NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.3301 8.1749 110.9393 60.9740 70.1526 172.8381 3 I 3.8436 8.0012 122.6266 60.7029 37.6444 174.9350 4 A 4.4257 9.4531 129.8419 51.8566 20.3624 176.0377 5 I 4.7779 8.1358 121.2049 59.3615 40.9670 174.7534 6 V 4.8129 8.3176 126.1697 61.0940 34.5727 173.9743 7 I 5.1186 9.0355 128.7424 59.6647 39.8684 174.9290 8 G 5.3540 9.5087 113.2136 43.9010 0.0000 171.5502 9 T 5.2106 8.1996 110.4174 59.9174 72.4006 173.4064 10 H 4.2206 9.1518 119.6278 56.9254 29.4048 178.0471 11 G 2.8308 8.2580 108.3353 45.8386 0.0000 175.2831 12 W 4.6377 8.8135 123.1669 56.2879 30.3526 177.0457 13 A 4.2140 7.8422 123.3878 54.5628 17.7943 180.1202 14 A 3.9702 8.1252 119.3514 55.5578 18.4771 179.1904 15 E 2.9155 7.7729 117.0231 59.2657 29.4251 178.9561 16 Q 3.9393 7.7818 117.5205 58.7171 28.8602 178.3980 17 L 3.9580 8.0577 120.2850 57.5765 41.5464 179.2957 18 L 3.9489 7.8280 120.3200 58.0998 42.0419 179.1559 19 K 3.9214 7.9362 118.4240 59.6543 31.8406 179.5019 20 T 3.7966 8.1901 116.0186 66.5371 68.4258 176.4602 21 A 3.9908 7.9968 122.5960 55.4431 18.3605 179.6174 22 E 4.6648 8.5035 118.2959 58.8692 29.2235 179.2015 23 M 4.0404 7.7283 117.9957 58.1922 32.3064 177.7131 24 L 4.2422 7.5165 118.1805 56.5034 42.2149 178.1193 25 L 4.6032 8.5820 116.3609 53.2221 43.2607 177.3906 26 G 4.0222 7.8984 105.2092 44.5404 0.0000 172.7623 27 E 4.3187 8.3739 118.3337 56.6602 29.9602 176.8982 28 Q 4.6751 9.0545 122.0964 54.2936 30.9476 175.1123 29 E 4.6112 8.4170 119.9247 55.4574 32.0552 174.7274 30 N 4.1752 8.6313 115.6213 54.9621 37.3496 173.5801 31 V 4.6957 7.8895 114.7161 60.9062 34.7806 174.4332 32 G 4.5341 9.1562 114.0023 44.5094 0.0000 171.0438 33 W 5.9651 7.8499 115.4193 55.4203 30.4850 173.6374 34 I 4.7152 9.0533 113.9910 59.3169 40.8832 173.5910 35 D 5.3272 8.6856 121.8389 51.6661 42.5883 175.1366 36 F 5.1025 8.3755 120.7505 56.7073 42.4625 173.6969 37 V 4.1040 9.3322 126.3872 59.8149 33.4613 173.1925 38 P 4.3955 0.0000 0.0000 64.1062 31.6380 175.9472 39 G 4.1792 9.1212 110.3753 45.9160 0.0000 174.0451 40 E 4.3778 8.1242 118.0897 55.8986 30.7029 175.4984 41 N 5.0039 8.0721 116.8634 50.6885 43.6133 175.2933 42 A 3.8483 8.2705 121.5981 55.6403 18.3713 179.6173 43 E 3.8910 8.0204 116.6223 59.6595 29.5634 179.5369 44 T 3.8146 7.7100 115.3299 66.6800 68.6059 176.5537 45 L 3.7602 7.6137 120.5683 57.6438 41.4489 179.5797 46 I 3.7998 8.0587 120.2012 64.5013 36.9853 178.2808 47 E 3.9462 8.0039 118.8269 59.3071 29.3980 179.5620 48 K 3.8389 7.8821 118.4392 59.6008 32.0671 178.9741 49 Y 4.3965 8.1086 117.3087 61.3469 37.8540 178.4456 50 N 4.4186 8.6569 117.4542 56.3871 38.4134 177.3471 51 A 4.0305 8.0451 121.3143 55.1250 18.6931 179.4904 52 Q 4.0317 7.9670 116.3817 59.1024 28.8056 178.7281 53 L 4.0082 8.4253 120.1944 57.7957 41.4418 179.3052 54 A 4.1523 7.9785 119.7339 54.6400 18.3114 178.8194 55 K 4.2990 7.7500 114.3584 55.8034 32.8910 176.4550 56 L 4.6571 7.3429 119.6334 52.7884 43.8307 175.8322 57 D 4.5901 8.8544 121.4880 53.9178 40.6424 175.9381 58 T 4.5240 8.2596 116.3944 61.4860 69.2417 176.5330 59 T 3.8990 8.5350 115.1634 64.7819 68.7263 175.3852 60 K 4.1627 8.5193 118.8807 56.0619 32.9422 175.4375 61 G 3.9499 6.3107 104.8937 42.9639 0.0000 172.6364 62 V 4.5304 8.0727 119.5232 60.7308 35.0721 173.5644 63 L 5.0399 8.6285 129.9989 53.3792 44.3428 174.8892 64 F 4.7916 9.2792 126.8189 56.4977 40.6951 174.8999 65 L 5.1324 9.0875 124.9165 53.3031 43.6446 176.1778 66 V 5.7255 9.0622 117.2943 58.5177 35.6458 176.8763 67 D 4.5636 9.0003 121.6618 56.3965 39.5807 176.4056 68 T 4.9516 7.7907 108.8741 58.3715 71.9656 172.6669 69 W 3.2064 8.5839 133.3713 58.4664 31.1151 176.5981 70 G 3.8474 6.7586 113.5994 