NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 Q 4.3125 8.3293 118.8275 55.6487 30.5074 175.5291 20 S 4.1277 8.0069 114.6135 57.9290 64.6564 173.3427 21 L 4.0010 9.8036 126.0337 58.5756 42.2943 180.0065 22 Y 4.2774 8.4809 116.7153 61.2945 37.5919 178.4624 23 E 4.0206 8.0975 118.2352 59.5724 29.8900 179.4435 24 R 4.0834 8.0245 117.7884 59.4279 29.9873 179.0902 25 L 4.0233 8.4266 117.8481 57.7605 41.7656 179.4326 26 S 4.3793 8.1110 113.3568 59.1989 62.6766 173.8288 27 Q 3.8971 7.3066 122.1800 57.6952 28.4657 176.8993 28 R 3.9770 8.7878 120.5780 56.5816 27.7207 176.4587 29 M 4.2890 7.3841 117.7513 54.9275 33.0716 175.8057 30 L 4.0945 8.9323 124.3855 54.9612 43.6150 175.4114 31 D 5.1908 8.6631 126.8505 53.2758 40.6054 175.6235 32 I 4.1465 8.3757 120.3022 62.0579 37.9652 177.0613 33 S 4.2598 8.2082 116.2070 58.1697 63.9233 174.5747 34 G 4.0492 8.8931 109.4171 45.0269 0.0000 173.8744 35 D 4.7725 7.6534 116.2423 52.6959 39.5989 177.0701 36 R 3.9018 8.4722 116.4543 56.9581 28.7176 177.4492 37 G 3.7108 8.5536 107.2568 48.3020 0.0000 173.6882 38 V 4.8820 7.5840 119.9655 61.0849 34.3060 174.4821 39 L 5.2825 8.8177 128.0804 52.7985 45.1309 175.7477 40 K 4.5880 9.0961 123.1997 54.5242 36.2420 174.3361 41 D 4.9055 8.5316 125.8462 52.2742 44.1580 174.4472 42 V 3.9767 8.3550 126.6017 62.7531 31.5774 175.1669 43 I 4.2165 8.7285 128.6379 61.8221 39.5461 175.7070 44 R 4.6459 7.5968 121.7378 54.3407 33.2351 174.3705 45 E 4.3253 9.0043 125.8641 56.3491 30.1844 177.9406 46 G 4.0567 8.4417 114.7610 45.4943 0.0000 172.6905 47 A 4.5105 8.4721 124.0007 52.2066 22.7742 178.5132 48 G 3.8888 8.5787 107.9078 45.0365 0.0000 173.3757 49 D 4.5974 8.5801 119.0936 54.3550 41.5385 176.0956 50 L 4.4433 8.2233 121.7114 54.2171 42.6662 177.0977 51 V 2.1907 7.7981 121.9303 63.2587 31.9042 175.7765 52 A 4.2371 8.3929 129.1302 51.0576 19.1247 176.5288 53 P 4.2021 0.0000 0.0000 65.5635 31.6089 176.8887 54 D 4.9332 7.8076 114.7877 53.8674 43.3420 175.4587 55 A 4.3140 8.4260 121.5537 52.2212 20.3618 177.5959 56 S 4.8450 8.5347 115.3981 57.3505 64.7384 174.3385 57 V 4.7696 8.8010 119.3588 59.9221 34.1471 175.2060 58 L 4.9009 9.2064 126.3578 53.7318 43.4934 175.6235 59 V 5.2105 8.4541 118.4976 59.6016 36.1543 174.9706 60 K 4.8108 8.9647 122.1501 54.8608 34.7736 175.0475 61 Y 5.5528 8.0329 121.2359 55.6134 42.1049 174.0635 62 S 4.9498 9.4142 116.1990 56.7699 67.4042 173.1912 63 G 3.0010 8.5901 110.6195 44.0378 0.0000 171.6354 64 Y 5.3048 9.1227 120.1221 55.9812 42.3646 174.4296 65 L 5.1552 8.6354 121.4526 52.9565 44.7540 177.3916 66 E 3.5765 8.5964 123.0028 59.3716 29.6752 177.6146 67 H 4.4437 8.0780 111.1476 56.7117 28.8444 174.6096 68 M 4.7372 7.4411 120.1608 53.9254 34.2676 175.1756 69 D 4.9728 8.6616 119.8746 53.0130 40.0304 176.0811 70 R 4.8163 7.6045 117.3465 53.4850 33.8407 173.2955 71 P 3.5973 0.0000 0.0000 63.0486 31.4185 176.4944 72 F 4.4915 8.4884 116.6202 59.3516 38.8582 175.2563 73 D 4.6551 6.6761 118.1606 52.5996 44.6966 173.9120 74 S 4.6246 8.2730 118.9638 56.1381 65.5686 172.9164 75 N 3.8653 7.9291 126.1290 53.5956 39.4355 173.1635 *83 L 4.3481 8.1819 120.8408 55.4726 43.3862 176.0664 84 M 4.4365 8.5176 124.2266 55.4886 35.9221 174.0887 85 K 4.7040 8.7004 130.9225 54.0697 33.3797 173.9279 86 L 4.4859 8.2669 126.2210 54.4155 40.8764 178.3007 *88 E 4.3065 8.3931 118.9754 56.1060 31.4580 176.0396 89 D 4.2752 7.7309 121.2577 54.8292 41.2320 177.1453 90 I 3.7998 8.2636 120.4812 60.7185 34.6138 174.2226 91 T 4.6299 7.8315 122.6515 60.2281 71.1766 175.1226 92 L 3.8878 8.0378 125.9086 54.5401 43.1892 177.5931 93 W 4.3603 8.7273 135.0000 60.6773 30.7265 177.9165 94 G 2.3488 7.7312 105.7735 47.6119 0.0000 175.2366 95 M 3.5304 6.6002 119.8096 57.8696 32.2502 177.6863 96 E 3.7640 8.0798 119.7164 59.3887 29.6602 178.8208 97 L 3.9949 7.6322 117.6561 57.4915 41.8837 179.4723 98 G 3.2866 7.9131 105.9557 47.7433 0.0000 175.6372 99 L 3.9670 7.8421 122.2980 57.3665 41.4179 179.6571 100 L 3.9512 7.6722 117.8152 56.9364 41.5839 178.6496 101 S 4.5302 7.7627 112.1455 58.0433 63.9786 173.7865 102 M 4.8084 7.4298 122.9675 54.0811 34.1088 174.9921 103 R 5.1328 8.2979 118.1356 53.8207 34.1194 175.4671 104 R 4.2476 8.6480 120.2129 58.2624 30.3153 177.4932 105 G 4.0803 9.3759 114.6341 44.8373 