NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 102 R 4.3696 8.1548 120.2374 56.4251 31.3713 174.5140 103 R 4.6189 7.5552 117.8797 50.8468 35.4334 173.7277 104 P 4.5287 0.0000 0.0000 66.5533 31.3244 178.0879 105 E 4.0442 8.2641 116.8763 59.0931 29.2428 178.9306 106 E 3.8842 8.0752 118.8896 58.9955 29.5662 178.9206 107 W 4.5742 8.4924 119.5671 59.7994 29.1021 178.6315 108 G 3.7370 8.6093 105.9410 47.8739 0.0000 175.3278 109 K 3.9602 8.3346 123.0109 59.2837 32.0488 178.7728 110 L 4.1533 8.2253 119.0308 57.8733 41.5973 179.5809 111 I 3.0446 8.0347 120.0439 64.3595 37.1046 177.9505 112 Y 3.7841 8.2140 120.4171 60.3042 38.5081 177.3408 113 Q 3.9720 8.1956 120.7234 59.1111 28.9086 178.4363 114 W 4.0566 7.7997 127.8007 60.3123 30.8594 177.8509 115 V 3.0468 7.3870 117.4220 65.8646 30.8607 177.9566 116 S 4.2403 7.1412 113.5473 60.4126 63.0443 175.2432 117 R 3.7314 7.7182 127.8996 58.7482 28.6143 175.6964 118 S 4.2389 8.0846 124.4371 57.9815 62.0025 170.0517 119 G 3.4640 6.1367 109.8163 45.8696 0.0000 173.3047 120 Q 4.4589 7.3141 114.3500 55.9259 30.4502 177.4455 121 N 4.4203 8.1242 115.9619 56.2892 38.8116 175.4021 122 N 4.4651 7.8357 113.9691 53.1143 39.4541 174.9654 123 S 4.7346 8.3849 116.4229 58.5950 65.7614 173.7369 124 V 4.7404 7.4076 119.3012 60.9899 33.0797 175.0229 125 F 5.3291 9.2821 126.3847 55.6709 42.9695 175.0704 126 T 4.7057 8.9840 112.3571 60.7837 69.2458 174.7807 127 L 4.1520 8.6444 122.9165 58.2688 42.3252 178.9606 128 Y 4.1348 8.4046 119.0600 60.8835 38.7172 178.1419 129 E 4.3311 8.3929 117.8038 59.1202 29.4574 178.9746 130 L 3.9506 7.5924 118.8568 57.1108 41.9422 178.3948 131 T 4.2775 7.6398 107.9306 61.7452 69.8181 175.2337 132 N 4.4223 7.7940 116.0995 52.1992 39.9566 174.4967 133 G 3.9577 7.3945 108.0576 44.7661 0.0000 173.9250 134 E 4.4360 8.6034 116.8423 58.6059 29.7109 179.2529 135 D 4.5791 8.1747 116.5756 56.5367 41.3599 176.7470 136 T 3.8504 7.5067 111.9354 61.2299 67.4499 175.1352 137 E 3.2832 7.8556 121.4004 59.1897 29.4693 178.0916 138 D 4.6493 7.6084 115.2306 53.9812 41.7889 176.3485 139 E 4.0701 7.4142 120.0089 55.3467 30.0719 177.7493 140 E 4.0784 8.5457 120.6806 58.9358 29.9150 178.0396 141 F 4.5068 7.3403 112.0057 56.5079 38.7139 175.1727 142 H 4.1227 7.4218 121.9448 57.4711 30.0058 175.9839 143 G 3.8739 8.5287 113.1650 45.4790 0.0000 174.0062 144 L 3.6022 7.1782 121.5328 55.2458 42.5720 177.1732 145 D 4.4706 8.2590 125.2349 53.1066 41.4558 176.9703 146 E 3.8518 8.6955 121.4372 59.4303 29.5211 179.0193 147 A 3.9674 7.8904 120.2125 55.6948 18.4986 179.6475 148 T 3.8738 8.2057 114.1304 66.2865 68.4549 176.9240 149 L 3.8085 7.8316 122.3794 58.1922 42.0152 179.0727 150 L 3.9721 8.2809 119.2319 57.9708 41.6555 179.8190 151 R 4.0885 7.8703 117.8231 58.9012 30.0259 178.9849 152 A 4.1740 8.1972 120.8385 55.3445 18.4646 179.7726 153 L 4.0547 8.1707 117.5752 57.8808 41.6175 179.8151 154 Q 4.0069 8.4505 118.2557 58.7898 28.4079 178.5182 155 A 4.0034 7.6987 120.4252 54.9968 18.7005 179.3622 156 L 4.0399 7.8496 117.2299 58.1112 41.7712 179.3150 157 Q 4.7896 8.5121 120.9748 58.9911 28.6682 178.6742 158 Q 3.9749 8.0442 117.7014 58.4696 28.5180 177.7251 159 E 4.2671 7.8948 117.7161 55.8195 29.3981 176.9326 160 H 4.4455 7.7325 114.6607 56.4963 26.9660 175.5815 161 K 4.6107 7.5721 118.2092 57.4011 33.0306 176.2476 162 A 5.0707 7.7569 120.4402 50.8991 22.7482 174.7290 163 E 5.1295 9.3149 121.6149 54.4847 32.7695 174.8577 164 I 4.4647 8.8737 128.2530 60.8303 38.6653 175.3301 165 I 4.5096 9.1582 128.4500 60.0208 38.6736 176.3070 166 T 4.4469 8.5423 116.1312 61.1325 69.9334 175.1009 167 V 3.7811 7.5247 117.2027 61.4966 32.1304 177.3915 168 S 4.1876 8.6922 120.5522 61.5059 62.8266 175.0856 169 D 4.5516 8.1657 117.3493 53.7850 