#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d69 n VAL 2 N 0.00 0.51 -3.64 1.61 0.31 -1.26 -3.87 118.33 111.98 3d69 n VAL 2 Ca 0.00 -0.50 -0.03 0.00 -0.01 0.00 0.00 64.34 63.80 3d69 n VAL 2 Cb 0.00 -0.13 -0.07 0.00 -0.91 0.00 0.00 33.84 32.73 3d69 n VAL 2 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3d69 s GLN 3 N -1.20 0.44 -0.11 5.55 -1.52 -1.05 -4.86 119.66 116.91 3d69 s GLN 3 Ca 0.59 0.76 -0.05 0.00 -1.95 0.00 0.00 55.36 54.72 3d69 s GLN 3 Cb -0.51 0.09 0.05 0.00 -0.22 0.00 0.00 33.01 32.42 3d69 s GLN 3 CO 0.63 -0.09 0.23 -0.51 -0.25 0.00 0.00 175.29 175.31 3d69 s LEU 4 N 1.40 0.04 -0.05 2.90 1.43 -1.26 -1.42 118.68 121.72 3d69 s LEU 4 Ca -0.09 0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 53.52 3d69 s LEU 4 Cb -0.04 0.63 0.03 0.00 0.03 0.00 0.00 46.19 46.84 3d69 s LEU 4 CO -0.16 -0.21 0.01 0.68 0.23 0.00 0.00 176.35 176.90 3d69 s VAL 5 N 1.93 0.22 0.39 -1.59 -7.23 -1.08 -4.40 120.40 108.64 3d69 s VAL 5 Ca -0.03 0.14 -0.02 0.00 -1.81 0.00 0.00 61.98 60.26 3d69 s VAL 5 Cb -0.11 -0.36 -0.04 0.00 0.56 0.00 0.00 36.38 36.43 3d69 s VAL 5 CO -0.08 0.19 0.63 -1.61 -0.31 0.00 0.00 175.10 173.92 3d69 s GLU 6 N 1.50 3.51 0.13 4.82 8.01 -1.26 -2.16 118.70 133.25 3d69 s GLU 6 Ca -0.03 -0.14 -0.24 0.00 0.01 0.00 0.00 54.97 54.57 3d69 s GLU 6 Cb -0.13 -2.56 0.07 0.00 -4.31 0.00 0.00 34.13 27.20 3d69 s GLU 6 CO -0.03 0.03 0.63 -1.12 0.01 0.00 0.00 175.26 174.78 3d69 s SER 7 N -4.02 -0.56 0.00 -0.19 0.01 -0.51 -4.80 113.70 103.63 3d69 s SER 7 Ca 0.43 0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.76 3d69 s SER 7 Cb -0.10 0.58 0.00 0.00 0.21 0.00 0.00 66.02 66.71 3d69 s SER 7 CO 0.39 -0.91 0.00 0.61 0.41 0.00 0.00 173.24 173.74 3d69 n GLY 8 N -0.24 1.55 3.83 3.44 0.00 -1.26 -0.67 105.19 111.83 3d69 n GLY 8 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 3d69 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d69 s GLY 9 N -2.00 2.09 0.00 -0.02 0.00 -1.26 -4.66 107.32 101.46 3d69 s GLY 9 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 44.04 3d69 s GLY 9 CO 0.00 -0.38 0.00 0.61 0.00 0.00 0.00 173.10 173.33 3d69 n GLY 10 N 2.12 1.28 3.15 0.20 0.00 -0.93 -4.87 105.19 106.14 3d69 n GLY 10 Ca -0.19 0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 3d69 n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d69 s VAL 11 N 1.57 1.46 -0.02 1.61 1.01 -1.26 0.26 120.40 125.03 3d69 s VAL 11 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3d69 s VAL 11 Cb 0.00 -1.24 0.02 0.00 0.00 0.00 0.00 36.38 35.16 3d69 s VAL 11 CO 0.00 0.42 0.01 0.68 0.00 0.00 0.00 175.10 176.21 3d69 s VAL 12 N -0.11 0.02 0.80 2.92 -7.23 0.26 -4.94 120.40 112.12 3d69 s VAL 12 Ca -0.01 0.12 -0.13 0.00 -1.81 0.00 0.00 61.98 60.15 3d69 s VAL 12 Cb -0.10 -0.11 0.08 0.00 0.56 0.00 0.00 36.38 36.81 3d69 s VAL 12 CO 0.01 0.08 1.20 -1.10 -0.31 0.00 0.00 175.10 174.97 3d69 s GLN 13 N 0.72 1.70 0.46 4.82 -0.21 -0.99 -0.84 119.66 125.31 3d69 s GLN 13 Ca -0.06 1.71 -0.22 0.00 0.02 0.00 0.00 