NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 F 4.6925 8.1833 115.8065 56.9773 38.8573 177.7029 7 Q 4.3336 9.0237 117.8398 55.7169 28.8232 174.6684 8 D 4.3964 8.0146 119.2529 56.2305 42.3527 177.2148 9 A 3.9623 7.4538 122.2975 54.0560 19.1622 177.4955 *10 Y 4.3716 7.1624 112.6017 56.6106 41.1454 180.2103 *15 S 4.5719 8.7233 119.2589 57.7385 64.8380 174.3391 16 H 4.7956 8.1168 116.1245 55.5174 29.1002 173.7106 17 C 4.5869 7.8324 120.6903 58.4261 32.9966 172.7416 18 Y 3.8344 8.8238 116.1653 58.8443 37.1743 176.1135 19 G 3.8004 7.8131 110.2216 43.7639 0.0000 173.2701 *30 L 4.1600 8.1808 126.8720 54.4410 43.1278 175.8242 31 K 4.6882 8.5226 123.8820 54.6811 34.4477 175.0749 32 S 5.0731 8.8712 120.1663 56.9956 65.4770 173.0488 33 Y 4.5303 8.5955 119.3045 55.8022 42.6023 174.4126 34 W 4.9103 8.7820 120.7502 56.4271 30.1862 177.1992 35 R 4.6114 9.4490 125.0270 54.1162 30.4659 176.3237 36 G 4.0561 8.0749 116.1548 46.0296 0.0000 173.8363 37 E 4.2294 8.9691 124.4874 56.6688 30.0771 175.5704 38 Q 5.0251 7.9356 118.1707 54.8016 31.7115 174.2710 39 T 5.0712 8.6710 110.4199 60.4238 72.4866 172.5263 40 I 5.1981 8.8130 120.7703 60.0258 41.9829 173.1777 41 A 5.3070 8.9426 127.8425 49.9187 23.1954 174.6305 42 H 5.3297 8.7406 114.9267 54.5473 32.5638 173.1978 43 F 4.5452 9.1934 124.2892 56.7622 42.9274 170.7490 *45 P 4.5021 0.0000 0.0000 62.2199 32.5484 176.6629 46 K 4.0029 8.1789 121.6924 55.4842 32.6048 176.2910 47 P 4.1763 0.0000 0.0000 65.5622 31.3009 177.5039 48 F 4.6119 7.2215 110.2316 57.9151 38.3855 174.8224 49 H 4.7431 8.1657 119.9633 56.6800 28.7851 175.3342 50 T 4.9474 7.8964 108.2362 60.8278 70.5752 173.9910 51 A 4.4264 8.5610 124.9643 53.2610 20.0769 176.3976 *53 P 4.1148 0.0000 0.0000 63.8531 32.0588 176.9138 54 G 3.8606 9.7202 111.5402 44.8096 0.0000 172.3583 55 F 5.0524 7.6624 117.0614 55.6059 43.7020 173.7717 56 V 4.5495 9.0951 122.5007 62.0356 32.5379 175.0817 57 Y 4.2969 9.4262 129.5197 58.2703 38.6658 177.5242 58 G 3.4089 8.7670 113.8358 47.2084 0.0000 175.2239 59 G 3.1915 5.3815 107.4977 46.8840 0.0000 175.3450 60 L 3.9582 7.2394 122.7292 58.3196 42.0359 178.8780 61 I 3.6381 7.8344 118.7828 64.7831 37.0763 177.9806 62 A 4.0104 7.7260 120.3792 55.0392 18.1716 179.7481 63 S 4.0342 8.2341 114.0919 61.9137 62.9607 177.0754 64 L 3.9159 8.3556 121.7651 57.8263 41.3500 179.6904 65 I 3.7270 8.0680 120.1639 64.1188 37.0867 178.1053 66 D 4.2671 8.1692 118.9531 57.7487 41.1985 178.2093 67 C 4.2178 8.1011 117.2061 62.8082 27.9988 175.5942 68 H 4.2190 8.4774 120.3355 59.1062 29.3411 177.6346 69 G 3.3613 8.2177 107.6575 47.9328 0.0000 175.9757 70 T 3.9892 7.9058 117.9208 66.1640 68.4186 177.1014 71 G 3.4595 8.0603 107.5877 48.0069 0.0000 175.5750 72 S 3.6580 8.3198 118.8705 61.0753 62.8051 176.9531 73 A 3.6381 7.8755 123.1235 55.1653 18.0930 179.7086 74 S 3.9007 7.9672 113.5889 61.6063 62.8964 176.8367 75 A 3.9979 7.9304 123.0255 55.1790 17.9314 179.2374 76 A 4.1714 7.6925 117.6072 55.6576 18.5099 179.4789 77 A 4.0876 7.5933 117.7838 55.2290 18.5413 179.0544 78 Q 4.1111 8.0232 117.3247 58.7607 28.9796 178.0497 79 R 4.3759 7.7259 116.8151 54.7200 30.7958 173.4213 *92 P 4.2565 0.0000 0.0000 62.5602 32.1230 175.9683 93 R 4.4617 8.3936 120.3962 56.0299 31.3339 175.4063 94 F 4.9057 8.8981 121.2316 55.7578 42.9680 174.5568 95 V 4.6232 8.6650 114.5257 59.5733 35.5834 175.1743 96 T 4.2561 8.6171 120.2015 63.9813 68.2998 173.9795 97 A 4.6205 9.0782 128.2854 53.0037 20.7599 177.1944 98 A 4.6141 7.7324 115.3442 50.5521 22.2996 175.2116 99 L 4.6936 8.3457 122.2658 53.5273 44.9167 175.0073 100 N 5.0692 8.7864 123.2501 51.4739 41.6803 173.5376 101 I 5.0083 8.1315 123.6753 58.3556 40.5339 174.6431 102 D 4.4555 8.3484 127.0162 53.5225 42.1644 175.3418 103 Y 4.7578 8.3732 122.7024 57.0134 37.5754 175.5250 104 L 4.3560 9.3992 126.5413 57.0447 42.4874 177.5506 105 A 4.5454 7.7329 118.1246 49.9100 21.7588 173.8136 106 P 4.4280 0.0000 0.0000 63.6200 