39.7995 176.5134 170 G 4.5653 7.1272 108.9223 46.0154 0.0000 173.0305 171 R 4.4160 7.3636 122.1494 55.4430 32.1223 177.6176 172 G 4.5221 7.9913 107.4102 46.3876 0.0000 171.2558 173 V 4.7799 8.0686 119.6819 60.2220 35.3179 173.7324 174 K 4.8498 8.8573 124.9795 54.7337 34.3999 174.7552 175 F 5.1849 8.7537 125.8612 56.0113 41.0953 175.9841 176 F 4.6728 8.9810 119.7869 57.7969 39.1116 175.0741 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 102 R 8.15 4.37 0.00 1.49 1.77 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.89 0.00 103 R 7.56 4.62 0.00 1.94 1.75 0.00 3.38 0.00 0.00 3.35 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 104 P 0.00 4.53 0.00 2.33 2.43 0.00 3.77 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 105 E 8.26 4.04 0.00 2.19 2.27 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 2.36 2.35 0.00 106 E 8.08 3.88 0.00 2.11 1.79 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 2.32 2.33 0.00 107 W 8.49 4.57 0.00 3.51 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 0.00 108 G 8.61 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 0.00 0.00 0.00 109 K 8.33 3.96 0.00 1.94 2.06 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.55 7.81 110 L 8.23 4.15 0.00 2.17 2.04 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.03 3.04 1.72 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 0.11 0.51 0.00 0.00 112 Y 8.21 3.78 0.00 3.20 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 0.00 113 Q 8.20 3.97 0.00 2.60 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.59 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 114 W 7.80 4.06 0.00 3.54 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 0.00 115 V 7.39 3.05 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 0.63 0.00 0.00 -0.10 0.00 0.00 116 S 7.14 4.24 0.00 3.67 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 0.00 117 R 7.72 3.73 0.00 1.75 1.86 0.00 3.17 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 118 S 8.08 4.24 0.00 3.83 3.84 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 0.00 119 G 6.14 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 0.00 0.00 0.00 120 Q 7.31 4.46 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.70 7.00 0.00 0.00 0.00 0.00 0.00 2.20 2.39 0.00 121 N 8.12 4.42 0.00 2.67 2.84 0.00 0.00 7.04 8.00 0.00 0.00 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 N 7.84 4.47 0.00 2.04 1.94 0.00 0.00 6.78 7.57 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 0.00 123 S 8.38 4.73 0.00 3.69 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 0.00 124 V 7.41 4.74 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 0.77 0.00 0.00 0.86 0.00 0.00 125 F 9.28 5.33 0.00 3.23 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 0.00 126 T 8.98 4.71 4.35 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 1.28 0.00 0.00 127 L 8.64 4.15 0.00 1.79 1.79 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 128 Y 8.40 4.13 0.00 3.05 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 0.00 129 E 8.39 4.33 0.00 2.41 2.39 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 2.74 2.65 0.00 130 L 7.59 3.95 0.00 1.84 1.71 1.04 0.42 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 0.00 131 T 7.64 4.28 4.08 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 1.21 0.00 0.00 132 N 7.79 4.42 0.00 1.44 2.30 0.00 0.00 6.97 7.69 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 0.00 133 G 7.39 3.96 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 0.00 134 E 8.60 4.44 0.00 2.09 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 2.56 2.32 0.00 135 D 8.17 4.58 0.00 2.98 3.15 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 0.00 136 T 7.51 3.85 3.16 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 1.09 0.00 0.00 137 E 7.86 3.28 0.00 2.07 1.79 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 1.99 2.50 0.00 138 D 7.61 4.65 0.00 2.58 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 0.00 139 E 7.41 4.07 0.00 1.33 1.12 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 1.55 2.00 0.00 140 E 8.55 4.08 0.00 2.17 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 0.00 2.34 2.32 0.00 141 F 7.34 4.51 0.00 3.