45.7568 0.0000 174.0698 71 G 4.0945 7.4654 105.9480 43.6592 0.0000 174.8140 72 S 4.0263 8.6524 115.4548 61.2338 62.8096 175.1443 73 P 4.2628 0.0000 0.0000 65.6279 30.9595 178.4349 74 F 3.8873 8.1202 118.6913 61.3280 39.4080 176.7426 75 N 4.1552 8.7928 116.2380 56.2375 37.8157 177.3160 76 A 3.8481 8.2627 122.2401 55.0522 18.4953 179.5308 77 A 3.0545 7.5308 118.9763 55.0142 17.8996 179.9469 78 S 3.6492 7.5663 113.8237 61.7547 62.5836 177.2559 79 R 3.8441 7.3192 119.2453 58.9245 29.7647 178.8979 80 I 3.8057 6.7797 118.4163 64.1914 37.5248 178.3523 81 V 3.8854 7.8395 112.2712 63.3397 31.2400 179.4471 82 V 3.5017 6.6502 111.9258 64.0668 31.3539 178.1978 83 D 4.9546 7.6883 117.6914 54.0224 41.7852 175.7908 84 K 4.3715 7.7897 117.9761 54.2334 34.3021 176.3066 85 E 4.0509 8.4480 124.2088 57.2430 30.4536 175.5548 86 H 2.8027 8.7377 120.2367 56.8243 26.1749 173.4665 87 Y 5.1467 7.9517 115.2092 56.3106 40.9088 174.8522 88 E 4.9373 9.5103 123.5429 54.8134 34.0783 173.6215 89 V 4.9609 8.4666 123.3915 61.1414 34.2243 174.5620 90 I 4.7810 8.9563 128.2052 59.5451 39.9839 175.2705 91 A 4.7565 9.1285 129.0266 51.8631 20.0578 176.7715 92 G 3.8552 8.4881 105.7007 45.8623 0.0000 174.4745 93 V 3.6417 7.5533 118.7173 62.2343 31.6187 175.5646 94 N 5.1106 8.3689 119.5680 50.2599 41.8210 175.4771 95 I 3.7034 8.2409 120.8365 64.0956 37.1331 176.8006 96 P 4.2400 0.0000 0.0000 65.7023 31.1999 178.2496 97 M 3.9913 8.7778 117.3261 58.5255 32.1437 177.9574 98 L 3.9311 7.9774 120.3913 58.1336 42.3004 179.0525 99 V 3.5427 8.0765 118.4435 66.0893 31.5164 177.5944 100 E 3.9391 8.2853 119.0237 59.5178 29.4396 178.9363 101 T 3.8438 8.0019 115.7483 66.6823 68.3299 176.7761 102 L 4.0003 7.8730 119.7646 57.8262 41.7121 179.0159 103 M 4.1410 8.2191 118.0021 58.6802 32.1986 178.2474 104 A 4.2771 8.1078 122.2928 54.4750 18.3655 179.3043 105 R 3.8000 7.9888 117.4163 59.9352 29.7806 178.2556 106 D 4.5188 7.6754 116.1426 56.1345 40.5268 177.0377 107 D 4.6837 8.1029 119.7745 51.9702 40.7112 175.8823 108 D 4.3689 7.6277 117.5801 55.2126 39.8085 170.7636 109 P 4.5522 0.0000 0.0000 62.0464 33.1098 177.1148 110 S 4.4655 8.4059 113.9373 57.5200 65.0569 174.9909 111 F 3.9930 8.6614 123.9766 61.8490 39.1044 176.9358 112 D 4.3374 8.2568 117.7718 57.3646 40.6072 178.6037 113 E 3.9065 8.0189 118.5605 59.2703 29.4119 179.1667 114 L 3.8268 7.8319 120.2767 57.9952 42.2781 178.9803 115 V 3.3413 7.4526 117.9777 65.9534 31.4176 177.7627 116 A 3.9646 7.8472 120.3248 55.1051 18.1334 179.3325 117 L 3.8583 8.0205 118.5703 58.1534 42.1556 178.9925 118 A 3.9462 8.1990 121.0140 55.1623 18.3147 179.8288 119 V 3.5244 7.6419 116.3252 66.0752 31.5865 177.8706 120 E 3.9177 8.2650 119.3154 59.5846 29.5424 178.9340 121 T 4.0125 8.3681 110.3268 64.4560 68.6353 176.9225 122 G 3.5883 7.9103 107.9868 47.8104 0.0000 175.6750 123 R 4.1164 7.9871 120.8489 58.9500 29.9503 178.9721 124 E 4.2127 8.3382 117.1691 58.6853 29.5249 179.0975 125 G 3.8791 7.9025 104.8907 45.4756 0.0000 173.6144 126 V 4.0587 7.1525 120.8672 61.8576 31.5412 175.3663 127 K 4.4994 8.2683 125.2347 55.2725 36.0612 175.3057 128 A 4.5693 8.2846 125.9768 50.6368 20.4083 177.0547 129 L 3.8584 8.4934 126.0602 58.4871 42.6165 177.8874 *130 K 4.1323 7.8326 122.8673 54.7360 32.3452 177.4780 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 2 T 8.17 4.33 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 3 I 8.00 3.84 1.88 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 1.59 0.70 1.04 0.00 0.00 4 A 9.45 4.43 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 5 I 8.14 4.78 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 0.78 0.88 0.00 0.00 6 V 8.32 4.81 1.37 0.00 0.00 