NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *46 Y 4.4593 8.1401 119.1527 57.8453 38.6902 172.2706 47 A 4.1390 7.6979 116.9008 55.6601 22.2888 173.2412 48 S 4.5587 8.0746 111.6865 61.5427 67.3259 170.0794 49 K 4.6891 8.0676 120.7328 56.3824 35.8785 170.2904 50 A 4.8134 9.1528 121.8408 52.9955 19.5214 180.7582 51 V 4.3910 8.0204 120.5134 63.5284 32.7153 169.8917 52 P 4.7955 0.0000 0.0000 63.2424 34.1964 177.2037 *53 H 4.9518 7.4761 121.5735 56.0083 28.0066 179.3992 *54 Y 4.8210 8.2865 117.3629 56.0037 41.0618 179.1421 55 N 4.5490 8.8370 115.4506 54.0721 36.9778 176.6288 56 R 3.9551 8.8070 121.8746 58.4765 29.7909 179.0714 57 L 4.3934 8.8337 126.5637 51.5313 44.3642 175.3902 58 D 4.8539 8.6462 118.2967 51.9291 37.1318 181.0743 59 S 4.4639 9.3755 118.4516 60.6896 62.3121 173.5505 *60 Y 4.5637 7.2027 124.0516 56.7850 35.1975 177.9591 61 K 4.4815 7.7525 126.3325 55.0145 29.8055 174.4147 62 V 4.4270 6.8356 117.8357 60.8108 34.1188 176.5798 63 I 4.7089 7.7128 121.4247 58.7082 40.2206 178.0558 64 E 4.4532 9.0644 123.8967 56.2019 29.0346 177.0781 65 Q 4.3651 8.9440 115.8134 56.7767 29.2133 175.9852 66 P 4.0307 0.0000 0.0000 63.4883 28.3488 175.4405 67 I 3.7066 7.1043 127.2492 60.8311 35.2195 176.2551 68 T 4.6479 8.5387 118.1993 59.2394 71.5553 174.1212 69 S 4.4447 8.9200 123.7410 58.0456 64.9569 175.2884 70 E 3.5360 8.2231 116.3443 58.5672 31.4992 179.1559 71 T 4.3160 7.4832 116.1895 65.4728 69.0580 178.6485 72 A 4.2265 9.1564 127.1666 56.1962 18.1738 179.9337 73 M 4.0005 8.2153 119.1955 60.6474 31.3006 181.0234 74 K 4.3320 7.5968 127.6238 60.3194 31.8412 181.1600 75 K 4.6420 8.3376 127.8618 60.7047 31.0615 181.3162 76 V 4.1398 8.0729 119.3954 62.4881 31.2564 179.0253 77 E 4.5731 9.7078 118.1910 57.3234 30.8410 182.4567 78 D 4.4957 9.4543 118.4030 56.2092 40.6786 180.3992 79 G 3.8718 7.8182 107.8923 45.4062 0.0000 172.9950 80 N 4.0557 8.4297 119.0820 52.6772 34.3373 178.8794 81 I 4.9868 7.2049 118.7941 59.5217 37.7031 175.6673 82 L 4.1863 8.5179 132.0615 54.5594 41.8836 176.6167 83 V 4.5990 8.2276 128.4372 60.7377 31.7791 173.1721 *84 F 4.2181 8.1504 125.9561 59.0555 38.8441 176.2665 85 Q 4.9728 8.0140 116.2552 57.6593 30.2056 169.8025 86 V 4.1915 7.8062 113.4384 63.3506 35.3916 168.7070 87 S 4.6985 8.2568 116.2198 59.9872 63.6982 171.3871 88 M 3.8935 8.3120 127.9352 57.2215 31.9329 177.8212 89 K 4.3874 7.8581 120.1192 53.3880 31.3167 178.1252 90 A 3.9480 8.9698 128.3767 54.1465 18.2031 179.7724 91 N 4.4614 8.8187 119.7850 54.0534 39.3161 174.6845 92 K 4.0599 8.9422 126.9750 56.9513 29.5907 183.0613 *93 Y 4.2112 9.1150 124.8826 59.9288 37.9292 180.8697 94 Q 4.1188 8.1321 123.4740 62.3357 28.1192 185.0000 95 I 3.9801 7.7064 123.8471 65.9065 35.7316 179.8455 96 K 3.9722 8.5654 126.6149 60.8804 31.0403 180.9224 97 K 4.1378 8.2342 125.4140 60.3513 32.1102 180.2928 98 A 4.1601 9.2165 123.9026 54.5003 17.8550 180.3352 99 V 3.6573 7.5121 119.5321 66.1739 32.4773 181.3081 100 K 4.1024 8.7103 126.9460 60.5351 31.1309 180.2304 101 E 4.5906 8.7401 119.0692 60.2507 30.2553 182.8598 102 L 3.8215 8.3542 119.5678 59.1532 40.9322 180.5569 *103 Y 3.8508 8.6814 124.1242 59.2712 37.7388 180.0991 104 E 4.1476 8.2003 107.7681 58.1639 26.4260 180.4220 105 V 4.4918 8.3463 124.0825 62.6714 36.9511 172.5052 106 D 5.3834 7.1887 118.4805 51.6952 40.9647 178.6270 107 V 4.6530 7.7751 119.9794 60.2646 35.8417 175.8793 108 L 4.5556 8.7805 121.9548 56.0411 42.5542 178.0287 109 K 4.8119 7.7122 121.2014 53.5814 35.5322 179.4640 110 V 4.8594 8.4709 109.9657 64.3906 35.2717 172.1987 111 N 3.9550 7.5138 118.7752 50.7712 37.8201 179.1222 112 T 5.3358 8.1339 119.6725 58.0239 70.4867 171.1671 113 L 4.1304 8.4896 132.3835 55.1024 42.6239 176.4922 114 V 4.4518 8.0640 121.9607 60.8445 29.7476 177.1424 115 R 3.8597 8.2982 127.3227 55.0771 30.7824 177.5476 116 P 4.4443 0.0000 0.0000 64.6104 30.8086 178.2008 117 N 4.7541 8.4468 115.0661 54.9242 38.9305 180.2484 118 G 3.6708 8.7543 109.0423 46.3597 0.0000 173.7489 119 T 3.7503 8.2136 117.0516 63.0429 69.2770 178.6684 120 K 4.6828 8.7015 134.8717 53.4315 30.5627 172.1334 121 K 4.5076 8.4479 128.0397 53.7874 33.5430 175.7471 122 A 4.5311 8.1854 128.1568 50.8741 21.3815 177.4711 *123 Y 4.5204 8.8123 122.4708 56.2169 39.0250 176.4130 124 V 4.6986 8.4356 127.2143 59.4006 34.0414 174.8726 125 R 4.9727 8.0776 125.9725 57.2813 32.3264 176.7474 126 L 4.4358 8.1486 114.8835 56.7295 44.8233 172.3584 127 T 4.1886 8.1927 116.2836 59.0176 69.2405 171.3708 128 A 4.1208 8.7344 123.5798 57.6577 19.1597 181.2079 129 D 4.6483 8.0707 116.4946 54.7330 39.0315 184.0671 *130 Y 3.7516 7.2635 120.7467 58.8490 35.0192 