55.36 56.81 3d69 s GLN 13 Cb -0.09 -1.79 -0.10 0.00 1.00 0.00 0.00 33.01 32.03 3d69 s GLN 13 CO -0.02 -2.16 0.77 -2.30 -2.12 0.00 0.00 175.29 169.46 3d69 n PRO 14 N -3.29 0.89 -0.62 2.91 -0.02 -1.26 -2.44 135.00 131.17 3d69 n PRO 14 Ca 0.13 0.33 -0.01 0.00 -2.02 0.00 0.00 63.50 61.93 3d69 n PRO 14 Cb 0.51 -1.81 -0.00 0.00 -0.02 0.00 0.00 33.50 32.17 3d69 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d69 n GLY 15 N 1.50 0.10 0.00 -1.23 0.00 -1.00 -4.82 105.19 99.74 3d69 n GLY 15 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3d69 n GLY 15 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3d69 n ARG 16 N 0.33 3.87 -4.09 1.61 3.00 -1.02 -3.59 116.66 116.77 3d69 n ARG 16 Ca -0.01 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.77 3d69 n ARG 16 Cb 0.28 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.64 3d69 n ARG 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3d69 s SER 17 N -1.06 0.52 0.00 6.15 0.15 -1.26 -1.53 113.70 116.67 3d69 s SER 17 Ca 0.00 -0.96 0.00 0.00 0.70 0.00 0.00 55.95 55.69 3d69 s SER 17 Cb 0.00 0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 3d69 s SER 17 CO 0.00 -0.57 0.00 -0.11 1.20 0.00 0.00 173.24 173.76 3d69 n LEU 18 N 0.21 0.00 -3.99 3.45 7.94 -0.99 -5.01 117.00 118.60 3d69 n LEU 18 Ca -0.15 0.00 -0.22 0.00 -1.11 0.00 0.00 56.01 54.54 3d69 n LEU 18 Cb 0.61 0.00 -0.16 0.00 0.53 0.00 0.00 43.42 44.40 3d69 n LEU 18 CO 0.28 0.00 -0.44 0.00 -1.11 0.00 0.00 177.39 176.11 3d69 s ARG 19 N -0.68 1.17 0.31 1.96 1.04 -1.26 -1.83 118.95 119.65 3d69 s ARG 19 Ca 0.00 -0.31 0.01 0.00 -1.04 0.00 0.00 55.73 54.38 3d69 s ARG 19 Cb 0.00 -1.05 -0.03 0.00 -2.04 0.00 0.00 34.95 31.83 3d69 s ARG 19 CO 0.00 0.07 0.50 -0.51 -0.04 0.00 0.00 175.30 175.31 3d69 s LEU 20 N 0.43 4.09 -0.02 -1.89 1.43 -0.45 -4.73 118.68 117.54 3d69 s LEU 20 Ca -0.08 0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 3d69 s LEU 20 Cb -0.12 -3.24 0.03 0.00 0.03 0.00 0.00 46.19 42.89 3d69 s LEU 20 CO 0.01 -0.22 0.02 -0.94 0.23 0.00 0.00 176.35 175.45 3d69 s SER 21 N -3.86 0.08 -0.19 2.29 1.04 0.15 -2.53 113.70 110.69 3d69 s SER 21 Ca 0.39 0.03 -0.02 0.00 0.48 0.00 0.00 55.95 56.83 3d69 s SER 21 Cb -0.10 -0.07 -0.01 0.00 0.10 0.00 0.00 66.02 65.95 3d69 s SER 21 CO 0.34 -0.11 -0.08 0.00 0.98 0.00 0.00 173.24 174.37 3d69 s ALA 23 N 1.12 3.65 0.32 0.00 0.00 -0.92 0.94 121.76 126.88 3d69 s ALA 23 Ca 0.01 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.30 3d69 s ALA 23 Cb -0.14 -2.25 -0.02 0.00 0.00 0.00 0.00 23.12 20.71 3d69 s ALA 23 CO -0.02 0.02 0.40 0.00 0.00 0.00 0.00 175.76 176.17 3d69 s ALA 24 N 0.63 4.08 0.06 0.00 0.00 -1.04 -2.64 121.76 122.86 3d69 s ALA 24 Ca 0.09 -1.48 -0.27 0.00 0.00 0.00 0.00 51.96 50.30 3d69 s ALA 24 Cb -0.12 -1.55 0.09 0.00 0.00 0.00 0.00 23.12 21.54 3d69 s ALA 24 CO 0.01 0.02 0.83 0.45 0.00 0.00 0.00 175.76 177.07 3d69 s SER 25 N -4.09 -0.38 -0.05 0.00 0.15 -0.51 -4.93 113.70 103.88 3d69 s SER 25 Ca 0.42 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.99 