NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 N 4.7411 8.4244 118.1297 53.6208 39.9403 173.1204 23 H 4.0664 9.0652 117.9395 58.8941 29.9901 174.2644 24 D 4.5471 8.3080 114.3424 52.6834 43.0726 172.4881 25 P 4.1558 0.0000 0.0000 62.3929 32.0821 175.6715 26 Q 4.5410 7.8861 122.3410 54.2077 31.0153 174.5779 27 F 4.9331 8.3514 122.1737 55.6118 43.2608 173.5291 28 E 4.4997 8.6732 120.3823 54.3248 30.7611 174.6633 29 P 4.3914 0.0000 0.0000 63.2043 31.9700 176.2565 30 I 4.1575 8.2017 120.9697 62.7065 37.9408 176.1921 31 V 4.4962 7.3757 110.8858 59.6636 35.5817 174.0930 32 S 4.6011 8.5335 115.1178 56.5122 64.0086 173.0447 33 L 4.7535 8.2904 127.4498 52.0034 43.9446 174.9787 34 P 4.4159 0.0000 0.0000 61.9776 32.0136 175.8981 35 E 4.0835 8.4904 121.5304 56.5745 30.1782 175.9936 36 Q 4.4751 8.2595 124.3585 54.3981 32.3684 174.0368 37 E 4.5316 8.7019 122.8233 54.6154 30.4263 175.5114 38 I 4.3379 8.0746 117.6835 59.2453 39.3776 175.6101 39 K 4.4524 8.2556 122.2205 55.8603 33.2226 177.2718 40 T 4.0616 8.4806 118.5483 64.2628 68.8227 174.9464 41 L 3.6915 7.9428 119.9025 55.4509 39.2892 175.1650 42 E 4.6773 7.9864 113.3492 56.8211 31.2540 175.2400 43 E 4.1952 8.3739 119.8224 58.8007 29.8998 177.6917 44 D 4.7027 8.0751 117.2192 54.3004 41.6551 175.8628 45 E 4.6086 7.1382 113.3447 55.2040 28.3839 176.6174 46 E 4.9003 8.9006 124.2161 53.4469 30.9383 174.7286 47 E 3.9498 8.7483 122.2637 56.7436 27.6355 173.2470 48 L 4.4073 8.6058 122.5626 56.2519 42.9930 176.9273 49 F 5.1520 8.0826 119.3884 56.4992 43.2974 173.5405 50 K 4.8029 7.4246 125.3481 55.3961 35.1331 174.6877 51 M 4.4140 8.5353 123.9936 54.2135 36.2118 173.8125 52 R 4.5584 9.1563 125.6980 56.5008 31.1745 174.9073 53 A 4.1851 8.4583 125.4448 51.5168 23.7238 174.6574 54 K 4.7072 7.9290 120.1528 54.6309 34.7568 174.7903 55 L 5.0888 9.1285 130.0730 53.7451 44.8028 174.9526 56 F 5.2351 9.2408 122.4618 55.8051 43.1231 174.2337 57 R 4.9366 9.5028 123.4157 55.1550 32.3718 174.4033 58 F 4.3617 7.8791 125.2307 57.0428 41.1884 175.8670 59 A 3.5403 7.6556 125.5347 50.7935 21.5681 177.6556 60 S 4.9954 7.5225 116.3305 61.5268 64.3606 176.8842 61 E 4.4650 8.4078 121.1225 56.1950 29.1543 177.0402 62 N 4.3547 7.8467 118.1854 53.8967 38.7079 176.9119 63 D 4.6492 8.2256 114.6513 54.5390 39.0527 174.2477 64 L 4.5336 6.9549 118.7185 51.4117 41.1389 172.7494 65 P 3.7833 0.0000 0.0000 62.3474 31.4932 175.5355 66 E 4.4631 7.2981 121.2171 54.3731 34.5308 174.5884 67 W 5.2685 8.6005 121.9201 55.6538 30.3056 175.8241 68 K 4.7036 8.6714 125.1096 54.5331 33.7821 176.3233 69 E 3.8656 8.8469 123.9077 56.6516 29.5556 176.6562 70 R 4.4307 9.6224 122.7032 54.8593 32.3540 175.9055 71 G 4.3034 6.7588 111.5190 45.4451 0.0000 171.1641 72 T 4.8215 7.6419 117.0054 61.3189 71.8945 173.7601 73 G 4.3203 8.1378 114.1231 45.6558 0.0000 170.3866 74 D 5.1577 7.9903 120.9537 53.4142 42.4911 176.4009 75 V 4.2084 8.7859 124.4188 62.4158 33.5704 174.8875 76 K 5.3648 8.8388 123.6719 55.1964 37.1442 174.9112 77 L 5.3780 9.1621 123.8885 53.2442 44.3482 175.6045 78 L 5.1427 8.8275 122.2615 52.9141 45.9916 175.2104 79 K 5.1020 8.6896 124.0098 54.7958 34.6621 174.8284 80 H 4.6651 9.1710 127.1327 56.0099 30.1706 175.5489 81 K 4.1523 8.5677 124.5574 59.6074 32.1990 179.5989 82 E 3.9056 7.6808 116.0187 58.3925 29.9294 176.5723 83 K 4.4537 7.1144 117.3008 55.3291 34.9548 175.4384 84 G 3.9422 8.5483 106.0540 45.9637 0.0000 173.1208 85 A 3.9151 7.7559 121.2039 52.3214 19.4318 176.5303 86 I 5.3037 8.4429 121.1951 59.6937 41.5411 174.6618 87 R 5.1787 9.2974 121.5055 54.7677 33.8720 173.1010 