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 0.00 0.00 0.65 0.00 0.00 7 I 9.04 5.12 2.06 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 1.23 0.61 1.07 0.00 0.00 8 G 9.51 5.35 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 9 T 8.20 5.21 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 1.31 0.00 0.00 10 H 9.15 4.22 0.00 3.02 3.17 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 8.26 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 0.00 0.00 0.00 12 W 8.81 4.64 0.00 3.40 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 13 A 7.84 4.21 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 14 A 8.13 3.97 1.56 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 15 E 7.77 2.92 0.00 1.16 1.34 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 1.97 1.65 0.00 16 Q 7.78 3.94 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 17 L 8.06 3.96 0.00 1.83 1.72 0.96 0.34 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 18 L 7.83 3.95 0.00 1.75 1.68 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.94 3.92 0.00 1.92 1.79 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.53 7.81 20 T 8.19 3.80 4.39 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 1.20 0.00 0.00 21 A 8.00 3.99 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 22 E 8.50 4.66 0.00 2.12 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 2.46 2.36 0.00 23 M 7.73 4.04 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 24 L 7.52 4.24 0.00 1.76 1.70 0.92 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.58 4.60 0.00 1.63 1.68 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.90 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 27 E 8.37 4.32 0.00 1.98 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 2.33 2.35 0.00 28 Q 9.05 4.68 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 29 E 8.42 4.61 0.00 1.94 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 2.23 2.27 0.00 30 N 8.63 4.18 0.00 2.95 2.81 0.00 0.00 6.29 7.98 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 31 V 7.89 4.70 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 0.93 0.00 0.00 0.98 0.00 0.00 32 G 9.16 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 0.00 0.00 0.00 0.00 33 W 7.85 5.97 0.00 3.52 3.09 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 34 I 9.05 4.72 1.57 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.92 0.68 0.00 0.00 35 D 8.69 5.33 0.00 2.48 2.85 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 36 F 8.38 5.10 0.00 2.91 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 37 V 9.33 4.10 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 1.00 0.00 0.00 0.95 0.00 0.00 38 P 0.00 4.40 0.00 2.07 1.93 0.00 3.67 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.94 0.00 39 G 9.12 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 0.00 0.00 0.00 0.00 40 E 8.12 4.38 0.00 2.44 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 0.00 2.38 2.45 0.00 41 N 8.07 5.00 0.00 2.67 2.64 0.00 0.00 6.75 8.14 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 42 A 8.27 3.85 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 43 E 8.02 3.89 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 2.35 2.36 0.00 44 T 7.71 3.81 4.32 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 1.17 0.00 0.00 45 L 7.61 3.76 0.00 1.69 1.43 0.39 0.52 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 46 I 8.06 3.80 1.99 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.86 0.89 0.00 0.00 47 E 8.00 3.95 0.00 2.13 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 2.51 2.47 0.00 48 K 7.88 3.84 0.00 1.65 1.56 0.00 1.50 0.00 0.00 1.51 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.48 