NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 33 T 4.3439 8.0327 117.3764 63.1225 70.1085 174.0695 34 L 3.7798 8.6879 128.5548 57.3648 42.0511 175.5327 35 E 4.0339 8.3377 119.0153 59.4870 30.2276 177.6362 36 D 4.3963 8.1329 117.5695 57.4822 41.1979 177.8106 37 D 4.3785 8.0707 119.4988 57.1729 40.7462 178.7102 38 L 4.1054 8.2370 119.7445 57.5424 41.5073 178.7541 39 N 4.5357 8.2586 117.1054 57.0111 38.9430 176.6697 40 E 3.9473 8.2748 119.6068 59.6516 29.5296 179.3829 41 T 3.5764 8.1594 116.0513 66.9410 68.5020 176.4184 42 N 4.6076 9.0553 118.9595 56.2310 38.5054 177.7446 43 K 4.0252 8.5145 120.5177 59.3282 32.0718 178.8486 44 Y 3.9080 8.0615 120.0063 60.8243 38.7000 177.3897 45 Y 4.3431 8.0122 117.7985 61.0317 37.8586 178.3345 46 L 4.1260 8.1975 122.6554 58.1024 42.0704 178.8300 47 T 3.8587 7.9521 114.8963 66.5447 68.4553 175.1623 48 N 4.6540 7.5991 115.0133 51.8703 39.0536 174.8468 49 Q 3.5123 8.0076 118.0218 57.1465 27.0999 175.4449 50 I 4.0212 8.0625 119.3559 63.7813 37.8680 176.2313 51 A 4.7178 7.4223 118.8489 51.0763 22.8491 175.6757 52 V 4.5076 9.0212 119.7534 61.2171 33.5654 174.2173 53 I 5.1900 8.2580 127.2496 59.8566 40.6650 174.6432 54 H 5.0429 8.8897 122.0974 53.6483 33.3647 172.4542 55 K 3.7419 8.5478 122.2772 55.7460 32.6664 176.8004 56 K 4.1886 8.7285 127.8899 55.4003 32.7460 175.5605 57 P 4.3025 0.0000 0.0000 62.7302 31.9898 176.5191 58 T 4.1129 8.0002 118.0999 62.9353 69.3150 172.7625 59 P 4.4904 0.0000 0.0000 62.5989 32.7738 175.7158 60 V 4.5244 7.7779 115.2231 61.0430 35.4225 174.5904 61 Q 3.1409 8.9184 116.8092 58.7142 28.8620 178.4632 *77 E 4.0666 9.2879 109.6066 56.1026 32.1095 176.7056 78 A 4.3021 7.4676 121.4186 51.2719 17.7318 177.3199 79 Y 5.0730 7.2869 120.2829 55.7151 41.2468 177.0278 80 F 4.7475 9.2456 122.3332 57.0736 40.0382 174.8325 81 K 4.7452 8.3024 123.2065 54.4198 35.0643 175.2923 82 Q 4.1860 8.6022 126.2120 55.6233 29.7972 175.4189 83 S 4.4817 8.4806 119.9918 57.7890 63.3487 173.4415 84 S 4.6200 8.5254 120.5551 58.2693 63.0213 173.0610 85 T 4.5711 7.5313 110.6199 59.8577 71.7010 173.2668 86 T 4.2574 8.0244 111.5077 61.8937 69.3883 173.9222 87 D 4.4206 8.6137 120.7494 55.5175 42.2505 175.9506 88 Y 4.9710 7.4882 116.8043 55.9730 41.0656 174.6287 89 N 4.8755 7.7297 119.5639 51.8601 41.4196 174.2966 90 G 4.1922 7.1106 104.7565 46.2167 0.0000 171.0869 91 I 5.0593 7.8486 119.6979 59.3803 41.3083 174.8762 92 Y 4.8433 8.4655 127.0120 56.8379 41.2467 175.1587 93 K 3.4097 9.4327 128.2110 57.4154 29.4533 176.1291 94 G 4.1015 8.4515 107.1516 45.1355 0.0000 174.0177 95 R 4.6969 7.7184 118.3326 54.8511 32.7264 175.3213 96 Y 4.7694 8.6266 123.4491 57.6365 40.2794 174.0807 97 I 5.0727 8.5185 126.9054 59.6732 41.0243 174.0622 98 D 4.9465 8.6881 124.8266 53.0298 45.1593 173.8095 99 F 5.3567 8.4285 118.6025 56.9197 41.5906 172.2057 100 E 5.2038 8.5444 119.4893 54.4420 33.2232 174.1781 101 A 5.4246 9.2289 125.5046 50.4113 21.9645 175.7016 102 K 4.9254 9.3397 120.7742 54.8344 37.1498 175.1152 103 E 5.8335 8.6783 119.2004 54.2745 32.7641 174.7296 104 T 4.1707 8.0780 113.3780 61.5667 70.2071 172.6638 105 K 3.7320 9.4927 126.5729 56.2183 31.9886 178.5024 106 N 3.7606 7.5393 115.5715 53.7328 39.0748 173.9149 107 K 4.6386 8.6692 125.9611 57.2895 33.6461 177.0954 108 T 4.3539 8.1710 115.0381 64.4605 70.6174 174.6422 109 S 5.2086 9.0909 113.5680 56.8195 66.7742 173.9952 110 F 4.5858 9.8470 125.3406 55.6606 40.4895 173.2279 111 P 4.3526 0.0000 0.0000 62.9097 31.1502 177.3453 112 L 4.4997 8.6091 124.3241 57.1594 41.7182 178.7383 113 Q 4.6040 8.0049 114.7089 56.6714 28.7828 176.6204 114 N 4.1948 7.9367 117.6447 55.9728 38.5564 175.1931 115 F 5.2765 7.7761 115.4679 56.2106 40.9792 174.3928 116 H 5.2552 8.4730 115.6606 