NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9089 8.3549 109.7369 44.9580 0.0000 173.0326 2 S 4.1074 8.3459 115.2546 58.2834 63.1986 172.4886 3 S 4.4524 7.5156 112.6761 56.9419 65.6725 174.8169 4 G 4.0856 7.7131 117.5505 45.7621 0.0000 170.9939 5 S 4.8433 8.2629 113.6087 56.5247 66.0537 173.6461 6 S 4.5758 8.4569 112.4489 57.8367 62.9738 175.2387 7 G 4.2834 8.2928 109.3729 45.6559 0.0000 171.9586 8 D 4.9100 8.0711 117.1692 51.2718 44.5761 174.2604 9 N 4.0562 8.7987 117.9016 55.0353 37.1894 174.8415 10 M 3.1293 8.5482 121.3963 56.3887 30.0632 178.0899 11 E 3.9921 8.2735 120.3852 59.2626 30.4526 176.9025 12 A 4.0873 8.3244 120.4756 56.0349 18.3232 178.9084 13 V 3.7117 8.4179 115.9853 65.6236 31.2711 178.1713 14 K 4.1739 7.9864 118.9643 59.8624 32.6227 178.7205 15 T 4.0676 7.9716 115.5603 66.8270 68.4703 176.5253 16 F 4.1687 8.1956 121.9505 61.2696 38.9910 176.7509 17 N 4.8027 8.9683 116.4708 55.9486 38.2167 177.2621 18 S 4.1399 7.7807 116.2243 61.0829 63.1271 176.3649 19 E 3.9172 7.8471 119.6643 59.0074 29.6816 178.5503 20 L 3.4482 7.5957 120.7094 58.4620 42.0698 178.8429 21 Y 3.3021 7.5238 115.9795 60.3361 37.8428 177.7339 22 S 4.1807 8.3344 114.8281 61.5569 62.1537 176.1719 23 L 4.1618 7.3152 120.4764 58.0428 41.1334 178.9646 24 N 3.8386 8.2978 115.5913 56.5308 38.7787 175.7646 25 D 4.3593 8.4114 116.7896 56.8983 41.0133 176.6929 26 Y 4.7781 8.0511 115.1232 56.1487 39.8121 175.0270 27 K 4.6728 8.3401 121.5871 52.9186 34.1809 174.6945 28 P 4.2253 0.0000 0.0000 62.4012 31.6539 174.5636 29 P 4.4804 0.0000 0.0000 62.6210 32.1447 175.3249 30 I 4.2922 7.9547 119.6569 59.4466 38.5434 175.9436 31 S 4.0131 8.6715 120.1314 59.2173 63.0948 175.3275 32 K 3.8124 9.0863 125.0706 59.9436 31.6479 178.7717 33 A 3.9721 7.9125 120.1605 54.7850 18.2360 179.2460 34 K 3.6702 8.4557 118.5497 60.0168 31.8589 178.7329 35 M 3.8419 7.3536 115.9976 59.0447 31.7959 179.2071 36 T 3.9659 7.5918 115.7480 66.6053 68.5065 176.8306 37 Q 3.9775 8.1674 120.1195 59.0372 28.5821 179.5516 38 I 3.6552 7.5580 120.1702 64.5565 37.3410 178.0551 39 T 3.9330 7.5443 116.0297 66.8950 68.4532 176.5932 40 K 3.9232 8.3880 120.0234 59.4714 31.7747 179.2097 41 A 4.2152 7.4394 120.1338 55.0388 18.7118 179.1931 42 A 3.7916 8.5666 119.4998 55.3197 18.2914 179.7045 43 I 3.6197 7.9423 117.8579 64.6169 37.2892 178.5214 44 K 4.2566 7.6550 117.4286 58.7071 32.1104 178.0874 45 A 4.3824 7.9888 119.8921 51.8408 18.7705 178.4912 46 I 3.5740 7.7894 122.8261 65.1457 37.9999 177.8531 47 K 3.7826 7.8636 117.3884 59.4237 32.1669 177.2305 48 F 5.1429 7.9095 116.4497 56.9672 39.6300 176.6235 49 Y 4.3461 8.3166 123.8491 60.3428 35.8796 178.5464 50 K 2.8930 7.5347 119.6003 59.5938 31.9380 178.3533 51 H 4.2346 8.7512 116.2234 59.1886 28.8548 177.0400 52 V 3.4734 8.1280 118.4416 66.1946 30.7300 177.9247 53 V 3.7516 7.8046 119.2939 66.2563 31.9193 177.7605 54 Q 4.1762 7.5062 116.3030 59.7662 28.8386 178.6390 55 S 4.3606 8.4741 115.8268 62.0676 62.7737 177.1622 56 V 3.9461 8.3370 120.0085 65.8728 30.1097 177.4237 57 E 4.3492 8.7188 118.6327 58.6190 29.5037 178.9536 58 K 3.8880 8.0199 118.2743 59.4440 32.4873 178.7389 59 F 3.8132 8.6597 121.2698 61.7182 38.7653 177.5705 60 I 3.4794 7.0699 118.6345 64.0231 36.9361 177.9310 61 Q 4.1032 8.3930 117.9954 58.7552 28.7426 178.1826 62 K 4.1214 7.7751 119.5892 59.1011 32.6726 176.8815 63 C 3.8424 7.5855 112.6078 58.1883 29.6399 172.7887 64 K 4.5623 8.2100 117.3895 54.2369 33.4954 175.8949 65 P 4.3353 0.0000 0.0000 65.2934 31.5044 177.6006 66 E 4.0753 8.0778 115.6837 58.4665 30.0808 176.7978 67 Y 4.4236 8.3989 117.1394 58.1071 38.0006 177.4887 68 K 3.9917 7.4356 122.1443 58.5399 32.6102 179.6204 69 V 3.4025 7.5651 118.1369 65.1557 31.5838 