174.3847 131 D 4.9827 8.3863 127.6605 52.0065 41.9513 175.6447 132 A 3.7267 8.3106 132.1340 53.7511 18.2386 180.3443 133 L 4.0834 5.7990 124.6164 60.9966 41.1530 180.3207 134 D 4.8293 8.6762 123.4776 59.0777 39.9251 181.1816 135 I 4.3804 7.4368 117.4833 61.8741 36.1537 177.6123 136 A 4.7510 8.3175 124.5384 53.9864 19.0973 179.7715 137 N 4.4219 8.1194 123.6457 56.8904 38.5835 179.4906 138 R 3.9915 7.8682 118.4370 57.9481 29.2552 178.9050 139 I 4.1456 7.9415 118.5784 60.6683 36.2453 176.9391 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 *46 Y 8.14 4.46 0.00 2.35 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 0.00 0.00 0.00 0.00 47 A 7.70 4.14 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 S 8.07 4.56 0.00 3.58 3.63 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 49 K 8.07 4.69 0.00 1.72 1.66 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.10 0.82 7.81 50 A 9.15 4.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.02 4.39 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 0.67 0.00 0.00 0.93 0.00 0.00 52 P 0.00 4.80 0.00 2.07 1.86 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.55 0.00 *53 H 7.48 4.95 0.00 3.01 2.55 0.00 7.11 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *54 Y 8.29 4.82 0.00 2.18 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 0.00 0.00 0.00 55 N 8.84 4.55 0.00 2.73 2.72 0.00 0.00 6.57 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 56 R 8.81 3.96 0.00 1.72 1.82 0.00 3.19 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.47 0.00 57 L 8.83 4.39 0.00 1.63 1.33 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 58 D 8.65 4.85 0.00 2.68 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 0.00 0.00 0.00 0.00 59 S 9.38 4.46 0.00 3.81 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 *60 Y 7.20 4.56 0.00 2.36 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 0.00 0.00 0.00 61 K 7.75 4.48 0.00 1.86 1.75 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.15 0.74 7.81 62 V 6.84 4.43 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 0.93 0.00 0.00 63 I 7.71 4.71 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 1.27 1.23 0.91 0.00 0.00 64 E 9.06 4.45 0.00 1.98 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.89 0.00 65 Q 8.94 4.37 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.41 0.00 0.00 0.00 0.00 0.00 2.24 1.88 0.00 66 P 0.00 4.03 0.00 2.07 2.39 0.00 3.74 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.58 0.00 67 I 7.10 3.71 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 1.16 1.09 0.91 0.00 0.00 68 T 8.54 4.65 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 1.21 0.00 0.00 69 S 8.92 4.44 0.00 3.60 3.68 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 70 E 8.22 3.54 0.00 1.97 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 0.00 2.26 1.87 0.00 71 T 7.48 4.32 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 1.21 0.00 0.00 72 A 9.16 4.23 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 73 M 8.22 4.00 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.21 0.00 74 K 7.60 4.33 0.00 1.95 1.86 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.34 7.81 75 K 8.34 4.64 0.00 1.74 1.89 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.37 7.81 76 V 8.07 4.14 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 0.71 0.00 0.00 0.93 0.00 0.00 77 E 9.71 4.57 0.00 1.68 1.64 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 2.13 2.08 0.00 78 D 9.45 4.50 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 7.82 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.43 4.06 0.00 2.95 2.75 0.00 0.00 6.69 7.79 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 81 I 7.20 4.99 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 1.27 0.52 0.91 0.00 0.00 82 L 8.52 4.19 0.00 1.33 1.60 0.92 0.88 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 83 V 8.23 4.60 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 0.85 0.00 0.00 0.93 0.00 0.00 *84 F 8.15 4.22 0.00 1.96 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 85 Q 8.01 4.97 0.00 2.02 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.75 0.00 0.00 0.00 0.00 0.00 2.16 1.87 0.00 86 V 7.81 4.19 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 0.93 0.00 0.00 87 S 8.26 4.70 0.00 3.58 3.67 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 0.00 0.00 0.00 88 M 8.31 3.89 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.17 0.00 89 K 7.86 4.39 0.00 1.77 1.72 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.01 7.81 90 A 8.97 3.95 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 91 N 8.82 