88 L 5.2678 9.0480 121.7930 53.4443 44.7061 174.9295 89 L 5.3033 8.9396 127.2694 53.8606 45.5999 174.4196 90 M 5.4243 9.3559 125.6390 52.7133 36.0269 174.0426 91 R 5.1856 8.3361 122.3356 54.2977 34.5853 175.0757 92 R 4.3478 9.0580 122.1806 55.9495 31.3865 176.1861 93 D 4.5812 8.5220 121.4618 55.5613 41.7523 177.7930 94 K 3.9170 8.8232 124.7188 58.5330 30.7886 177.2236 95 T 3.9561 7.5733 111.6016 62.6468 67.6121 175.5617 96 L 4.0751 8.0832 118.2994 55.1121 40.0570 174.5906 97 K 4.2724 7.2647 118.5380 56.2868 33.2604 176.4633 98 I 4.5005 8.2748 124.4570 61.3403 37.6921 175.5121 99 C 4.8803 8.6919 120.1161 57.2296 30.8611 173.5380 100 A 4.4668 7.7589 117.1132 51.8394 22.3136 175.5926 101 N 5.6276 9.9215 122.0937 54.4811 41.5429 172.7033 102 H 5.1991 8.2141 120.5340 54.1663 32.2577 172.5137 103 Y 4.8710 8.5271 117.1035 58.1728 39.0248 175.4708 104 I 4.4276 8.6342 124.1756 60.3806 37.6927 176.2047 105 T 4.4018 8.4757 117.5987 59.6735 70.4326 173.3419 106 P 4.2804 0.0000 0.0000 65.9489 31.8312 177.7458 107 M 4.3768 7.7234 117.7668 53.7348 30.7266 175.1201 108 M 4.9480 7.5242 118.4642 54.1868 36.6115 173.0184 109 E 4.8072 8.6427 126.0613 55.8034 31.1643 176.9310 110 L 4.6663 8.0456 110.9030 52.6446 41.9811 176.9191 111 K 3.9386 8.5019 118.3885 56.7101 33.3444 176.7417 112 P 5.1290 0.0000 0.0000 63.1087 32.5482 175.5509 113 N 4.6665 8.6369 119.9808 52.5385 39.6860 176.6782 114 A 3.6778 9.0498 130.8095 53.0850 19.9042 179.8411 115 G 4.0723 8.7462 118.2735 43.9463 0.0000 174.8840 116 S 3.4615 8.7367 123.1263 58.3443 62.0943 171.6777 117 D 4.5760 7.9541 115.7899 53.6860 41.3163 175.9048 118 R 4.5442 8.0683 117.0323 55.6636 32.3685 174.3131 119 A 5.0419 7.3613 120.1263 49.7787 21.7050 176.1721 120 W 5.4663 8.7952 120.9179 55.1238 33.3103 175.0668 121 V 5.3034 8.9199 114.9949 59.8703 34.7961 174.8998 122 W 5.3580 8.5319 119.0125 55.6782 31.9705 172.5668 123 N 5.2538 9.0042 117.0112 52.5702 41.9417 173.7985 124 T 4.7496 8.3389 117.9683 62.8601 72.9590 174.7219 125 H 4.4828 9.0843 122.1146 57.1655 29.3087 175.9767 126 A 4.4951 7.4630 120.2785 51.7389 19.9639 174.8194 127 D 4.9138 9.1805 121.8580 54.0269 42.6598 176.3775 128 F 4.8838 8.9085 125.1377 57.7690 40.1573 177.0823 129 A 4.0049 8.6602 124.2333 54.3601 18.2774 178.9849 130 D 4.6776 7.8718 112.9977 53.5075 41.0731 175.8710 131 E 2.0000 7.3016 116.5537 56.0974 27.5960 174.5102 132 C 4.5640 7.0685 116.6129 56.9766 34.4344 171.0016 133 P 4.6305 0.0000 0.0000 63.2745 31.6958 176.0586 134 K 4.6863 9.0029 124.1046 53.9933 36.4615 174.5858 135 P 4.8466 0.0000 0.0000 63.1739 32.3357 175.2718 136 E 4.6260 9.1842 122.2353 55.0039 33.4598 173.7062 137 L 4.6748 8.4803 127.0662 53.3531 43.6378 175.6958 138 L 5.0974 7.7744 124.6892 53.5526 44.6310 174.8925 139 A 4.4114 7.3420 115.4164 51.7849 22.2355 175.4202 140 I 5.0092 8.7213 123.2759 59.1599 41.5396 174.1543 141 R 5.0213 8.6975 128.6094 54.6274 32.9638 174.3519 142 F 5.0373 8.4605 121.9578 55.3488 42.4894 175.4981 143 L 4.0830 9.0386 121.5933 57.9713 42.4002 177.2566 144 N 5.1187 7.8824 114.5161 51.0373 42.3412 175.3822 145 A 4.3419 8.6239 124.9738 53.7439 18.7369 179.7368 146 E 4.0713 8.0895 116.1581 59.1323 29.9141 178.7329 147 N 4.3850 8.0099 116.9553 55.9285 38.7136 176.9261 148 A 3.6797 7.8618 121.8396 55.1712 18.2561 179.8340 149 Q 4.0852 7.8450 115.8307 59.1549 28.7736 178.7579 150 K 3.6025 7.9282 119.2281 59.3212 31.9749 179.2452 151 F 2.9182 8.1994 121.0184 60.5446 39.2900 177.1748 152 K 3.1060 8.1919 119.5521 59.4836 31.9958 178.4671 153 T 3.5954 8.2740 114.1238 65.0477 67.3344 