NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3801 8.3044 120.3494 54.7976 33.4196 174.9042 2 I 3.5842 8.4036 125.9736 61.3044 38.7288 173.2722 3 Q 4.9184 8.3712 125.2852 54.2133 33.8079 173.7991 4 S 5.1468 8.4650 114.9637 56.9945 66.3837 173.1937 5 Q 4.7379 8.8739 120.6951 54.8940 29.8641 175.8061 6 I 4.3760 8.4242 112.3147 60.1373 39.0495 174.8124 7 N 4.8651 7.8518 119.8054 50.9345 40.7441 174.7212 8 R 4.0189 8.5864 123.7755 59.1849 29.4601 178.3400 9 N 4.3907 8.5028 117.6218 56.0310 38.4835 177.1712 10 I 3.6590 7.4208 120.6930 64.6990 37.2122 178.7629 11 R 4.0059 7.8985 118.0688 59.0008 30.0066 179.0413 12 L 4.0149 8.0121 119.1990 57.5029 41.6272 178.8596 13 D 4.3647 8.5370 119.4136 57.4434 40.8337 178.6616 14 L 3.9293 7.8765 120.1680 58.0988 42.0705 178.7084 15 A 4.2510 8.1899 122.2481 54.7821 18.3826 179.4111 16 D 4.3073 8.0484 116.8444 57.2979 40.8770 178.6896 17 A 4.0056 7.9817 121.3190 55.3772 18.3710 179.6676 18 I 3.6570 8.2502 118.5041 64.7164 37.2140 178.7691 19 L 4.1685 8.0940 119.6109 57.2423 41.3653 179.4554 20 L 3.8791 7.7891 120.1611 58.0712 42.0647 178.6254 21 S 4.0090 7.9363 113.0917 61.5084 62.2474 175.7367 22 K 3.6929 8.3930 122.3109 59.8147 31.7210 178.3358 23 A 3.9394 7.8618 120.5411 54.8951 18.1959 179.6887 24 K 3.8500 8.2216 116.2663 59.6659 32.1514 178.4501 25 K 4.1128 8.3120 115.2484 56.1677 32.3819 176.0727 26 D 4.2852 7.5226 117.7527 55.0712 39.9765 173.1522 27 L 4.6814 7.8692 116.9147 53.7557 43.7122 177.3554 28 S 4.6108 8.5892 116.0097 56.9210 66.4209 175.5111 29 F 4.2140 8.3462 120.8206 60.3262 38.6897 177.5172 30 A 4.0639 8.2604 120.1957 55.5794 17.8672 179.3253 31 E 4.2009 7.8053 116.4555 59.1907 29.6294 179.4905 32 I 3.8640 7.5109 118.0821 64.3353 37.0179 178.1443 33 A 4.3375 8.4115 121.5007 53.4276 17.8628 176.7142 34 D 4.4314 7.7390 117.9799 57.0164 41.0452 177.4641 35 G 3.9129 9.1871 112.7094 46.0057 0.0000 173.4476 36 T 4.3126 7.5911 109.9848 60.4146 70.3072 175.7959 37 G 3.9667 8.4382 108.9493 45.0962 0.0000 172.9305 38 L 4.6436 7.3059 118.4239 52.2447 44.2757 176.9875 39 A 4.2101 8.3017 123.7086 51.7606 20.4133 178.3529 40 E 3.9274 8.9084 121.8198 59.9278 29.6546 179.9017 41 A 3.9853 8.0550 119.7625 55.2405 18.3426 179.3458 42 F 3.9368 8.0249 118.5741 61.4057 39.7518 177.5480 43 V 3.7288 8.3564 118.3300 66.0790 31.2827 178.2336 44 T 3.7264 8.4019 115.8933 66.3539 68.2545 176.3062 45 A 3.8106 7.7053 122.3913 55.1260 18.3398 179.5286 46 A 4.2274 7.3350 119.9337 54.8798 18.3806 179.8902 47 L 4.0370 7.7479 116.9949 57.6325 41.4042 178.7572 48 L 4.5726 7.7278 116.5502 54.5130 41.5616 177.5959 49 G 3.8836 7.9115 106.7135 45.8886 0.0000 174.4209 50 Q 4.5377 8.1467 115.9555 55.3102 29.6437 175.2866 51 Q 4.4208 7.3572 115.7463 54.5631 32.6782 172.8757 52 A 4.7672 8.3181 121.9078 51.1405 20.4134 176.7398 53 L 4.7658 8.8958 121.3924 52.7428 43.8955 174.9924 54 P 4.4475 0.0000 0.0000 62.5735 32.5223 177.2592 55 A 3.9739 8.8474 123.1626 55.6068 18.2464 179.8271 56 D 4.2780 8.1025 116.4141 57.5615 40.9674 178.5952 57 A 3.9889 8.0942 120.3748 55.2991 18.3714 179.1789 58 A 3.9630 8.2445 119.2135 55.6107 18.4374 180.1614 59 R 3.9182 8.1914 116.4549 59.0266 30.0279 179.1216 60 L 3.9371 7.9203 120.1543 58.4070 42.2260 179.4925 61 V 3.7837 8.0955 112.6549 64.3495 31.4127 178.8652 62 G 3.6419 8.2640 105.3637 47.6659 0.0000 175.6588 63 A 4.0377 8.2043 123.0371 54.8445 18.2046 179.8810 64 K 3.9642 7.8062 115.9959 58.8759 32.2002 178.5608 65 L 4.4128 7.7434 116.0900 53.1071 42.7047 175.7098 66 D 4.3376 7.4965 117.6008 55.0755 40.0838 173.5204 67 L 4.3383 8.3610 117.7472 53.9976 43.1125 177.9612 68 D 4.7100 8.2568 121.9793 52.9038 41.9785 