NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4233 8.2649 123.5880 51.5687 20.9982 175.9123 2 K 4.3229 7.5105 114.8089 54.3650 34.4894 174.5925 3 K 4.1200 8.5709 125.6311 56.6154 32.3681 177.5740 4 V 3.8372 8.3448 127.1000 61.7311 31.6784 175.4143 5 Q 4.5684 8.6034 124.3910 53.1189 31.8482 174.0864 6 A 4.0976 8.3562 122.0044 52.8233 18.9923 176.1196 7 Y 4.9332 7.7725 118.4054 56.6476 40.7241 174.1323 8 V 4.6502 8.6896 114.2572 59.4116 34.9545 174.8262 9 K 5.2163 8.3468 122.3844 55.2659 35.1725 175.1029 10 L 4.5256 8.5518 121.2788 54.9174 44.2189 173.8257 11 Q 4.8517 8.6924 119.3771 55.0490 29.9175 174.9344 12 V 4.5129 8.0450 117.1253 58.7774 34.7956 175.5386 13 A 4.0533 8.7707 124.8339 52.4607 18.5325 176.4769 14 A 3.8597 8.3258 119.1172 53.6848 18.9756 179.2304 15 G 3.9480 7.4398 107.6695 41.1694 0.0000 171.7765 16 M 4.1801 7.6952 120.3360 55.7830 35.0122 173.7748 17 A 4.2176 8.4843 126.7051 52.3740 21.8045 175.2336 18 N 4.6440 9.0696 117.1829 52.7796 38.2208 172.8833 19 P 4.3494 0.0000 0.0000 62.7769 31.8963 176.5691 20 S 4.0012 8.7011 116.8475 61.3001 62.5759 173.4704 21 P 4.3688 0.0000 0.0000 65.3898 31.1630 176.0227 22 P 4.4580 0.0000 0.0000 65.2554 33.0083 177.8013 23 V 4.2167 7.7511 107.1307 60.1157 33.1010 181.9578 24 G 3.8796 9.6268 121.7159 46.5106 0.0000 173.2512 25 P 3.9628 0.0000 0.0000 66.1453 31.2438 175.8310 26 A 3.9105 7.9317 118.4869 55.2910 18.5304 178.8650 27 L 4.1839 7.5771 116.2048 57.0761 41.3399 179.1521 28 G 3.6456 8.6034 107.8861 47.9737 0.0000 175.6439 29 Q 4.0262 7.6015 119.5336 58.9816 28.7800 178.6033 30 Q 4.1515 7.6407 118.1086 57.3346 28.6400 177.4605 31 G 4.1484 7.4252 107.5331 45.3139 0.0000 174.0028 32 V 3.8232 7.4647 118.1530 62.5631 32.2527 176.7268 33 N 4.8388 8.8348 123.0251 51.3935 37.6484 175.7405 34 I 3.7028 8.1099 126.0612 64.6740 37.3609 176.8037 35 M 3.9960 8.2212 118.0076 58.8697 31.9716 177.6302 36 E 4.0023 8.3252 118.5432 59.3137 29.5116 178.3407 37 F 4.3757 8.6861 120.8807 61.4257 39.5971 176.4916 38 C 3.9605 8.5551 114.6337 61.5668 29.0435 176.0037 39 K 3.9652 7.9496 121.9320 58.6684 31.6002 178.7337 40 A 4.0760 8.4684 121.5987 55.1885 18.3989 179.1720 41 F 3.9859 8.8189 119.8589 61.5644 39.2906 176.9693 42 N 4.0860 8.1118 115.3093 56.2239 38.0574 176.8799 43 A 3.9760 7.4092 121.6928 55.3158 18.7546 179.2726 44 K 4.0229 7.7550 116.7239 59.2033 32.2971 179.3700 45 T 3.6531 7.5712 116.2769 66.2763 67.9087 176.3022 46 D 4.2706 7.4368 120.5356 57.2453 40.9058 178.4940 47 S 4.1674 7.8066 111.7856 61.4639 62.6594 175.4087 48 I 3.8220 7.4573 121.4137 61.2252 37.2807 176.0809 49 E 5.1725 7.2447 117.0236 56.0494 32.3319 176.2820 50 K 4.4734 8.7568 122.3312 55.7254 34.3281 176.6942 51 G 3.9973 9.0049 109.6481 44.8341 0.0000 173.1947 52 L 4.7542 7.4440 119.7232 51.9552 44.4262 174.0259 53 P 4.5852 0.0000 0.0000 63.0363 31.8821 175.7028 54 I 4.6738 8.2484 125.9945 58.5996 39.5549 173.9134 55 P 4.7955 0.0000 0.0000 62.6523 32.6951 175.6394 56 V 4.8889 9.1805 123.1291 59.9328 35.2896 174.9670 57 V 4.2920 8.1655 122.8883 61.3537 32.6313 174.2677 58 I 4.4288 8.4667 129.9387 61.1942 38.4832 175.3601 59 T 4.7060 9.5385 125.0739 61.8507 70.4478 173.3856 60 V 4.4427 7.7697 126.7130 62.1973 33.1080 174.9818 61 Y 4.8394 8.8069 124.3554 56.0822 40.5743 176.5090 62 A 4.0294 8.8627 122.1598 55.7592 18.7392 178.4022 63 D 4.6373 8.3854 113.6611 54.0061 40.5031 176.5417 64 R 3.7299 8.0467 113.1247 56.9743 29.2981 175.9299 65 S 4.7927 7.9917 113.9423 58.5582 64.3267 172.1211 66 F 5.2530 7.8156 114.9692 56.5181 40.2623 172.5934 67 T 5.2388 9.0107 113.9005 60.9593 71.4854 172.0549 68 F 5.9000 8.2285 116.7628 56.5589 40.4911 173.3998 69 V 4.3254 8.5209 121.1910 61.5472 33.8867 174.2203 70 T 4.7297 8.6500 124.9500 62.8743 69.1601 174.5613 71 K 4.5550 7.9872 127.8290 55.0417 34.6038 176.4374 72 T 4.3832 8.6512 109.8218 60.4550 69.8735 172.5421 73 P 4.3539 0.0000 0.0000 62.0066 32.2178 175.0127 74 P 4.3633 0.0000 0.0000 63.0260 33.2861 177.5443 75 A 4.0274 8.5311 