175.7989 154 K 3.6925 7.2878 121.3363 59.2702 32.0614 178.4466 155 F 3.5162 7.8038 121.1707 61.0400 39.1954 176.6159 156 E 3.9015 8.2548 118.8590 59.6174 29.3327 179.3873 157 E 3.8751 7.8794 117.0407 59.6617 29.5893 178.8531 158 C 4.0560 7.7740 117.5057 62.4761 28.0715 176.1004 159 R 3.7213 7.8510 120.4232 58.8892 29.5664 178.4808 160 K 3.8211 7.9465 119.6050 59.4869 32.2564 178.1415 161 E 3.8628 8.4793 119.9105 59.6602 29.2266 179.0532 162 I 3.6529 7.4147 118.4627 64.1443 37.1924 177.6009 163 E 4.0438 7.9664 119.3781 59.4866 29.5047 178.3826 164 E 3.9841 8.5755 117.3596 58.4258 29.8187 180.5175 165 R 2.9597 8.4830 109.4161 54.5800 32.7994 177.3721 166 E 3.7123 9.1851 111.5244 57.7483 30.3981 178.1138 167 K 4.1133 8.7695 121.8911 56.8269 32.3816 174.7082 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 22 N 8.42 4.74 0.00 2.74 2.89 0.00 0.00 6.89 7.27 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 23 H 9.07 4.07 0.00 3.14 3.34 0.00 5.98 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.31 4.55 0.00 2.52 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 25 P 0.00 4.16 0.00 2.37 1.94 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 26 Q 7.89 4.54 0.00 1.80 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 27 F 8.35 4.93 0.00 2.97 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 28 E 8.67 4.50 0.00 2.10 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 2.37 0.00 29 P 0.00 4.39 0.00 2.08 2.05 0.00 3.69 0.00 0.00 3.84 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 30 I 8.20 4.16 1.86 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 1.41 0.50 0.90 0.00 0.00 31 V 7.38 4.50 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 0.68 0.00 0.00 0.92 0.00 0.00 32 S 8.53 4.60 0.00 3.78 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.29 4.75 0.00 1.63 1.53 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.42 0.00 2.04 1.98 0.00 3.68 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 35 E 8.49 4.08 0.00 1.90 1.85 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 2.29 2.36 0.00 36 Q 8.26 4.48 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.62 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 37 E 8.70 4.53 0.00 1.97 1.87 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 2.21 2.26 0.00 38 I 8.07 4.34 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 1.42 0.58 0.91 0.00 0.00 39 K 8.26 4.45 0.00 1.77 1.97 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.40 7.81 40 T 8.48 4.06 4.47 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 1.28 0.00 0.00 41 L 7.94 3.69 0.00 1.75 1.78 0.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 42 E 7.99 4.68 0.00 1.88 1.85 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 2.20 2.34 0.00 43 E 8.37 4.20 0.00 2.13 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 2.40 0.00 44 D 8.08 4.70 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 7.14 4.61 0.00 2.12 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 0.00 2.57 2.32 0.00 46 E 8.90 4.90 0.00 2.19 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 2.07 2.06 0.00 47 E 8.75 3.95 0.00 2.16 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 2.18 2.34 0.00 48 L 8.61 4.41 0.00 1.67 1.74 0.91 0.68 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 49 F 8.08 5.15 0.00 3.07 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 50 K 7.42 4.80 0.00 1.67 1.48 0.00 1.83 0.00 0.00 1.58 0.00 0.00 2.70 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.21 1.37 7.81 51 M 8.54 4.41 0.00 2.09 1.40 0.00 0.00 