32.2924 176.0024 107 T 4.5527 8.6708 119.7272 61.6660 69.7148 172.9403 108 P 4.4290 0.0000 0.0000 61.5452 33.2287 177.5403 *110 G 3.8052 8.6283 111.8998 45.2192 0.0000 172.2885 111 V 4.3528 7.3273 118.2890 60.0386 34.0796 174.8435 112 E 4.1065 8.6881 127.0286 56.5509 30.2117 175.8884 113 L 4.7595 9.5696 127.4663 53.8217 43.8470 175.0524 114 E 5.0030 9.2203 124.3800 54.3521 32.3756 174.2971 115 L 5.1406 8.9709 126.9136 52.9407 44.5838 175.3879 116 V 4.7616 8.5982 123.9516 61.0923 34.0736 174.6025 117 G 4.4693 9.0732 113.9223 44.3512 0.0000 170.7571 118 E 5.0028 9.0034 125.0866 54.1818 32.3124 174.7267 119 I 4.5459 8.5121 127.9797 61.0648 37.1935 175.5859 120 K 4.4588 9.3284 127.3402 57.2201 33.7824 176.8439 121 E 4.7410 7.8239 120.1048 54.8668 33.1519 173.9251 122 V 4.5198 8.1925 125.6576 60.9621 34.6855 175.1959 *125 R 4.3638 8.4668 124.9510 55.2945 32.7173 174.4176 126 K 5.2782 8.1416 118.8320 55.6060 35.2703 174.8657 127 V 4.7527 8.9083 127.0855 61.1167 34.8844 174.1168 128 V 4.7033 8.5452 125.8344 61.1056 33.7083 174.5061 129 V 4.8994 8.3075 126.7182 61.0270 34.9847 173.7736 130 E 4.8672 8.9125 127.4154 54.5851 31.3606 174.4321 131 I 5.0064 9.0908 127.7195 59.3746 40.6962 174.2414 132 A 4.9862 8.6533 128.3316 49.9919 21.6009 174.6479 133 L 5.1247 9.0172 125.4914 53.4579 44.6561 175.4912 134 S 5.2143 8.8918 121.2459 57.1687 66.4296 174.6566 135 A 4.4229 8.4486 120.3823 52.3475 22.7701 176.3300 *139 L 4.0898 7.7395 116.8232 55.2323 43.0806 175.6216 140 C 4.7540 9.0697 122.8681 61.0102 30.8343 173.8151 141 A 4.9387 7.6890 118.3138 50.8415 22.4281 175.3470 142 R 4.9646 8.8196 121.3758 54.2471 33.2336 175.4166 143 G 4.7737 9.9073 110.8021 42.5795 0.0000 171.2923 144 H 5.1627 8.6009 123.0732 54.1667 33.2646 173.6039 *146 V 4.0255 8.1571 121.8072 62.9440 32.7806 173.5243 147 A 5.3027 8.7639 130.2793 50.3988 21.6100 175.8476 148 V 4.6632 8.4978 114.4344 59.7648 35.6246 178.8502 149 K 3.1428 9.2104 127.5087 55.6263 32.4664 175.0660 *151 P 4.1281 0.0000 0.0000 62.8817 31.5405 176.6187 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 6 F 8.18 4.69 0.00 2.95 2.27 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 7 Q 9.02 4.33 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 8 D 8.01 4.40 0.00 2.06 2.50 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 0.00 9 A 7.45 3.96 1.10 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 *10 Y 7.16 4.37 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *15 S 8.72 4.57 0.00 3.86 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 16 H 8.12 4.80 0.00 3.14 3.28 0.00 5.69 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 C 7.83 4.59 0.00 2.99 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 18 Y 8.82 3.83 0.00 2.98 3.07 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 19 G 7.81 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 *30 L 8.18 4.16 0.00 1.62 1.64 1.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 31 K 8.52 4.69 0.00 1.86 1.33 0.00 1.84 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.46 7.81 32 S 8.87 5.07 0.00 3.47 3.60 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 33 Y 8.60 4.53 0.00 2.78 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 34 W 8.78 4.91 0.00 3.22 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 35 R 9.45 4.61 0.00 1.74 1.87 0.00 3.33 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 36 G 8.07 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 37 E 8.97 4.23 0.00 2.01 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 2.19 2.30 0.00 38 Q 7.94 5.03 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.65 2.43 0.00 39 T 8.67 5.07 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 0.61 0.00 0.00 40 I 8.81 5.20 1.89 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 1.04 1.57 1.02 0.00 0.00 41 A 8.94 5.31 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 42 H 8.74 5.33 0.00 3.00 3.18 