NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6994 8.1627 120.6171 55.4887 34.1902 173.4542 2 R 4.9084 8.8577 126.1026 53.6793 32.9957 169.2606 3 V 4.8480 9.2718 126.2177 61.0137 35.4678 173.1526 4 L 5.0527 9.2277 130.4957 53.4838 44.1984 174.7777 5 L 5.0645 9.2772 128.1520 53.3875 43.7734 175.8355 6 I 4.8753 8.8807 125.7151 59.4615 40.2164 174.5884 7 H 4.9026 9.1667 129.3777 56.2497 30.6511 174.3833 8 S 5.0843 9.4689 121.8666 56.6494 66.6864 175.0783 9 D 4.5134 8.8759 121.9476 57.5552 41.7158 175.9059 10 Y 5.1942 7.0044 113.7927 56.5894 41.3411 173.3549 11 I 4.8978 8.5775 120.3047 59.9685 41.5581 173.3635 12 E 5.3743 9.9843 129.1178 54.8046 33.0637 174.5511 13 Y 5.6327 8.3513 119.3338 55.7035 42.4734 173.8691 14 E 4.8398 9.7051 121.6407 54.5136 32.9446 174.6207 15 V 4.1196 9.1825 128.7323 62.3042 32.2969 174.0956 16 K 4.7055 9.1084 124.4704 56.9964 33.8590 179.6852 17 D 4.9157 9.3080 132.4648 55.0427 42.3709 174.9205 18 K 4.3465 8.7181 123.6420 55.5069 31.8987 177.6173 19 A 4.1162 8.2824 125.0359 51.4079 20.2714 177.3370 20 L 4.6253 7.2589 114.0423 52.4002 44.4336 176.4239 21 K 3.8953 8.7776 121.7552 59.3392 32.0174 176.7753 22 N 4.7092 7.6506 115.4294 50.8131 39.8150 171.8782 23 P 4.6347 0.0000 0.0000 60.6508 33.9512 174.8984 24 E 4.1538 8.2279 120.0411 56.0451 29.6970 174.9358 25 P 4.7384 0.0000 0.0000 62.9835 32.2235 175.5278 26 I 4.6446 8.2191 114.9760 59.5763 41.0654 173.7758 27 S 4.6972 8.1040 114.9999 56.2772 65.4379 174.4770 28 E 3.9134 8.6848 120.0221 59.6414 28.7979 177.9942 29 D 4.3684 7.7106 117.2773 57.3372 41.3308 177.4919 30 M 4.3732 7.8293 116.8907 56.2200 32.5662 177.8326 31 K 4.0581 7.7625 119.7139 58.3623 32.1907 176.3575 32 R 4.3200 6.9502 112.1616 54.7020 33.0144 174.5132 33 G 4.1408 6.8896 104.8259 45.8186 0.0000 172.2130 34 R 5.7251 8.2213 119.7292 55.3876 33.2226 173.9304 35 M 5.0851 8.7193 124.2451 53.6917 36.4358 174.0042 36 E 5.0296 8.5640 118.9814 54.3173 33.7696 175.5118 37 E 3.8994 8.4477 118.8940 57.5596 27.4920 175.1241 38 V 4.7921 8.0762 118.3384 59.7462 36.1259 176.2745 39 L 4.6163 8.9689 125.6453 54.0993 43.3707 175.2576 40 V 4.4119 8.8596 127.7822 61.8104 33.3186 174.5673 41 A 5.0290 8.9372 130.8796 50.0465 20.1096 174.3770 42 F 4.8411 8.8990 120.3613 58.0465 40.4703 174.8206 43 I 5.1578 9.1630 123.9681 59.5361 41.2257 174.2269 44 S 4.8911 9.1660 121.7315 56.4053 64.8896 173.0059 45 V 4.3069 8.4703 128.3069 62.4872 32.4518 175.2723 46 E 4.8545 9.4264 128.3968 54.9607 31.1810 177.2259 47 K 3.7653 8.9001 122.5855 60.1444 32.0562 178.8960 48 V 3.5651 7.9322 117.5561 66.5153 31.4216 177.3413 49 D 4.5357 8.1144 118.0141 57.4500 40.3820 178.7494 50 E 4.1263 8.2298 118.4036 58.6812 29.3770 179.1789 51 K 4.2237 8.2986 118.7633 58.3744 33.7970 177.4171 52 N 4.9898 7.6672 115.8158 49.8450 39.5428 172.2009 53 P 4.2109 0.0000 0.0000 65.6595 31.9085 177.5622 54 E 3.9065 8.1028 117.2069 59.0396 29.6677 178.0694 55 E 3.8556 8.3741 119.4068 59.4016 29.6970 178.8876 56 V 3.5932 7.7137 118.0489 66.1856 31.5009 178.0182 57 S 4.1256 7.9776 114.6324 61.6039 62.6953 176.6961 58 L 3.9643 7.8435 121.4184 57.7342 41.4128 179.5083 59 K 3.8528 8.0963 118.0273 59.7106 32.0700 179.1196 60 A 4.0715 8.3774 121.0771 55.3207 18.2754 179.7267 61 I 3.6851 8.0206 118.4657 64.3004 37.1516 178.3480 62 E 3.9215 8.1460 120.1137 59.3885 29.4669 178.6694 63 E 3.9751 8.5833 118.9688 59.6157 29.5447 179.5540 64 I 3.6890 8.1969 120.1868 64.2692 37.0175 178.7285 65 S 3.8670 8.1095 116.0695 61.3560 62.6760 176.4405 66 K 3.8742 8.0745 122.2855 59.7169 31.8105 178.9446 67 V 3.5386 7.6311 117.9402 65.7600 31.3974 