NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 63 D 4.5456 8.2227 120.1846 54.3129 43.5234 177.2819 64 L 3.7881 7.5822 120.0093 57.4329 42.1150 175.6999 65 E 3.8231 8.4260 120.1257 59.0391 29.7692 178.2043 66 A 3.9914 7.9843 120.3793 55.7425 18.3844 179.5820 67 T 3.7795 7.5306 113.9482 66.9279 68.4869 176.9299 68 L 4.0185 8.0020 120.8506 57.6529 41.5534 179.7693 69 R 3.8066 8.6270 118.7710 59.0332 29.9554 178.8971 70 A 3.9833 8.3031 120.9740 55.1194 18.3102 179.7764 71 I 3.5957 7.6682 118.2120 64.4815 37.1559 178.5189 72 V 3.5086 7.7811 119.1335 66.4740 31.2292 177.2813 73 H 4.3820 8.2050 118.9848 58.9085 29.6353 177.2942 74 S 4.0005 8.2312 116.5022 61.4272 62.5033 176.5708 75 A 3.9740 8.1722 123.5701 55.3962 18.1184 179.8623 76 T 3.8377 8.0989 114.3671 66.8847 68.6853 177.1180 77 S 4.0691 8.0720 116.8938 61.7913 62.7111 176.9089 78 L 3.9868 7.6675 120.1582 57.5985 41.4919 178.8182 79 V 3.7623 7.5401 116.6168 63.0163 32.2235 174.7408 80 D 4.2747 7.7725 117.8888 55.3829 39.5887 172.6128 81 A 4.8521 7.9331 119.1913 51.1861 19.9604 179.0964 82 R 3.8610 9.0149 121.5194 58.8464 31.3125 176.1002 83 Y 5.2167 8.2199 115.6016 56.2237 41.6260 175.2540 84 G 4.5118 9.3174 108.9520 44.9889 0.0000 171.2232 85 A 4.9303 8.9070 125.2640 49.8207 23.2144 174.5976 *87 E 4.8398 8.7633 111.3324 57.0888 31.6634 175.4592 88 V 4.8299 8.9857 123.6221 61.3002 34.0568 173.9712 89 H 5.6390 8.9296 123.3866 53.7590 31.8052 173.5888 90 D 4.8291 8.7413 119.5645 52.4372 41.0086 177.2053 91 R 4.1005 8.5648 117.1227 58.4761 30.1072 177.5400 92 Q 4.3461 8.1520 114.4459 55.6774 28.7372 174.9784 93 H 4.1720 7.9896 113.1871 57.3841 26.7517 174.7757 94 R 4.3260 8.5941 119.0823 54.8326 30.8964 176.5020 95 V 4.0730 8.4087 122.7089 63.4153 31.9389 175.0989 96 L 4.5464 9.2580 127.9875 56.1442 43.3537 176.9715 97 H 5.0781 8.0065 114.4038 54.0262 33.3871 172.6504 98 F 5.3338 9.0305 123.9162 56.9108 41.8718 173.8703 99 V 4.2848 8.2080 119.3845 59.6478 35.0336 174.3996 100 Y 5.0828 7.1131 120.4919 56.0210 41.0520 173.3916 101 E 4.6457 10.2787 121.0219 55.8145 33.2787 175.5297 102 G 4.2037 9.1540 111.7260 45.8933 0.0000 173.3192 103 I 4.6843 7.6881 119.7589 58.3155 40.6745 175.2276 104 D 4.6818 8.5551 127.2418 53.0736 41.5811 176.9609 105 E 4.0357 8.6803 120.4601 59.3529 29.6210 178.8666 106 E 3.9790 8.2062 118.3846 59.6584 29.5571 179.2346 107 T 3.8659 8.0360 115.3375 66.5689 68.6222 176.7204 108 V 3.5492 7.5875 119.9265 66.3434 31.2446 178.3410 109 R 3.9798 7.8649 116.4515 59.2980 29.9370 178.9922 110 R 3.8558 7.7039 117.1897 59.1170 30.0782 178.7865 111 I 3.9917 7.9932 119.5030 60.6476 37.3303 179.4555 112 G 3.8216 8.4136 108.6543 46.3224 0.0000 175.7336 113 H 4.3145 9.5259 111.8398 55.3427 29.7130 176.1246 114 L 4.1597 8.2076 121.8219 53.5460 42.2798 175.2341 115 P 4.2816 0.0000 0.0000 63.0514 31.6876 176.4368 116 K 4.2706 8.3740 117.3389 55.7565 33.4245 175.9629 117 G 3.5256 7.8036 106.3136 46.4526 0.0000 172.5718 118 L 4.5019 7.3822 118.3989 52.9058 45.7207 178.7910 119 G 4.0934 8.0477 108.7521 46.0018 0.0000 176.4699 120 V 3.3257 8.1089 120.9240 65.7637 31.1738 177.5665 121 I 3.6614 7.4281 119.2232 64.2544 36.9144 178.4981 122 G 3.5645 7.7549 106.0919 46.9862 0.0000 175.5288 123 L 3.9115 7.9220 122.7863 58.2082 41.7281 179.1979 124 L 4.0546 7.7534 118.7622 57.5266 41.2285 179.7325 125 I 3.7458 7.4921 119.2860 64.1638 37.2400 177.3007 126 E 4.2365 8.1226 119.4576 57.6146 29.4776 176.7479 127 D 4.5737 7.7313 117.9522 50.6613 41.3834 173.4088 128 P 4.6181 0.0000 0.0000 61.3413 31.0585 175.2519 129 K 4.6203 8.2937 120.9912 54.6083 35.2842 173.6661 130 P 4.4213 0.0000 0.0000 63.4363 31.9992 175.1707 131 L 4.8291 9.7620 126.6590 53.2183 45.2226 175.0264 132 R 5.1470 8.7317 125.5332 54.7947 32.8211 173.9320 133 L 4.9964 9.4414 125.6747 53.2550 45.8168 177.6453 134 D 4.4738 8.9982 121.2528 56.6391 41.5719 176.3163 135 D 4.8163 7.8795 118.3784 52.1409 42.8064 175.8267 136 V 3.6415 9.1674 128.7694 64.3762 31.5003 178.3972 137 S 4.0794 8.3619 112.5304 58.9384 63.4244 174.6194 138 A 4.2034 7.6134 122.3456 53.2039 18.9262 177.0485 139 H 4.3171 7.5835 117.2200 54.9957 30.3576 