121.1807 55.1365 18.3779 180.0797 76 A 3.9521 7.9366 118.9014 55.4618 18.5628 180.1646 77 V 3.5874 7.7061 110.3714 64.6240 31.7219 178.7075 78 L 4.0580 7.8446 118.2586 57.7535 41.3851 179.6161 79 L 4.0480 8.0816 119.0705 57.3998 41.5365 179.6588 80 K 3.9908 8.0075 118.9419 59.2850 32.1509 179.5455 81 K 4.0019 8.1804 118.9478 59.9193 32.3320 179.0569 82 A 3.9837 8.0052 120.9576 54.8540 18.4022 179.2029 83 A 4.1516 8.3650 118.5255 53.0774 18.4989 178.7813 84 G 3.8352 7.7218 104.3856 45.6825 0.0000 173.2300 85 I 4.4662 7.4405 112.1556 58.8924 39.8109 175.8076 86 K 4.1990 8.5123 120.2342 58.1995 32.5401 176.8771 87 S 4.7353 7.5973 111.6843 56.0913 66.8516 173.3629 88 G 3.9012 8.2345 109.9547 45.2302 0.0000 173.2432 89 S 4.1093 8.2529 113.3523 59.5605 62.5288 174.2716 90 G 4.3374 9.1525 108.0539 45.1156 0.0000 173.7598 91 K 4.6023 7.4462 116.4120 53.6310 32.4997 173.6902 92 P 4.2937 0.0000 0.0000 64.7535 32.5390 177.9925 93 N 4.2859 8.9565 121.4738 54.7276 37.8941 176.3178 94 K 4.0939 8.8599 117.1714 58.7578 32.2533 176.7966 95 D 4.7478 7.7985 116.3209 52.0765 43.5018 174.7696 96 K 4.4775 8.6205 126.2905 55.7440 32.6421 176.7882 97 V 3.8564 8.2502 124.8085 65.4702 32.5527 175.3905 98 G 4.3177 7.6255 105.7579 45.5083 0.0000 171.8063 99 K 5.3441 8.4047 117.5648 55.4800 36.1626 175.8506 100 I 4.8115 9.0345 121.4791 59.4469 41.5266 175.5611 101 S 4.6569 8.5298 120.4465 57.8286 63.9975 175.3757 102 R 3.9071 8.6216 121.9132 59.3572 29.6443 178.9100 103 A 3.9823 7.9688 120.3293 55.3646 18.4267 179.4205 104 Q 4.1182 7.8333 116.5925 59.0957 28.6654 178.8780 105 L 4.0052 7.7777 119.5973 57.9611 41.5621 179.4676 106 Q 3.9374 7.9540 119.0815 59.0814 28.9291 177.9811 107 E 4.3077 7.9208 120.8768 59.1223 29.5581 179.4546 108 I 3.6758 8.1984 119.8278 64.4045 36.9188 178.4057 109 A 4.0179 8.0383 120.9219 55.0495 18.2985 179.5475 110 Q 4.0766 8.3109 116.9914 59.3895 28.6224 178.8047 111 T 3.9266 7.8222 115.4440 66.7229 68.8720 176.2982 112 K 4.2919 8.5063 119.1324 56.2222 31.9933 178.5654 113 A 3.9538 7.5336 121.5487 55.4626 18.2608 179.1744 114 A 4.0880 7.9471 117.2972 55.5695 18.5985 179.0525 115 D 4.4801 7.9636 114.8220 55.7295 41.5861 177.1375 116 M 4.3455 7.5872 119.4059 55.2611 32.5711 176.4589 117 T 4.2255 8.4224 111.0660 62.3063 69.9634 175.3425 118 G 3.8446 8.0788 110.0306 45.8949 0.0000 173.3353 119 A 4.1110 8.7212 127.3492 54.3330 19.0177 177.2146 120 D 5.0504 7.6007 113.4391 51.6284 46.1243 176.8828 121 I 3.7083 8.1505 120.7812 64.7174 37.0734 178.4587 122 E 3.9503 8.2432 118.6651 59.3332 29.3063 179.0268 123 A 3.9867 7.9830 120.3236 55.5206 18.5784 179.3428 124 M 4.0307 7.9750 115.2867 58.9095 31.0188 178.8834 125 T 3.8728 8.0018 116.6549 66.5072 68.5024 176.7282 126 R 4.7256 7.9417 121.2780 58.9673 30.1978 179.3405 127 S 4.1440 8.0056 114.8246 61.6435 62.9241 176.7581 128 I 3.7935 7.7826 122.5041 64.3761 36.8337 178.1408 129 E 4.0710 8.4948 119.7321 59.4936 29.0732 179.5203 130 G 3.7645 7.5771 104.8801 48.1384 0.0000 175.4617 131 T 4.0339 7.6107 110.8944 64.4128 68.8022 176.5362 132 A 3.9768 7.9022 123.5395 55.0758 18.2358 179.8123 133 R 3.8729 8.0051 115.2782 59.4991 30.1705 179.0791 134 S 4.3943 7.7477 113.9239 60.1529 63.3014 175.3124 135 M 4.5518 7.7468 118.2159 54.2758 31.5086 176.3041 136 G 3.7042 8.0204 107.3018 46.7847 0.0000 172.8427 137 L 4.9974 7.9322 120.2009 52.5831 43.2481 176.9869 138 V 4.0521 8.2971 124.1694 62.4523 33.3394 174.9565 139 V 5.4759 8.1051 116.9505 58.7808 34.4647 174.6945 140 E 4.3848 8.7346 126.4178 54.9870 31.0619 175.7185 141 D 4.5246 8.6302 125.9228 54.5707 41.1264 176.3400 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 A 8.26 4.42 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 2 K 7.51 4.32 0.00 1.80 1.69 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.50 7.81 3 K 8.57 4.12 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.46 7.81 4 V 8.34 3.84 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 0.76 0.00 0.00 0.93 0.00 0.00 5 Q 