177.6682 68 A 3.8999 7.8419 120.5831 55.2111 18.1422 179.4343 69 E 3.9675 8.4620 116.9775 59.7595 29.3989 179.3950 70 Q 4.0099 7.9303 116.5351 59.1534 29.0029 179.1139 71 V 3.8772 7.8866 109.7625 60.3855 32.7253 175.8715 72 K 3.7799 7.7772 117.0264 57.3916 29.5997 175.3967 73 A 4.7760 8.3849 120.9370 50.8634 21.0077 177.3134 74 E 4.7303 8.7885 120.6679 56.6675 31.5677 175.2387 75 N 5.6277 8.1634 117.5879 51.3354 41.8833 173.6756 76 V 4.9028 8.8588 122.4315 61.0215 35.5103 173.6578 77 F 5.0791 9.0848 129.6440 56.3669 42.2028 173.9835 78 V 4.2142 8.2969 127.4869 62.1079 32.7394 174.0458 79 Y 4.4240 8.5548 130.3338 54.8806 40.9178 172.9552 80 P 4.7112 0.0000 0.0000 63.1222 32.2890 176.7709 81 F 4.8229 9.4082 127.4359 56.5325 41.3850 174.1073 82 A 4.2008 8.1384 129.3223 52.7634 18.1314 177.5269 83 H 4.8463 7.7345 113.8973 57.1713 29.5832 174.8831 84 L 4.6007 8.1000 119.1208 55.0829 42.4821 176.3246 85 S 4.7261 7.6840 111.4981 56.8424 65.4951 173.1568 86 S 4.7281 8.6757 119.2281 58.2779 63.9354 174.4893 87 E 4.7645 8.1336 120.4500 54.7921 28.3839 175.0602 88 L 4.7220 7.7935 120.4577 54.6466 43.1070 178.3559 89 A 4.6570 8.9114 124.7462 50.7012 19.9700 177.7852 90 K 4.0309 8.8567 119.3532 56.3299 33.5744 176.1129 91 P 4.4727 0.0000 0.0000 66.1416 31.1482 178.5686 92 S 4.0072 8.1899 112.1540 61.8798 62.4751 176.7545 93 V 3.5036 7.7037 121.3391 65.0782 31.3017 177.4910 94 A 3.9287 7.9562 120.5511 55.5829 18.3854 179.2655 95 M 3.0097 7.7790 116.7718 58.2676 32.0426 178.0106 96 D 4.1402 7.5697 118.2574 57.3706 41.5022 178.0959 97 I 3.6718 7.7917 120.4578 64.5835 37.2375 178.4046 98 L 4.0115 8.0279 119.7147 57.7657 41.3317 179.2054 99 N 4.3345 7.8755 116.6140 56.4653 38.3824 177.2291 100 R 3.8810 8.0173 119.5157 59.2306 30.1479 178.8721 101 V 3.6828 7.6999 117.9610 66.3152 31.4440 177.0887 102 Y 4.0794 7.8544 118.6049 61.0677 38.6142 178.2582 103 Q 3.9763 8.6973 119.2109 58.9929 28.6294 179.1785 104 G 3.6710 9.0901 106.0880 47.7611 0.0000 175.4479 105 L 4.2454 8.1711 121.6074 57.6132 41.6351 179.6875 106 K 3.9746 7.8787 118.4968 59.4253 31.6967 179.2397 107 E 4.1368 8.0072 118.0704 59.1241 29.4243 178.7019 108 R 4.2758 7.6424 115.2767 56.1232 30.3399 177.2903 109 G 3.7515 8.1632 107.6067 45.5023 0.0000 173.7746 110 F 4.5253 7.7170 117.1203 56.4361 40.6917 174.6899 111 N 4.6954 9.1893 120.7124 53.1424 39.7758 173.9626 112 V 4.9883 8.5271 125.9648 61.1132 34.4335 174.4429 113 G 4.6769 9.0693 113.4904 44.7225 0.0000 171.1050 114 K 4.2331 8.3182 117.0121 55.9482 35.2550 174.6102 115 A 4.2237 7.4455 122.2999 48.8161 21.1887 174.8699 116 P 4.4496 0.0000 0.0000 62.8855 32.1871 175.7775 117 F 4.1754 9.4400 124.6969 58.5553 40.9333 176.0624 118 G 3.3956 7.7581 112.0891 45.7722 0.0000 172.0024 119 Y 5.0260 7.3445 114.6504 55.8702 42.1950 174.3769 120 Y 4.6541 8.8919 119.3033 57.3693 39.5373 175.1170 121 K 5.3567 8.8991 121.7070 54.7374 36.4270 175.7260 122 A 4.8577 9.1336 125.3247 51.6397 20.5952 176.2683 123 F 5.5619 8.0461 113.0806 56.1153 41.2136 173.5839 124 K 4.8046 9.6613 119.2982 54.9096 35.7704 175.3647 125 I 5.0113 8.5924 123.3160 59.5321 41.9843 174.6219 126 S 4.2535 7.8490 120.2662 56.3072 64.2250 172.2253 127 C 4.6106 8.3562 127.8689 58.4358 32.1275 174.6755 128 K 3.7559 8.3246 127.1967 57.8481 31.7330 178.3544 129 G 3.8285 7.4904 101.9655 45.9469 0.0000 173.1460 130 H 4.6929 7.6007 116.6794 54.0519 29.7396 174.4363 131 P 4.2538 0.0000 0.0000 65.5791 30.8402 177.6095 132 L 4.4327 7.8273 114.8910 54.6220 42.2371 177.5376 133 A 3.9789 7.9938 122.4254 53.5700 18.4952 176.8179 134 E 5.0543 7.7206 114.6256 54.6426 