7.81 49 Y 8.11 4.40 0.00 3.22 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 50 N 8.66 4.42 0.00 2.94 2.90 0.00 0.00 6.96 7.62 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 51 A 8.05 4.03 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 52 Q 7.97 4.03 0.00 2.38 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.48 0.00 0.00 0.00 0.00 0.00 2.42 2.52 0.00 53 L 8.43 4.01 0.00 1.91 1.82 1.27 0.87 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 54 A 7.98 4.15 1.36 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 55 K 7.75 4.30 0.00 1.84 1.85 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.61 7.81 56 L 7.34 4.66 0.00 1.65 1.65 0.89 0.96 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 57 D 8.85 4.59 0.00 2.63 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 58 T 8.26 4.52 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 1.22 0.00 0.00 59 T 8.54 3.90 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 1.27 0.00 0.00 60 K 8.52 4.16 0.00 1.78 1.92 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.44 7.81 61 G 6.31 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 62 V 8.07 4.53 0.67 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 0.01 0.00 0.00 0.48 0.00 0.00 63 L 8.63 5.04 0.00 1.70 1.40 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.28 4.79 0.00 3.07 2.79 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 65 L 9.09 5.13 0.00 1.61 1.63 0.93 0.61 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 66 V 9.06 5.73 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 0.61 0.00 0.00 1.23 0.00 0.00 67 D 9.00 4.56 0.00 2.83 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 68 T 7.79 4.95 4.31 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 1.28 0.00 0.00 69 W 8.58 3.21 0.00 3.24 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 70 G 6.76 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 0.00 0.00 0.00 71 G 7.47 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 0.00 0.00 0.00 72 S 8.65 4.03 0.00 3.44 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 73 P 0.00 4.26 0.00 2.23 2.21 0.00 3.43 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.12 0.00 74 F 8.12 3.89 0.00 3.24 3.17 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 75 N 8.79 4.16 0.00 2.93 2.79 0.00 0.00 6.97 7.60 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 76 A 8.26 3.85 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.53 3.05 0.63 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 0.00 0.00 78 S 7.57 3.65 0.00 3.64 3.61 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 79 R 7.32 3.84 0.00 1.78 1.89 0.00 3.07 0.00 0.00 3.14 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 80 I 6.78 3.81 1.59 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.45 0.92 0.00 0.00 81 V 7.84 3.89 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.89 0.00 0.00 82 V 6.65 3.50 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 0.60 0.00 0.00 0.91 0.00 0.00 83 D 7.69 4.95 0.00 2.52 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 84 K 7.79 4.37 0.00 1.50 0.98 0.00 1.35 0.00 0.00 1.54 0.00 0.00 2.48 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.56 1.03 7.81 85 E 8.45 4.05 0.00 1.81 1.65 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 2.09 2.24 0.00 86 H 8.74 2.80 0.00 3.19 2.55 0.00 5.63 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Y 7.95 5.15 0.00 2.88 2.97 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 0.00 0.00 0.00 88 E 9.51 4.94 0.00 2.39 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 0.00 2.27 2.40 0.00 89 V 8.47 4.96 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 0.53 0.00 