174.5171 140 P 4.2352 0.0000 0.0000 64.6384 31.5057 176.7742 141 A 4.3966 7.7758 119.9598 51.7116 19.6178 176.6751 142 S 4.2587 8.1902 113.2778 58.3195 62.8272 174.5328 143 I 3.8189 7.9943 126.7617 60.8136 38.6960 175.6447 144 G 3.6990 7.7677 104.8503 44.6051 0.0000 172.6277 145 F 4.5757 7.7623 117.4539 55.4679 40.0066 174.4258 146 P 4.6111 0.0000 0.0000 61.3504 32.2058 173.8820 147 P 4.0187 0.0000 0.0000 64.5257 31.4716 176.9298 148 Y 3.7858 8.1639 117.7075 58.3074 35.9960 169.1849 149 H 4.2684 7.6590 120.1007 54.8082 30.5122 173.1978 150 P 4.1697 0.0000 0.0000 61.9585 31.5961 174.3767 151 P 4.0013 0.0000 0.0000 62.5857 31.8585 175.5346 *153 R 4.5855 7.8610 117.5947 56.7086 31.3927 174.6540 154 T 4.9082 8.4198 109.1261 61.7531 70.7513 172.6252 155 F 5.3462 10.0242 126.2872 56.4763 43.1956 173.0822 156 L 4.6172 8.0996 127.1773 52.9426 44.9687 175.2568 157 G 4.3961 9.2123 113.4728 44.6463 0.0000 171.6760 158 V 4.8966 8.7053 115.6536 58.4156 36.4836 173.0992 159 P 4.7844 0.0000 0.0000 63.1135 32.3735 175.8736 160 V 4.3856 8.9034 123.7971 61.8704 32.6851 174.7092 161 R 4.9046 8.3786 123.2975 55.5407 33.1356 173.7974 162 V 4.8152 8.1946 112.6425 58.9004 34.8043 177.2783 163 R 3.9427 8.4738 116.4904 59.5240 29.3409 177.9754 164 D 4.4453 8.0357 117.5220 56.8554 41.3651 176.0230 165 E 4.4329 7.5920 116.5073 55.0966 32.9395 173.6304 166 S 4.6143 8.2664 119.8085 56.7625 63.8647 173.6196 167 F 4.8256 8.9915 125.2068 56.8436 40.8617 175.5527 168 G 4.2676 7.0127 106.4960 45.8238 0.0000 171.0007 169 T 5.2087 8.8311 115.4527 61.7907 72.5360 173.5048 170 L 5.0000 8.9542 128.1647 53.5287 44.3795 174.6630 171 Y 5.3327 8.7973 123.8244 55.4476 41.9595 173.9627 172 L 5.4493 9.1172 121.9127 53.2934 46.1304 175.6237 173 T 5.8775 8.8759 111.7712 59.6570 72.7889 171.9945 174 D 4.8202 9.0444 120.9704 54.0094 37.2498 173.0426 175 K 4.2064 7.2545 122.0244 56.0276 33.0122 176.3994 176 T 3.8699 8.3832 115.8409 62.7759 69.1635 173.7785 177 N 4.6259 9.4095 117.6852 54.3272 36.0307 175.1639 178 G 3.9079 7.7164 102.5404 46.3031 0.0000 174.6434 179 Q 4.2697 7.2277 117.9531 53.9898 29.5838 174.3893 180 P 4.4420 0.0000 0.0000 62.2428 32.2299 176.3319 181 F 4.3286 8.6418 119.3685 57.7266 39.6751 175.8506 182 S 4.7736 9.0047 119.9045 56.8672 66.1808 175.0608 183 D 4.4253 8.6068 121.6593 57.8605 40.4568 178.9622 184 D 4.3774 8.1200 118.5210 57.5244 40.8097 178.4192 185 D 4.3992 7.9577 118.7600 57.4013 40.9119 178.4212 186 E 3.8728 8.2587 119.6628 59.3425 29.7130 179.0778 187 V 3.7217 7.9675 118.2137 65.8255 31.6268 177.5496 188 L 3.8969 8.0071 120.0474 58.3665 41.9387 179.0499 189 V 3.5873 8.0982 118.3479 66.1122 31.3960 177.8140 190 Q 3.9699 8.1944 117.4865 59.0329 28.3399 178.9717 191 A 3.9877 7.9354 121.3386 55.2323 18.4097 179.7503 192 L 4.0340 8.0743 117.3077 57.8153 41.5886 179.6327 193 A 4.0633 8.3481 120.7486 54.8126 18.3911 179.5010 194 A 3.9715 8.0662 119.4278 55.3620 18.5713 179.7523 195 A 3.9955 7.8119 117.7169 54.9722 18.4054 179.8037 196 A 4.0357 7.9202 119.3583 55.1626 18.3962 179.8201 197 G 4.1246 8.4057 106.0742 47.5574 0.0000 175.8325 198 I 3.7483 7.7586 121.7944 63.9697 37.2278 178.4455 199 A 3.9399 7.8923 121.2183 54.9866 18.1246 179.7790 200 V 3.2527 8.1699 116.8746 66.0952 31.3715 177.8212 201 A 3.6968 7.6226 119.1358 55.4668 18.5158 178.8767 202 N 4.3668 8.1953 115.0156 56.5317 38.4954 177.0918 203 A 3.9737 7.7554 122.2210 55.0154 18.3158 179.3503 204 R 4.1226 7.9368 114.3658 57.4139 30.1040 176.9690 205 L 4.7218 7.4109 123.2864 54.7441 42.6869 176.2537 *206 Y 4.2582 7.5180 120.0732 56.8821 38.0150 176.8431 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 63 D 8.22 4.55 0.00 2.75 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 64 L 7.58 3.79 0.00 1.81 1.55 0.84 0.50 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 65 E 8.43 3.82 0.00 1.99 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 2.32 2.27 0.00 66 A 7.98 3.99 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 67 T 7.53 3.78 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 1.18 0.00 0.00 68 L 8.00 4.02 0.00 1.79 1.66 0.83 0.76 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 