175.5687 70 P 4.0935 0.0000 0.0000 65.7935 31.1950 178.2797 71 G 3.9868 7.5478 104.0106 48.0715 0.0000 174.7966 72 L 3.7005 7.7240 122.7986 57.9672 41.9098 178.6180 73 Y 4.3043 7.5265 115.8099 61.2944 37.6961 178.7065 74 V 3.7072 7.8982 119.0078 66.3579 31.4278 178.1956 75 I 3.7411 7.8390 119.2515 64.2567 36.9076 177.8939 76 D 4.8292 8.4871 118.9263 57.8254 40.7370 178.0005 77 S 4.2674 8.7707 113.9266 62.0154 62.1996 175.9391 78 I 3.7636 7.7738 122.6070 63.6016 36.8661 177.9938 79 V 3.7168 8.2996 120.3698 65.6222 31.1311 178.5969 80 R 3.9463 8.2809 116.7895 59.8523 30.2652 178.6187 81 Q 4.1405 7.8768 117.1942 58.4357 28.3264 178.4885 82 S 4.3015 8.4081 114.9177 62.1902 62.9571 176.8441 83 R 3.9919 8.4506 122.4087 59.0682 29.4317 176.9545 84 H 4.4728 8.5981 117.4678 57.9708 30.2775 176.4506 85 Q 3.9640 8.0798 119.6188 59.5820 28.8507 179.3410 86 F 4.2968 8.3183 116.8382 58.4721 39.8920 175.4805 87 G 4.5969 7.5987 104.2688 43.5718 0.0000 175.0535 88 Q 3.8764 8.8541 117.6869 59.0338 28.7689 178.6642 89 E 4.0748 8.0675 115.2009 57.8071 29.9771 177.6579 90 K 4.1474 7.2633 118.5882 57.9383 32.9116 176.5233 91 D 4.3465 7.8860 117.3093 54.0480 41.9936 176.7074 92 V 3.8872 7.7761 114.7373 61.1566 34.2145 178.0938 93 F 3.8514 8.1869 118.4153 59.7832 38.7327 177.6122 94 A 3.8886 8.1274 120.4789 54.6896 18.1005 177.8073 95 P 4.4133 0.0000 0.0000 64.9141 31.6831 178.2039 96 R 4.0774 7.6911 119.1140 59.2959 29.9987 178.3687 97 F 4.6249 8.5689 118.3741 60.5229 38.7842 177.7885 98 S 4.2268 8.5416 113.8897 61.5555 62.3542 175.7340 99 N 4.4383 7.7403 119.7660 55.7264 38.5791 175.3080 100 N 4.9699 7.6325 113.9395 53.3449 39.7685 176.7788 101 I 3.7089 8.0726 121.8911 64.3521 37.9987 177.2649 102 I 3.6892 7.8396 120.0860 64.7215 37.1811 177.9680 103 S 4.3064 8.2250 113.1387 61.9093 61.7995 176.5189 104 T 4.0794 8.0978 118.3598 66.7325 68.2917 176.8505 105 F 3.8077 8.9155 120.1522 60.3778 38.6196 177.4806 106 Q 4.2532 8.8101 118.2584 59.5563 28.3997 179.1557 107 N 4.4448 7.7275 114.0679 55.3964 38.4171 176.7144 108 L 4.1639 7.0880 120.1739 56.5862 41.9388 177.5992 109 Y 4.6238 8.0881 114.3506 58.9551 38.0272 177.3250 110 R 4.1284 7.4563 120.1521 57.5017 30.5477 176.5210 111 C 4.0650 6.9857 112.9052 57.4484 29.9544 173.1818 112 P 4.1688 0.0000 0.0000 64.2756 31.3334 176.6443 113 G 4.1701 7.9166 107.5532 46.4827 0.0000 175.2997 114 D 4.5868 8.0298 116.3272 55.4146 41.1191 176.6876 115 D 4.8412 7.6998 118.2687 53.8695 42.3513 177.7657 116 K 3.9838 7.8846 120.0842 59.5132 32.0479 178.5687 117 S 4.1185 8.1990 112.8479 61.7173 61.9452 176.3705 118 K 4.1922 7.8581 118.9895 58.6853 31.7483 178.6750 119 I 3.9119 8.1239 120.4715 63.4433 37.0821 178.3183 120 V 3.6909 7.7370 112.7921 63.7723 31.1860 178.5775 121 R 3.9486 8.0688 116.4073 59.0515 29.1878 179.1452 122 V 3.2763 7.2382 118.7222 65.5619 31.4518 177.9306 123 L 3.9316 7.6284 118.2413 57.9912 41.6741 179.1161 124 N 4.4281 7.8733 115.7156 56.2513 38.4331 177.5066 125 L 4.1861 7.5728 120.1369 57.2772 41.6781 179.3381 126 W 4.5743 8.5299 119.3344 60.2044 28.9411 178.3404 127 Q 4.0912 8.2848 117.8439 58.8880 28.3509 178.3137 128 K 4.1563 7.7111 119.7658 59.5442 32.3048 178.3384 129 N 4.6239 8.5767 114.3045 53.8493 38.4476 175.1369 130 N 4.4317 7.7641 115.4995 54.1912 36.4767 175.9248 131 V 3.5186 8.2257 120.9209 65.2335 31.7445 176.2206 132 F 4.8279 7.7241 115.4278 54.9232 43.0245 174.4287 133 K 4.3080 8.5572 122.2373 56.4601 33.4880 178.3127 134 S 4.2999 8.7611 116.3095 61.6821 62.5244 176.1163 135 E 4.2795 8.2431 120.9841 58.0691 29.2353 177.4664 136 I 4.2330 8.0557 119.6097 63.2688 38.2486 177.7786 137 I 3.6533 7.7369 120.0938 63.8088 36.7143 177.7292 138 Q 3.9401 8.5079 121.4065 