53.5735 32.2941 173.8735 117 D 4.4705 8.8693 121.1720 58.1622 40.6000 178.8080 118 H 4.1622 7.8106 115.7604 59.1344 28.5772 177.5405 119 Q 3.9743 7.8123 119.0256 59.0976 28.5055 179.0060 120 I 3.4873 7.1574 120.3295 64.1949 36.9318 178.1211 121 E 3.7707 8.1838 120.2933 59.3598 29.3618 178.1381 122 H 4.0352 8.3920 118.4887 59.7170 29.8270 177.1135 123 M 4.0404 7.9895 120.2640 58.2362 31.7102 178.6588 124 K 3.6880 8.2325 119.0355 59.7154 32.2298 179.2106 125 Q 3.9309 8.1891 118.2051 58.8828 28.6407 179.2031 126 V 3.5099 7.8765 119.4104 65.9785 31.5877 178.2523 127 K 4.0580 8.5315 118.4300 59.5318 31.7195 179.2685 128 A 4.1664 8.2290 120.2128 54.8156 18.2234 178.6149 129 Q 4.2897 7.7823 114.8607 55.2545 28.9058 175.4713 130 D 4.4294 8.3033 118.6864 55.3219 39.0476 174.2090 131 G 4.1531 7.7979 104.9064 45.5705 0.0000 174.2870 132 I 4.3192 8.2892 121.0894 60.3152 38.1686 174.9957 133 C 5.9438 8.7314 126.8990 56.4458 35.5653 172.4567 134 F 4.8127 7.3558 117.9233 56.8832 40.1070 172.3187 135 V 4.8818 8.0753 111.4155 59.5250 36.0042 175.0260 136 I 4.9126 8.4096 122.6705 59.6784 40.1706 174.6832 137 I 4.9876 9.1865 128.1132 59.5493 40.3802 174.6008 138 S 5.0217 9.0622 122.8576 57.3755 63.3023 172.4137 139 A 4.4415 8.9742 127.1571 51.3990 22.9527 175.6944 140 F 4.1692 9.0739 116.5491 59.2649 36.1148 175.3008 141 D 4.4795 8.6488 115.3874 55.2835 38.5297 173.1745 142 Q 4.5391 8.0356 117.6187 54.0867 32.8310 173.9494 143 V 4.7605 7.4577 116.8136 61.7366 34.8073 173.6432 144 Y 5.3170 9.7036 125.7591 56.2253 42.2704 174.3388 145 F 4.9325 9.5459 125.8818 56.8606 41.2062 174.3640 146 L 5.0945 8.6821 130.1212 53.0587 44.1146 175.1393 147 E 4.3537 9.2989 125.5691 56.9802 30.3306 178.6782 148 A 3.5338 8.6463 124.7729 55.1612 18.3206 180.0273 149 D 4.2365 7.8158 116.8575 57.4649 40.6986 179.0813 150 K 3.8478 7.7851 118.3016 59.4529 32.2436 179.1344 151 L 4.3258 7.6594 119.8763 57.7487 41.7043 178.9159 152 F 4.5854 7.9358 118.2094 61.0714 38.9254 176.5041 153 Y 4.3843 8.0217 118.9412 61.3050 38.2997 178.6820 154 F 4.7025 7.8192 117.1806 60.0513 39.1328 177.2988 155 W 4.4794 8.2917 127.5716 60.4297 30.7749 177.7087 156 D 4.6199 9.3887 119.4296 56.4780 40.9762 176.9762 157 R 4.2952 7.9475 116.2463 56.1997 29.2181 176.1247 158 K 4.2501 7.2611 117.9919 59.0706 34.5874 176.3911 159 E 3.8939 7.9050 119.8692 58.9915 29.3129 177.7509 160 K 3.5371 7.1834 115.2453 59.4758 32.8264 174.8369 161 N 4.7972 7.4660 115.1553 52.1431 41.3800 172.7867 162 G 4.0261 8.3985 112.3621 47.0587 0.0000 174.7056 163 R 4.3146 7.7507 123.4813 55.6574 28.4342 176.6766 164 K 4.6960 7.9938 125.5753 56.4620 33.8276 176.5154 165 S 5.4442 7.9231 113.8930 58.2651 67.6004 173.6081 166 I 4.1749 8.3591 122.0210 59.6456 39.4493 175.0845 167 R 4.6241 8.6461 125.6413 55.6347 31.7153 178.2209 168 K 4.1324 9.3008 126.3893 58.9858 32.9740 178.0007 169 D 4.3244 8.0318 119.0401 56.2224 39.3987 177.7653 170 E 3.9252 8.2860 120.3826 59.4691 29.5844 179.2066 171 L 3.8259 7.7457 119.3652 58.1981 41.8854 178.6432 172 E 3.9863 7.8233 117.4947 58.7077 29.4363 178.3964 173 E 4.2038 7.7696 118.0217 58.2555 29.9299 178.1118 174 T 4.1582 7.6064 108.3975 62.6677 70.0182 174.9666 175 A 5.0108 7.2600 121.8212 50.5860 20.9386 176.2100 176 Y 4.6982 9.3384 118.6629 56.0135 39.8921 173.6826 177 P 4.7773 0.0000 0.0000 62.9870 32.4192 175.4431 178 I 4.4421 8.7667 124.8826 59.5325 39.0542 175.7342 179 S 4.1640 8.6345 122.7488 59.0227 63.6036 173.3906 180 L 4.7336 8.5326 125.3717 54.3631 43.0269 176.2598 181 G 4.0144 8.6092 108.6383 45.7955 0.0000 173.3681 182 Y 3.9357 8.7007 119.9081 60.5567 40.3290 176.7419 183 A 4.1052 7.4915 122.4186 50.5819 17.3203 178.9689 184 P 3.6004 0.0000 0.0000 64.0697 31.7849 176.3544 185 R 