0.00 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.77 0.00 52 R 9.16 4.56 0.00 1.83 1.84 0.00 3.17 0.00 0.00 3.41 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 53 A 8.46 4.19 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.93 4.71 0.00 1.72 1.60 0.00 1.68 0.00 0.00 1.28 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.73 0.96 7.81 55 L 9.13 5.09 0.00 1.73 1.51 1.07 0.36 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 56 F 9.24 5.24 0.00 2.81 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 57 R 9.50 4.94 0.00 1.98 1.84 0.00 3.26 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 58 F 7.88 4.36 0.00 1.83 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 59 A 7.66 3.54 0.65 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 60 S 7.52 5.00 0.00 3.93 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 61 E 8.41 4.46 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 62 N 7.85 4.35 0.00 2.75 2.77 0.00 0.00 7.10 7.97 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 63 D 8.23 4.65 0.00 2.80 2.82 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 64 L 6.95 4.53 0.00 1.50 1.52 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 3.78 0.00 2.04 2.28 0.00 3.61 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 66 E 7.30 4.46 0.00 1.64 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 0.00 2.20 2.40 0.00 67 W 8.60 5.27 0.00 3.13 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 68 K 8.67 4.70 0.00 1.77 1.72 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.34 7.81 69 E 8.85 3.87 0.00 1.72 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.25 0.00 70 R 9.62 4.43 0.00 1.75 1.85 0.00 3.44 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 71 G 6.76 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 T 7.64 4.82 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 73 G 8.14 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 74 D 7.99 5.16 0.00 2.63 2.58 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 75 V 8.79 4.21 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 1.09 0.00 0.00 0.93 0.00 0.00 76 K 8.84 5.36 0.00 1.91 1.67 0.00 1.86 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.43 7.81 77 L 9.16 5.38 0.00 1.83 1.61 0.96 0.85 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 78 L 8.83 5.14 0.00 1.59 1.53 1.01 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.69 5.10 0.00 1.73 1.67 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.70 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.74 7.81 80 H 9.17 4.67 0.00 3.18 3.18 0.00 5.82 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 81 K 8.57 4.15 0.00 1.95 1.82 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.73 7.81 82 E 7.68 3.91 0.00 1.65 1.93 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 2.21 2.27 0.00 83 K 7.11 4.45 0.00 1.60 1.66 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.34 1.32 7.81 84 G 8.55 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.76 3.92 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 86 I 8.44 5.30 1.82 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 1.39 0.99 0.89 0.00 0.00 87 R 9.30 5.18 0.00 1.85 2.02 0.00 2.81 0.00 0.00 2.93 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 88 L 9.05 5.27 0.00 1.83 1.54 1.31 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.94 5.30 0.00 1.79 1.48 1.06 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 90 M 9.36 5.42 0.00 2.11 1.90 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 2.55 2.32 0.00 91 R 8.34 5.19 0.00 1.75 1.74 0.00 3.18 0.00 0.00 3.