58.9323 28.7770 177.7217 139 P 4.1101 0.0000 0.0000 65.9005 30.2224 178.2272 140 L 3.9817 7.3911 118.4150 57.4512 41.1809 179.5160 141 L 4.3615 8.0812 118.7331 57.3038 41.8131 178.6597 142 D 4.3691 7.6245 117.8311 57.7588 40.9330 178.1913 143 M 3.7452 8.0837 119.1582 58.4576 31.6458 178.8840 144 A 2.9742 6.5116 119.6438 54.7906 18.6325 179.2800 145 A 4.1643 8.1002 118.6233 52.4913 19.2931 175.4843 146 G 3.5028 7.4162 109.2875 46.5419 0.0000 173.1586 147 S 3.4931 9.4664 124.3828 59.0026 61.1275 173.3366 148 G 4.0652 8.1295 101.8277 44.4408 0.0000 171.8662 149 P 4.2350 0.0000 0.0000 61.9609 31.9274 176.3163 150 S 3.9857 8.5660 115.4281 58.8843 61.7342 173.2073 151 S 4.6652 8.5042 123.3441 56.4437 63.2839 174.0818 152 G 3.7351 8.4025 115.9168 46.0131 0.0000 171.7773 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 G 8.35 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 S 8.35 4.11 0.00 3.95 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 3 S 7.52 4.45 0.00 3.77 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 4 G 7.71 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.26 4.84 0.00 3.94 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 6 S 8.46 4.58 0.00 3.98 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 7 G 8.29 4.28 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 0.00 8 D 8.07 4.91 0.00 2.58 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 9 N 8.80 4.06 0.00 2.74 2.81 0.00 0.00 6.09 7.62 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 10 M 8.55 3.13 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.60 0.00 11 E 8.27 3.99 0.00 2.35 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 0.00 2.45 2.43 0.00 12 A 8.32 4.09 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 13 V 8.42 3.71 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 1.20 0.00 0.00 1.15 0.00 0.00 14 K 7.99 4.17 0.00 1.98 1.91 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.22 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.71 7.81 15 T 7.97 4.07 4.56 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 1.28 0.00 0.00 16 F 8.20 4.17 0.00 3.24 3.26 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 17 N 8.97 4.80 0.00 3.06 2.88 0.00 0.00 7.44 7.40 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 18 S 7.78 4.14 0.00 4.04 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 19 E 7.85 3.92 0.00 1.60 1.86 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 2.48 2.42 0.00 20 L 7.60 3.45 0.00 0.64 1.40 0.01 0.71 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 21 Y 7.52 3.30 0.00 2.78 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 22 S 8.33 4.18 0.00 3.95 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 23 L 7.32 4.16 0.00 1.77 1.93 0.98 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.30 3.84 0.00 2.65 2.84 0.00 0.00 7.12 8.01 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 25 D 8.41 4.36 0.00 2.32 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 0.00 0.00 0.00 26 Y 8.05 4.78 0.00 2.97 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 27 K 8.34 4.67 0.00 1.72 1.66 0.00 1.79 0.00 0.00 2.40 0.00 0.00 3.13 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.58 7.81 28 P 0.00 4.23 0.00 1.83 1.84 0.00 3.17 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 29 P 0.00 4.48 0.00 2.20 2.08 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 30 I 7.95 4.29 1.90 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 1.46 0.95 0.77 0.00 0.00 31 S 8.67 4.01 0.00 3.66 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 32 K 9.09 3.81 0.00 1.74 1.88 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.48 7.81 33 A 7.91 3.97 