NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4278 8.3049 120.3478 54.7816 33.6431 175.0139 2 E 3.9765 8.6809 125.0979 56.5739 30.5489 174.4075 3 L 5.2049 8.6887 123.0873 53.4340 46.0266 175.2661 4 T 4.9310 9.1372 116.5962 60.6938 71.2133 172.0915 5 T 5.2834 8.5033 109.7273 60.1203 72.0749 173.1993 6 R 4.7479 9.0051 122.2742 55.0130 34.2519 173.7570 7 T 4.9983 8.3795 120.4624 61.7569 70.5365 174.0703 8 L 4.3587 9.3453 128.9953 53.3322 42.6671 175.5966 9 P 4.5796 0.0000 0.0000 62.2820 32.0278 176.2694 10 A 4.0459 8.4793 121.6320 54.1938 18.3873 177.6967 11 R 4.3170 7.6444 116.2071 54.8125 29.5880 175.6797 12 K 4.3563 8.4073 124.9669 56.5173 33.9428 176.2535 13 H 5.3161 9.5569 121.2911 54.7261 30.1003 173.7001 14 I 4.9047 8.9823 125.3935 59.7692 39.3539 174.8068 15 A 5.2550 9.0788 128.6639 50.2386 21.5265 175.3598 16 L 5.0377 9.1094 122.9503 52.9051 44.6626 175.9721 17 V 4.6957 8.6740 122.7949 61.3279 35.3690 173.8150 18 A 5.4137 8.1926 125.7203 51.1654 22.4410 176.0350 19 H 4.6975 9.2109 119.0207 55.6753 30.1829 176.3162 20 D 4.4632 9.2576 120.8743 58.4505 40.5240 179.3829 21 H 4.3618 8.4275 113.3392 57.7577 29.0824 176.2152 22 C 4.7690 8.1668 117.6654 59.2220 28.8054 175.6637 23 K 4.1006 8.2119 124.4720 60.2559 31.7253 179.5308 24 Q 4.0960 8.1894 120.3593 60.5635 27.9975 180.2217 25 M 4.3424 8.1485 120.2947 58.3662 32.1029 178.4977 26 L 4.2564 8.1644 120.1797 58.4097 42.2336 178.6523 27 M 4.0956 8.5543 119.0358 58.8716 31.9761 178.9442 28 S 4.4489 8.2648 116.2802 60.8206 62.7726 176.6768 29 W 4.1620 8.2976 130.1894 60.4038 30.8864 177.8878 30 V 3.6782 8.6098 118.6461 66.1090 30.9625 177.8362 31 E 3.9417 8.3145 118.2631 59.5531 29.1339 179.5348 32 R 4.0632 7.9935 116.3307 58.1251 30.3065 177.1289 33 H 4.5373 7.2952 114.5910 55.1158 29.7440 175.2988 34 Q 3.9016 7.7588 123.0187 58.9927 28.3791 176.8784 35 P 4.1889 0.0000 0.0000 65.7871 31.6348 177.9581 36 L 4.1278 7.7587 118.2528 58.1803 42.1388 178.7688 37 L 4.1760 8.0693 118.9276 57.8281 41.2683 179.3198 38 E 4.0715 8.0848 117.8601 59.1600 29.4277 178.4808 39 Q 4.2824 7.6944 115.1424 56.3005 29.0269 174.4867 40 H 5.0359 7.8103 116.7721 53.8686 33.0619 172.7507 41 V 4.2381 8.4836 119.1276 61.6740 32.9104 174.4636 42 L 5.3514 8.3555 127.4507 53.4851 44.3998 175.0470 43 Y 5.2265 9.0424 119.2951 56.7158 42.6964 173.9723 44 A 5.1917 8.6418 121.0993 52.1987 23.5558 176.0089 45 T 4.1057 8.4647 109.5181 61.6879 70.1181 175.7551 46 G 3.9183 8.9545 110.8478 49.4272 0.0000 176.3858 47 T 3.8584 8.0066 116.5895 66.1891 68.8594 176.7855 48 T 3.9795 8.0485 117.2087 66.7803 68.5026 176.6033 49 G 3.6446 8.4816 107.7557 47.9169 0.0000 175.4806 50 N 4.3583 7.9542 119.1330 55.9469 38.2197 177.4734 51 L 3.9945 7.8814 120.3085 57.8241 41.6493 179.6063 52 I 3.6435 7.6664 119.5409 64.5604 37.0995 178.7447 53 S 4.3403 8.2178 117.4927 61.9380 62.6133 176.4520 54 R 4.4255 8.0792 121.0122 58.7505 29.0830 179.2344 55 A 4.8176 7.5355 120.1723 53.0089 21.1544 177.4497 56 T 4.3201 8.3066 104.0021 60.6484 70.2174 175.7705 57 G 3.9017 8.2943 109.5547 45.9391 0.0000 173.8434 58 M 4.2220 7.6487 119.0683 54.5849 32.6453 175.5638 59 N 4.4666 8.4706 120.1210 53.1972 39.3715 174.4643 60 V 4.3679 8.0462 125.2078 61.0460 34.4865 174.8577 61 N 4.5401 8.9552 126.3242 52.8547 38.6323 173.6124 62 A 4.7743 8.3026 126.0295 51.6399 19.4617 176.9723 63 M 4.5156 9.1426 124.6574 54.6045 35.4515 175.9489 64 L 4.2724 9.0959 119.7783 54.8043 43.5553 176.7826 65 S 4.2503 8.6977 115.2905 58.7990 63.2627 174.9853 66 G 3.8036 9.1364 113.0847 47.9372 0.0000 174.2406 67 P 4.3882 0.0000 0.0000 64.3418 31.4222 177.4972 68 M 4.4616 8.2157 115.2220 