NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 G 3.9428 8.2133 109.7359 45.6569 0.0000 175.7878 102 R 3.9140 7.9808 117.3254 55.8685 30.1784 174.5972 103 K 4.3100 7.4493 114.5031 55.5992 36.2904 174.4654 104 K 4.0907 8.6798 122.4565 56.2130 32.5857 176.3867 105 I 4.3953 8.1409 119.6228 59.3854 39.5859 174.4457 106 Q 4.6479 8.1645 122.3010 54.3561 30.9285 176.7553 107 I 4.1500 8.0133 125.5288 60.6792 35.0118 174.7263 108 T 4.5879 7.3911 115.6306 60.0669 70.4900 173.2790 109 R 4.0080 8.3829 127.2635 56.3432 30.5305 176.0279 110 I 4.1102 8.2095 125.3927 60.8435 37.7123 177.0777 111 M 3.7613 8.6465 125.5131 57.8847 32.1114 176.7522 112 D 4.4997 7.6201 119.1245 53.6514 41.3570 176.4103 113 E 3.8043 8.7566 126.6034 59.1264 29.2739 178.6134 114 R 3.8521 7.8534 118.1904 59.6027 30.3058 177.9596 115 N 4.3516 8.0928 116.3919 56.3468 38.4905 176.4000 116 R 3.8899 8.9790 121.5722 59.7763 30.2582 178.3164 117 Q 4.1203 8.0419 118.4231 58.7554 28.9822 178.2763 118 V 3.6087 7.4358 119.2324 66.2241 31.7262 177.8965 119 T 3.8769 8.1660 113.0242 65.1027 67.0758 175.8757 120 F 4.1741 8.0479 121.8314 61.6214 39.0152 177.2955 121 T 3.6640 8.0002 115.0978 66.4231 68.1666 176.8466 122 K 3.9814 7.8621 120.0752 59.5452 31.5270 179.6274 123 R 3.8918 7.7673 118.0343 58.8393 29.9121 178.2755 124 K 3.3324 8.0234 119.8664 59.9282 31.8595 178.5206 125 F 3.9334 8.0683 120.0804 60.9814 39.1973 177.7169 126 G 3.5159 7.7559 104.7699 47.2097 0.0000 175.2771 127 L 3.9715 8.8630 123.5454 58.0037 42.1007 178.4858 128 M 3.5439 7.4096 116.8208 58.4111 30.5617 178.3789 129 K 3.5018 7.1822 120.3358 59.1684 32.1757 178.9365 130 K 3.8486 8.9693 119.3384 59.3558 31.8617 178.9911 131 A 3.5448 7.8048 120.5300 55.3400 18.0315 178.9433 132 Y 3.9938 7.1196 119.0512 59.9111 39.0527 177.5902 133 E 3.9023 8.2476 119.6176 59.4592 29.5186 179.1585 134 L 3.9574 8.6025 121.2938 58.0654 42.0087 178.9667 135 S 4.0758 7.7610 113.5203 61.2295 62.1059 176.2896 136 V 3.4668 7.3563 120.1780 65.6553 31.2737 177.7649 137 L 4.1732 7.6576 117.6257 56.7551 41.5928 177.4689 138 A 4.4794 7.4983 117.0520 50.5216 20.9989 174.8000 139 D 4.2564 8.4650 115.1739 54.7876 39.9851 172.2756 140 A 4.4356 7.4317 121.2578 51.0913 20.8368 176.5770 141 E 4.4885 8.4443 119.0724 55.9543 29.9407 176.6880 142 I 4.8497 8.1879 122.2333 59.5748 42.3707 174.6473 143 A 4.7416 8.5964 125.0498 50.4829 21.6860 175.0982 144 L 4.7556 8.7388 124.2518 54.0115 44.5876 175.3424 145 I 5.1526 8.5151 126.2131 59.6491 40.2342 174.9076 146 I 4.8018 8.1621 125.7404 59.5045 41.2618 174.6872 147 F 5.1170 8.7958 122.5404 54.9872 38.7019 174.0639 148 N 4.4922 8.6320 120.1441 53.5608 39.7529 175.9566 149 S 4.3003 8.4855 117.9443 60.7281 63.2741 174.8668 150 S 4.4507 8.1523 116.5139 58.2406 62.6295 172.9336 151 N 4.0928 8.3217 120.7399 53.3928 36.5314 172.2757 152 K 4.4448 7.6353 120.1258 54.8733 35.7337 173.9188 153 L 4.8040 8.4917 130.0246 52.7594 43.3284 175.2125 154 F 4.5843 8.4937 127.3740 56.3136 42.8632 172.8112 155 Q 5.0802 8.4198 126.3757 54.5202 31.4096 173.4880 156 Y 4.8771 8.8292 126.6018 55.8766 42.3635 174.2817 157 A 4.7806 7.3428 126.9595 51.1752 21.3763 176.3027 158 S 4.1197 8.3097 119.0470 59.6448 64.1179 175.0499 159 T 4.3064 7.6190 115.0946 61.7483 67.9342 171.9802 160 D 4.0412 8.3108 119.8000 54.0599 40.0426 173.3385 161 M 4.1803 8.3757 125.5425 57.6522 31.9042 176.7627 162 D 4.4052 8.4310 118.6507 57.8132 40.5714 178.5773 163 K 4.0139 8.0421 118.6142 60.0432 32.8818 179.0998 164 V 3.9912 7.9856 119.4151 65.8613 30.9984 177.8037 165 L 4.0162 7.8277 117.8052 57.8248 41.3455 179.3157 166 L 4.0180 7.2353 118.8610 57.9500 42.4447 178.3866 167 K 4.0242 9.3698 119.9884 59.9073 32.2389 177.8770 168 Y 4.3366 8.1963 119.6065 