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 34 K 8.46 3.67 0.00 1.19 1.71 0.00 1.26 0.00 0.00 0.94 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.77 1.26 7.81 35 M 7.35 3.84 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.80 0.00 36 T 7.59 3.97 4.43 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 1.21 0.00 0.00 37 Q 8.17 3.98 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 38 I 7.56 3.66 1.84 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.68 0.64 0.00 0.00 39 T 7.54 3.93 4.37 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 1.24 0.00 0.00 40 K 8.39 3.92 0.00 1.83 1.91 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.66 7.81 41 A 7.44 4.22 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.57 3.79 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 I 7.94 3.62 1.94 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.87 1.15 0.00 0.00 44 K 7.65 4.26 0.00 2.18 1.91 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.71 7.81 45 A 7.99 4.38 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.79 3.57 1.89 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.91 0.71 0.00 0.00 47 K 7.86 3.78 0.00 1.56 1.68 0.00 1.04 0.00 0.00 1.36 0.00 0.00 2.70 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.52 0.21 7.81 48 F 7.91 5.14 0.00 3.04 2.88 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 49 Y 8.32 4.35 0.00 2.29 2.88 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 50 K 7.53 2.89 0.00 1.64 1.68 0.00 0.61 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 51 H 8.75 4.23 0.00 3.28 3.40 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.13 3.47 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 0.48 0.00 0.00 0.51 0.00 0.00 53 V 7.80 3.75 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 0.67 0.00 0.00 0.50 0.00 0.00 54 Q 7.51 4.18 0.00 2.10 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.49 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 55 S 8.47 4.36 0.00 4.43 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 0.00 56 V 8.34 3.95 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 1.03 0.00 0.00 1.49 0.00 0.00 57 E 8.72 4.35 0.00 2.32 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 0.00 2.56 2.92 0.00 58 K 8.02 3.89 0.00 1.96 1.98 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.90 1.55 7.81 59 F 8.66 3.81 0.00 1.65 2.87 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 0.00 60 I 7.07 3.48 2.04 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.90 0.85 0.00 0.00 61 Q 8.39 4.10 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.01 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 62 K 7.78 4.12 0.00 1.71 1.93 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.13 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.64 1.59 7.81 63 C 7.59 3.84 0.00 2.46 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 0.00 0.00 0.00 64 K 8.21 4.56 0.00 2.07 1.80 0.00 1.65 0.00 0.00 2.14 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.52 7.81 65 P 0.00 4.34 0.00 2.00 2.12 0.00 3.66 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 2.02 2.08 0.00 66 E 8.08 4.08 0.00 1.91 2.07 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 2.20 1.52 0.00 67 Y 8.40 4.42 0.00 2.95 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 68 K 7.44 3.99 0.00 1.57 1.81 0.00 1.70 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.43 7.81 69 V 7.57 3.40 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 0.38 0.00 0.00 0.72 0.00 0.00 70 P 0.00 4.09 0.00 2.34 2.19 0.00 3.59 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.12 0.00 71 G 7.55 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 0.00 0.00 0.00 72 L 