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 92 R 9.06 4.35 0.00 1.69 1.80 0.00 3.09 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 93 D 8.52 4.58 0.00 2.63 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.82 3.92 0.00 1.86 1.90 0.00 1.61 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.45 7.81 95 T 7.57 3.96 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 96 L 8.08 4.08 0.00 1.82 1.76 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.26 4.27 0.00 1.49 1.70 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.54 7.81 98 I 8.27 4.50 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.47 1.01 0.00 0.00 99 C 8.69 4.88 0.00 2.99 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 0.00 100 A 7.76 4.47 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 0.00 101 N 9.92 5.63 0.00 2.85 2.77 0.00 0.00 6.58 7.44 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 0.00 102 H 8.21 5.20 0.00 3.38 3.56 0.00 5.70 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 8.53 4.87 0.00 2.98 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 0.00 104 I 8.63 4.43 1.74 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.47 0.55 0.00 0.00 105 T 8.48 4.40 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 106 P 0.00 4.28 0.00 2.07 2.14 0.00 3.68 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 107 M 7.72 4.38 0.00 2.02 2.04 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 2.60 2.62 0.00 108 M 7.52 4.95 0.00 2.20 2.01 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 2.77 2.84 0.00 109 E 8.64 4.81 0.00 2.00 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 2.25 2.25 0.00 110 L 8.05 4.67 0.00 0.82 1.07 -0.11 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.50 3.94 0.00 1.82 1.85 0.00 1.72 0.00 0.00 1.88 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.73 7.81 112 P 0.00 5.13 0.00 2.08 2.22 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.67 0.00 113 N 8.64 4.67 0.00 2.63 2.62 0.00 0.00 7.20 7.96 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 0.00 114 A 9.05 3.68 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.75 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 0.00 116 S 8.74 3.46 0.00 3.84 3.68 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 0.00 117 D 7.95 4.58 0.00 2.75 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 0.00 118 R 8.07 4.54 0.00 1.74 1.99 0.00 3.06 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 119 A 7.36 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 W 8.80 5.47 0.00 3.53 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 0.00 121 V 8.92 5.30 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 0.74 0.00 0.00 1.13 0.00 0.00 122 W 8.53 5.36 0.00 3.44 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 N 9.00 5.25 0.00 2.74 2.74 0.00 0.00 6.67 7.70 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 0.00 124 T 8.34 4.75 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 1.29 0.00 0.00 125 H 9.08 4.48 0.00 3.22 3.38 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.46 4.50 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 0.00 127 D 9.18 4.91 0.00 2.81 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 0.00 128 F 8.91 4.88 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 0.00 129 A 8.66 4.00 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 0.00 130 D 7.87 4.68 0.00 2.56 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 0.00 131 E 7.30 2.00 0.00 1.78 1.63 