177.1953 69 E 4.0164 8.5354 117.9704 59.3971 29.4181 178.9530 70 D 4.3677 8.0921 118.5257 57.5673 40.9235 178.8651 71 S 4.1056 8.9191 115.6701 61.7522 62.6547 176.7299 72 I 3.6940 7.4816 120.9180 64.3841 37.1570 177.9229 73 L 4.2248 8.1816 121.1378 58.2327 41.9889 178.8201 74 L 3.9951 8.5502 119.2376 57.9554 41.6355 179.4167 75 L 4.1404 8.2227 118.0497 56.8378 41.2972 178.4715 76 Q 4.8844 7.5448 117.7907 55.0392 29.6611 175.8148 77 M 4.4837 7.2855 119.9042 55.1119 33.0885 176.2715 78 I 4.1127 8.3958 123.7001 60.5065 38.2069 174.3951 79 P 4.6990 0.0000 0.0000 62.3889 32.7963 176.1442 80 L 4.3708 8.2655 122.8522 53.8883 41.6220 176.2043 81 R 4.1582 8.3318 125.2047 55.8164 30.9067 175.1176 82 G 3.0383 8.1131 107.8739 44.8197 0.0000 173.1107 83 C 4.3059 8.1577 122.7890 58.7990 30.7380 174.4862 84 I 3.9484 7.5628 121.8861 60.5910 37.3236 174.8511 85 D 4.4814 8.9306 125.7283 57.1627 41.5159 176.6186 86 D 4.6424 7.3539 115.0074 53.3632 41.5386 174.2638 87 R 4.1316 8.1887 126.8471 56.8805 29.5323 177.1973 88 I 4.0930 7.1883 116.0197 58.4008 39.3792 173.8275 89 P 4.4950 0.0000 0.0000 62.7023 31.8998 176.4909 90 T 4.1658 8.3158 111.1515 63.3530 69.9648 175.3651 91 D 4.5058 7.9847 122.4116 53.2097 42.3008 174.6630 92 P 4.4702 0.0000 0.0000 66.1249 31.1276 178.8542 93 T 3.9448 7.9467 113.1561 67.0549 68.4550 176.2436 94 M 4.5121 8.1220 120.3975 58.6288 31.9271 178.1864 95 Y 4.1419 8.7799 120.0839 60.6506 38.8752 178.3738 96 K 3.9054 7.9440 119.6174 59.1496 31.9229 179.3326 97 F 4.1585 7.4642 117.0496 60.6209 38.8526 176.8734 98 Y 3.9232 7.9821 118.6853 60.7372 38.5583 177.7554 99 E 3.7043 7.9036 120.1956 59.2972 29.5865 178.5848 100 M 4.1851 8.1199 118.9558 58.3066 31.8927 178.7368 101 L 3.9178 7.5961 118.7391 57.9919 41.6174 179.5867 102 Q 3.7686 7.3844 116.3667 58.4170 28.5550 178.5659 103 V 3.7236 7.4988 118.1806 64.3833 32.2810 176.5654 104 Y 4.6791 7.9919 113.8605 57.2619 38.7729 177.6879 105 G 3.7032 8.3265 109.0662 48.2275 0.0000 176.0242 106 T 4.0642 7.8326 111.6346 64.3622 69.0036 176.9350 107 T 3.9181 7.8878 118.4643 66.5095 68.5802 176.3997 108 L 4.0285 8.5196 121.3164 57.7985 41.6295 179.0595 109 K 3.7485 8.1737 119.2435 59.3708 32.0823 178.1703 110 A 4.0141 8.2514 120.7012 55.6917 18.2826 179.7318 111 L 4.0273 8.0405 117.0139 57.6749 41.6563 179.7486 112 V 3.8595 8.0257 118.4181 66.4641 31.3434 177.8830 113 H 5.1403 8.1881 117.2999 58.0816 28.3898 177.2699 114 E 3.9097 8.1393 120.2721 59.4423 29.5971 178.7700 115 K 3.9271 8.1993 117.1315 58.2177 32.2509 178.2551 116 F 4.2089 8.4477 116.1639 60.3228 40.8702 174.4579 117 G 3.7816 7.5523 102.4340 43.6000 0.0000 171.6785 118 D 4.5957 9.1327 119.9446 54.8996 41.4568 175.7530 119 G 3.9534 7.8396 116.2885 46.1613 0.0000 170.3367 120 I 4.7770 7.4802 113.6924 59.2178 41.6833 174.7616 121 I 4.4930 8.1998 124.3750 60.3648 37.8075 175.8942 122 S 4.2375 9.0865 122.9737 58.5563 62.7372 173.8408 123 A 3.8177 8.5368 127.1279 51.9595 19.7006 176.8628 124 I 4.2690 7.5811 114.9659 63.0456 39.1220 176.7676 125 N 4.7962 8.2299 123.3310 52.3563 37.3424 172.7394 126 F 5.4239 8.1111 123.0217 56.6955 43.0327 172.4880 127 K 4.5900 7.7580 124.1161 54.7217 35.8265 174.6681 128 L 5.7347 8.4174 125.2541 52.8960 43.7483 175.1311 129 D 4.8650 8.3839 118.6082 51.7799 43.3779 173.8414 130 V 4.8790 8.3748 119.5304 61.1627 33.9127 174.7770 131 K 4.6905 8.7586 126.4025 54.4391 36.0363 175.0420 132 K 4.8424 8.7136 125.8016 55.6790 33.1813 176.0876 133 V 4.6344 8.8034 119.9203 59.0228 35.6366 175.1834 134 A 4.2169 8.8141 125.7388 52.6730 18.9821 176.2802 135 D 4.6861 8.8103 120.1914 52.9514 42.2598 176.2387 136 P 4.3163 0.0000 0.0000 65.4990 31.7419 