4.5417 8.3693 121.3749 57.9466 30.1078 175.9595 186 I 4.5822 7.4903 118.2380 59.1722 38.9347 176.1954 187 D 4.6742 8.2978 130.3828 53.2817 37.6164 176.2068 188 Y 4.2540 7.5929 121.7403 59.9661 38.7587 178.1450 189 I 3.1960 7.0839 121.6696 63.6906 36.7524 178.1795 190 S 3.9355 7.6049 113.2606 61.4498 62.2559 176.3215 191 I 3.4734 7.3764 121.9344 63.9973 36.7182 178.3070 192 I 3.6366 7.4672 120.8407 64.3403 36.8174 178.0229 193 E 4.2109 8.6291 120.4441 59.3032 29.0966 179.0356 194 Q 4.0078 7.4355 117.5995 59.0366 29.0477 178.2990 195 L 3.8883 7.4435 117.9338 57.1285 41.6193 177.7131 196 Y 4.4452 7.9077 113.3032 56.9629 40.3171 175.4768 197 F 4.3559 8.1448 122.8802 57.4842 39.6165 174.7282 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 33 T 8.03 4.34 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 1.28 0.00 0.00 34 L 8.69 3.78 0.00 1.87 1.72 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.34 4.03 0.00 2.17 1.99 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 2.44 2.48 0.00 36 D 8.13 4.40 0.00 2.85 2.67 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 37 D 8.07 4.38 0.00 2.93 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 38 L 8.24 4.11 0.00 1.92 1.83 0.83 0.40 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 39 N 8.26 4.54 0.00 3.06 3.03 0.00 0.00 7.20 7.69 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 40 E 8.27 3.95 0.00 2.11 1.88 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 2.30 2.43 0.00 41 T 8.16 3.58 4.41 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 1.09 0.00 0.00 42 N 9.06 4.61 0.00 2.82 3.21 0.00 0.00 7.12 5.27 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 43 K 8.51 4.03 0.00 1.81 1.88 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.68 7.81 44 Y 8.06 3.91 0.00 2.92 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 45 Y 8.01 4.34 0.00 3.20 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 46 L 8.20 4.13 0.00 1.85 1.85 0.98 1.01 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 47 T 7.95 3.86 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 1.14 0.00 0.00 48 N 7.60 4.65 0.00 2.43 2.65 0.00 0.00 7.14 7.78 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 49 Q 8.01 3.51 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 50 I 8.06 4.02 1.98 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.70 0.76 0.00 0.00 51 A 7.42 4.72 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 52 V 9.02 4.51 2.15 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 1.15 0.00 0.00 0.98 0.00 0.00 53 I 8.26 5.19 2.14 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.91 1.26 0.00 0.00 54 H 8.89 5.04 0.00 3.06 3.13 0.00 5.61 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 55 K 8.55 3.74 0.00 1.36 1.52 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.56 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.02 0.45 7.81 56 K 8.73 4.19 0.00 1.48 1.61 0.00 1.80 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.27 7.81 57 P 0.00 4.30 0.00 1.96 1.90 0.00 3.59 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 1.96 2.04 0.00 58 T 8.00 4.11 3.98 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 1.19 0.00 0.00 59 P 0.00 4.49 0.00 2.03 1.91 0.00 3.61 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 2.08 2.06 0.00 60 V 7.78 4.52 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 0.37 0.00 0.00 0.85 0.00 0.00 61 Q 8.92 3.14 0.00 2.32 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.18 0.00 0.00 0.00 0.00 0.00 2.66 2.55 0.00 *77 E 9.29 4.07 0.00 1.99 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 2.22 2.27 0.00 78 A 7.47 4.30 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 7.29 5.07 0.00 2.95 