0.00 0.61 0.00 0.00 90 I 8.96 4.78 1.94 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 1.25 0.76 0.99 0.00 0.00 91 A 9.13 4.76 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 92 G 8.49 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 93 V 7.55 3.64 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 0.79 0.00 0.00 0.98 0.00 0.00 94 N 8.37 5.11 0.00 2.96 2.93 0.00 0.00 6.29 7.97 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 95 I 8.24 3.70 1.88 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 1.65 0.94 0.91 0.00 0.00 96 P 0.00 4.24 0.00 2.28 2.10 0.00 3.72 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 2.12 2.15 0.00 97 M 8.78 3.99 0.00 2.26 2.11 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 2.84 2.55 0.00 98 L 7.98 3.93 0.00 1.91 1.65 0.93 0.81 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 99 V 8.08 3.54 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 0.89 0.00 0.00 0.99 0.00 0.00 100 E 8.29 3.94 0.00 2.23 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 2.30 2.49 0.00 101 T 8.00 3.84 4.40 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 1.16 0.00 0.00 102 L 7.87 4.00 0.00 1.65 1.73 0.99 0.87 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 0.00 103 M 8.22 4.14 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 104 A 8.11 4.28 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 0.00 105 R 7.99 3.80 0.00 2.08 2.02 0.00 3.08 0.00 0.00 3.42 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 106 D 7.68 4.52 0.00 2.88 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 0.00 107 D 8.10 4.68 0.00 2.94 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 0.00 108 D 7.63 4.37 0.00 2.69 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 0.00 109 P 0.00 4.55 0.00 2.19 2.03 0.00 3.89 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.01 0.00 110 S 8.41 4.47 0.00 4.10 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 0.00 111 F 8.66 3.99 0.00 2.92 3.04 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 0.00 112 D 8.26 4.34 0.00 2.77 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 0.00 113 E 8.02 3.91 0.00 2.28 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 2.32 0.00 114 L 7.83 3.83 0.00 1.64 1.44 0.91 0.68 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 V 7.45 3.34 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 0.86 0.00 0.00 0.31 0.00 0.00 116 A 7.85 3.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.02 3.86 0.00 1.80 1.76 1.00 1.08 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 0.00 118 A 8.20 3.95 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 0.00 119 V 7.64 3.52 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 1.09 0.00 0.00 1.01 0.00 0.00 120 E 8.27 3.92 0.00 2.13 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 2.30 2.31 0.00 121 T 8.37 4.01 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 1.37 0.00 0.00 122 G 7.91 3.59 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 0.00 0.00 0.00 123 R 7.99 4.12 0.00 1.97 1.98 0.00 3.12 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 124 E 8.34 4.21 0.00 1.98 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 2.34 2.57 0.00 125 G 7.90 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 0.00 126 V 7.15 4.06 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 0.89 0.00 0.00 0.94 0.00 0.00 127 K 8.27 4.50 0.00 1.74 1.64 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.35 1.60 7.81 128 A 8.28 4.57 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 3.86 0.00 1.60 1.70 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 *130 K 7.83 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.