8.60 4.57 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 6 A 8.36 4.10 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 7.77 4.93 0.00 3.03 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 8 V 8.69 4.65 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 0.64 0.00 0.00 0.73 0.00 0.00 9 K 8.35 5.22 0.00 1.77 1.93 0.00 1.67 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.41 7.81 10 L 8.55 4.53 0.00 1.69 1.68 0.77 0.53 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 11 Q 8.69 4.85 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 12 V 8.05 4.51 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 0.73 0.00 0.00 0.13 0.00 0.00 13 A 8.77 4.05 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 0.00 0.00 0.00 0.00 0.00 14 A 8.33 3.86 1.43 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 15 G 7.44 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 M 7.70 4.18 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 17 A 8.48 4.22 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 18 N 9.07 4.64 0.00 2.75 3.29 0.00 0.00 6.94 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 19 P 0.00 4.35 0.00 2.25 2.16 0.00 3.70 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 2.06 1.95 0.00 20 S 8.70 4.00 0.00 3.84 3.93 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 21 P 0.00 4.37 0.00 2.07 2.10 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 22 P 0.00 4.46 0.00 2.02 2.09 0.00 3.69 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 2.02 2.10 0.00 23 V 7.75 4.22 2.04 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 0.73 0.00 0.00 1.00 0.00 0.00 24 G 9.63 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 3.96 0.00 2.13 2.12 0.00 3.98 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 2.10 2.16 0.00 26 A 7.93 3.91 1.25 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 0.00 0.00 0.00 27 L 7.58 4.18 0.00 1.58 1.66 0.29 0.26 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 28 G 8.60 3.65 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 0.00 0.00 0.00 29 Q 7.60 4.03 0.00 1.93 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.95 0.00 0.00 0.00 0.00 0.00 2.73 2.51 0.00 30 Q 7.64 4.15 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.21 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 31 G 7.43 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 32 V 7.46 3.82 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 -0.05 0.00 0.00 0.67 0.00 0.00 33 N 8.83 4.84 0.00 3.19 2.93 0.00 0.00 6.90 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.11 3.70 1.90 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 1.52 0.82 0.99 0.00 0.00 35 M 8.22 4.00 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 36 E 8.33 4.00 0.00 2.18 2.34 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 2.51 2.43 0.00 37 F 8.69 4.38 0.00 3.15 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 38 C 8.56 3.96 0.00 3.14 3.22 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 39 K 7.95 3.97 0.00 1.82 1.87 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.46 7.81 40 A 8.47 4.08 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.82 3.99 0.00 1.51 2.43 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 42 N 8.11 4.09 0.00 2.81 2.83 0.00 0.00 7.02 7.19 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 43 A 7.41 3.98 1.40 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 44 K 7.76 4.02 0.00 1.92 1.77 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.43 7.81 45 T 7.57 3.65 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 46 D 7.44 4.27 0.00 2.54 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 47 S 7.81 4.17 0.00 3.83 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 48 I 7.46 3.82 1.81 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 1.55 0.85 0.90 0.00 0.00 49 E 7.24 5.17 0.00 2.05 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 2.05 2.06 0.00 50 K 8.76 4.47 0.00 1.74 1.74 0.00 1.88 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.55 7.81 51 G 9.