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 F 9.19 4.55 0.00 3.01 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 *45 P 0.00 4.50 0.00 2.12 2.10 0.00 3.70 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 2.01 2.38 0.00 46 K 8.18 4.00 0.00 0.79 1.26 0.00 1.90 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.42 7.81 47 P 0.00 4.18 0.00 2.03 2.11 0.00 3.47 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 48 F 7.22 4.61 0.00 3.04 3.16 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 49 H 8.17 4.74 0.00 3.54 3.46 0.00 5.80 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.90 4.95 4.33 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 1.32 0.00 0.00 51 A 8.56 4.43 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.11 0.00 2.15 2.10 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 54 G 9.72 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 0.00 0.00 0.00 55 F 7.66 5.05 0.00 3.03 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 56 V 9.10 4.55 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 0.86 0.00 0.00 1.07 0.00 0.00 57 Y 9.43 4.30 0.00 3.26 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 58 G 8.77 3.41 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 59 G 5.38 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 0.00 0.00 0.00 60 L 7.24 3.96 0.00 1.96 1.95 0.74 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.83 3.64 2.10 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.72 1.02 0.00 0.00 62 A 7.73 4.01 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 63 S 8.23 4.03 0.00 3.90 3.85 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 64 L 8.36 3.92 0.00 1.54 1.60 0.68 0.15 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 65 I 8.07 3.73 1.91 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 1.37 0.94 0.88 0.00 0.00 66 D 8.17 4.27 0.00 2.99 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 67 C 8.10 4.22 0.00 3.02 2.96 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 68 H 8.48 4.22 0.00 3.24 3.32 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.22 3.36 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 0.00 70 T 7.91 3.99 4.24 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 0.00 0.00 1.27 0.00 0.00 71 G 8.06 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.32 3.66 0.00 3.78 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 73 A 7.88 3.64 1.04 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 0.00 0.00 74 S 7.97 3.90 0.00 3.95 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 75 A 7.93 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.69 4.17 1.38 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 77 A 7.59 4.09 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.02 4.11 0.00 2.31 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.03 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 79 R 7.73 4.38 0.00 1.82 2.09 0.00 3.07 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 *92 P 0.00 4.26 0.00 2.63 2.23 0.00 3.99 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 2.01 2.11 0.00 93 R 8.39 4.46 0.00 1.79 1.91 0.00 3.07 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 94 F 8.90 4.91 0.00 2.75 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 95 V 8.67 4.62 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 0.75 0.00 0.00 0.95 0.00 0.00 96 T 8.62 4.26 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 1.24 0.00 0.00 97 A 9.08 4.62 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 98 A 7.73 4.61 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 99 L 8.35 4.69 0.00 1.52 1.50 0.89 0.91 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 0.00 100 N 8.79 5.07 0.00 2.61 2.65 0.00 0.00 6.33 8.80 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 0.00 101 I 8.13 5.01 1.40 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.61 0.16 0.00 0.00 102 D 8.35 