32.6089 175.0200 135 L 5.0607 9.2222 124.3969 53.0722 46.6847 175.7288 136 S 5.3111 8.4899 113.8198 57.1943 66.6372 173.4081 137 R 4.7279 8.9043 118.7124 55.1966 34.9020 174.1734 138 T 5.0152 8.6109 119.5033 61.9472 70.7141 173.5558 139 I 4.5377 8.9565 128.2144 59.5876 39.3092 175.8058 140 V 4.5405 8.2684 119.4952 58.3915 35.0199 173.8241 141 P 4.5918 0.0000 0.0000 63.6509 31.6064 177.0029 142 E 4.6945 10.3092 119.6533 55.8765 31.5435 173.9116 143 E 4.8254 8.4171 113.3323 54.6822 33.9026 179.8371 144 A 4.2906 8.3005 121.6832 52.3744 19.2906 177.7465 145 R 4.1582 8.2400 121.1725 55.8191 30.9603 176.7301 146 V 4.2477 8.1785 124.7716 61.7112 32.4618 175.8460 147 E 4.2748 8.3669 121.3661 55.9280 30.6079 173.3296 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 1 M 8.16 4.70 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 2 R 8.86 4.91 0.00 1.98 1.79 0.00 3.36 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 3 V 9.27 4.85 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 0.91 0.00 0.00 0.96 0.00 0.00 4 L 9.23 5.05 0.00 1.77 1.56 0.97 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 5 L 9.28 5.06 0.00 1.70 1.56 0.90 0.36 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 6 I 8.88 4.88 1.94 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 1.26 1.04 0.92 0.00 0.00 7 H 9.17 4.90 0.00 3.19 3.18 0.00 5.54 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 9.47 5.08 0.00 3.67 3.57 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 9 D 8.88 4.51 0.00 2.40 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Y 7.00 5.19 0.00 3.08 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 11 I 8.58 4.90 1.75 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 0.79 0.88 0.55 0.00 0.00 12 E 9.98 5.37 0.00 1.94 1.76 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 2.17 2.22 0.00 13 Y 8.35 5.63 0.00 3.29 3.24 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 14 E 9.71 4.84 0.00 2.00 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 2.22 2.23 0.00 15 V 9.18 4.12 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 0.57 0.00 0.00 0.91 0.00 0.00 16 K 9.11 4.71 0.00 1.98 0.88 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.66 1.63 7.81 17 D 9.31 4.92 0.00 2.85 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 18 K 8.72 4.35 0.00 1.54 1.59 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.02 7.81 19 A 8.28 4.12 0.21 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 20 L 7.26 4.63 0.00 1.41 1.45 0.79 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.78 3.90 0.00 1.69 1.88 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.54 7.81 22 N 7.65 4.71 0.00 2.62 2.69 0.00 0.00 6.86 8.02 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 23 P 0.00 4.63 0.00 1.31 1.63 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.25 0.00 24 E 8.23 4.15 0.00 2.19 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 2.42 2.32 0.00 25 P 0.00 4.74 0.00 2.15 2.08 0.00 3.81 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 2.01 1.99 0.00 26 I 8.22 4.64 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.79 0.96 0.00 0.00 27 S 8.10 4.70 0.00 4.02 4.04 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 28 E 8.68 3.91 0.00 2.10 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 2.38 2.44 0.00 29 D 7.71 4.37 0.00 2.65 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 30 M 7.83 4.37 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.59 0.00 31 K 7.76 4.06 0.00 2.12 1.86 0.00 1.43 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.49 7.81 32 R 6.95 4.32 0.00 1.51 