7.72 3.70 0.00 1.25 1.57 0.61 -0.45 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 73 Y 7.53 4.30 0.00 3.21 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 74 V 7.90 3.71 2.33 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 1.15 0.00 0.00 0.99 0.00 0.00 75 I 7.84 3.74 2.12 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.57 0.40 0.00 0.00 76 D 8.49 4.83 0.00 3.43 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 77 S 8.77 4.27 0.00 4.04 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 78 I 7.77 3.76 2.06 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.80 -0.11 0.00 0.00 79 V 8.30 3.72 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 1.10 0.00 0.00 1.30 0.00 0.00 80 R 8.28 3.95 0.00 1.96 2.03 0.00 3.47 0.00 0.00 3.49 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.98 0.00 81 Q 7.88 4.14 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 82 S 8.41 4.30 0.00 4.13 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 83 R 8.45 3.99 0.00 2.13 2.19 0.00 2.97 0.00 0.00 3.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 84 H 8.60 4.47 0.00 3.11 3.51 0.00 6.04 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.08 3.96 0.00 2.40 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 86 F 8.32 4.30 0.00 3.05 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 87 G 7.60 4.60 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 88 Q 8.85 3.88 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 89 E 8.07 4.07 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 90 K 7.26 4.15 0.00 2.11 1.96 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.74 7.81 91 D 7.89 4.35 0.00 2.69 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 V 7.78 3.89 0.67 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 0.24 0.00 0.00 -0.85 0.00 0.00 93 F 8.19 3.85 0.00 3.17 3.21 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 94 A 8.13 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.41 0.00 2.19 2.13 0.00 3.13 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.85 0.00 96 R 7.69 4.08 0.00 2.05 1.89 0.00 3.10 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.49 0.00 97 F 8.57 4.62 0.00 3.48 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 98 S 8.54 4.23 0.00 4.22 4.53 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 99 N 7.74 4.44 0.00 2.84 2.94 0.00 0.00 6.84 7.89 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 0.00 100 N 7.63 4.97 0.00 2.90 2.85 0.00 0.00 6.58 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 I 8.07 3.71 1.92 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 1.02 1.01 0.89 0.00 0.00 102 I 7.84 3.69 1.91 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.64 0.96 0.00 0.00 103 S 8.22 4.31 0.00 3.94 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 0.00 104 T 8.10 4.08 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 105 F 8.92 3.81 0.00 3.28 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 0.00 106 Q 8.81 4.25 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.87 0.00 0.00 0.00 0.00 0.00 2.77 2.66 0.00 107 N 7.73 4.44 0.00 2.85 2.84 0.00 0.00 7.07 7.76 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 0.00 108 L 7.09 4.16 0.00 1.07 1.37 0.33 0.59 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 0.00 109 Y 8.09 4.62 0.00 2.95 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 0.00 110 R 7.46 4.13 0.00 1.82 1.99 0.00 3.21 0.00 0.00 3.