0.0000 172.9943 106 E 4.5105 8.1669 121.6436 55.7831 31.3064 175.0088 107 L 5.2884 9.0779 127.5734 53.3373 45.0166 175.0007 108 A 5.0491 9.1679 126.9476 50.2880 23.1022 174.5852 109 R 5.1010 8.7570 118.4676 54.5416 33.3108 175.4334 110 F 5.2056 9.4030 119.8898 55.7001 43.9949 173.5875 111 L 4.8738 8.6363 120.8433 52.9284 44.8771 175.4084 112 F 5.5946 8.7233 122.8204 55.5342 41.1975 175.8265 113 K 4.5262 9.0732 123.7952 55.6026 33.1157 176.5241 114 P 4.3302 0.0000 0.0000 66.0790 31.3818 178.8576 115 N 4.4048 8.3311 113.9729 55.6869 38.6485 175.1120 116 Y 4.7253 8.4105 114.1071 57.3872 40.3035 175.6141 117 A 4.3024 8.0714 121.1445 52.7214 18.5336 176.8929 118 Y 4.5978 9.1901 122.5776 57.2062 40.2417 177.0456 119 G 4.0643 8.2566 109.5919 45.6221 0.0000 175.0483 120 T 3.8818 8.4298 107.7268 64.5435 69.2396 176.4994 121 L 3.9797 8.0707 123.1566 55.6279 42.8844 177.9464 122 G 3.9535 7.8161 106.5843 45.9060 0.0000 173.6168 123 C 4.6844 8.2869 111.4007 56.7562 29.0425 171.4236 124 P 4.5303 0.0000 0.0000 62.0905 31.7050 175.5815 125 P 4.5656 0.0000 0.0000 63.0020 32.0435 176.7857 126 L 3.9425 7.9338 121.4309 57.9191 42.3571 176.5548 127 I 4.3154 7.5168 121.9084 58.6146 39.1578 173.8090 128 P 4.7298 0.0000 0.0000 61.3332 32.2478 174.6472 129 P 4.3873 0.0000 0.0000 62.8189 32.0359 175.9467 130 N 4.2380 8.6577 118.0164 54.8053 36.5318 174.4812 131 T 4.5857 7.9867 113.5989 62.7593 70.1424 175.2197 132 T 4.6832 8.7089 123.2917 63.3102 69.4722 174.5908 133 V 5.0113 8.9277 119.6380 59.7113 35.3198 174.3099 134 L 4.9843 9.0573 125.0678 53.3717 44.6028 175.0756 135 F 5.3174 9.0851 124.5036 55.6901 42.7214 173.4600 136 E 5.1751 9.2783 124.5179 54.8575 31.6319 174.5876 137 I 5.3108 9.2849 127.4162 59.5752 41.4183 173.7271 138 E 5.0065 9.6771 128.1811 54.4754 32.1347 174.5127 139 L 4.7745 8.9428 130.5929 53.9893 41.8078 176.6418 140 L 4.2372 8.8431 127.1814 57.6105 42.4267 176.7577 141 D 4.7806 7.9487 115.4330 53.6824 44.6233 174.2726 142 F 5.5038 8.2527 116.2143 55.4743 41.1324 174.2051 143 L 4.3760 8.8666 120.2960 55.0932 42.7436 176.2739 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 19 Q 8.33 4.31 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.97 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 20 S 8.01 4.13 0.00 4.29 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 21 L 9.80 4.00 0.00 1.79 1.94 0.95 1.24 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 22 Y 8.48 4.28 0.00 3.10 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 23 E 8.10 4.02 0.00 2.16 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 2.43 0.00 24 R 8.02 4.08 0.00 2.02 1.99 0.00 3.32 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.83 0.00 25 L 8.43 4.02 0.00 1.79 1.66 0.90 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.11 4.38 0.00 4.07 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 0.00 27 Q 7.31 3.90 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.05 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 28 R 8.79 3.98 0.00 1.95 2.07 0.00 3.35 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 29 M 7.38 4.29 0.00 1.77 2.07 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.38 0.00 30 L 8.93 4.09 0.00 1.67 1.65 0.89 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.66 5.19 0.00 2.67 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 32 I 8.38 4.15 1.85 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 1.32 0.63 0.93 0.00 0.00 33 S 8.21 4.26 0.00 3.61 3.48 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 34 G 8.89 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 35 D 7.65 4.77 0.00 2.81 2.78 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 36 R 8.47 3.90 0.00 2.03 2.11 0.00 3.44 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 37 G 8.55 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.58 4.88 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 1.06 0.00 0.00 -0.02 0.00 0.00 39 L 8.82 5.28 0.00 1.63 1.44 0.99 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 40 K 9.10 4.59 0.00 1.65 1.47 0.00 1.62 0.00 0.00 1.49 0.00 0.00 2.65 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.97 0.37 7.81 41 D 8.53 4.91 0.00 2.62 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 42 V 