NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9704 8.3549 109.7370 45.4006 0.0000 173.0283 2 L 4.4077 8.0166 120.0832 50.7092 43.8917 175.6420 3 S 4.4950 9.7424 118.5161 57.9882 66.1038 174.9875 4 D 4.6566 8.6866 121.5843 57.3260 40.5185 179.0183 5 G 3.7562 8.1642 105.7946 48.0678 0.0000 175.2805 6 E 3.8964 8.2178 121.5152 58.7749 29.3939 179.5446 7 W 4.3753 8.1269 118.9205 59.9136 29.0217 178.3683 8 Q 4.0832 8.5256 119.5926 59.1823 28.4780 178.3140 9 L 4.0388 8.0427 120.1648 57.5697 41.5449 179.5989 10 V 3.6933 8.1200 118.3440 66.2796 31.6933 178.2457 11 L 4.1743 8.5273 118.9378 57.6411 41.1499 179.3815 12 N 4.4021 8.3911 116.5326 56.3374 38.8670 177.4263 13 V 3.7956 7.9583 120.6139 64.6789 31.4274 178.2180 14 W 4.1254 8.8062 129.3565 59.8498 30.3618 177.8707 15 G 3.8918 8.1680 105.8101 48.0520 0.0000 175.7328 16 K 3.8565 7.7341 119.6050 58.9963 32.2277 179.3109 17 V 2.8126 6.8930 117.9730 65.7606 31.1185 177.8326 18 E 3.8904 7.9139 116.7249 58.8055 29.3137 178.4944 19 A 4.2236 7.3924 119.2348 52.9925 19.8081 177.1754 20 D 4.5599 7.9273 114.1998 52.2260 43.6759 175.8857 21 V 3.5450 7.7003 124.3491 66.1360 32.0638 176.7957 22 A 4.1167 8.0053 120.0227 55.0199 18.2486 179.7018 23 G 3.5532 8.1476 105.5486 47.7042 0.0000 175.7189 24 H 4.1080 8.2163 118.8138 58.3128 28.6778 178.1009 25 G 3.5782 8.4211 107.9375 47.8295 0.0000 175.2881 26 Q 3.8461 8.2690 122.9667 58.9469 29.0602 178.2978 27 E 3.8406 8.0525 120.0993 59.0266 29.5322 178.9283 28 V 3.5217 7.7819 118.4904 65.8573 31.5160 178.0959 29 L 3.4272 7.6567 118.6794 57.6399 41.3324 179.5294 30 I 3.6483 7.6431 119.7643 64.3285 36.8981 178.7655 31 R 3.8354 7.9009 118.9265 59.0119 29.8119 178.5992 32 L 3.9086 8.0112 120.4478 58.4909 41.8151 179.1956 33 F 4.4934 7.9890 117.5804 60.3298 38.5480 177.6969 34 K 4.1935 8.2095 117.6896 58.7247 32.2109 179.0531 35 G 3.7445 8.2498 105.5247 46.2135 0.0000 173.7086 36 H 4.7112 8.1741 117.8138 51.7580 29.7048 171.6535 37 P 4.5044 0.0000 0.0000 64.7232 31.3307 177.5146 38 E 4.2997 8.2430 115.9050 59.4027 29.4703 179.1111 39 T 3.8162 8.2942 111.3427 64.4400 68.6959 176.1321 40 L 3.6969 7.9337 122.9910 58.0289 41.7579 178.6972 41 E 4.2378 7.9117 117.6156 58.7641 29.4378 178.6453 42 K 4.4477 8.0639 116.9488 56.5984 32.6861 177.2872 43 F 4.4584 8.3499 119.7235 55.6089 39.7116 175.7251 44 D 4.3557 8.3878 125.1654 57.2246 40.5464 178.8765 45 K 4.0298 7.8339 117.3789 58.5782 32.3969 177.5208 46 F 5.1484 7.9569 116.1498 57.1605 39.1811 177.5561 47 K 4.1412 7.8055 120.4568 58.8819 31.8496 177.5352 48 H 4.4935 8.2097 112.4564 55.7895 29.1102 175.2393 49 L 4.3494 7.4482 121.4042 54.2717 40.5853 176.6845 50 K 4.3361 8.8827 123.6372 56.8242 32.7950 177.5080 51 S 4.6293 7.4142 113.2371 55.7008 67.0078 174.3043 52 E 3.8756 8.7331 122.8056 59.8051 29.4342 178.7784 53 D 4.3748 8.0517 118.2310 57.2508 40.6409 178.5062 54 E 3.9581 7.9502 118.5071 59.7444 29.6634 178.9725 55 M 4.0983 8.3060 119.0086 58.2787 31.7521 179.0072 56 K 3.9600 8.3250 117.9413 58.7446 32.2647 178.4958 57 A 4.4379 7.4946 118.9694 52.0597 19.3007 177.1898 58 S 4.1491 7.3179 113.7237 57.8231 62.8722 174.0648 59 E 3.9397 9.1031 128.9590 59.7718 29.3681 178.2690 60 D 4.5346 8.2309 118.2513 57.4159 40.8444 178.5544 61 L 3.4578 7.9784 120.8014 57.8322 42.0531 178.9662 62 K 3.9010 7.9241 119.2528 59.3397 32.0443 179.0247 63 K 4.0349 8.2605 118.9132 59.6791 31.9200 178.8556 64 H 4.3182 8.7867 118.9435 59.1185 29.8099 177.3842 65 G 3.6337 8.3609 107.8493 47.8205 0.0000 174.9515 66 N 4.2831 8.1984 119.5270 56.7690 39.0000 176.9037 67 T 3.8727 8.0591 117.1034 66.6712 68.5449 