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 80 F 9.25 4.75 0.00 2.79 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 81 K 8.30 4.75 0.00 1.73 1.65 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.37 7.81 82 Q 8.60 4.19 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 83 S 8.48 4.48 0.00 3.84 3.73 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 84 S 8.53 4.62 0.00 3.84 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 85 T 7.53 4.57 3.73 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 1.06 0.00 0.00 86 T 8.02 4.26 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 1.19 0.00 0.00 87 D 8.61 4.42 0.00 2.84 2.22 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 0.00 0.00 0.00 0.00 88 Y 7.49 4.97 0.00 1.43 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 0.00 0.00 0.00 89 N 7.73 4.88 0.00 2.38 2.83 0.00 0.00 6.52 7.37 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 90 G 7.11 4.19 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 91 I 7.85 5.06 1.95 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 2.02 1.03 0.00 0.00 92 Y 8.47 4.84 0.00 2.97 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 93 K 9.43 3.41 0.00 1.09 1.54 0.00 0.61 0.00 0.00 1.25 0.00 0.00 2.54 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.67 0.21 7.81 94 G 8.45 4.10 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 0.00 95 R 7.72 4.70 0.00 2.10 1.97 0.00 3.34 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.93 0.00 96 Y 8.63 4.77 0.00 3.10 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 97 I 8.52 5.07 1.94 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.12 1.25 0.00 0.00 98 D 8.69 4.95 0.00 2.48 2.47 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 99 F 8.43 5.36 0.00 2.23 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 0.00 100 E 8.54 5.20 0.00 2.04 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 2.49 2.72 0.00 101 A 9.23 5.42 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 0.00 102 K 9.34 4.93 0.00 1.86 1.68 0.00 1.61 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.63 1.26 7.81 103 E 8.68 5.83 0.00 1.92 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 2.18 2.10 0.00 104 T 8.08 4.17 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 1.08 0.00 0.00 105 K 9.49 3.73 0.00 1.78 1.65 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.72 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.41 7.81 106 N 7.54 3.76 0.00 2.75 3.17 0.00 0.00 6.86 6.68 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 0.00 107 K 8.67 4.64 0.00 1.80 1.89 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.48 7.81 108 T 8.17 4.35 4.23 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 1.14 0.00 0.00 109 S 9.09 5.21 0.00 3.85 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 0.00 110 F 9.85 4.59 0.00 3.04 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 0.00 111 P 0.00 4.35 0.00 2.06 2.09 0.00 3.23 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 1.63 1.80 0.00 112 L 8.61 4.50 0.00 1.91 2.11 1.22 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 8.00 4.60 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.09 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 114 N 7.94 4.19 0.00 2.33 2.41 0.00 0.00 6.87 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 0.00 115 F 7.78 5.28 0.00 3.38 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 0.00 116 H 8.47 5.26 0.00 3.47 3.48 0.00 5.48 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 0.00 117 D 8.87 4.47 0.00 2.80 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 0.00 118 H 7.81 4.16 0.00 3.03 3.31 0.00 5.65 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 0.00 119 Q 7.81 3.97 