54.6095 32.7599 175.2984 69 G 3.5941 8.1777 109.0215 45.2948 0.0000 176.3987 70 G 3.7218 8.7591 109.0677 48.1993 0.0000 175.4035 71 D 4.2633 8.0457 121.0001 57.2512 40.8740 178.9474 72 Q 3.9777 7.9874 117.8626 58.7264 28.7768 178.5337 73 Q 3.9472 8.1553 119.3538 58.9377 28.7873 178.9161 74 V 3.6045 7.9872 119.4807 65.6838 31.5041 178.1590 75 G 3.6047 8.2296 105.5493 47.8097 0.0000 175.2428 76 A 3.9090 8.2940 124.1803 54.8078 18.3237 179.5659 77 L 3.7596 7.7601 117.2298 57.9293 41.6524 179.8680 78 I 3.4829 7.6264 119.6925 64.4353 36.8979 178.7000 79 S 2.7900 7.4434 113.3116 60.6884 62.7181 175.4838 80 E 3.9380 7.5226 119.6266 55.8545 29.3926 177.1124 81 G 3.6205 7.5322 107.4419 46.2195 0.0000 174.7077 82 K 4.1113 7.9983 118.5035 55.9022 32.7918 176.6816 83 I 4.3223 7.2362 119.6584 59.4581 39.4496 174.6654 84 D 4.8274 8.8614 124.4235 54.8499 42.9228 177.1274 85 V 4.7072 7.6064 117.0401 60.8932 35.5625 173.8227 86 L 5.1110 8.8566 128.7907 53.3822 45.0663 174.9441 87 I 4.6305 8.8315 127.8241 59.7080 39.3422 174.6584 88 F 5.3770 9.4745 131.2922 56.6753 41.7371 173.6308 89 F 5.6243 9.2539 127.3614 56.1676 38.0880 175.1940 90 W 4.5670 7.8977 119.5950 54.9914 29.9869 176.2668 91 D 4.3395 9.1643 121.7165 53.5153 40.1425 174.0831 92 P 4.2709 0.0000 0.0000 63.1316 31.6270 176.4282 93 L 4.7470 8.4690 117.6780 54.3711 42.7714 175.9108 94 N 4.8577 7.8916 115.5571 51.5130 42.4263 174.1416 95 A 4.1980 8.6642 126.6182 52.1675 19.1596 176.9295 96 V 4.5771 8.0131 115.5515 58.4982 34.7145 174.3969 97 P 4.4197 0.0000 0.0000 65.4527 31.6120 176.8677 98 N 4.9610 7.8908 116.6549 52.7525 38.8231 176.8351 99 D 4.3370 8.1803 122.0504 58.2247 41.4916 175.0648 100 P 4.2450 0.0000 0.0000 66.0081 31.1788 177.9740 101 D 4.3524 8.0621 118.1448 57.0155 40.7838 178.6769 102 V 3.7907 7.9296 118.6154 66.2019 31.5342 178.3027 103 K 3.8252 8.0786 117.8877 59.3043 31.8224 179.3017 104 A 3.9787 8.4975 121.6068 54.9459 18.2516 179.5023 105 L 3.9515 8.1847 119.0677 58.2792 42.3257 179.2129 106 L 4.0919 8.0293 119.1013 57.5044 41.3996 179.4346 107 R 3.8645 8.1611 118.9016 59.4915 29.9865 178.6209 108 L 4.0432 7.9996 118.5749 57.8106 41.4852 179.3880 109 A 4.1013 8.1671 120.7584 55.3202 18.3707 179.9786 110 T 3.8459 7.7832 114.0455 66.6736 68.3734 177.0847 111 V 3.3409 7.6532 119.4186 65.8626 31.4333 176.8771 112 W 4.2636 8.2930 116.0670 56.1824 29.3505 175.6041 113 N 4.1441 7.6215 116.4131 54.7964 37.1060 173.1015 114 I 4.6583 7.2703 110.2186 58.2924 41.0556 175.2124 115 P 4.4702 0.0000 0.0000 63.0696 32.2239 175.5231 116 V 5.1091 8.4954 123.2125 61.0529 34.8235 174.1756 117 A 4.9598 9.1877 128.9165 50.3998 21.6830 176.4587 118 T 5.3551 9.0727 110.3254 60.6307 70.0052 173.6221 119 N 4.1040 7.5034 119.3532 50.3504 41.4340 175.2691 120 V 3.2885 7.5266 119.2456 65.9687 31.6783 177.4020 121 A 4.1265 7.9493 119.9356 55.9269 18.1907 179.6798 122 T 3.9363 8.5975 114.0830 66.5861 68.4800 176.8788 123 A 3.9969 8.0902 122.8245 55.2940 18.4191 179.4930 124 D 4.5684 8.8093 117.8131 57.6944 40.7257 179.0307 125 F 4.0107 8.1826 116.8041 60.4201 39.0415 177.6429 126 I 4.0269 8.1113 119.5348 64.5628 36.8163 178.4194 127 I 2.6686 7.6579 117.9054 63.3531 37.8183 177.1686 128 Q 4.1877 7.6922 116.7117 55.7575 29.4230 176.2285 129 S 4.2021 7.4665 116.5289 57.6504 63.0640 172.6838 130 P 4.2660 0.0000 0.0000 66.6169 30.8374 176.6602 131 H 4.8838 8.1108 114.5394 55.5880 28.5608 176.9635 132 F 4.2296 8.3536 124.6577 60.2668 39.2758 175.7016 133 N 5.0439 8.2968 114.8228 53.0422 39.5623 173.7322 134 D 4.9667 7.5054 117.4767 52.5208 43.9398 175.2122 135 A 4.5660 8.3515 122.0705 51.6431 19.3796 177.3923 136 V 4.4683 