NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 86 R 4.2550 8.2544 120.8614 55.4071 32.0610 175.3706 87 R 3.7874 8.0061 117.2892 56.1582 30.3931 173.9545 88 Y 4.3610 8.5874 125.1749 58.4766 40.1481 175.9373 89 R 3.8749 6.5757 124.0793 55.4719 31.2899 174.6507 90 T 3.4748 7.7925 123.6431 63.4093 68.8409 174.1041 91 T 4.1968 7.9412 116.8216 59.7836 70.1212 174.3635 92 F 4.7598 8.3203 125.7856 56.6460 40.1320 176.2331 93 T 4.1299 9.0739 116.0956 62.0644 70.3265 175.5008 94 S 4.2032 8.6314 115.3845 60.9134 62.4228 176.2270 95 F 4.3233 8.1954 123.6403 61.3526 39.2876 177.1130 96 Q 3.4531 8.5303 117.7727 58.8986 28.3949 178.1029 97 L 3.4903 7.9453 122.3043 57.4464 42.0171 178.4733 98 E 3.7884 7.6441 119.3743 59.5162 29.6272 178.8655 99 E 3.8181 7.6460 118.3634 58.9132 29.2857 179.4731 100 L 3.3156 7.4437 119.3047 57.6231 41.5733 179.3666 101 E 3.9823 7.6409 118.4201 59.2100 29.0912 179.4361 102 K 3.9518 7.7471 118.8789 59.2506 32.6706 178.5786 103 A 4.1384 7.9330 121.1821 55.1854 18.1842 179.3000 104 F 4.4716 8.5640 119.8308 60.7991 39.3545 177.1739 105 S 4.1362 7.6826 112.8922 62.0385 62.8546 175.8673 106 R 3.9493 7.8700 121.3408 55.9824 29.8369 176.0658 107 T 4.6356 7.0157 107.9346 60.3491 71.6673 174.9045 108 H 4.0298 8.6073 119.3575 57.0621 29.6186 175.3780 109 Y 4.7871 7.4518 116.1226 55.2437 38.0091 173.1371 110 P 4.3825 0.0000 0.0000 62.0117 32.8629 177.6321 111 D 4.5993 8.3171 120.1811 52.8941 41.6365 177.4722 112 V 3.4193 8.1725 119.2362 66.3582 31.3785 178.1310 113 F 4.2032 7.9499 116.7802 60.7119 38.7436 177.6396 114 T 3.8748 8.8062 115.8379 66.6165 68.1810 176.7307 115 R 3.7700 7.8439 119.8642 59.2933 30.1442 178.3874 116 E 3.8596 8.4896 119.1615 59.5272 29.7332 178.1811 117 E 3.9339 8.7253 119.4131 59.4893 29.6948 178.8522 118 L 3.8774 8.3634 120.1876 57.9534 42.2046 178.4718 119 A 3.9948 8.1236 121.1123 55.6361 18.0490 179.3790 120 M 3.9827 7.7967 115.3689 58.6448 32.2315 178.8906 121 K 4.2148 7.7714 117.6717 58.5165 32.2820 177.1388 122 I 4.6658 7.0987 109.0900 59.7294 38.7422 175.0871 123 G 3.9323 8.2997 107.6199 47.5132 0.0000 173.7114 124 L 4.9297 7.6801 116.5417 52.3449 45.9419 176.9725 125 T 4.2718 8.1364 110.0953 61.0032 70.1163 175.2310 126 E 3.9445 8.9814 122.7857 59.7067 29.6180 178.9495 127 A 4.0650 8.0611 120.0269 55.4046 18.4666 179.5843 128 R 4.0693 7.9011 116.2781 59.4043 30.0003 179.3632 129 I 3.9796 7.4324 118.8179 64.1956 37.3624 177.7703 130 Q 4.0350 8.5419 120.9131 59.4726 28.7351 179.0904 131 V 3.6656 7.9681 118.6577 65.5187 31.6713 177.3898 132 W 4.0860 8.2452 128.2178 60.9722 30.4657 177.8677 133 F 3.9711 9.0388 117.4830 60.5021 38.4736 177.6911 134 Q 4.0212 8.1092 117.5379 59.0907 28.6160 178.7029 135 N 4.1657 8.5214 117.4571 56.3990 38.7671 177.3106 136 R 3.1642 7.6034 120.1960 59.4203 29.6999 178.7109 137 R 4.0109 7.8067 117.4138 58.8893 29.5574 178.7352 138 A 3.9647 7.7146 120.3363 55.0361 18.1838 179.1966 139 K 3.8069 7.6996 116.6338 59.8847 32.2806 178.3254 140 W 4.1799 8.1388 117.0107 59.8524 29.0780 178.2261 141 R 4.1124 7.9065 117.8832 59.0320 29.6950 176.3561 142 K 4.1377 7.5847 120.5326 56.9868 32.8820 176.3208 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 86 R 8.25 4.25 0.00 1.80 2.03 0.00 3.24 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 87 R 8.01 3.79 0.00 1.91 1.85 0.00 3.33 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 88 Y 8.59 4.36 0.00 2.87 2.90 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 89 R 6.58 3.87 0.00 1.59 1.54 0.00 3.34 0.00 0.00 3.05 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.47 0.00 90 T 7.79 3.47 3.57 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 0.94 0.00 0.00 91 T 7.94 4.20 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 1.12 0.00 0.00 92 F 8.32 4.76 0.00 3.08 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 93 T 9.07 4.13 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 1.35 0.00 0.00 94 S 8.63 4.20 0.00 3.96 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 95 F 8.20 4.32 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 96 Q 8.53 3.45 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.57 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 97 L 7.95 3.49 0.00 1.97 1.66 1.05 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 