69 R 8.63 3.81 0.00 1.97 1.88 0.00 3.03 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 70 A 8.30 3.98 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 71 I 7.67 3.60 1.99 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 1.67 0.82 0.90 0.00 0.00 72 V 7.78 3.51 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 1.03 0.00 0.00 0.89 0.00 0.00 73 H 8.20 4.38 0.00 3.40 3.47 0.00 5.88 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 74 S 8.23 4.00 0.00 4.03 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 75 A 8.17 3.97 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 0.00 0.00 0.00 0.00 0.00 76 T 8.10 3.84 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 1.27 0.00 0.00 77 S 8.07 4.07 0.00 3.76 3.83 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 78 L 7.67 3.99 0.00 1.69 1.73 0.92 0.93 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 79 V 7.54 3.76 2.32 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 1.10 0.00 0.00 1.04 0.00 0.00 80 D 7.77 4.27 0.00 2.91 2.64 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 0.00 0.00 0.00 81 A 7.93 4.85 1.51 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 82 R 9.01 3.86 0.00 1.77 1.53 0.00 2.85 0.00 0.00 2.90 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 83 Y 8.22 5.22 0.00 3.03 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 84 G 9.32 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 85 A 8.91 4.93 0.81 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 *87 E 8.76 4.84 0.00 2.36 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 2.55 2.75 0.00 88 V 8.99 4.83 2.23 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 1.09 0.00 0.00 1.02 0.00 0.00 89 H 8.93 5.64 0.00 3.19 3.32 0.00 5.80 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.74 4.83 0.00 2.97 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 91 R 8.56 4.10 0.00 1.85 2.04 0.00 3.22 0.00 0.00 3.30 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 92 Q 8.15 4.35 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.59 2.30 0.00 93 H 7.99 4.17 0.00 3.32 3.38 0.00 5.66 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 94 R 8.59 4.33 0.00 2.16 1.86 0.00 3.14 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 95 V 8.41 4.07 2.10 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 0.90 0.00 0.00 1.00 0.00 0.00 96 L 9.26 4.55 0.00 1.54 1.46 0.95 0.36 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 97 H 8.01 5.08 0.00 3.09 3.15 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 9.03 5.33 0.00 2.98 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 99 V 8.21 4.28 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 0.84 0.00 0.00 0.84 0.00 0.00 100 Y 7.11 5.08 0.00 2.75 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 0.00 101 E 10.28 4.65 0.00 1.94 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 2.21 2.23 0.00 102 G 9.15 4.20 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 0.00 103 I 7.69 4.68 1.99 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.05 0.99 0.00 0.00 104 D 8.56 4.68 0.00 2.94 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 0.00 105 E 8.68 4.04 0.00 2.14 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 2.40 2.49 0.00 106 E 8.21 3.98 0.00 2.27 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 0.00 2.40 2.41 0.00 107 T 8.04 3.87 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 1.23 0.00 0.00 108 V 7.59 3.55 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 1.09 0.00 0.00 0.93 0.00 0.00 109 R 7.86 3.98 0.00 2.03 1.96 0.00 3.22 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.95 0.00 110 R 7.70 3.86 0.00 1.92 1.59 0.00 2.92 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.81 0.00 111 I 7.99 3.99 2.01 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.74 0.97 0.00 0.00 112 G 8.41 3.82 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 0.00 0.00 0.00 113 H 9.53 4.31 0.00 3.29 3.30 0.00 5.53 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 0.00 114 L 8.21 4.16 0.00 1.62 1.50 1.