8.4524 115.8424 59.6055 35.5119 174.7004 137 D 5.3569 8.7069 124.2302 53.4755 42.0845 175.8719 138 I 4.7551 9.0001 115.8532 58.9179 41.3779 174.3699 139 L 4.8371 8.5527 124.2944 54.6130 42.4361 176.2263 140 I 4.8752 9.0334 116.8001 57.9740 41.5975 172.8439 141 P 4.3979 0.0000 0.0000 62.8817 32.1308 176.6292 142 D 4.6348 8.8561 122.9750 53.6291 40.9132 176.1738 143 Y 4.2984 8.8052 130.9649 61.1505 39.0122 177.9312 144 Q 4.0489 8.5163 123.6855 61.2071 28.1826 181.7801 145 R 4.1662 9.2569 123.5997 61.1474 29.3047 180.0242 146 Y 4.1896 7.9696 120.1354 60.3768 38.8937 178.0537 147 L 3.4677 8.0669 121.3051 58.0209 42.0013 178.4990 148 A 3.9252 7.4835 119.2388 55.4683 18.4895 179.1039 149 D 4.3429 7.9070 117.0277 57.6463 40.7063 179.0627 150 R 3.8336 7.1336 117.2516 58.6806 29.9760 178.0369 151 L 4.5226 7.0523 115.7424 54.2704 41.9909 176.7885 152 K 4.1048 7.7633 124.8669 56.8399 31.9449 176.7905 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 8.30 4.43 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 2 E 8.68 3.98 0.00 2.04 1.89 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 2.42 2.36 0.00 3 L 8.69 5.20 0.00 1.47 1.52 0.90 0.76 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 4 T 9.14 4.93 4.29 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 1.33 0.00 0.00 5 T 8.50 5.28 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 1.23 0.00 0.00 6 R 9.01 4.75 0.00 1.91 1.79 0.00 3.01 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 7 T 8.38 5.00 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 1.25 0.00 0.00 8 L 9.35 4.36 0.00 1.52 1.55 0.92 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.58 0.00 2.18 2.07 0.00 3.87 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 10 A 8.48 4.05 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 11 R 7.64 4.32 0.00 1.76 1.87 0.00 3.21 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 12 K 8.41 4.36 0.00 1.42 1.52 0.00 1.48 0.00 0.00 1.83 0.00 0.00 2.47 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 0.53 7.81 13 H 9.56 5.32 0.00 3.18 3.27 0.00 5.79 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.98 4.90 2.02 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.66 1.05 0.00 0.00 15 A 9.08 5.26 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 16 L 9.11 5.04 0.00 1.54 1.54 1.01 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.67 4.70 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 0.51 0.00 0.00 0.67 0.00 0.00 18 A 8.19 5.41 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 19 H 9.21 4.70 0.00 3.32 3.34 0.00 5.68 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 9.26 4.46 0.00 2.72 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 21 H 8.43 4.36 0.00 3.24 3.40 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.17 4.77 0.00 3.27 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.21 4.10 0.00 1.99 1.92 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.75 7.81 24 Q 8.19 4.10 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.88 0.00 0.00 0.00 0.00 0.00 2.37 2.03 0.00 25 M 8.15 4.34 0.00 2.13 2.41 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.62 0.00 26 L 8.16 4.26 0.00 1.91 1.93 0.51 0.94 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 27 M 8.55 4.10 0.00 2.10 2.36 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 3.03 0.00 28 S 8.26 4.45 0.00 4.13 3.99 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 29 W 8.30 4.16 0.00 3.58 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.61 3.68 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 1.01 0.00 0.00 1.19 0.00 0.00 31 E 8.31 3.94 0.00 2.19 