175.8833 68 N 4.2703 8.2625 118.8559 57.0234 39.0313 177.0039 69 L 4.2387 8.2288 120.2340 57.7509 41.6907 179.5432 70 T 3.9353 8.3546 116.1952 66.7784 68.5582 176.3573 71 A 4.0090 8.0218 122.4890 54.9794 18.3876 179.4116 72 L 3.7270 8.0324 119.0962 58.1048 42.1355 179.4154 73 G 3.5233 8.4044 105.9059 47.6800 0.0000 175.8707 74 G 3.6134 7.8650 107.1615 47.4354 0.0000 175.5902 75 I 3.8079 7.5017 121.8069 64.2402 37.1129 178.4892 76 L 3.9356 7.9488 120.0411 57.7606 41.1949 179.7630 77 K 3.9113 7.7743 116.8620 58.4463 32.3115 178.4583 78 K 4.0557 7.8961 117.7068 54.2870 32.3678 178.6937 79 K 2.0000 8.8008 120.1964 55.1758 32.0495 175.9998 80 G 4.0919 8.8390 115.1753 46.8006 0.0000 173.6194 81 H 4.5309 7.2192 118.2008 54.8444 27.2903 174.7129 82 H 5.1827 7.3402 112.0166 53.9499 29.7595 176.4924 83 E 4.0608 8.4337 123.2033 59.9530 29.1239 178.2744 84 A 4.0111 7.8721 119.6592 55.2140 18.4617 179.0345 85 E 4.0780 8.0694 116.6589 59.4066 29.6073 179.1661 86 L 4.0551 8.4891 120.8678 58.2111 42.1637 178.6607 87 T 3.8920 8.0122 115.7921 66.6864 68.4942 174.6302 88 P 4.3292 0.0000 0.0000 65.2880 31.2325 178.6217 89 L 4.0088 7.5083 116.1081 58.1011 42.1198 178.6655 90 A 4.2041 8.3098 121.0140 55.3204 18.3333 179.5596 91 Q 3.9184 8.2359 116.6890 59.2839 28.8833 179.4019 92 S 4.0655 8.1193 115.2000 61.7557 63.0593 176.1689 93 H 4.3317 8.7794 119.7384 58.0444 28.3817 177.7661 94 A 2.5800 8.3398 123.1478 54.6083 17.9642 179.4564 95 T 3.8228 6.9746 111.9663 65.6408 69.1718 176.7212 96 K 3.9101 7.4813 119.6649 59.6235 32.4942 177.5547 97 H 4.3011 8.1418 114.2735 55.8853 29.6048 175.4051 98 K 3.4563 7.3609 116.2204 56.3409 28.4801 175.8878 99 I 4.3546 7.8681 119.1038 58.8190 38.5786 175.0962 100 P 4.5819 0.0000 0.0000 62.1104 32.2085 177.5921 101 V 3.6625 8.2758 118.6554 65.8910 31.3194 178.2746 102 K 3.9396 7.8654 118.3424 60.1750 32.3015 178.6342 103 Y 4.1719 7.7968 117.4963 60.6742 37.7896 178.0384 104 L 4.2061 8.0478 119.6387 57.7626 41.7381 179.2657 105 E 4.0384 8.1832 118.7159 59.3367 29.4058 179.2203 106 F 4.6551 8.0027 117.8907 60.8661 38.8990 177.6346 107 I 3.8607 8.2415 118.2261 63.9178 37.7576 177.9681 108 S 4.2155 8.4077 116.2982 61.8177 62.6547 176.5152 109 E 4.0492 8.4814 120.8237 59.4619 29.1424 179.3651 110 A 4.3864 7.9886 122.0947 54.5792 18.4432 179.6253 111 I 3.6564 8.0926 118.5823 64.6834 37.1827 178.5229 112 I 3.8221 7.8027 120.3959 64.7169 36.8856 178.4932 113 Q 4.0253 8.4467 119.0237 59.0054 28.5621 179.1371 114 V 3.5269 8.1280 119.5734 65.7973 31.4732 177.9793 115 L 3.7281 7.7779 118.6735 57.8195 41.1596 179.3197 116 Q 4.2266 7.9657 118.0937 59.2560 29.0892 177.9900 117 S 4.1962 8.0054 113.1218 61.4361 62.5978 175.9164 118 K 4.0776 8.2192 119.7802 58.2060 33.0966 177.0889 119 H 5.0050 8.4715 116.4411 53.5993 30.0281 172.6577 120 P 4.3362 0.0000 0.0000 65.8967 31.8243 179.5377 121 G 3.7931 8.3023 104.8461 48.4017 0.0000 173.6661 122 D 4.7294 7.9756 116.7295 54.1349 41.9306 176.4257 123 F 5.1341 8.4034 121.6423 56.8046 39.2912 175.2989 124 G 3.8953 7.4724 110.3477 44.0896 0.0000 170.9590 125 A 3.8660 8.4337 120.9247 55.4326 18.4331 179.8555 126 D 4.2047 7.9676 116.5854 57.4134 40.8990 178.6677 127 A 3.9821 7.8568 120.7156 55.2317 18.4137 179.3920 128 Q 3.2861 7.7263 116.6156 58.8470 28.7510 179.4901 129 G 3.5151 8.0419 106.3322 47.6913 0.0000 175.6096 130 A 3.8719 8.1152 123.5557 55.0509 18.3612 179.4497 131 M 4.0591 8.3977 117.0385 58.7238 32.2344 178.5067 132 S 4.1599 8.2538 115.4209 61.7122 62.9885 176.8313 133 K 3.8579 8.0655 120.7345 59.3186 31.7493 179.2642 134 A 3.7918 7.8984 120.9215 55.2013 18.2429 