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.28 0.00 1.93 1.85 0.00 2.95 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.99 0.00 116 K 8.37 4.27 0.00 1.69 1.82 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.36 7.81 117 G 7.80 3.53 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 0.00 118 L 7.38 4.50 0.00 1.61 1.52 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.05 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 0.00 120 V 8.11 3.33 1.53 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 0.37 0.00 0.00 0.61 0.00 0.00 121 I 7.43 3.66 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 1.19 0.16 0.81 0.00 0.00 122 G 7.75 3.56 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 0.00 123 L 7.92 3.91 0.00 1.68 1.85 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 124 L 7.75 4.05 0.00 1.94 1.74 1.09 0.93 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 0.00 125 I 7.49 3.75 1.72 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.54 0.52 0.00 0.00 126 E 8.12 4.24 0.00 2.03 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 0.00 2.31 2.33 0.00 127 D 7.73 4.57 0.00 2.77 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 0.00 128 P 0.00 4.62 0.00 2.17 2.14 0.00 3.13 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.02 0.00 129 K 8.29 4.62 0.00 1.74 1.77 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.47 7.81 130 P 0.00 4.42 0.00 2.00 2.09 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 131 L 9.76 4.83 0.00 1.69 1.70 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 132 R 8.73 5.15 0.00 1.83 1.81 0.00 3.45 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 133 L 9.44 5.00 0.00 1.70 1.58 0.80 0.97 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 0.00 134 D 9.00 4.47 0.00 2.73 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 0.00 135 D 7.88 4.82 0.00 2.73 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 0.00 136 V 9.17 3.64 2.26 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 0.86 0.00 0.00 0.52 0.00 0.00 137 S 8.36 4.08 0.00 3.90 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 0.00 138 A 7.61 4.20 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 0.00 139 H 7.58 4.32 0.00 2.94 3.07 0.00 5.60 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 0.00 140 P 0.00 4.24 0.00 1.96 2.01 0.00 2.99 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 141 A 7.78 4.40 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 0.00 142 S 8.19 4.26 0.00 3.86 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 0.00 143 I 7.99 3.82 1.75 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.78 0.75 0.00 0.00 144 G 7.77 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 0.00 0.00 0.00 145 F 7.76 4.58 0.00 3.03 2.77 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 0.00 146 P 0.00 4.61 0.00 2.37 2.30 0.00 3.77 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 2.20 2.03 0.00 147 P 0.00 4.02 0.00 2.19 1.76 0.00 3.82 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 2.07 2.09 0.00 148 Y 8.16 3.79 0.00 3.21 3.18 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 0.00 149 H 7.66 4.27 0.00 3.23 3.18 0.00 5.77 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 P 0.00 4.17 0.00 1.48 1.85 0.00 3.15 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.95 0.00 151 P 0.00 4.00 0.00 2.18 2.07 0.00 3.75 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 *153 R 7.86 4.59 0.00 2.05 2.13 0.00 3.24 0.00 0.00 3.45 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 154 T 8.42 4.91 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 1.36 0.00 0.00 155 F 10.02 5.35 0.00 3.16 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 0.00 156 L 8.10 4.62 0.00 0.47 0.13 0.77 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 157 G 9.21 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 0.00 0.00 0.00 0.00 158 V 8.71 4.90 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 0.68 0.00 0.00 0.97 0.00 0.00 159 P 0.00 4.78 0.00 2.08 2.07 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 160 V 8.90 4.39 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 nan 0.00 0.00 0.99 0.00 0.00 161 R 8.38 