q 9.31 4.51 0.00 2.04 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 74 V 8.17 5.19 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 1.16 0.00 0.00 1.02 0.00 0.00 75 N 8.58 4.64 0.00 2.64 2.69 0.00 0.00 6.76 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 76 L 8.03 4.81 0.00 1.45 1.49 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.84 4.54 0.00 2.69 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 6.57 4.55 0.00 1.85 1.77 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.42 7.81 79 R 7.48 4.28 0.00 1.91 2.00 0.00 3.10 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 80 R 8.37 4.47 0.00 2.20 1.91 0.00 3.32 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.50 0.00 81 R 7.40 3.38 0.00 1.97 2.27 0.00 3.18 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 82 R 7.61 4.61 0.00 1.95 1.86 0.00 3.17 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.38 0.00 83 P 0.00 4.75 0.00 1.98 2.00 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.98 0.00 84 E 7.81 4.58 0.00 1.90 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 2.18 2.16 0.00 85 H 7.61 4.75 0.00 3.09 3.00 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 V 6.93 4.82 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 0.42 0.00 0.00 0.41 0.00 0.00 87 D 8.57 5.16 0.00 2.59 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 88 F 9.16 5.44 0.00 2.82 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 89 F 9.15 5.66 0.00 3.07 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 90 V 8.27 4.13 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 0.85 0.00 0.00 1.00 0.00 0.00 91 L 9.01 3.85 0.00 1.49 1.49 0.84 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.27 4.96 0.00 3.98 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 93 D 8.59 4.59 0.00 2.80 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 94 E 7.64 4.11 0.00 1.96 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 2.37 2.43 0.00 95 P 0.00 5.21 0.00 2.08 2.08 0.00 3.34 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.81 0.00 96 V 8.35 4.51 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 0.80 0.00 0.00 1.05 0.00 0.00 97 E 8.60 5.06 0.00 2.03 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 0.00 2.33 2.38 0.00 98 M 9.26 4.48 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 99 Y 9.90 4.58 0.00 2.73 3.11 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 0.00 100 V 8.78 4.64 2.29 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 0.96 0.00 0.00 1.03 0.00 0.00 101 P 0.00 4.17 0.00 2.34 1.96 0.00 3.79 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.60 0.00 102 L 8.19 4.77 0.00 1.64 1.39 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 103 R 7.84 4.33 0.00 1.58 1.60 0.00 2.43 0.00 0.00 2.83 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.20 0.00 104 F 9.06 4.40 0.00 3.08 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.59 4.05 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 0.84 0.00 0.00 0.91 0.00 0.00 106 G 7.79 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 0.00 107 T 7.82 4.52 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 1.18 0.00 0.00 108 P 0.00 4.60 0.00 2.33 1.54 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.84 0.00 109 A 9.18 4.38 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 0.00 110 G 9.21 4.45 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 0.00 111 V 8.20 4.58 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 0.79 0.00 0.00 0.91 0.00 0.00 112 R 8.57 4.07 0.00 1.77 1.66 0.00 3.26 0.00 0.00 3.22 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 113 A 9.38 4.05 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 0.00 114 G 7.23 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 0.00 0.00 0.00 115 G 8.53 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.66 4.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.91 0.00 0.00 117 L 7.80 4.48 0.00 1.49 1.29 1.07 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 118 Q 7.42 4.30 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.52 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 119 E 8.38 5.42 0.00 2.35 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 2.44 2.36 0.00 120 I 8.50 3.62 1.91 0.00 0.00 nan 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 0.84 0.99 0.00 0.00 121 H 7.45 4.75 0.00 3.25 3.11 0.00 5.76 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 8.63 4.21 0.00 2.01 2.48 0.00 3.09 0.00 0.00 3.42 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 123 D 7.28 4.96 0.00 2.86 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 0.00 124 I 8.08 4.51 1.83 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 1.04 0.69 0.83 0.00 0.00 125 L 7.87 4.34 0.00 0.36 1.07 1.14 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 126 V 8.18 4.91 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 0.62 