179.7726 135 L 4.0848 8.1696 117.6748 57.7498 41.5792 179.3128 136 E 3.9391 8.5411 119.7215 59.1562 29.5694 178.6349 137 L 3.9475 8.2054 120.5713 58.0222 42.1736 178.4857 138 F 4.1399 8.3662 120.5602 61.5737 39.2486 177.3200 139 R 3.4847 8.3202 117.7129 59.1374 29.7666 178.8040 140 N 4.2219 8.3135 116.4566 56.5914 38.6033 177.3261 141 D 4.3033 8.1607 120.0909 57.3428 40.7384 178.8460 142 M 3.7066 7.6348 119.2782 57.9884 31.7601 178.5868 143 A 3.6811 7.7838 120.7807 54.9732 18.4246 179.4967 144 A 3.8983 8.1482 119.6483 55.2384 18.5731 179.8289 145 K 3.9610 7.9762 118.1348 59.6424 32.1562 178.6752 146 Y 4.3995 8.4019 117.5234 61.0431 37.8523 178.2186 147 K 3.8533 8.3568 120.6974 59.8821 32.0451 178.2233 148 E 3.9673 7.8097 117.5500 59.2095 29.5769 178.2233 149 L 4.3170 7.7300 116.9963 55.2912 41.8675 177.6407 150 G 3.8320 8.1318 106.8405 45.7066 0.0000 172.5851 151 F 4.6305 8.1477 122.0660 55.9985 40.1854 175.5650 152 Q 3.8821 8.1177 129.6481 54.7772 27.8414 175.6896 153 G 3.6574 8.1643 112.9636 45.7261 0.0000 171.4947 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 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 L 8.02 4.41 0.00 0.69 0.71 0.62 -0.92 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 3 S 9.74 4.50 0.00 4.00 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 4 D 8.69 4.66 0.00 2.77 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.16 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 6 E 8.22 3.90 0.00 2.03 1.71 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 2.22 2.27 0.00 7 W 8.13 4.38 0.00 3.57 3.19 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 8 Q 8.53 4.08 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.67 0.00 9 L 8.04 4.04 0.00 1.97 1.74 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.12 3.69 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.87 0.00 0.00 11 L 8.53 4.17 0.00 1.82 1.80 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.39 4.40 0.00 2.89 2.93 0.00 0.00 7.03 8.53 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 13 V 7.96 3.80 2.29 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 1.13 0.00 0.00 0.94 0.00 0.00 14 W 8.81 4.13 0.00 3.59 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 15 G 8.17 3.89 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 0.00 0.00 0.00 16 K 7.73 3.86 0.00 1.54 1.35 0.00 1.54 0.00 0.00 1.50 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.31 7.81 17 V 6.89 2.81 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 -0.34 0.00 0.00 18 E 7.91 3.89 0.00 2.03 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 2.40 2.49 0.00 19 A 7.39 4.22 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 20 D 7.93 4.56 0.00 2.67 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 21 V 7.70 3.55 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 1.03 0.00 0.00 0.92 0.00 0.00 22 A 8.01 4.12 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 23 G 8.15 3.55 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 0.00 0.00 0.00 24 H 8.22 4.11 0.00 3.32 3.21 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.42 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.27 3.85 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 27 E 8.05 3.84 0.00 1.99 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 2.22 2.23 0.00 28 V 7.78 3.52 2.16 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 1.01 0.00 0.00 0.93 0.00 0.00 29 L 7.66 3.43 0.00 1.58 0.97 0.91 0.64 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 30 I 7.64 3.65 1.78 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 1.47 