98 E 7.64 3.79 0.00 2.16 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 2.26 2.34 0.00 99 E 7.65 3.82 0.00 1.55 1.69 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 1.80 1.72 0.00 100 L 7.44 3.32 0.00 0.36 0.13 -0.67 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 101 E 7.64 3.98 0.00 2.04 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 2.39 2.46 0.00 102 K 7.75 3.95 0.00 1.82 1.91 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.44 7.81 103 A 7.93 4.14 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 0.00 104 F 8.56 4.47 0.00 2.91 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 0.00 105 S 7.68 4.14 0.00 4.10 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 0.00 106 R 7.87 3.95 0.00 1.98 1.89 0.00 3.10 0.00 0.00 3.27 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 107 T 7.02 4.64 4.34 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 1.24 0.00 0.00 108 H 8.61 4.03 0.00 2.93 3.08 0.00 5.84 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 7.45 4.79 0.00 2.96 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 0.00 110 P 0.00 4.38 0.00 1.88 1.82 0.00 3.50 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.57 0.00 111 D 8.32 4.60 0.00 3.06 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 0.00 112 V 8.17 3.42 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 0.81 0.00 0.00 0.76 0.00 0.00 113 F 7.95 4.20 0.00 3.31 3.08 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 0.00 0.00 0.00 114 T 8.81 3.87 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 1.18 0.00 0.00 115 R 7.84 3.77 0.00 1.99 1.90 0.00 3.03 0.00 0.00 2.85 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.62 0.00 116 E 8.49 3.86 0.00 2.05 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 2.33 2.33 0.00 117 E 8.73 3.93 0.00 2.16 2.15 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 2.33 2.36 0.00 118 L 8.36 3.88 0.00 1.96 1.74 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.12 3.99 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 0.00 120 M 7.80 3.98 0.00 2.04 2.31 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 2.66 2.57 0.00 121 K 7.77 4.21 0.00 2.01 1.98 0.00 1.75 0.00 0.00 1.87 0.00 0.00 3.20 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.51 1.62 7.81 122 I 7.10 4.67 1.71 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.79 0.56 0.00 0.00 123 G 8.30 3.93 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 0.00 124 L 7.68 4.93 0.00 1.64 1.63 1.06 1.15 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 0.00 125 T 8.14 4.27 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 1.25 0.00 0.00 126 E 8.98 3.94 0.00 2.01 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 2.35 2.28 0.00 127 A 8.06 4.07 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 0.00 128 R 7.90 4.07 0.00 2.12 2.25 0.00 3.36 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.93 0.00 129 I 7.43 3.98 2.10 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 1.38 0.72 1.06 0.00 0.00 130 Q 8.54 4.04 0.00 2.46 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.84 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 131 V 7.97 3.67 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.05 0.00 0.00 132 W 8.25 4.09 0.00 3.61 3.36 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 0.00 133 F 9.04 3.97 0.00 3.29 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 Q 8.11 4.02 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 135 N 8.52 4.17 0.00 2.50 2.62 0.00 0.00 6.73 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 0.00 136 R 7.60 3.16 0.00 0.67 0.68 0.00 2.21 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 137 R 7.81 4.01 0.00 2.14 1.97 0.00 2.77 0.00 0.00 2.45 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 138 A 7.71 3.96 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 0.00 139 K 7.70 3.81 0.00 1.72 2.17 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.53 7.81 140 W 8.14 4.18 0.00 3.71 3.32 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 0.00 141 R 7.91 4.11 0.00 2.15 2.00 0.00 3.31 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 142 K 7.58 4.14 0.00 1.90 1.77 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.58 1.35 7.81