176.6750 137 E 4.3427 8.0869 115.8532 55.8955 29.4568 176.5103 138 G 3.7930 8.8553 108.3364 47.0541 0.0000 172.9179 139 G 3.8009 8.6938 108.3256 43.7791 0.0000 171.4180 140 E 5.1511 8.5206 117.1675 54.6111 32.4991 175.9207 141 R 4.7265 9.6559 123.0434 54.4710 32.9785 174.9487 142 A 4.8781 8.5380 124.6350 50.8712 20.5738 176.6700 143 V 4.2288 8.9315 123.4535 61.3756 33.6006 174.2484 144 I 4.8679 8.4021 129.1582 59.9270 39.1327 175.3055 145 T 4.5393 8.6054 124.1245 61.7688 70.8262 173.1921 146 L 4.6073 8.5381 126.8458 53.2056 43.5528 175.7647 147 D 4.6549 8.5866 124.1239 52.3348 43.2678 174.2014 148 G 4.6611 8.4844 112.0642 43.7348 0.0000 170.8490 149 K 4.3261 8.9643 124.9327 56.3053 33.6057 175.1122 150 Y 4.7466 8.5416 127.9981 57.0487 39.9327 174.2745 151 L 4.4881 8.3172 126.9399 52.0912 44.3388 174.1765 152 P 4.5448 0.0000 0.0000 62.3176 32.7964 175.9573 153 T 4.2550 8.5563 119.6074 63.2121 69.0112 174.3936 154 K 4.6350 8.5327 125.6956 53.5033 34.7569 174.3797 155 P 4.3486 0.0000 0.0000 62.9908 31.9536 176.2859 156 F 4.5664 7.9848 114.6193 57.0709 37.9267 174.8939 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 8.30 4.38 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.40 3.58 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.05 0.91 0.00 0.00 3 Q 8.37 4.92 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.55 2.26 0.00 4 S 8.47 5.15 0.00 3.80 3.77 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 5 Q 8.87 4.74 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 6 I 8.42 4.38 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.66 0.91 0.00 0.00 7 N 7.85 4.87 0.00 2.76 2.67 0.00 0.00 6.96 7.65 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 8 R 8.59 4.02 0.00 2.06 2.26 0.00 3.14 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 9 N 8.50 4.39 0.00 2.88 2.91 0.00 0.00 6.84 7.43 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 10 I 7.42 3.66 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 1.52 1.34 0.91 0.00 0.00 11 R 7.90 4.01 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.52 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.01 4.01 0.00 1.70 1.70 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.54 4.36 0.00 2.87 2.73 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 14 L 7.88 3.93 0.00 1.79 1.87 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.19 4.25 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.05 4.31 0.00 2.94 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 17 A 7.98 4.01 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 18 I 8.25 3.66 2.07 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 1.54 0.66 0.96 0.00 0.00 19 L 8.09 4.17 0.00 1.87 1.75 1.00 0.52 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 20 L 7.79 3.88 0.00 1.78 1.81 0.92 0.73 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 21 S 7.94 4.01 0.00 3.94 3.98 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 0.00 0.00 0.00 22 K 8.39 3.69 0.00 1.80 1.86 0.00 1.21 0.00 0.00 1.20 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.26 7.81 23 A 7.86 3.94 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 24 K 8.22 3.85 0.00 1.86 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.52 7.81 25 K 8.31 4.11 0.00 1.68 1.82 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.49 7.81 26 D 7.52 4.29 0.00 2.76 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 27 L 7.87 4.68 0.00 1.53 1.54 0.88 1.13 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 28 S 8.59 4.61 0.00 4.02 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 29 F 8.35 4.21 0.00 3.20 3.09 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 