8.35 3.98 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 0.88 0.00 0.00 0.85 0.00 0.00 43 I 8.73 4.22 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.98 0.89 0.00 0.00 44 R 7.60 4.65 0.00 1.86 1.69 0.00 3.24 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 1.59 1.64 0.00 45 E 9.00 4.33 0.00 1.90 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 2.30 2.26 0.00 46 G 8.44 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 47 A 8.47 4.51 1.24 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 0.00 0.00 0.00 48 G 8.58 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.58 4.60 0.00 2.87 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 50 L 8.22 4.44 0.00 1.51 1.53 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 51 V 7.80 2.19 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 0.41 0.00 0.00 0.24 0.00 0.00 52 A 8.39 4.24 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 53 P 0.00 4.20 0.00 2.04 2.17 0.00 3.63 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 2.04 2.14 0.00 54 D 7.81 4.93 0.00 2.50 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.43 4.31 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 56 S 8.53 4.84 0.00 3.95 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 57 V 8.80 4.77 2.14 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 0.78 0.00 0.00 0.97 0.00 0.00 58 L 9.21 4.90 0.00 1.76 1.73 0.96 0.94 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 59 V 8.45 5.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.10 0.00 0.00 60 K 8.96 4.81 0.00 1.72 1.67 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.37 7.81 61 Y 8.03 5.55 0.00 3.27 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 9.41 4.95 0.00 3.85 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 63 G 8.59 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 0.00 0.00 0.00 64 Y 9.12 5.30 0.00 2.97 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 65 L 8.64 5.16 0.00 1.62 1.43 0.74 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.60 3.58 0.00 1.16 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.87 0.00 67 H 8.08 4.44 0.00 3.29 3.36 0.00 5.53 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 M 7.44 4.74 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 69 D 8.66 4.97 0.00 2.79 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 70 R 7.60 4.82 0.00 1.78 1.81 0.00 3.40 0.00 0.00 3.32 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 71 P 0.00 3.60 0.00 1.72 1.14 0.00 3.73 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 1.81 1.76 0.00 72 F 8.49 4.49 0.00 2.97 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 6.68 4.66 0.00 2.57 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 0.00 0.00 0.00 74 S 8.27 4.62 0.00 3.63 3.49 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 75 N 7.93 3.87 0.00 2.10 2.45 0.00 0.00 7.12 7.32 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 *83 L 8.18 4.35 0.00 1.76 1.62 0.95 0.90 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 84 M 8.52 4.44 0.00 2.16 1.91 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 85 K 8.70 4.70 0.00 1.49 1.68 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.80 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.42 1.04 7.81 86 L 8.27 4.49 0.00 1.53 1.85 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 *88 E 8.39 4.31 0.00 2.09 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 2.17 2.34 0.00 89 D 7.73 4.28 0.00 2.69 2.65 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 0.00 0.00 0.00 0.00 90 I 8.26 3.80 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 1.41 0.62 0.91 0.00 0.00 91 T 7.83 4.63 4.18 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 1.13 0.00 0.00 92 L 8.04 3.89 0.00 1.53 1.12 0.37 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 93 W 8.73 4.36 0.00 3.24 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 7.73 2.35 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 0.00 95 M 6.60 3.53 0.00 1.80 1.44 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 96 E 8.08 3.76 0.00 2.00 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 2.32 2.31 0.00 97 L 7.63 3.99 0.00 1.32 1.51 0.31 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 