4.46 0.00 2.47 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.37 4.76 0.00 2.87 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 0.00 104 L 9.40 4.36 0.00 1.51 1.73 0.91 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.73 4.55 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 0.00 106 P 0.00 4.43 0.00 2.44 1.86 0.00 3.80 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.91 0.00 107 T 8.67 4.55 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 1.27 0.00 0.00 108 P 0.00 4.43 0.00 1.96 1.88 0.00 3.43 0.00 0.00 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.81 0.00 *110 G 8.63 3.81 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 0.00 0.00 0.00 111 V 7.33 4.35 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 0.83 0.00 0.00 0.90 0.00 0.00 112 E 8.69 4.11 0.00 1.93 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 2.34 2.34 0.00 113 L 9.57 4.76 0.00 1.61 1.61 1.02 0.66 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 0.00 114 E 9.22 5.00 0.00 2.06 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 115 L 8.97 5.14 0.00 1.35 1.23 0.90 0.78 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 0.00 116 V 8.60 4.76 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 0.99 0.00 0.00 0.92 0.00 0.00 117 G 9.07 4.47 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 0.00 118 E 9.00 5.00 0.00 2.10 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 2.22 2.32 0.00 119 I 8.51 4.55 1.96 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 1.47 1.15 0.96 0.00 0.00 120 K 9.33 4.46 0.00 1.61 1.88 0.00 1.75 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.54 7.81 121 E 7.82 4.74 0.00 2.02 1.75 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 2.31 2.33 0.00 122 V 8.19 4.52 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 0.90 0.00 0.00 0.96 0.00 0.00 *125 R 8.47 4.36 0.00 1.81 1.84 0.00 3.18 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 126 K 8.14 5.28 0.00 1.78 1.70 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.64 7.81 127 V 8.91 4.75 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 0.87 0.00 0.00 0.62 0.00 0.00 128 V 8.55 4.70 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 0.85 0.00 0.00 0.95 0.00 0.00 129 V 8.31 4.90 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 0.81 0.00 0.00 0.85 0.00 0.00 130 E 8.91 4.87 0.00 2.11 1.79 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 2.21 2.26 0.00 131 I 9.09 5.01 1.85 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 1.31 0.72 0.94 0.00 0.00 132 A 8.65 4.99 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 0.00 133 L 9.02 5.12 0.00 1.66 1.51 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.89 5.21 0.00 3.79 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.45 4.42 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 *139 L 7.74 4.09 0.00 1.63 1.64 1.01 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 140 C 9.07 4.75 0.00 3.02 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 0.00 141 A 7.69 4.94 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 0.00 142 R 8.82 4.96 0.00 1.65 1.75 0.00 3.35 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 143 G 9.91 4.77 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 0.00 144 H 8.60 5.16 0.00 3.23 3.13 0.00 5.90 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *146 V 8.16 4.03 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 1.01 0.00 0.00 0.94 0.00 0.00 147 A 8.76 5.30 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 0.00 148 V 8.50 4.66 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 0.72 0.00 0.00 0.86 0.00 0.00 149 K 9.21 3.14 0.00 1.07 0.96 0.00 1.57 0.00 0.00 1.50 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.22 1.06 7.81 *151 P 0.00 4.13 0.00 2.21 2.02 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.93 0.00 * Residues marked with a * may have inaccurate shift predictions.