30 A 8.26 4.06 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 31 E 7.81 4.20 0.00 2.13 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 2.34 2.21 0.00 32 I 7.51 3.86 1.95 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.52 0.98 0.00 0.00 33 A 8.41 4.34 1.44 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 0.00 0.00 34 D 7.74 4.43 0.00 2.97 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 35 G 9.19 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 36 T 7.59 4.31 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 1.25 0.00 0.00 37 G 8.44 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 38 L 7.31 4.64 0.00 1.71 1.64 0.99 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.30 4.21 1.30 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 40 E 8.91 3.93 0.00 2.04 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 2.48 2.45 0.00 41 A 8.05 3.99 1.30 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 42 F 8.02 3.94 0.00 3.19 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 43 V 8.36 3.73 2.17 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 1.06 0.00 0.00 1.14 0.00 0.00 44 T 8.40 3.73 4.02 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 0.00 0.00 0.31 0.00 0.00 45 A 7.71 3.81 1.17 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 46 A 7.34 4.23 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 47 L 7.75 4.04 0.00 1.93 1.81 1.14 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.73 4.57 0.00 1.65 1.63 0.76 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 49 G 7.91 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 50 Q 8.15 4.54 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 51 Q 7.36 4.42 0.00 1.54 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.97 0.00 0.00 0.00 0.00 0.00 1.99 1.35 0.00 52 A 8.32 4.77 1.30 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 53 L 8.90 4.77 0.00 1.61 1.66 0.96 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.45 0.00 2.09 1.98 0.00 3.70 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 55 A 8.85 3.97 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 56 D 8.10 4.28 0.00 2.71 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 57 A 8.09 3.99 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 58 A 8.24 3.96 1.47 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 0.00 0.00 59 R 8.19 3.92 0.00 2.03 2.00 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 60 L 7.92 3.94 0.00 1.99 1.80 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.10 3.78 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 0.83 0.00 0.00 1.08 0.00 0.00 62 G 8.26 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.20 4.04 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 64 K 7.81 3.96 0.00 1.90 1.88 0.00 1.87 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.48 7.81 65 L 7.74 4.41 0.00 1.71 1.68 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.50 4.34 0.00 2.71 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 67 L 8.36 4.34 0.00 1.64 1.58 0.93 1.20 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 68 D 8.26 4.71 0.00 2.95 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 69 E 8.54 4.02 0.00 2.00 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 2.40 2.34 0.00 70 D 8.09 4.37 0.00 2.72 2.73 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 71 S 8.92 4.11 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 72 I 7.48 3.69 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.47 0.92 0.00 0.00 73 L 8.18 4.22 0.00 1.83 1.96 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.55 4.00 0.00 1.84 1.71 