61.3570 38.4544 178.5258 169 T 4.0210 7.6629 115.4562 66.3377 68.7421 176.1767 170 E 4.0343 8.5743 121.3446 59.4395 29.2657 178.7601 171 Y 4.0157 7.5934 115.3235 60.5061 38.1061 176.9603 172 N 4.3481 7.6673 116.3843 54.0912 39.5399 174.4629 173 E 4.2723 7.2450 121.3378 54.8053 30.6789 174.2356 174 P 4.4147 0.0000 0.0000 63.1170 31.3896 176.0677 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 101 G 8.21 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 0.00 102 R 7.98 3.91 0.00 1.89 2.01 0.00 3.41 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 103 K 7.45 4.31 0.00 1.80 1.72 0.00 1.49 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.27 1.34 7.81 104 K 8.68 4.09 0.00 1.74 1.76 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.42 7.81 105 I 8.14 4.40 1.88 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 0.78 0.97 0.00 0.00 106 Q 8.16 4.65 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.50 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 107 I 8.01 4.15 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 1.30 0.92 0.92 0.00 0.00 108 T 7.39 4.59 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 1.28 0.00 0.00 109 R 8.38 4.01 0.00 1.81 1.82 0.00 3.27 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 110 I 8.21 4.11 1.89 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 1.43 0.72 0.95 0.00 0.00 111 M 8.65 3.76 0.00 2.01 2.14 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 2.61 2.56 0.00 112 D 7.62 4.50 0.00 2.52 2.64 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 0.00 113 E 8.76 3.80 0.00 2.03 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 2.38 2.37 0.00 114 R 7.85 3.85 0.00 1.92 1.91 0.00 3.24 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 115 N 8.09 4.35 0.00 2.88 2.80 0.00 0.00 6.74 7.66 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 0.00 116 R 8.98 3.89 0.00 2.10 2.09 0.00 3.13 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 117 Q 8.04 4.12 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.63 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 118 V 7.44 3.61 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 0.90 0.00 0.00 0.98 0.00 0.00 119 T 8.17 3.88 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 1.37 0.00 0.00 120 F 8.05 4.17 0.00 3.23 3.13 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 0.00 121 T 8.00 3.66 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 1.21 0.00 0.00 122 K 7.86 3.98 0.00 1.90 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.65 1.62 7.81 123 R 7.77 3.89 0.00 1.64 1.86 0.00 3.26 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 124 K 8.02 3.33 0.00 0.99 1.50 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.21 1.07 7.81 125 F 8.07 3.93 0.00 3.10 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 0.00 126 G 7.76 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 0.00 127 L 8.86 3.97 0.00 1.71 1.44 0.86 0.76 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 0.00 128 M 7.41 3.54 0.00 1.59 1.55 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 2.13 0.00 129 K 7.18 3.50 0.00 1.43 1.83 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.32 7.81 130 K 8.97 3.85 0.00 1.73 1.76 0.00 1.56 0.00 0.00 1.55 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.43 7.81 131 A 7.80 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Y 7.12 3.99 0.00 2.67 2.93 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 0.00 133 E 8.25 3.90 0.00 2.02 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 2.41 2.56 0.00 134 L 8.60 3.96 0.00 1.66 1.72 0.90 -0.22 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 0.00 135 S 7.76 4.08 0.00 4.07 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 