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.53 2.64 0.00 120 I 7.16 3.49 1.33 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 -0.36 0.32 0.00 0.00 121 E 8.18 3.77 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 2.30 2.33 0.00 122 H 8.39 4.04 0.00 3.27 3.45 0.00 5.84 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 0.00 123 M 7.99 4.04 0.00 2.26 2.44 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.54 0.00 124 K 8.23 3.69 0.00 1.74 1.62 0.00 1.38 0.00 0.00 1.33 0.00 0.00 2.59 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.30 0.82 7.81 125 Q 8.19 3.93 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 126 V 7.88 3.51 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 1.28 0.00 0.00 0.88 0.00 0.00 127 K 8.53 4.06 0.00 2.14 2.00 0.00 1.95 0.00 0.00 1.86 0.00 0.00 3.12 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.62 1.81 7.81 128 A 8.23 4.17 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 0.00 129 Q 7.78 4.29 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.72 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 130 D 8.30 4.43 0.00 2.79 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 0.00 131 G 7.80 4.15 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 0.00 132 I 8.29 4.32 1.87 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 -0.10 0.32 0.71 0.00 0.00 133 C 8.73 5.94 0.00 3.04 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 0.00 134 F 7.36 4.81 0.00 2.58 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 0.00 135 V 8.08 4.88 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 0.27 0.00 0.00 0.84 0.00 0.00 136 I 8.41 4.91 1.79 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.80 0.88 0.00 0.00 137 I 9.19 4.99 1.87 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.02 0.77 0.00 0.00 138 S 9.06 5.02 0.00 3.90 3.79 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 0.00 139 A 8.97 4.44 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 F 9.07 4.17 0.00 3.42 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 0.00 141 D 8.65 4.48 0.00 2.89 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 0.00 142 Q 8.04 4.54 0.00 1.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 143 V 7.46 4.76 1.99 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 1.00 0.00 0.00 0.87 0.00 0.00 144 Y 9.70 5.32 0.00 2.80 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 0.00 145 F 9.55 4.93 0.00 3.03 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 0.00 146 L 8.68 5.09 0.00 1.82 1.51 1.07 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 147 E 9.30 4.35 0.00 2.10 2.03 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 2.59 2.81 0.00 148 A 8.65 3.53 1.06 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 0.00 149 D 7.82 4.24 0.00 2.70 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 0.00 150 K 7.79 3.85 0.00 1.91 1.82 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.71 1.45 7.81 151 L 7.66 4.33 0.00 1.80 1.58 1.17 0.66 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 0.00 152 F 7.94 4.59 0.00 3.31 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 0.00 153 Y 8.02 4.38 0.00 2.86 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 0.00 154 F 7.82 4.70 0.00 3.37 3.27 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 0.00 155 W 8.29 4.48 0.00 3.85 3.50 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 0.00 156 D 9.39 4.62 0.00 2.66 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 0.00 157 R 7.95 4.30 0.00 1.91 1.84 0.00 3.14 0.00 0.00 3.43 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 158 K 7.26 4.25 0.00 1.58 1.42 0.00 0.61 0.00 0.00 1.14 0.00 0.00 2.67 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.09 