NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3100 8.2893 120.3248 54.5585 32.8120 177.5306 2 S 3.4280 9.2657 114.5668 58.7582 61.6550 170.9210 3 H 4.5995 8.2279 130.9108 56.5462 30.0604 178.7547 4 Q 4.3664 7.7974 120.7976 55.4593 27.9688 175.9168 5 D 4.7576 7.2110 120.5553 53.3814 43.2489 176.7165 6 D 4.2972 7.1412 118.7986 52.5636 42.0672 174.1410 7 Y 4.6629 6.6866 117.2910 56.8105 37.5156 175.3783 8 L 4.7345 7.6984 126.9872 52.0852 42.5107 176.4400 9 S 4.7807 7.9796 117.0943 57.1194 65.9654 177.7538 10 V 3.9226 7.4355 117.1217 64.7383 31.9570 177.9552 11 E 4.0037 8.4184 117.7961 59.7325 29.2219 179.3632 12 E 3.9334 9.5471 118.5792 59.4318 29.8252 178.9668 13 L 4.0025 7.9988 118.4000 58.1227 41.4691 179.5904 14 I 3.6694 8.1002 118.5365 64.4041 37.3744 177.6234 15 E 4.0235 7.9841 119.4126 60.2563 29.5064 178.1499 16 I 3.4873 8.1454 117.9446 64.7392 37.1180 177.7873 17 Q 3.8500 8.3292 119.9846 59.4664 29.3502 179.7600 18 K 4.0409 7.9356 121.9230 59.1575 32.1770 178.1032 19 E 3.9050 8.4017 119.3563 59.4514 29.6829 178.0965 20 E 4.2450 8.2318 118.1779 59.7250 29.5410 179.4461 21 T 4.1526 8.4360 114.6570 67.2281 68.6706 176.1602 22 R 3.9208 7.8851 118.9297 59.7472 30.2428 178.3994 23 D 4.4161 8.2499 118.2384 57.7345 40.8123 179.1127 24 I 3.6625 7.9008 119.6673 64.6861 37.2027 178.2390 25 I 3.6287 8.1478 120.7192 64.7642 36.8783 178.2751 26 Q 3.9253 8.4548 118.5834 58.9443 28.5586 178.7981 27 A 3.8991 7.8008 121.1391 55.1030 18.0473 179.0242 28 L 3.6820 7.9783 118.9164 58.9200 41.8039 178.8601 29 L 3.9935 8.4831 119.0667 57.3458 41.2988 179.0194 30 E 3.8401 8.5130 120.4650 59.7559 29.8401 178.7483 31 D 4.4669 8.0342 117.3832 56.6916 41.2804 176.3837 32 G 3.8774 9.8255 104.6141 44.9885 0.0000 173.7965 33 S 4.4743 7.4641 115.4530 58.9408 63.6947 173.2933 34 D 5.0251 8.4180 119.5450 51.9258 44.1834 175.4589 35 P 4.4548 0.0000 0.0000 64.8244 32.0024 176.7160 36 D 4.6455 8.0281 117.4092 53.6450 40.1002 177.5818 37 A 4.1414 7.8009 122.1997 52.5618 18.5814 174.3921 38 L 3.6587 7.5648 120.4914 54.5690 42.4590 173.5076 39 Y 4.6322 8.8529 119.9859 56.1734 40.3152 174.8585 40 E 4.8815 8.6835 121.9985 55.0232 31.1820 175.5707 41 I 4.4054 8.6693 126.6221 61.1366 39.0170 174.9904 42 E 5.2380 8.9717 125.5658 54.8424 33.1133 174.2319 43 H 5.5453 9.4381 122.5976 54.5646 32.8986 171.8242 44 H 5.1997 9.4079 120.4747 54.3257 31.0193 174.0933 45 L 4.4706 8.4869 122.3579 52.6430 45.7285 175.5297 46 F 5.4973 6.9576 116.7209 55.1889 41.9085 173.2074 47 A 4.9019 8.8054 120.2254 51.1041 22.2499 175.5230 48 E 4.4075 8.9801 115.5048 56.2016 31.6046 176.6666 49 D 4.3140 7.6354 119.4744 51.9744 43.0821 176.4925 50 F 4.1753 6.5175 123.9277 60.9499 38.9712 177.0783 51 D 4.3370 8.3185 116.9439 57.2037 41.2506 177.6737 52 K 3.8736 8.2227 119.6596 60.1974 31.9586 177.5474 53 L 3.8878 8.4320 121.0361 57.8114 41.9974 178.4954 54 E 4.0198 8.2981 118.4522 59.1900 29.6388 179.5963 55 K 3.9571 8.1496 119.7888 59.5505 32.4436 178.7807 56 A 2.9323 8.3105 120.8763 54.6423 18.2599 179.4743 57 A 3.8619 8.1484 119.8886 54.9178 18.0682 180.1480 58 V 3.5965 7.3748 116.2066 66.1580 31.9287 177.3387 59 E 4.0234 7.9521 118.4590 59.4994 29.4251 178.2014 60 A 3.8411 7.6849 120.2974 55.6751 18.1948 179.3964 61 F 4.7859 8.0604 118.6644 60.6092 39.4257 177.0401 62 K 3.5402 7.9171 119.0817 59.3192 32.0123 178.5207 63 M 4.2932 7.8766 118.1592 56.5631 32.8172 178.3638 64 G 4.9580 7.1548 120.9793 46.8056 0.0000 172.1257 65 F 4.7339 7.5089 117.4470 55.2419 43.2050 176.9672 66 E 4.8548 9.5148 124.5301 55.5402 27.2255 175.9034 67 V 4.2591 8.2024 121.5565 61.9599 32.6881 175.8730 68 L 4.8470 10.2228 125.1705 52.8000 44.7806 175.2285 69 E 4.3212 9.0232 125.8016 57.1431 30.3720 176.0811 70 A 5.3834 8.3446 126.1762 50.7977 