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 2.33 2.58 0.00 32 R 7.99 4.06 0.00 1.52 1.76 0.00 3.06 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.89 0.00 33 H 7.30 4.54 0.00 2.50 2.76 0.00 5.64 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.76 3.90 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.30 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 35 P 0.00 4.19 0.00 2.00 2.07 0.00 3.56 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.11 0.00 36 L 7.76 4.13 0.00 1.73 1.59 1.18 0.49 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 37 L 8.07 4.18 0.00 1.73 1.75 0.85 0.85 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 38 E 8.08 4.07 0.00 2.07 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 2.63 0.00 39 Q 7.69 4.28 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.66 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 40 H 7.81 5.04 0.00 3.23 3.45 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.48 4.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.84 0.00 0.00 42 L 8.36 5.35 0.00 1.72 1.56 0.96 0.93 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 43 Y 9.04 5.23 0.00 2.93 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 44 A 8.64 5.19 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 45 T 8.46 4.11 4.22 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 1.12 0.00 0.00 46 G 8.95 3.92 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 0.00 0.00 0.00 47 T 8.01 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 1.23 0.00 0.00 48 T 8.05 3.98 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 49 G 8.48 3.64 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 0.00 0.00 0.00 50 N 7.95 4.36 0.00 2.92 2.88 0.00 0.00 7.06 6.77 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 51 L 7.88 3.99 0.00 1.88 1.74 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.67 3.64 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.93 0.93 0.00 0.00 53 S 8.22 4.34 0.00 4.09 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 54 R 8.08 4.43 0.00 1.92 1.86 0.00 3.21 0.00 0.00 3.23 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 55 A 7.54 4.82 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 56 T 8.31 4.32 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 1.24 0.00 0.00 57 G 8.29 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 0.00 0.00 0.00 58 M 7.65 4.22 0.00 2.04 2.00 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 2.62 2.46 0.00 59 N 8.47 4.47 0.00 2.65 2.68 0.00 0.00 6.71 7.71 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 60 V 8.05 4.37 2.05 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 0.86 0.00 0.00 0.92 0.00 0.00 61 N 8.96 4.54 0.00 2.11 2.59 0.00 0.00 6.43 8.31 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 62 A 8.30 4.77 1.22 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 0.00 0.00 63 M 9.14 4.52 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.86 0.00 64 L 9.10 4.27 0.00 1.64 1.58 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.70 4.25 0.00 3.91 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 66 G 9.14 3.80 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 0.00 0.00 0.00 67 P 0.00 4.39 0.00 2.05 2.16 0.00 3.69 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 2.06 2.22 0.00 68 M 8.22 4.46 0.00 1.98 2.19 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 69 G 8.18 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 70 G 8.76 3.72 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 0.00 0.00 0.00 71 D 8.05 4.26 0.00 2.71 2.69 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 