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.22 4.14 0.00 1.90 1.73 0.94 0.80 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 76 Q 7.54 4.88 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.89 0.00 0.00 0.00 0.00 0.00 2.53 2.26 0.00 77 M 7.29 4.48 0.00 1.92 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.53 0.00 78 I 8.40 4.11 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.00 0.92 0.00 0.00 79 P 0.00 4.70 0.00 2.08 2.07 0.00 3.74 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 1.94 1.98 0.00 80 L 8.27 4.37 0.00 1.66 1.64 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.33 4.16 0.00 1.81 1.88 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 82 G 8.11 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 0.00 0.00 0.00 83 C 8.16 4.31 0.00 3.06 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 84 I 7.56 3.95 1.85 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 1.30 0.53 0.88 0.00 0.00 85 D 8.93 4.48 0.00 2.63 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 86 D 7.35 4.64 0.00 2.60 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.19 4.13 0.00 1.96 2.01 0.00 3.19 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 88 I 7.19 4.09 1.75 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.74 0.59 0.00 0.00 89 P 0.00 4.49 0.00 2.19 2.04 0.00 3.51 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 90 T 8.32 4.17 4.23 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 1.19 0.00 0.00 91 D 7.98 4.51 0.00 2.85 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 92 P 0.00 4.47 0.00 2.22 2.12 0.00 3.68 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 93 T 7.95 3.94 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 94 M 8.12 4.51 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.62 0.00 95 Y 8.78 4.14 0.00 3.16 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 96 K 7.94 3.91 0.00 1.41 1.54 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.62 1.57 7.81 97 F 7.46 4.16 0.00 3.38 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 98 Y 7.98 3.92 0.00 2.97 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 99 E 7.90 3.70 0.00 1.89 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 2.29 2.38 0.00 100 M 8.12 4.19 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.60 0.00 101 L 7.60 3.92 0.00 1.47 1.53 0.89 1.56 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 0.00 102 Q 7.38 3.77 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.86 0.00 0.00 0.00 0.00 0.00 1.72 2.35 0.00 103 V 7.50 3.72 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 0.15 0.00 0.00 0.84 0.00 0.00 104 Y 7.99 4.68 0.00 3.25 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 0.00 105 G 8.33 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 7.83 4.06 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 107 T 7.89 3.92 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 1.33 0.00 0.00 108 L 8.52 4.03 0.00 1.81 1.74 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.17 3.75 0.00 1.84 1.95 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.48 7.81 110 A 8.25 4.