20.8754 175.4783 71 E 4.7185 8.7221 116.4827 55.0464 33.2188 173.8924 72 E 4.3056 8.5971 124.1958 56.4447 29.9395 176.6085 73 T 4.6928 9.3421 114.7243 59.6964 72.7606 172.8675 74 E 4.7873 8.4049 121.2610 54.7550 32.7577 174.8887 75 D 4.7798 8.3893 126.8170 56.0489 41.4243 175.3004 76 E 4.0541 8.6746 111.8854 56.8596 27.7139 176.0892 77 D 4.7235 8.1967 115.0105 54.5297 46.1657 175.7770 78 G 3.8206 7.8832 105.6168 46.5327 0.0000 174.7818 79 N 4.2974 8.6809 114.1229 53.9431 38.7222 174.1396 80 K 4.8131 7.5854 114.3303 56.0958 33.9577 173.5517 81 L 5.0014 8.7985 124.5447 53.3124 45.0098 175.9603 82 L 4.8694 8.4101 119.1180 53.8065 43.8660 175.4428 83 C 5.2138 8.5613 120.4003 57.8722 34.5198 173.0665 84 F 5.2376 8.7817 122.1025 55.7688 40.3218 174.3176 85 D 5.5700 8.8800 117.3975 52.4797 44.9149 174.9655 86 A 5.4224 9.2832 122.4955 50.5158 22.5826 175.3171 87 T 5.6688 8.5508 109.9296 59.5681 73.1039 172.9697 88 M 4.6779 8.2353 120.7471 54.6970 35.4960 173.4710 89 Q 4.8262 8.7866 126.5526 56.0887 29.6270 175.6208 90 S 4.6775 8.9266 116.1965 57.1731 66.7881 174.7645 91 A 4.6317 8.7022 123.4753 52.0682 19.4785 177.1416 92 L 4.2757 8.3772 120.8934 54.2785 41.3822 175.7413 93 D 4.7556 8.0848 124.8294 51.5041 46.0058 176.1454 94 A 3.9481 8.5718 125.4758 55.0195 18.3208 180.2001 95 K 3.8408 7.8696 115.6909 59.6396 32.5399 178.7910 96 L 4.0207 7.8335 119.9943 58.1418 42.2276 178.4603 97 I 3.6802 7.9268 119.5483 64.9468 37.1812 178.0913 98 D 4.2120 8.2974 119.5404 57.1037 40.4668 178.8100 99 E 3.9814 8.5255 119.4708 59.6700 29.5951 179.0950 100 Q 4.0587 8.1884 117.5088 59.4032 28.6668 179.5241 101 V 3.2842 7.5936 118.4440 65.5993 31.4576 178.0710 102 E 3.8483 7.8856 118.5884 59.1006 29.2068 179.4828 103 K 3.8780 8.1240 118.6430 59.5187 32.1193 179.5557 104 L 3.6106 7.5847 119.1682 57.3775 41.2699 179.8507 105 V 3.3598 7.4930 118.3492 66.0104 31.5609 177.6816 106 N 4.2546 8.1155 116.2252 56.4096 38.1955 177.2160 107 L 3.9905 7.8927 120.4240 57.8659 42.5275 178.4897 108 A 4.1231 8.0616 121.0018 55.4954 18.2171 179.6255 109 E 4.0660 8.2104 115.2497 58.9658 29.5387 179.1897 110 K 4.1583 7.9675 119.3039 59.3446 32.3021 176.9942 111 F 4.2857 8.4624 116.9884 55.7168 39.4476 175.6846 112 D 5.7405 7.1536 133.1047 55.6390 44.1560 176.2765 113 I 4.6144 7.7117 112.4029 59.0223 41.0811 174.0074 114 I 4.3225 7.5441 120.4772 59.3442 39.6806 174.1123 115 Y 4.0453 8.4903 131.8172 56.6481 39.2370 175.6260 116 D 4.0777 6.6726 123.0212 51.1409 42.7172 174.2506 117 G 4.8780 6.4527 110.7971 45.3911 0.0000 168.7038 118 W 5.5541 8.7273 123.5340 54.2919 31.0019 175.1111 119 G 3.6192 8.7172 108.9021 44.6547 0.0000 171.0267 120 T 5.0370 7.5896 114.6531 59.9196 69.9333 173.2888 121 Y 4.1379 8.2492 126.0212 58.3581 39.1989 175.7522 122 Y 5.0163 8.6842 120.6300 55.7867 39.5787 174.0208 123 E 3.7556 8.1685 125.5734 56.8367 30.8269 177.5119 124 G 4.1031 8.1152 111.9194 46.2291 0.0000 173.2100 125 L 4.5044 7.1597 118.0136 53.3935 45.1177 174.5338 126 E 3.7711 9.1797 123.6878 57.9108 27.8270 177.7873 127 H 5.1591 9.0526 116.4954 55.0422 34.5607 173.9589 128 H 4.7737 8.2294 119.4006 55.9292 29.4678 177.3558 129 H 4.2125 9.0301 114.9186 56.5975 27.7886 171.0854 130 H 3.6306 9.6703 121.3091 57.4654 28.5930 171.5647 131 H 3.8804 8.9693 131.5807 56.2208 27.6925 174.0265 132 H 4.5606 8.6892 120.4036 55.4287 28.5488 174.6321 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 8.29 4.31 0.00 1.97 1.70 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 2 S 9.27 3.43 0.00 4.16 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 3 H 8.23 4.60 0.00 3.23 3.42 0.00 5.71 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 7.80 4.37 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.35 