1.65 0.00 3.01 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.49 0.00 33 G 6.89 4.14 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 0.00 34 R 8.22 5.73 0.00 1.71 1.72 0.00 3.16 0.00 0.00 3.84 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.48 0.00 35 M 8.72 5.09 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.69 0.00 36 E 8.56 5.03 0.00 1.85 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 2.31 2.36 0.00 37 E 8.45 3.90 0.00 2.08 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 2.31 2.40 0.00 38 V 8.08 4.79 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 0.80 0.00 0.00 1.09 0.00 0.00 39 L 8.97 4.62 0.00 1.72 1.53 0.89 0.63 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 40 V 8.86 4.41 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 0.04 0.00 0.00 0.83 0.00 0.00 41 A 8.94 5.03 1.18 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 42 F 8.90 4.84 0.00 2.91 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 43 I 9.16 5.16 1.97 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 1.17 0.89 0.98 0.00 0.00 44 S 9.17 4.89 0.00 4.08 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 45 V 8.47 4.31 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 1.00 0.00 0.00 0.99 0.00 0.00 46 E 9.43 4.85 0.00 2.06 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 2.31 2.43 0.00 47 K 8.90 3.77 0.00 1.85 1.84 0.00 1.55 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.53 7.81 48 V 7.93 3.57 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 1.02 0.00 0.00 0.94 0.00 0.00 49 D 8.11 4.54 0.00 2.88 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 50 E 8.23 4.13 0.00 2.06 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 2.42 0.00 51 K 8.30 4.22 0.00 1.76 1.87 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.54 7.81 52 N 7.67 4.99 0.00 2.86 2.62 0.00 0.00 7.25 7.59 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 53 P 0.00 4.21 0.00 2.17 2.10 0.00 3.64 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.31 0.00 54 E 8.10 3.91 0.00 2.07 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 2.37 2.42 0.00 55 E 8.37 3.86 0.00 2.25 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 0.00 2.31 2.32 0.00 56 V 7.71 3.59 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 1.03 0.00 0.00 0.97 0.00 0.00 57 S 7.98 4.13 0.00 4.06 3.90 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 58 L 7.84 3.96 0.00 1.89 1.72 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.10 3.85 0.00 1.94 1.87 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.70 1.58 7.81 60 A 8.38 4.07 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 61 I 8.02 3.69 2.04 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 1.40 1.16 0.93 0.00 0.00 62 E 8.15 3.92 0.00 2.10 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 2.31 2.40 0.00 63 E 8.58 3.98 0.00 1.96 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 2.49 2.50 0.00 64 I 8.20 3.69 1.86 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 1.48 0.76 0.74 0.00 0.00 65 S 8.11 3.87 0.00 4.10 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 66 K 8.07 3.87 0.00 1.93 1.97 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 67 V 7.63 3.54 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 1.01 0.00 0.00 0.91 0.00 0.00 68 A 7.84 3.90 1.17 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 0.00 0.00 69 E 8.46 3.97 0.00 2.18 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 2.77 2.59 0.00 70 Q 7.93 4.01 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.69 0.00 71 V 7.89 3.88 1.84 