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 H 7.42 4.12 0.00 3.09 3.07 0.00 5.84 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 0.00 143 G 8.53 3.87 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 0.00 0.00 0.00 144 L 7.18 3.60 0.00 1.61 1.30 0.29 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 145 D 8.26 4.47 0.00 2.85 2.71 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 0.00 0.00 0.00 146 E 8.70 3.85 0.00 2.04 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 2.37 2.39 0.00 147 A 7.89 3.97 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 0.00 148 T 8.21 3.87 4.12 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 1.12 0.00 0.00 149 L 7.83 3.81 0.00 1.68 1.83 0.80 0.38 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 0.00 150 L 8.28 3.97 0.00 1.78 1.70 1.02 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 151 R 7.87 4.09 0.00 1.94 2.01 0.00 3.31 0.00 0.00 3.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.80 0.00 152 A 8.20 4.17 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 0.00 153 L 8.17 4.05 0.00 2.00 1.71 1.03 0.89 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 0.00 154 Q 8.45 4.01 0.00 2.24 2.15 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 2.38 2.46 0.00 155 A 7.70 4.00 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 0.00 156 L 7.85 4.04 0.00 2.04 1.80 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 157 Q 8.51 4.79 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 158 Q 8.04 3.97 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 159 E 7.89 4.27 0.00 2.08 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 2.23 2.40 0.00 160 H 7.73 4.45 0.00 3.32 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 K 7.57 4.61 0.00 1.54 1.50 0.00 1.25 0.00 0.00 0.61 0.00 0.00 2.67 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 1.39 7.81 162 A 7.76 5.07 1.12 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 0.00 0.00 163 E 9.31 5.13 0.00 2.33 2.04 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 2.25 2.32 0.00 164 I 8.87 4.46 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 1.18 0.63 0.90 0.00 0.00 165 I 9.16 4.51 1.88 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 1.30 0.50 0.98 0.00 0.00 166 T 8.54 4.45 4.24 0.00 0.00 0.00 0.00 0.00 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 0.00 167 V 7.52 3.78 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 0.74 0.00 0.00 0.97 0.00 0.00 168 S 8.69 4.19 0.00 3.85 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 0.00 169 D 8.17 4.55 0.00 2.78 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 0.00 170 G 7.13 4.57 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 0.00 0.00 0.00 171 R 7.36 4.42 0.00 1.91 1.87 0.00 3.28 0.00 0.00 3.35 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 172 G 7.99 4.52 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 0.00 173 V 8.07 4.78 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 0.71 0.00 0.00 0.40 0.00 0.00 174 K 8.86 4.85 0.00 1.69 1.45 0.00 1.55 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.30 1.22 7.81 175 F 8.75 5.18 0.00 2.99 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 F 8.98 4.67 0.00 3.18 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