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 5 D 7.21 4.76 0.00 2.58 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 D 7.14 4.30 0.00 2.50 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 0.00 0.00 0.00 0.00 7 Y 6.69 4.66 0.00 3.06 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 8 L 7.70 4.73 0.00 1.52 1.52 0.94 0.94 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 9 S 7.98 4.78 0.00 3.90 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 10 V 7.44 3.92 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 0.81 0.00 0.00 0.93 0.00 0.00 11 E 8.42 4.00 0.00 2.01 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 0.00 2.41 2.44 0.00 12 E 9.55 3.93 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 13 L 8.00 4.00 0.00 1.73 1.79 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.10 3.67 2.07 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.54 0.88 0.00 0.00 15 E 7.98 4.02 0.00 2.30 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 0.00 2.31 2.40 0.00 16 I 8.15 3.49 2.02 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 0.84 0.97 0.00 0.00 17 Q 8.33 3.85 0.00 2.33 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.97 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 18 K 7.94 4.04 0.00 2.13 1.80 0.00 1.61 0.00 0.00 1.63 0.00 0.00 3.15 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.40 7.81 19 E 8.40 3.90 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 20 E 8.23 4.25 0.00 2.12 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 0.00 2.47 2.35 0.00 21 T 8.44 4.15 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 1.03 0.00 0.00 22 R 7.89 3.92 0.00 1.99 2.01 0.00 3.30 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.88 0.00 23 D 8.25 4.42 0.00 2.81 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 24 I 7.90 3.66 2.12 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.08 0.88 0.00 0.00 25 I 8.15 3.63 2.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.81 0.87 0.00 0.00 26 Q 8.45 3.93 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.59 0.00 27 A 7.80 3.90 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 28 L 7.98 3.68 0.00 1.76 1.56 0.88 1.00 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 29 L 8.48 3.99 0.00 1.93 1.62 0.90 0.79 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 E 8.51 3.84 0.00 2.06 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 2.32 2.36 0.00 31 D 8.03 4.47 0.00 2.66 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 32 G 9.83 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 33 S 7.46 4.47 0.00 4.05 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.42 5.03 0.00 2.81 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 4.45 0.00 2.20 2.19 0.00 3.79 0.00 0.00 3.73 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 36 D 8.03 4.65 0.00 2.87 2.97 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 37 A 7.80 4.14 1.46 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 0.00 0.00 0.00 38 L 7.56 3.66 0.00 1.89 1.70 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 8.85 4.63 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.68 4.88 0.00 2.02 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 2.37 2.30 0.00 41 I 8.67 4.41 2.17 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 1.25 0.00 0.00 42 E 8.97 5.24 0.00 2.10 1.80 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 2.09 2.30 0.00 43 H 9.44 5.55 0.00 3.17 3.41 0.00 5.65 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 44 H 9.41 5.20 0.00 3.25 3.38 0.00 5.75 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.49 4.47 0.00 0.71 0.99 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 46 F 6.96 5.50 0.00 3.13 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 