0.00 136 V 7.36 3.47 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 0.78 0.00 0.00 0.46 0.00 0.00 137 L 7.66 4.17 0.00 1.66 1.69 0.90 0.54 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 0.00 138 A 7.50 4.48 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 0.00 139 D 8.46 4.26 0.00 2.64 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 0.00 140 A 7.43 4.44 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 0.00 141 E 8.44 4.49 0.00 1.89 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 2.30 2.30 0.00 142 I 8.19 4.85 1.97 0.00 0.00 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 1.19 1.16 0.96 0.00 0.00 143 A 8.60 4.74 1.21 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 0.00 0.00 144 L 8.74 4.76 0.00 1.83 1.66 0.93 0.73 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 0.00 145 I 8.52 5.15 2.08 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 1.39 0.85 0.78 0.00 0.00 146 I 8.16 4.80 1.92 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 1.30 1.30 1.15 0.00 0.00 147 F 8.80 5.12 0.00 2.83 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 0.00 148 N 8.63 4.49 0.00 3.14 2.85 0.00 0.00 7.21 7.81 0.00 0.00 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 S 8.49 4.30 0.00 4.00 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 0.00 150 S 8.15 4.45 0.00 4.00 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 0.00 151 N 8.32 4.09 0.00 2.91 2.89 0.00 0.00 6.80 6.67 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 0.00 152 K 7.64 4.44 0.00 1.90 1.70 0.00 1.90 0.00 0.00 1.96 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.53 7.81 153 L 8.49 4.80 0.00 1.57 1.45 0.10 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 154 F 8.49 4.58 0.00 3.14 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 0.00 155 Q 8.42 5.08 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.44 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 156 Y 8.83 4.88 0.00 3.46 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 0.00 157 A 7.34 4.78 1.13 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 0.00 0.00 158 S 8.31 4.12 0.00 3.92 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 0.00 159 T 7.62 4.31 4.50 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 1.24 0.00 0.00 160 D 8.31 4.04 0.00 2.88 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 0.00 161 M 8.38 4.18 0.00 2.11 2.04 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 2.68 2.61 0.00 162 D 8.43 4.41 0.00 2.98 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 0.00 163 K 8.04 4.01 0.00 2.09 2.06 0.00 1.44 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.61 1.50 7.81 164 V 7.99 3.99 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 1.03 0.00 0.00 0.98 0.00 0.00 165 L 7.83 4.02 0.00 1.77 1.74 0.94 0.78 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 0.00 166 L 7.24 4.02 0.00 1.66 1.71 0.93 0.65 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 0.00 167 K 9.37 4.02 0.00 2.03 1.94 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.61 1.64 7.81 168 Y 8.20 4.34 0.00 3.24 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 0.00 169 T 7.66 4.02 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 1.24 0.00 0.00 170 E 8.57 4.03 0.00 1.84 1.72 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 2.25 2.50 0.00 171 Y 7.59 4.02 0.00 2.83 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 N 7.67 4.35 0.00 2.52 2.77 0.00 0.00 7.24 7.73 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 0.00 173 E 7.25 4.27 0.00 2.18 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 2.27 2.22 0.00 174 P 0.00 4.41 0.00 2.21 2.01 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00