4.46 0.00 2.66 2.82 0.00 0.00 7.09 7.04 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 92 K 8.94 4.06 0.00 1.87 1.73 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.23 1.23 7.81 *93 Y 9.12 4.21 0.00 2.23 2.33 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 94 Q 8.13 4.12 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.50 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 95 I 7.71 3.98 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 1.38 0.52 0.91 0.00 0.00 96 K 8.57 3.97 0.00 1.75 1.78 0.00 1.79 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.11 7.81 97 K 8.23 4.14 0.00 1.88 1.79 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.36 7.81 98 A 9.22 4.16 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 99 V 7.51 3.66 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 0.93 0.00 0.00 100 K 8.71 4.10 0.00 1.70 1.89 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.36 7.81 101 E 8.74 4.59 0.00 2.02 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 2.20 2.18 0.00 102 L 8.35 3.82 0.00 1.65 1.44 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 *103 Y 8.68 3.85 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.20 4.15 0.00 2.05 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 2.20 2.07 0.00 105 V 8.35 4.49 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 0.86 0.00 0.00 0.93 0.00 0.00 106 D 7.19 5.38 0.00 2.69 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 0.00 107 V 7.78 4.65 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 0.87 0.00 0.00 0.93 0.00 0.00 108 L 8.78 4.56 0.00 1.63 1.56 0.92 0.64 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 0.00 109 K 7.71 4.81 0.00 1.62 1.67 0.00 1.77 0.00 0.00 1.85 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 0.95 7.81 110 V 8.47 4.86 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 1.19 0.00 0.00 0.93 0.00 0.00 111 N 7.51 3.96 0.00 2.66 2.69 0.00 0.00 6.68 7.22 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 0.00 112 T 8.13 5.34 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 1.21 0.00 0.00 113 L 8.49 4.13 0.00 1.33 1.58 0.92 0.86 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 0.00 114 V 8.06 4.45 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 0.86 0.00 0.00 0.93 0.00 0.00 115 R 8.30 3.86 0.00 1.72 1.86 0.00 3.25 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.51 0.00 116 P 0.00 4.44 0.00 2.08 1.99 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.60 0.00 117 N 8.45 4.75 0.00 2.74 2.73 0.00 0.00 7.05 7.22 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 0.00 118 G 8.75 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 119 T 8.21 3.75 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 1.21 0.00 0.00 120 K 8.70 4.68 0.00 1.52 1.64 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.28 0.99 7.81 121 K 8.45 4.51 0.00 1.50 1.71 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.33 1.26 7.81 122 A 8.19 4.53 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 *123 Y 8.81 4.52 0.00 1.97 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 0.00 0.00 0.00 0.00 124 V 8.44 4.70 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 0.84 0.00 0.00 0.93 0.00 0.00 125 R 8.08 4.97 0.00 1.57 1.62 0.00 3.27 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.17 0.00 126 L 8.15 4.44 0.00 1.59 1.41 0.92 0.92 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 0.00 127 T 8.19 4.19 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 1.21 0.00 0.00 128 A 8.73 4.12 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.07 4.65 0.00 2.72 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 0.00 0.00 0.00 0.00 *130 Y 7.26 3.75 0.00 2.37 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 0.00 0.00 0.00 0.00 131 D 8.39 4.98 0.00 2.57 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 0.00 132 A 8.31 3.73 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 5.80 4.08 0.00 1.58 1.65 0.92 1.00 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 0.00 134 D 8.68 4.83 0.00 2.73 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.44 4.38 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 1.57 1.11 0.91 0.00 0.00 136 A 8.32 4.75 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 0.00 137 N 8.12 4.42 0.00 2.76 2.74 0.00 0.00 6.82 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 0.00 138 R 7.87 3.99 0.00 1.82 1.66 0.00 3.26 0.00 0.00 3.26 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 139 I 7.94 4.15 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 1.27 0.89 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.