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.44 4.75 0.00 1.65 1.59 0.96 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.59 0.00 1.96 2.04 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 2.05 2.15 0.00 54 I 8.25 4.67 2.12 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 1.35 0.94 1.08 0.00 0.00 55 P 0.00 4.80 0.00 2.15 2.21 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 56 V 9.18 4.89 2.42 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 0.68 0.00 0.00 1.42 0.00 0.00 57 V 8.17 4.29 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 0.35 0.00 0.00 0.88 0.00 0.00 58 I 8.47 4.43 1.63 0.00 0.00 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 -0.12 -0.36 0.42 0.00 0.00 59 T 9.54 4.71 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 1.05 0.00 0.00 60 V 7.77 4.44 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 0.88 0.00 0.00 0.83 0.00 0.00 61 Y 8.81 4.84 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 62 A 8.86 4.03 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 63 D 8.39 4.64 0.00 2.80 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 64 R 8.05 3.73 0.00 2.28 2.10 0.00 3.20 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 65 S 7.99 4.79 0.00 4.03 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 66 F 7.82 5.25 0.00 3.06 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 67 T 9.01 5.24 4.50 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 1.36 0.00 0.00 68 F 8.23 5.90 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 69 V 8.52 4.33 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 1.00 0.00 0.00 0.90 0.00 0.00 70 T 8.65 4.73 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 71 K 7.99 4.56 0.00 1.90 2.15 0.00 1.71 0.00 0.00 1.88 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.39 7.81 72 T 8.65 4.38 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 1.26 0.00 0.00 73 P 0.00 4.35 0.00 2.22 2.21 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 2.01 2.01 0.00 74 P 0.00 4.36 0.00 2.19 2.05 0.00 3.62 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 75 A 8.53 4.03 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 76 A 7.94 3.95 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 77 V 7.71 3.59 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 0.93 0.00 0.00 1.00 0.00 0.00 78 L 7.84 4.06 0.00 1.73 1.73 0.93 0.45 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 79 L 8.08 4.05 0.00 1.89 1.72 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.01 3.99 0.00 2.02 2.03 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.75 7.81 81 K 8.18 4.00 0.00 2.00 2.07 0.00 1.32 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.62 7.81 82 A 8.01 3.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.36 4.15 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 84 G 7.72 3.84 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 0.00 0.00 0.00 85 I 7.44 4.47 1.87 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 1.41 0.73 0.91 0.00 0.00 86 K 8.51 4.20 0.00 1.77 1.90 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.45 7.81 87 S 7.60 4.74 0.00 3.80 3.74 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 88 G 8.23 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 89 S 8.25 4.11 0.00 3.98 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 90 G 9.15 4.34 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 0.00 91 K 7.45 4.60 0.00 1.90 1.90 0.00 1.36 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.39 7.81 92 P 0.00 4.29 0.00 2.19 2.26 0.00 3.71 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 2.15 2.13 0.00 93 N 8.96 4.29 0.00 2.88 2.98 0.00 0.00 7.01 7.61 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 94 K 8.86 4.09 0.00 1.92 1.87 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.54 7.81 95 D 7.80 4.75 0.00 2.59 2.50 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 