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.04 4.03 0.00 1.83 1.76 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.03 3.86 2.25 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 1.14 0.00 0.00 1.03 0.00 0.00 113 H 8.19 5.14 0.00 3.29 3.37 0.00 5.69 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.14 3.91 0.00 2.04 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 2.29 2.34 0.00 115 K 8.20 3.93 0.00 1.55 1.14 0.00 1.72 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.53 7.81 116 F 8.45 4.21 0.00 2.36 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 0.00 117 G 7.55 3.78 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 0.00 0.00 0.00 118 D 9.13 4.60 0.00 2.75 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 0.00 119 G 7.84 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 7.48 4.78 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.08 0.90 0.00 0.00 121 I 8.20 4.49 1.84 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.73 0.93 0.00 0.00 122 S 9.09 4.24 0.00 3.93 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.54 3.82 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 0.00 124 I 7.58 4.27 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 0.93 0.00 0.00 125 N 8.23 4.80 0.00 2.78 2.75 0.00 0.00 6.73 8.06 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 0.00 126 F 8.11 5.42 0.00 2.90 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 0.00 127 K 7.76 4.59 0.00 1.70 1.36 0.00 1.55 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.15 1.24 7.81 128 L 8.42 5.73 0.00 1.65 1.29 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.38 4.87 0.00 2.64 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.37 4.88 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 0.88 0.00 0.00 0.90 0.00 0.00 131 K 8.76 4.69 0.00 1.72 1.64 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.42 7.81 132 K 8.71 4.84 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.48 7.81 133 V 8.80 4.63 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 0.74 0.00 0.00 0.94 0.00 0.00 134 A 8.81 4.22 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 0.00 135 D 8.81 4.69 0.00 2.73 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 0.00 136 P 0.00 4.32 0.00 2.11 2.08 0.00 4.06 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 2.03 2.05 0.00 137 E 8.09 4.34 0.00 1.91 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 2.30 2.24 0.00 138 G 8.86 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 0.00 139 G 8.69 3.80 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 0.00 0.00 0.00 140 E 8.52 5.15 0.00 1.84 1.84 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 2.20 2.31 0.00 141 R 9.66 4.73 0.00 1.71 1.82 0.00 3.11 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 142 A 8.54 4.88 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 0.00 143 V 8.93 4.23 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 0.97 0.00 0.00 0.94 0.00 0.00 144 I 8.40 4.87 1.99 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.81 0.89 0.00 0.00 145 T 8.61 4.54 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 1.17 0.00 0.00 146 L 8.54 4.61 0.00 1.65 1.97 1.02 1.17 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 0.00 147 D 8.59 4.65 0.00 2.55 2.38 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 0.00 148 G 8.48 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 0.00 0.00 0.00 0.00 149 K 8.96 4.33 0.00 2.03 1.70 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.43 7.81 150 Y 8.54 4.75 0.00 2.47 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 0.00 151 L 8.32 4.49 0.00 1.37 1.37 0.85 0.85 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 0.00 152 P 0.00 4.54 0.00 2.08 2.05 0.00 3.55 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.99 0.00 153 T 8.56 4.26 4.27 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 1.26 0.00 0.00 154 K 8.53 4.63 0.00 1.74 1.73 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.44 7.81 155 P 0.00 4.35 0.00 2.02 1.94 0.00 3.64 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 2.03 2.08 0.00 156 F 7.98 4.57 0.00 3.06 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