47 A 8.81 4.90 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 48 E 8.98 4.41 0.00 1.91 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 0.00 2.25 2.25 0.00 49 D 7.64 4.31 0.00 2.59 2.61 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 50 F 6.52 4.18 0.00 3.16 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.32 4.34 0.00 2.90 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 52 K 8.22 3.87 0.00 1.93 1.86 0.00 1.72 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.61 1.77 7.81 53 L 8.43 3.89 0.00 1.87 1.68 1.19 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.30 4.02 0.00 2.05 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 2.30 2.36 0.00 55 K 8.15 3.96 0.00 2.14 2.13 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.21 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.55 7.81 56 A 8.31 2.93 0.95 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 57 A 8.15 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 7.37 3.60 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.99 0.00 0.00 59 E 7.95 4.02 0.00 2.13 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 2.36 2.38 0.00 60 A 7.68 3.84 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 61 F 8.06 4.79 0.00 3.07 3.46 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 0.00 62 K 7.92 3.54 0.00 1.92 1.76 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.34 7.81 63 M 7.88 4.29 0.00 2.20 2.43 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 2.64 2.57 0.00 64 G 7.15 4.96 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 0.00 0.00 0.00 65 F 7.51 4.73 0.00 3.22 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 66 E 9.51 4.85 0.00 2.07 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 2.41 2.46 0.00 67 V 8.20 4.26 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 1.07 0.00 0.00 68 L 10.22 4.85 0.00 1.88 1.86 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 69 E 9.02 4.32 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 70 A 8.34 5.38 1.52 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 71 E 8.72 4.72 0.00 2.07 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 72 E 8.60 4.31 0.00 1.90 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 0.00 2.36 2.47 0.00 73 T 9.34 4.69 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 1.12 0.00 0.00 74 E 8.40 4.79 0.00 1.85 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 75 D 8.39 4.78 0.00 2.61 2.46 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 0.00 76 E 8.67 4.05 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 2.22 2.31 0.00 77 D 8.20 4.72 0.00 2.66 2.61 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 78 G 7.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.68 4.30 0.00 2.85 2.95 0.00 0.00 6.72 6.69 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 80 K 7.59 4.81 0.00 1.78 1.68 0.00 1.88 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.52 7.81 81 L 8.80 5.00 0.00 1.78 1.74 0.87 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.41 4.87 0.00 1.80 1.80 1.07 0.82 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 83 C 8.56 5.21 0.00 2.94 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 84 F 8.78 5.24 0.00 3.40 3.17 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 85 D 8.88 5.57 0.00 2.67 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 86 A 9.28 5.42 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 87 T 8.55 5.67 4.33 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 1.38 0.00 0.00 88 M 8.24 4.68 0.00 2.04 1.67 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.27 0.00 89 Q 8.79 4.83 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 90 S 8.93 4.68 0.00 3.87 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 