4.90 0.00 1.88 1.89 0.00 2.93 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 162 V 8.19 4.82 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 1.01 0.00 0.00 1.06 0.00 0.00 163 R 8.47 3.94 0.00 1.91 2.06 0.00 3.04 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 164 D 8.04 4.45 0.00 2.70 2.77 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 0.00 165 E 7.59 4.43 0.00 1.80 1.28 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 1.65 2.02 0.00 166 S 8.27 4.61 0.00 3.76 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 0.00 167 F 8.99 4.83 0.00 3.08 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 0.00 168 G 7.01 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 0.00 0.00 0.00 169 T 8.83 5.21 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 1.43 0.00 0.00 170 L 8.95 5.00 0.00 1.79 1.54 0.88 0.56 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 0.00 171 Y 8.80 5.33 0.00 2.93 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 0.00 172 L 9.12 5.45 0.00 1.00 1.60 0.97 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.88 5.88 4.64 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 0.00 0.00 1.70 0.00 0.00 174 D 9.04 4.82 0.00 3.23 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 0.00 175 K 7.25 4.21 0.00 0.79 1.44 0.00 1.67 0.00 0.00 1.13 0.00 0.00 2.96 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.29 1.47 7.81 176 T 8.38 3.87 4.20 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 1.18 0.00 0.00 177 N 9.41 4.63 0.00 2.85 2.91 0.00 0.00 6.95 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 0.00 178 G 7.72 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 0.00 179 Q 7.23 4.27 0.00 1.77 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 180 P 0.00 4.44 0.00 2.22 2.20 0.00 3.73 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 1.98 1.99 0.00 181 F 8.64 4.33 0.00 3.09 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 0.00 182 S 9.00 4.77 0.00 4.07 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 0.00 183 D 8.61 4.43 0.00 2.80 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 0.00 184 D 8.12 4.38 0.00 2.78 2.74 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 0.00 185 D 7.96 4.40 0.00 3.02 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 0.00 186 E 8.26 3.87 0.00 2.18 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 2.30 2.30 0.00 187 V 7.97 3.72 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 0.94 0.00 0.00 1.01 0.00 0.00 188 L 8.01 3.90 0.00 1.88 1.84 0.92 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 0.00 189 V 8.10 3.59 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 0.99 0.00 0.00 0.98 0.00 0.00 190 Q 8.19 3.97 0.00 2.40 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 191 A 7.94 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 0.00 192 L 8.07 4.03 0.00 1.85 1.72 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 193 A 8.35 4.06 1.45 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 0.00 194 A 8.07 3.97 1.42 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 0.00 0.00 195 A 7.81 4.00 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 0.00 196 A 7.92 4.04 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 0.00 197 G 8.41 4.12 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 0.00 0.00 0.00 198 I 7.76 3.75 1.89 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 1.49 0.56 0.92 0.00 0.00 199 A 7.89 3.94 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 0.00 200 V 8.17 3.25 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.92 0.00 0.00 201 A 7.62 3.70 1.51 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 0.00 202 N 8.20 4.37 0.00 2.93 2.91 0.00 0.00 7.12 8.82 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 0.00 203 A 7.76 3.97 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 0.00 204 R 7.94 4.12 0.00 1.84 1.97 0.00 3.08 0.00 0.00 3.06 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 205 L 7.41 4.72 0.00 1.73 1.78 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 *206 Y 7.52 4.26 0.00 2.37 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.