98 G 7.91 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 0.00 0.00 0.00 99 L 7.84 3.97 0.00 1.69 1.63 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.67 3.95 0.00 1.74 1.69 0.84 0.93 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 0.00 101 S 7.76 4.53 0.00 4.08 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 0.00 102 M 7.43 4.81 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.89 0.00 103 R 8.30 5.13 0.00 1.91 2.02 0.00 3.16 0.00 0.00 3.13 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.55 0.00 104 R 8.65 4.25 0.00 2.03 1.89 0.00 3.14 0.00 0.00 3.01 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 105 G 9.38 4.08 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 0.00 0.00 0.00 106 E 8.17 4.51 0.00 2.24 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 2.34 2.45 0.00 107 L 9.08 5.29 0.00 1.77 1.47 1.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 108 A 9.17 5.05 0.96 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 0.00 109 R 8.76 5.10 0.00 1.53 1.68 0.00 2.95 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 110 F 9.40 5.21 0.00 2.32 2.35 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 0.00 111 L 8.64 4.87 0.00 1.47 1.46 0.84 0.40 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 0.00 112 F 8.72 5.59 0.00 3.03 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 0.00 113 K 9.07 4.53 0.00 1.88 1.87 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.67 1.66 7.81 114 P 0.00 4.33 0.00 2.24 2.20 0.00 3.71 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 115 N 8.33 4.40 0.00 2.66 2.68 0.00 0.00 6.74 7.46 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 0.00 116 Y 8.41 4.73 0.00 3.05 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 0.00 117 A 8.07 4.30 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 0.00 118 Y 9.19 4.60 0.00 3.07 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 0.00 119 G 8.26 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 0.00 120 T 8.43 3.88 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 121 L 8.07 3.98 0.00 1.64 1.77 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 122 G 7.82 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 C 8.29 4.68 0.00 2.68 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 0.00 124 P 0.00 4.53 0.00 2.16 2.04 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 125 P 0.00 4.57 0.00 2.18 2.17 0.00 3.75 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 1.94 1.93 0.00 126 L 7.93 3.94 0.00 1.57 1.70 0.92 0.98 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 0.00 127 I 7.52 4.32 1.68 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.06 0.75 0.00 0.00 128 P 0.00 4.73 0.00 1.92 1.96 0.00 3.68 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 1.96 2.05 0.00 129 P 0.00 4.39 0.00 1.94 2.25 0.00 3.87 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 130 N 8.66 4.24 0.00 2.90 2.95 0.00 0.00 6.93 7.34 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 0.00 131 T 7.99 4.59 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 132 T 8.71 4.68 4.53 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 1.41 0.00 0.00 133 V 8.93 5.01 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 1.05 0.00 0.00 1.62 0.00 0.00 134 L 9.06 4.98 0.00 1.07 1.48 0.49 1.21 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 0.00 135 F 9.09 5.32 0.00 2.89 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 0.00 136 E 9.28 5.18 0.00 2.15 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 2.32 2.33 0.00 137 I 9.28 5.31 2.19 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.89 1.05 0.00 0.00 138 E 9.68 5.01 0.00 2.03 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 2.25 2.38 0.00 139 L 8.94 4.77 0.00 1.84 1.65 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 140 L 8.84 4.24 0.00 1.74 1.75 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 141 D 7.95 4.78 0.00 2.69 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 0.00 142 F 8.25 5.50 0.00 3.06 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 0.00 143 L 8.87 4.38 0.00 1.64 1.51 0.94 0.91 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 * Residues marked with a * may have inaccurate shift predictions.