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 0.69 0.00 0.00 0.79 0.00 0.00 72 K 7.78 3.78 0.00 1.96 1.91 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.53 7.81 73 A 8.38 4.78 1.27 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 74 E 8.79 4.73 0.00 2.01 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 2.38 2.39 0.00 75 N 8.16 5.63 0.00 2.87 2.78 0.00 0.00 6.52 7.68 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 76 V 8.86 4.90 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 0.93 0.00 0.00 0.53 0.00 0.00 77 F 9.08 5.08 0.00 3.21 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 78 V 8.30 4.21 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 0.81 0.00 0.00 0.99 0.00 0.00 79 Y 8.55 4.42 0.00 2.95 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 0.00 0.00 0.00 0.00 80 P 0.00 4.71 0.00 1.95 2.14 0.00 3.33 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 81 F 9.41 4.82 0.00 3.62 3.10 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 82 A 8.14 4.20 1.09 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 83 H 7.73 4.85 0.00 2.64 3.16 0.00 5.64 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 84 L 8.10 4.60 0.00 1.75 1.80 1.14 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.68 4.73 0.00 3.79 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 86 S 8.68 4.73 0.00 3.87 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 87 E 8.13 4.76 0.00 2.05 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 2.19 2.31 0.00 88 L 7.79 4.72 0.00 1.57 1.59 0.86 0.95 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 89 A 8.91 4.66 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 90 K 8.86 4.03 0.00 1.98 1.96 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.41 7.81 91 P 0.00 4.47 0.00 2.25 2.41 0.00 3.65 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 2.16 2.25 0.00 92 S 8.19 4.01 0.00 4.00 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 93 V 7.70 3.50 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 1.09 0.00 0.00 0.91 0.00 0.00 94 A 7.96 3.93 1.50 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 0.00 0.00 95 M 7.78 3.01 0.00 1.54 0.70 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.21 0.00 96 D 7.57 4.14 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 97 I 7.79 3.67 1.96 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 1.50 0.55 0.91 0.00 0.00 98 L 8.03 4.01 0.00 1.73 1.67 1.13 0.59 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 99 N 7.88 4.33 0.00 2.82 2.90 0.00 0.00 7.16 7.63 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 0.00 100 R 8.02 3.88 0.00 2.01 1.96 0.00 3.18 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.89 0.00 101 V 7.70 3.68 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 1.08 0.00 0.00 1.02 0.00 0.00 102 Y 7.85 4.08 0.00 3.12 3.13 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 0.00 103 Q 8.70 3.98 0.00 2.31 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.67 2.57 0.00 104 G 9.09 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 0.00 105 L 8.17 4.25 0.00 1.93 1.66 0.88 0.47 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 0.00 106 K 7.88 3.97 0.00 1.80 1.74 0.00 1.50 0.00 0.00 1.23 0.00 0.00 2.77 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.09 1.03 7.81 107 E 8.01 4.14 0.00 2.09 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 2.33 2.43 0.00 108 R 7.64 4.28 0.00 2.27 2.03 0.00 3.40 0.00 0.00 3.25 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 109 G 8.16 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 F 7.72 4.53 0.00 2.93 2.95 