0.00 0.00 0.00 0.00 72 Q 7.99 3.98 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 73 Q 8.16 3.95 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 74 V 7.99 3.60 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 0.90 0.00 0.00 0.92 0.00 0.00 75 G 8.23 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.29 3.91 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 77 L 7.76 3.76 0.00 1.71 1.47 0.74 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.63 3.48 1.95 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 1.49 0.63 0.90 0.00 0.00 79 S 7.44 2.79 0.00 3.82 3.92 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 80 E 7.52 3.94 0.00 1.95 1.83 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 2.15 2.18 0.00 81 G 7.53 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.00 4.11 0.00 1.47 1.61 0.00 1.51 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.25 1.20 7.81 83 I 7.24 4.32 1.70 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.64 0.90 0.00 0.00 84 D 8.86 4.83 0.00 2.49 2.65 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 0.00 0.00 0.00 85 V 7.61 4.71 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.92 0.00 0.00 86 L 8.86 5.11 0.00 1.81 1.52 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.83 4.63 1.68 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 1.14 0.82 0.08 0.00 0.00 88 F 9.47 5.38 0.00 2.98 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 89 F 9.25 5.62 0.00 3.01 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 90 W 7.90 4.57 0.00 3.15 1.81 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 91 D 9.16 4.34 0.00 2.80 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 92 P 0.00 4.27 0.00 1.83 1.04 0.00 3.46 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.50 0.00 93 L 8.47 4.75 0.00 1.61 1.61 0.85 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.89 4.86 0.00 2.77 2.61 0.00 0.00 7.02 7.35 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 95 A 8.66 4.20 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 96 V 8.01 4.58 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 0.70 0.00 0.00 0.98 0.00 0.00 97 P 0.00 4.42 0.00 2.19 2.20 0.00 3.76 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 2.01 1.97 0.00 98 N 7.89 4.96 0.00 2.97 3.10 0.00 0.00 5.90 8.07 0.00 0.00 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 D 8.18 4.34 0.00 2.97 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 0.00 100 P 0.00 4.25 0.00 2.30 2.29 0.00 3.66 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 101 D 8.06 4.35 0.00 2.98 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 0.00 102 V 7.93 3.79 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 0.67 0.00 0.00 1.28 0.00 0.00 103 K 8.08 3.83 0.00 1.93 1.76 0.00 1.26 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.35 1.33 7.81 104 A 8.50 3.98 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 0.00 105 L 8.18 3.95 0.00 1.83 1.98 0.94 0.25 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 0.00 106 L 8.03 4.09 0.00 1.79 1.65 0.38 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.16 3.86 0.00 2.00 2.10 0.00 3.07 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 108 L 8.00 4.04 0.00 1.98 1.87 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.17 4.10 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.78 3.85 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 1.19 0.00 0.00 111 V 7.65 3.34 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 0.00 0.00 0.87 0.00 0.00 112 W 8.29 4.26 0.00 3.42 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 0.00 113 N 7.62 4.14 