0.00 0.00 1.05 0.00 0.00 127 K 9.00 5.63 0.00 1.81 1.80 0.00 1.89 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.26 7.81 128 V 7.98 4.62 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 0.70 0.00 0.00 1.06 0.00 0.00 129 S 8.44 4.41 0.00 4.00 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 0.00 130 P 0.00 4.28 0.00 2.13 2.21 0.00 3.71 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 131 R 7.72 4.13 0.00 1.94 2.05 0.00 3.05 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 132 N 7.92 4.40 0.00 2.69 2.78 0.00 0.00 7.07 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 0.00 133 I 7.82 4.46 1.84 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 1.40 0.84 0.99 0.00 0.00 134 P 0.00 4.43 0.00 2.18 2.00 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 135 E 7.63 3.83 0.00 1.20 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 0.00 2.10 2.05 0.00 136 F 6.66 4.88 0.00 3.04 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 0.00 137 I 7.82 4.77 1.91 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 1.35 0.98 0.96 0.00 0.00 138 E 7.66 3.87 0.00 1.91 1.74 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 1.83 2.21 0.00 139 V 7.83 4.49 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 0.69 0.00 0.00 0.83 0.00 0.00 140 D 9.08 5.10 0.00 2.64 2.92 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 0.00 141 V 8.22 4.57 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.98 0.00 0.00 142 S 9.03 4.24 0.00 4.00 4.04 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 0.00 143 G 7.08 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 4.58 0.00 1.59 1.57 1.05 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.03 4.40 0.00 2.13 1.70 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 2.25 2.32 0.00 146 I 7.07 3.67 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 1.34 0.66 0.92 0.00 0.00 147 G 7.62 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 0.00 0.00 0.00 0.00 148 D 8.60 4.78 0.00 2.81 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 S 7.38 4.63 0.00 4.17 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 0.00 150 L 7.58 4.58 0.00 2.14 1.79 0.96 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 151 H 8.85 5.14 0.00 3.42 3.13 0.00 5.78 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 A 10.20 3.97 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 0.00 153 S 9.30 4.50 0.00 3.85 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 D 7.51 4.95 0.00 2.79 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 0.00 155 L 7.55 4.60 0.00 1.55 1.50 0.92 0.91 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 0.00 156 K 8.36 4.06 0.00 1.70 1.79 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.43 7.81 157 L 7.39 3.37 0.00 1.76 2.01 0.92 1.11 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 0.00 158 P 0.00 4.31 0.00 2.21 2.22 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 159 P 0.00 4.16 0.00 2.07 2.03 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 160 G 7.14 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.13 4.84 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 0.93 0.00 0.00 0.93 0.00 0.00 162 E 8.95 4.84 0.00 2.03 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 2.30 2.23 0.00 163 L 8.77 4.54 0.00 1.62 1.70 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 164 A 8.67 4.57 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 0.00 165 V 7.99 3.93 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 0.82 0.00 0.00 0.80 0.00 0.00 166 S 7.37 4.69 0.00 3.99 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 0.00 167 P 0.00 4.52 0.00 2.32 2.04 0.00 3.74 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 1.94 0.00 168 E 8.64 4.59 0.00 1.86 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 2.18 2.33 0.00 169 E 8.15 3.97 0.00 1.97 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 0.00 2.33 2.38 0.00 170 T 8.09 4.50 4.28 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 1.31 0.00 0.00 171 I 8.29 4.49 1.95 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 1.23 0.93 0.86 0.00 0.00 172 A 7.73 5.21 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 A 8.32 4.65 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 0.00 174 V 8.29 4.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.97 0.00 0.00 175 V 8.10 4.74 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 0.91 0.00 0.00 0.93 0.00 0.00 176 P 0.00 4.86 0.00 2.07 2.05 0.00 3.75 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 1.98 1.96 0.00 177 P 0.00 4.64 0.00 2.08 2.11 0.00 3.72 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 1.92 2.08 0.00 178 E 8.36 4.40 0.00 1.94 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 2.21 2.20 0.00 *179 D 7.88 4.44 0.00 2.44 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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.