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 0.00 111 N 9.19 4.70 0.00 2.85 3.09 0.00 0.00 6.91 8.36 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 0.00 112 V 8.53 4.99 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 0.90 0.00 0.00 0.95 0.00 0.00 113 G 9.07 4.68 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 0.00 0.00 0.00 114 K 8.32 4.23 0.00 1.23 1.16 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.33 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.80 0.83 7.81 115 A 7.45 4.22 0.34 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 0.00 116 P 0.00 4.45 0.00 1.89 1.94 0.00 3.04 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 117 F 9.44 4.18 0.00 3.14 2.95 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 0.00 118 G 7.76 3.40 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 0.00 119 Y 7.34 5.03 0.00 2.72 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 0.00 120 Y 8.89 4.65 0.00 3.11 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 0.00 121 K 8.90 5.36 0.00 1.90 2.01 0.00 1.62 0.00 0.00 1.99 0.00 0.00 2.93 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.44 1.64 7.81 122 A 9.13 4.86 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 0.00 123 F 8.05 5.56 0.00 3.47 3.43 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 0.00 124 K 9.66 4.80 0.00 1.84 1.92 0.00 1.79 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.40 7.81 125 I 8.59 5.01 2.09 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 1.16 1.00 1.09 0.00 0.00 126 S 7.85 4.25 0.00 2.95 2.72 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 0.00 0.00 0.00 0.00 127 C 8.36 4.61 0.00 2.95 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 0.00 128 K 8.32 3.76 0.00 1.59 1.47 0.00 1.42 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.50 1.22 7.81 129 G 7.49 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 0.00 0.00 0.00 130 H 7.60 4.69 0.00 3.26 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.25 0.00 2.05 2.14 0.00 3.70 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 2.04 2.14 0.00 132 L 7.83 4.43 0.00 1.72 1.69 0.92 0.90 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 0.00 133 A 7.99 3.98 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 0.00 134 E 7.72 5.05 0.00 1.72 1.84 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 2.22 2.26 0.00 135 L 9.22 5.06 0.00 1.51 1.48 0.92 0.53 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 0.00 136 S 8.49 5.31 0.00 3.82 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 0.00 137 R 8.90 4.73 0.00 1.72 1.80 0.00 3.33 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 138 T 8.61 5.02 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 1.22 0.00 0.00 139 I 8.96 4.54 1.88 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 1.23 0.62 0.92 0.00 0.00 140 V 8.27 4.54 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 0.76 0.00 0.00 0.94 0.00 0.00 141 P 0.00 4.59 0.00 2.04 1.98 0.00 3.62 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 2.26 2.08 0.00 142 E 10.31 4.69 0.00 1.89 1.76 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 2.14 2.08 0.00 143 E 8.42 4.83 0.00 1.93 1.67 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 2.14 2.10 0.00 144 A 8.30 4.29 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 0.00 145 R 8.24 4.16 0.00 1.95 1.83 0.00 3.18 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 146 V 8.18 4.25 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 0.00 147 E 8.37 4.27 0.00 1.96 1.61 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 2.12 1.86 0.00