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.73 0.00 111 C 6.99 4.07 0.00 3.26 3.12 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 0.00 112 P 0.00 4.17 0.00 2.03 2.17 0.00 3.80 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 113 G 7.92 4.17 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 0.00 114 D 8.03 4.59 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 0.00 115 D 7.70 4.84 0.00 2.57 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.88 3.98 0.00 2.03 1.94 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.72 1.54 7.81 117 S 8.20 4.12 0.00 3.88 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 0.00 118 K 7.86 4.19 0.00 1.88 1.77 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.60 7.81 119 I 8.12 3.91 1.97 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.90 0.15 0.00 0.00 120 V 7.74 3.69 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.99 0.00 0.00 121 R 8.07 3.95 0.00 2.03 2.33 0.00 2.84 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.58 0.00 122 V 7.24 3.28 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 -0.05 0.00 0.00 0.92 0.00 0.00 123 L 7.63 3.93 0.00 1.90 1.77 1.15 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 124 N 7.87 4.43 0.00 2.91 2.88 0.00 0.00 7.36 6.63 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 0.00 125 L 7.57 4.19 0.00 1.82 1.77 0.88 0.81 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 0.00 126 W 8.53 4.57 0.00 3.65 3.44 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 0.00 127 Q 8.28 4.09 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.03 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 128 K 7.71 4.16 0.00 2.02 2.11 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.51 7.81 129 N 8.58 4.62 0.00 2.91 2.93 0.00 0.00 7.57 8.01 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 0.00 130 N 7.76 4.43 0.00 2.94 2.98 0.00 0.00 6.90 7.58 0.00 0.00 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 V 8.23 3.52 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 0.01 0.00 0.00 1.12 0.00 0.00 132 F 7.72 4.83 0.00 3.04 2.87 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 0.00 133 K 8.56 4.31 0.00 1.98 1.98 0.00 1.56 0.00 0.00 1.90 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.65 7.81 134 S 8.76 4.30 0.00 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 0.00 135 E 8.24 4.28 0.00 1.99 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 0.00 2.31 2.48 0.00 136 I 8.06 4.23 2.12 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 1.57 0.82 0.87 0.00 0.00 137 I 7.74 3.65 1.97 0.00 0.00 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 1.68 1.11 1.02 0.00 0.00 138 Q 8.51 3.94 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 139 P 0.00 4.11 0.00 2.28 2.28 0.00 3.78 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 2.23 2.04 0.00 140 L 7.39 3.98 0.00 1.63 1.60 0.29 0.07 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 0.00 141 L 8.08 4.36 0.00 1.83 1.74 0.96 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 142 D 7.62 4.37 0.00 2.59 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 M 8.08 3.75 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.59 0.00 144 A 6.51 2.97 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 0.00 145 A 8.10 4.16 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 0.00 146 G 7.42 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 0.00 0.00 0.00 147 S 9.47 3.49 0.00 3.93 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 0.00 148 G 8.13 4.07 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 0.00 0.00 0.00 149 P 0.00 4.23 0.00 2.18 2.05 0.00 3.76 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 1.97 1.94 0.00 150 S 8.57 3.99 0.00 3.84 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 0.00 151 S 8.50 4.67 0.00 3.83 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 0.00 152 G 8.40 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 0.00 0.00 0.00