1.11 7.81 159 E 7.91 3.89 0.00 1.82 1.88 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 2.25 2.31 0.00 160 K 7.18 3.54 0.00 1.86 1.69 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.49 7.81 161 N 7.47 4.80 0.00 2.69 2.67 0.00 0.00 6.85 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 0.00 162 G 8.40 4.03 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 0.00 0.00 0.00 163 R 7.75 4.31 0.00 1.91 2.00 0.00 3.40 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 164 K 7.99 4.70 0.00 1.82 1.95 0.00 1.37 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.51 7.81 165 S 7.92 5.44 0.00 3.75 3.78 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 0.00 166 I 8.36 4.17 1.68 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.00 -0.25 0.00 0.00 167 R 8.65 4.62 0.00 1.76 1.81 0.00 3.16 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 168 K 9.30 4.13 0.00 1.00 1.42 0.00 0.91 0.00 0.00 1.17 0.00 0.00 2.81 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.28 1.19 7.81 169 D 8.03 4.32 0.00 2.87 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 0.00 170 E 8.29 3.93 0.00 2.05 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 2.34 2.46 0.00 171 L 7.75 3.83 0.00 1.60 1.55 0.71 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 172 E 7.82 3.99 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 173 E 7.77 4.20 0.00 1.86 1.95 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 2.32 2.52 0.00 174 T 7.61 4.16 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 1.29 0.00 0.00 175 A 7.26 5.01 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 0.00 176 Y 9.34 4.70 0.00 2.89 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 0.00 177 P 0.00 4.78 0.00 2.05 2.08 0.00 3.88 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 2.04 2.04 0.00 178 I 8.77 4.44 1.87 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.83 0.99 0.00 0.00 179 S 8.63 4.16 0.00 3.75 3.78 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 0.00 180 L 8.53 4.73 0.00 1.49 1.55 0.89 0.92 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 0.00 181 G 8.61 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 0.00 0.00 0.00 182 Y 8.70 3.94 0.00 2.96 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 0.00 183 A 7.49 4.11 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 0.00 184 P 0.00 3.60 0.00 1.81 1.25 0.00 3.42 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.89 0.00 185 R 8.37 4.54 0.00 1.91 1.93 0.00 3.35 0.00 0.00 3.18 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.39 0.00 186 I 7.49 4.58 1.96 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 1.17 0.58 0.99 0.00 0.00 187 D 8.30 4.67 0.00 2.71 2.53 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 0.00 188 Y 7.59 4.25 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 0.00 189 I 7.08 3.20 0.95 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 -0.36 -0.04 0.00 0.00 190 S 7.60 3.94 0.00 4.10 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 0.00 191 I 7.38 3.47 1.56 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 1.37 0.57 -0.48 0.00 0.00 192 I 7.47 3.64 1.77 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.99 1.10 0.00 0.00 193 E 8.63 4.21 0.00 2.04 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 2.31 2.45 0.00 194 Q 7.44 4.01 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 195 L 7.44 3.89 0.00 1.57 1.18 0.22 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 196 Y 7.91 4.45 0.00 3.16 2.63 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 0.00 197 F 8.14 4.36 0.00 3.27 2.94 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 * Residues marked with a * may have inaccurate shift predictions.