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 1.95 1.98 0.00 132 C 7.07 4.56 0.00 2.77 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 0.00 133 P 0.00 4.63 0.00 2.08 2.13 0.00 3.83 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.40 0.00 134 K 9.00 4.69 0.00 1.72 1.67 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.66 7.81 135 P 0.00 4.85 0.00 1.96 2.03 0.00 3.71 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 2.06 2.14 0.00 136 E 9.18 4.63 0.00 2.05 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 2.21 2.30 0.00 137 L 8.48 4.67 0.00 1.65 1.41 0.59 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 138 L 7.77 5.10 0.00 0.27 1.02 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.34 4.41 0.46 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 0.00 140 I 8.72 5.01 2.13 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 1.31 1.22 0.00 0.00 141 R 8.70 5.02 0.00 1.78 1.73 0.00 3.10 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.48 0.00 142 F 8.46 5.04 0.00 2.92 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 9.04 4.08 0.00 1.63 1.77 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 144 N 7.88 5.12 0.00 2.77 2.69 0.00 0.00 6.93 8.14 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 0.00 145 A 8.62 4.34 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 0.00 146 E 8.09 4.07 0.00 2.27 2.23 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 2.38 2.48 0.00 147 N 8.01 4.39 0.00 2.99 2.87 0.00 0.00 7.04 7.26 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 0.00 148 A 7.86 3.68 1.19 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 0.00 0.00 149 Q 7.84 4.09 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.72 0.00 0.00 0.00 0.00 0.00 2.77 2.62 0.00 150 K 7.93 3.60 0.00 2.02 1.94 0.00 1.89 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.84 7.81 151 F 8.20 2.92 0.00 2.90 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 0.00 152 K 8.19 3.11 0.00 1.25 1.81 0.00 0.99 0.00 0.00 1.49 0.00 0.00 2.61 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.11 0.46 7.81 153 T 8.27 3.60 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 1.11 0.00 0.00 154 K 7.29 3.69 0.00 1.51 1.20 0.00 1.47 0.00 0.00 1.46 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.37 7.81 155 F 7.80 3.52 0.00 2.21 2.52 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 0.00 156 E 8.25 3.90 0.00 2.17 1.88 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 2.19 2.28 0.00 157 E 7.88 3.88 0.00 2.14 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 0.00 2.35 2.23 0.00 158 C 7.77 4.06 0.00 2.79 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 R 7.85 3.72 0.00 1.60 2.06 0.00 3.25 0.00 0.00 3.04 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.95 0.00 160 K 7.95 3.82 0.00 1.80 1.81 0.00 1.66 0.00 0.00 1.52 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.40 7.81 161 E 8.48 3.86 0.00 1.96 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 2.27 2.33 0.00 162 I 7.41 3.65 1.94 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.88 0.00 0.00 163 E 7.97 4.04 0.00 1.93 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 0.00 2.30 2.34 0.00 164 E 8.58 3.98 0.00 2.09 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 0.00 2.31 2.54 0.00 165 R 8.48 2.96 0.00 1.92 1.78 0.00 3.23 0.00 0.00 3.21 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 166 E 9.19 3.71 0.00 2.08 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 2.26 2.29 0.00 167 K 8.77 4.11 0.00 1.83 1.77 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.46 7.81