91 A 8.70 4.63 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 92 L 8.38 4.28 0.00 1.06 1.44 0.17 0.87 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 93 D 8.08 4.76 0.00 2.66 2.46 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 0.00 94 A 8.57 3.95 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 95 K 7.87 3.84 0.00 1.71 1.86 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.42 7.81 96 L 7.83 4.02 0.00 1.70 1.64 0.92 1.18 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 97 I 7.93 3.68 1.76 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 1.65 0.82 0.10 0.00 0.00 98 D 8.30 4.21 0.00 2.88 2.62 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 99 E 8.53 3.98 0.00 2.07 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 2.30 2.48 0.00 100 Q 8.19 4.06 0.00 2.31 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.96 0.00 0.00 0.00 0.00 0.00 2.59 2.65 0.00 101 V 7.59 3.28 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 0.95 0.00 0.00 0.80 0.00 0.00 102 E 7.89 3.85 0.00 2.22 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 0.00 2.28 2.28 0.00 103 K 8.12 3.88 0.00 1.71 1.75 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.47 7.81 104 L 7.58 3.61 0.00 1.17 1.21 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.49 3.36 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.66 0.00 0.00 106 N 8.12 4.25 0.00 2.80 2.84 0.00 0.00 6.75 6.23 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 0.00 107 L 7.89 3.99 0.00 1.53 1.62 0.69 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.06 4.12 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 0.00 109 E 8.21 4.07 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 110 K 7.97 4.16 0.00 2.04 2.25 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.48 7.81 111 F 8.46 4.29 0.00 3.02 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 0.00 112 D 7.15 5.74 0.00 2.78 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 0.00 113 I 7.71 4.61 2.09 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 1.36 0.61 1.05 0.00 0.00 114 I 7.54 4.32 1.89 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 1.20 0.72 0.87 0.00 0.00 115 Y 8.49 4.05 0.00 2.89 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 0.00 116 D 6.67 4.08 0.00 2.61 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 0.00 117 G 6.45 4.88 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 0.00 118 W 8.73 5.55 0.00 3.61 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 0.00 119 G 8.72 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 0.00 120 T 7.59 5.04 4.36 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 1.09 0.00 0.00 121 Y 8.25 4.14 0.00 3.07 2.86 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 0.00 122 Y 8.68 5.02 0.00 2.90 2.99 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 0.00 123 E 8.17 3.76 0.00 1.76 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 2.07 1.86 0.00 124 G 8.12 4.10 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 0.00 0.00 0.00 125 L 7.16 4.50 0.00 1.51 1.54 0.75 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 126 E 9.18 3.77 0.00 1.97 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 127 H 9.05 5.16 0.00 3.13 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 H 8.23 4.77 0.00 3.04 2.29 0.00 5.95 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 H 9.03 4.21 0.00 3.32 3.47 0.00 5.93 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 9.67 3.63 0.00 3.18 3.33 0.00 5.88 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 H 8.97 3.88 0.00 3.13 3.28 0.00 5.74 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 H 8.69 4.56 0.00 3.27 3.22 0.00 5.63 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