0.60 0.87 0.00 0.00 31 R 7.90 3.84 0.00 1.95 1.93 0.00 3.25 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 32 L 8.01 3.91 0.00 1.68 1.41 1.02 0.88 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 33 F 7.99 4.49 0.00 2.98 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.21 4.19 0.00 1.74 1.83 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.70 1.58 7.81 35 G 8.25 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 36 H 8.17 4.71 0.00 2.98 2.73 0.00 5.65 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.50 0.00 2.15 2.12 0.00 3.82 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 2.09 2.00 0.00 38 E 8.24 4.30 0.00 2.30 2.30 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 2.41 2.57 0.00 39 T 8.29 3.82 4.46 0.00 0.00 0.00 0.00 0.00 0.00 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 40 L 7.93 3.70 0.00 1.58 1.78 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.91 4.24 0.00 2.12 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 2.39 2.40 0.00 42 K 8.06 4.45 0.00 1.73 1.64 0.00 1.92 0.00 0.00 1.76 0.00 0.00 3.18 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.73 1.87 7.81 43 F 8.35 4.46 0.00 3.21 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.39 4.36 0.00 2.62 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.83 4.03 0.00 1.06 1.24 0.00 1.47 0.00 0.00 1.51 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.32 7.81 46 F 7.96 5.15 0.00 2.91 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 47 K 7.81 4.14 0.00 1.83 1.90 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.49 1.41 7.81 48 H 8.21 4.49 0.00 3.30 3.43 0.00 5.52 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.45 4.35 0.00 1.53 1.56 0.71 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.88 4.34 0.00 1.84 1.83 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.71 1.51 7.81 51 S 7.41 4.63 0.00 3.97 3.89 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 52 E 8.73 3.88 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 53 D 8.05 4.37 0.00 2.71 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.95 3.96 0.00 2.06 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 2.34 2.33 0.00 55 M 8.31 4.10 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.51 0.00 56 K 8.32 3.96 0.00 1.79 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.41 7.81 57 A 7.49 4.44 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 58 S 7.32 4.15 0.00 3.79 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 59 E 9.10 3.94 0.00 2.11 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 2.41 2.43 0.00 60 D 8.23 4.53 0.00 3.11 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.98 3.46 0.00 1.07 1.53 0.69 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.92 3.90 0.00 1.87 1.92 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.45 7.81 63 K 8.26 4.03 0.00 2.09 1.91 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.70 7.81 64 H 8.79 4.32 0.00 3.60 3.78 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.36 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.20 4.28 0.00 2.79 3.02 0.00 0.00 7.26 6.50 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 67 T 8.06 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 1.27 0.00 0.00 68 N 8.26 4.27 0.00 2.78 2.97 0.00 0.00 7.29 7.03 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 69 L 8.23 4.24 0.00 1.79 1.92 0.87 0.78 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 70 T 8.35 3.94 4.49 0.00 0.00 0.00 0.00 0.00 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 71 A 8.02 4.01 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 