96 K 8.62 4.48 0.00 1.76 1.74 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.48 7.81 97 V 8.25 3.86 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 0.72 0.00 0.00 1.01 0.00 0.00 98 G 7.63 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.40 5.34 0.00 1.77 1.73 0.00 1.52 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.46 7.81 100 I 9.03 4.81 1.87 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 1.29 0.89 0.98 0.00 0.00 101 S 8.53 4.66 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 0.00 102 R 8.62 3.91 0.00 2.16 1.97 0.00 3.10 0.00 0.00 3.40 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 103 A 7.97 3.98 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 0.00 104 Q 7.83 4.12 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 105 L 7.78 4.01 0.00 1.87 1.73 0.92 1.26 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 0.00 106 Q 7.95 3.94 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 107 E 7.92 4.31 0.00 2.20 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 2.33 2.49 0.00 108 I 8.20 3.68 2.00 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 1.46 0.79 0.92 0.00 0.00 109 A 8.04 4.02 1.43 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 0.00 110 Q 8.31 4.08 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.72 0.00 111 T 7.82 3.93 4.38 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 1.22 0.00 0.00 112 K 8.51 4.29 0.00 1.81 1.84 0.00 1.90 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.32 7.81 113 A 7.53 3.95 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.95 4.09 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 0.00 115 D 7.96 4.48 0.00 2.77 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 0.00 116 M 7.59 4.35 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.48 0.00 117 T 8.42 4.23 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 0.00 118 G 8.08 3.84 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 0.00 0.00 0.00 119 A 8.72 4.11 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 0.00 120 D 7.60 5.05 0.00 2.64 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 0.00 121 I 8.15 3.71 1.87 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 1.64 0.77 0.91 0.00 0.00 122 E 8.24 3.95 0.00 2.05 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 2.45 0.00 123 A 7.98 3.99 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 0.00 124 M 7.97 4.03 0.00 2.29 2.35 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 2.60 2.77 0.00 125 T 8.00 3.87 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 1.26 0.00 0.00 126 R 7.94 4.73 0.00 1.99 1.99 0.00 3.14 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 127 S 8.01 4.14 0.00 4.07 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 0.00 128 I 7.78 3.79 2.02 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 1.86 1.38 0.92 0.00 0.00 129 E 8.49 4.07 0.00 2.23 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 0.00 130 G 7.58 3.76 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 0.00 0.00 0.00 131 T 7.61 4.03 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 0.00 132 A 7.90 3.98 1.40 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 0.00 133 R 8.01 3.87 0.00 1.95 2.02 0.00 3.16 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 134 S 7.75 4.39 0.00 3.94 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 0.00 135 M 7.75 4.55 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.79 0.00 136 G 8.02 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 0.00 137 L 7.93 5.00 0.00 1.51 1.61 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.30 4.05 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 0.94 0.00 0.00 0.93 0.00 0.00 139 V 8.11 5.48 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 0.88 0.00 0.00 0.93 0.00 0.00 140 E 8.73 4.38 0.00 2.09 1.82 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 2.32 2.39 0.00 141 D 8.63 4.52 0.00 2.70 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00