0.00 2.82 2.94 0.00 0.00 6.97 7.31 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 0.00 114 I 7.27 4.66 2.15 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.87 1.01 0.00 0.00 115 P 0.00 4.47 0.00 2.20 2.14 0.00 3.87 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.15 0.00 116 V 8.50 5.11 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 0.94 0.00 0.00 1.04 0.00 0.00 117 A 9.19 4.96 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 0.00 118 T 9.07 5.36 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 1.42 0.00 0.00 119 N 7.50 4.10 0.00 2.63 2.59 0.00 0.00 5.83 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 0.00 120 V 7.53 3.29 1.94 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 1.22 0.00 0.00 0.70 0.00 0.00 121 A 7.95 4.13 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 0.00 122 T 8.60 3.94 4.29 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 1.29 0.00 0.00 123 A 8.09 4.00 0.78 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 0.00 0.00 124 D 8.81 4.57 0.00 2.98 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 0.00 125 F 8.18 4.01 0.00 3.17 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 0.00 126 I 8.11 4.03 2.13 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.01 1.17 0.00 0.00 127 I 7.66 2.67 1.97 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 -0.36 0.88 0.00 0.00 128 Q 7.69 4.19 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 129 S 7.47 4.20 0.00 4.10 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 0.00 130 P 0.00 4.27 0.00 2.17 2.21 0.00 3.84 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 1.89 1.99 0.00 131 H 8.11 4.88 0.00 3.29 3.35 0.00 5.63 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.35 4.23 0.00 3.20 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 0.00 133 N 8.30 5.04 0.00 2.82 2.88 0.00 0.00 6.85 8.06 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 0.00 134 D 7.51 4.97 0.00 2.70 2.56 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 0.00 135 A 8.35 4.57 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 0.00 136 V 8.45 4.47 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 0.81 0.00 0.00 0.98 0.00 0.00 137 D 8.71 5.36 0.00 2.54 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.00 4.76 1.91 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 1.39 0.76 0.94 0.00 0.00 139 L 8.55 4.84 0.00 1.56 1.65 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 140 I 9.03 4.88 2.15 0.00 0.00 1.07 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 1.07 1.14 0.00 0.00 141 P 0.00 4.40 0.00 1.72 1.75 0.00 3.41 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.00 0.00 142 D 8.86 4.63 0.00 2.80 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 0.00 143 Y 8.81 4.30 0.00 3.38 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 Q 8.52 4.05 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.01 0.00 145 R 9.26 4.17 0.00 1.77 1.96 0.00 3.24 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 146 Y 7.97 4.19 0.00 3.04 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 L 8.07 3.47 0.00 0.99 1.48 0.83 1.32 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 0.00 148 A 7.48 3.93 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 0.00 149 D 7.91 4.34 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 7.13 3.83 0.00 1.67 1.83 0.00 3.06 0.00 0.00 2.79 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.13 0.00 151 L 7.05 4.52 0.00 1.58 1.62 0.89 0.64 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 0.00 152 K 7.76 4.10 0.00 1.82 1.69 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.57 7.81