72 L 8.03 3.73 0.00 1.59 1.63 0.11 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.40 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.87 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.50 3.81 1.83 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.80 0.86 0.00 0.00 76 L 7.95 3.94 0.00 1.11 1.54 -0.38 1.01 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 77 K 7.77 3.91 0.00 1.65 1.81 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.61 7.81 78 K 7.90 4.06 0.00 1.84 1.85 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.48 1.90 7.81 79 K 8.80 2.00 0.00 1.03 0.74 0.00 1.47 0.00 0.00 1.54 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.54 0.99 7.81 80 G 8.84 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 81 H 7.22 4.53 0.00 3.20 3.23 0.00 5.79 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.34 5.18 0.00 3.21 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.43 4.06 0.00 2.04 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 2.34 0.00 84 A 7.87 4.01 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 85 E 8.07 4.08 0.00 2.22 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 2.38 2.42 0.00 86 L 8.49 4.06 0.00 1.71 1.70 0.77 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.01 3.89 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 88 P 0.00 4.33 0.00 2.19 2.13 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.16 0.00 89 L 7.51 4.01 0.00 1.89 1.86 1.00 1.15 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 90 A 8.31 4.20 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.24 3.92 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 92 S 8.12 4.07 0.00 3.99 4.13 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 93 H 8.78 4.33 0.00 3.57 3.60 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.34 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 6.97 3.82 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 1.10 0.00 0.00 96 K 7.48 3.91 0.00 1.53 1.49 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.23 1.33 7.81 97 H 8.14 4.30 0.00 2.97 3.14 0.00 5.85 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.36 3.46 0.00 1.86 1.88 0.00 1.75 0.00 0.00 2.36 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.26 1.26 7.81 99 I 7.87 4.35 2.11 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 1.40 0.98 1.19 0.00 0.00 100 P 0.00 4.58 0.00 1.96 1.96 0.00 3.25 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 0.93 1.29 0.00 101 V 8.28 3.66 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 1.00 0.00 0.00 0.92 0.00 0.00 102 K 7.87 3.94 0.00 1.61 1.90 0.00 1.48 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.27 1.38 7.81 103 Y 7.80 4.17 0.00 3.29 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 0.00 104 L 8.05 4.21 0.00 1.84 1.80 0.72 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.18 4.04 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 106 F 8.00 4.66 0.00 3.18 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.24 3.86 2.03 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 1.59 1.66 1.15 0.00 0.00 108 S 8.41 4.22 0.00 4.17 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.48 4.05 0.00 2.31 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 2.43 2.44 0.00 110 A 7.99 4.39 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 0.00 111 I 8.09 3.66 2.10 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 1.62 1.06 1.08 0.00 0.00 112 I 7.80 3.82 2.12 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.86 1.20 0.00 0.00 113 Q 8.45 4.03 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.62 0.00 114 V 8.13 3.53 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.89 0.00 0.00 115 L 7.78 3.73 0.00 0.95 0.55 0.73 0.32 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 0.00 116 Q 7.97 4.23 0.00 2.37 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.96 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 117 S 8.01 4.20 0.00 3.87 4.05 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 0.00 0.00 0.00 118 K 8.22 4.08 0.00 1.40 1.41 0.00 1.66 0.00 0.00 1.35 0.00 0.00 2.57 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.28 1.40 7.81 119 H 8.47 5.01 0.00 3.07 3.18 0.00 5.65 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.34 0.00 2.13 2.17 0.00 3.88 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 121 G 8.30 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 0.00 0.00 0.00 122 D 7.98 4.73 0.00 2.75 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 0.00 123 F 8.40 5.13 0.00 2.94 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 0.00 124 G 7.47 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 0.00 125 A 8.43 3.87 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 0.00 126 D 7.97 4.20 0.00 2.67 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 0.00 127 A 7.86 3.98 1.38 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 0.00 0.00 0.00 128 Q 7.73 3.29 0.00 2.01 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.16 1.59 0.00 129 G 8.04 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.12 3.87 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 0.00 131 M 8.40 4.06 0.00 2.46 2.38 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.90 0.00 132 S 8.25 4.16 0.00 4.05 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 0.00 133 K 8.07 3.86 0.00 1.80 1.68 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.54 7.81 134 A 7.90 3.79 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 0.00 135 L 8.17 4.08 0.00 1.95 1.83 1.01 0.65 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 0.00 136 E 8.54 3.94 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.32 0.00 137 L 8.21 3.95 0.00 1.83 1.94 0.98 1.39 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 0.00 138 F 8.37 4.14 0.00 3.14 3.28 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 0.00 139 R 8.32 3.48 0.00 1.96 1.85 0.00 3.19 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.02 0.00 140 N 8.31 4.22 0.00 2.94 2.83 0.00 0.00 7.08 8.58 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 0.00 141 D 8.16 4.30 0.00 2.64 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 0.00 142 M 7.63 3.71 0.00 1.22 1.57 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.81 0.00 143 A 7.78 3.68 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 0.00 144 A 8.15 3.90 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 0.00 145 K 7.98 3.96 0.00 2.02 1.97 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.58 7.81 146 Y 8.40 4.40 0.00 3.18 3.03 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 0.00 147 K 8.36 3.85 0.00 1.84 2.04 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.81 3.97 0.00 2.10 2.28 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 2.35 2.38 0.00 149 L 7.73 4.32 0.00 1.94 1.73 1.03 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.13 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 0.00 151 F 8.15 4.63 0.00 2.72 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 8.12 3.88 0.00 1.88 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.14 0.00 153 G 8.16 3.66 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 0.00 0.00 0.00