3d69 s SER 25 Cb -0.08 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 3d69 s SER 25 CO 0.29 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.58 3d69 n GLY 26 N -0.31 0.46 3.82 9.45 0.00 -1.25 -2.52 105.19 114.84 3d69 n GLY 26 Ca -0.10 -0.16 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 3d69 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3d69 s PHE 27 N -1.90 -0.03 -1.45 1.61 -0.71 -1.26 -4.38 117.98 109.86 3d69 s PHE 27 Ca 0.00 -0.43 -0.14 0.00 -1.04 0.00 0.00 56.93 55.32 3d69 s PHE 27 Cb 0.00 0.72 0.05 0.00 -1.21 0.00 0.00 43.02 42.58 3d69 s PHE 27 CO 0.00 -1.15 2.21 0.25 -1.34 0.00 0.00 175.22 175.20 3d69 n THR 28 N -0.54 3.53 -0.33 -4.49 -2.24 -1.26 -4.68 114.28 104.28 3d69 n THR 28 Ca -0.06 -3.11 0.34 0.00 -2.27 0.00 0.00 64.05 58.96 3d69 n THR 28 Cb 0.60 -2.59 0.73 0.00 -2.10 0.00 0.00 70.33 66.97 3d69 n THR 28 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3d69 h PHE 29 N 5.96 0.07 0.00 4.78 3.57 -1.95 0.32 116.94 129.69 3d69 h PHE 29 Ca 0.56 0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.06 3d69 h PHE 29 Cb 0.63 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.35 3d69 h PHE 29 CO 1.45 0.00 0.01 0.77 -2.23 0.00 0.00 178.31 178.32 3d69 h SER 30 N 0.04 0.00 0.00 0.41 0.02 -1.89 -2.85 113.55 109.27 3d69 h SER 30 Ca 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.52 3d69 h SER 30 Cb 2.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.75 3d69 h SER 30 CO -0.04 0.00 -0.85 0.35 -1.14 0.00 0.00 176.83 175.15 3d69 n THR 31 N -2.73 0.00 -3.34 -2.27 -2.24 0.11 -4.58 114.28 99.23 3d69 n THR 31 Ca -0.02 -0.24 -0.35 0.00 -2.27 0.00 0.00 64.05 61.16 3d69 n THR 31 Cb 0.07 0.65 -0.06 0.00 -2.10 0.00 0.00 70.33 68.89 3d69 n THR 31 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3d69 s TYR 32 N -2.09 3.60 0.84 4.78 2.02 -1.08 -4.68 117.35 120.74 3d69 s TYR 32 Ca -0.00 1.07 -0.12 0.00 -0.37 0.00 0.00 57.07 57.65 3d69 s TYR 32 Cb 0.05 -2.38 0.10 0.00 -0.40 0.00 0.00 41.96 39.33 3d69 s TYR 32 CO 0.29 0.41 1.18 0.00 -1.57 0.00 0.00 175.55 175.86 3d69 s ALA 33 N -1.49 2.46 0.05 3.71 0.00 -1.26 -4.19 121.76 121.03 3d69 s ALA 33 Ca 0.39 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.70 3d69 s ALA 33 Cb -0.15 -2.96 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 3d69 s ALA 33 CO 0.19 -1.85 -0.07 -1.64 0.00 0.00 0.00 175.76 172.40 3d69 s MET 34 N -5.55 0.55 0.33 0.00 1.00 -0.58 -2.49 119.30 112.57 3d69 s MET 34 Ca 0.63 -0.84 0.08 0.00 0.00 0.00 0.00 55.69 55.56 3d69 s MET 34 Cb -0.11 -0.22 -0.06 0.00 0.00 0.00 0.00 34.83 34.43 3d69 s MET 34 CO 0.50 0.02 -0.07 -1.01 0.00 0.00 0.00 175.02 174.47 3d69 s HIS 35 N -1.80 2.28 -0.04 -0.03 3.76 0.33 -1.63 115.29 118.15 3d69 s HIS 35 Ca -0.07 -0.59 -0.01 0.00 -0.15 0.00 0.00 55.06 54.24 3d69 s HIS 35 Cb -0.07 -1.35 0.03 0.00 1.11 0.00 0.00 32.58 32.30 3d69 s HIS 35 CO -0.01 0.47 0.05 -1.58 -0.85 0.00 0.00 174.74 172.81 3d69 s TRP 36 N -2.76 0.12 -0.09 1.40 0.23 -1.09 -2.17 118.94 114.60 3d69 s TRP 36 Ca 0.32 0.18 -0.01 0.00 -2.03 0.00 0.00 56.10 54.56 3d69 s TRP 36 Cb 0.04 -0.46 0.03 0.00 0.03 0.00 0.00 33.47 33.11 3d69 s TRP 36 CO 0.15 -0.18 -0.03 0.08 0.96 0.00 0.00 176.95 177.93 3d69 s VAL 37 N 1.86 0.64 0.32 4.03 1.01 -0.71 -0.61 120.40 126.93 3d69 s VAL 37 Ca 0.01 -0.05 0.06 0.00 0.00 0.00 0.00 61.98 62.01 3d69 s VAL 37 Cb -0.12 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 3d69 s VAL 37 CO -0.03 0.30 0.43 0.00 0.00 0.00 0.00 175.10 175.80 3d69 s ARG 38 N 1.83 3.13 -0.25 2.72 1.70 -0.47 -0.33 118.95 127.28 3d69 s ARG 38 Ca 0.04 -1.00 -0.02 0.00 -0.47 0.00 0.00 55.73 54.29 3d69 s ARG 38 Cb -0.12 -2.80 0.13 0.00 -0.57 0.00 0.00 34.95 31.59 3d69 s ARG 38 CO -0.06 0.14 0.32 -1.14 -1.08 0.00 0.00 175.30 173.48 3d69 s GLN 39 N -4.12 0.31 1.14 3.89 0.74 0.64 -1.00 119.66 121.27 3d69 s GLN 39 Ca 0.42 0.23 -0.12 0.00 0.05 0.00 0.00 55.36 55.94 3d69 s GLN 39 Cb -0.09 -0.69 0.27 0.00 1.10 0.00 0.00 33.01 33.61 3d69 s GLN 39 CO 0.30 -0.79 1.04 0.00 -0.55 0.00 0.00 175.29 175.29 3d69 s ALA 40 N 2.44 -0.30 -0.22 1.58 0.00 -1.26 -1.60 121.76 122.40 3d69 s ALA 40 Ca 0.10 -0.05 -0.34 0.00 0.00 0.00 0.00 51.96 51.68 3d69 s ALA 40 Cb -0.15 -3.27 -0.11 0.00 0.00 0.00 0.00 23.12 19.59 3d69 s ALA 40 CO -0.21 -3.76 2.05 -2.30 0.00 0.00 0.00 175.76 171.54 3d69 n PRO 41 N -4.87 1.66 0.00 0.00 -0.02 -1.26 -2.76 135.00 127.75 3d69 n PRO 41 Ca 0.04 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3d69 n PRO 41 Cb 0.54 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 3d69 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d69 n GLY 42 N 5.43 0.44 3.32 -1.23 0.00 -1.26 -4.93 105.19 106.96 3d69 n GLY 42 Ca 0.31 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.00 3d69 n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d69 n LYS 43 N 0.00 -0.27 -1.01 1.61 4.76 -1.11 -4.95 118.16 117.19 3d69 n LYS 43 Ca 0.00 -0.05 -0.29 0.00 -2.87 0.00 0.00 58.31 55.10 3d69 n LYS 43 Cb 0.00 -1.67 0.22 0.00 -1.84 0.00 0.00 35.03 31.74 3d69 n LYS 43 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3d69 s GLY 44 N -1.80 1.56 0.77 0.72 0.00 -1.26 -4.34 107.32 102.97 3d69 s GLY 44 Ca 0.53 -0.67 -0.11 0.00 0.00 0.00 0.00 44.72 44.48 3d69 s GLY 44 CO 0.71 0.12 1.09 1.08 0.00 0.00 0.00 173.10 176.09 3d69 s LEU 45 N -6.88 2.98 -0.08 0.66 1.43 -1.26 -4.27 118.68 111.27 3d69 s LEU 45 Ca 0.69 1.77 -0.04 0.00 -1.03 0.00 0.00 54.13 55.52 3d69 s LEU 45 Cb -0.15 -4.47 0.04 0.00 0.03 0.00 0.00 46.19 41.64 3d69 s LEU 45 CO 0.58 -2.02 0.18 -0.70 0.23 0.00 0.00 176.35 174.62 3d69 s GLU 46 N -4.92 0.15 0.33 1.70 2.12 -0.17 -4.99 118.70 112.92 3d69 s GLU 46 Ca 0.61 0.39 -0.26 0.00 0.36 0.00 0.00 54.97 56.07 3d69 s GLU 46 Cb -0.17 -0.10 -0.10 0.00 0.26 0.00 0.00 34.13 34.02 3d69 s GLU 46 CO 0.56 -0.13 0.96 -0.46 -0.54 0.00 0.00 175.26 175.64 3d69 s TRP 47 N 0.96 3.64 0.00 5.30 -0.00 -1.26 -1.37 118.94 126.21 3d69 s TRP 47 Ca -0.07 1.77 0.00 0.00 -0.00 0.00 0.00 56.10 57.79 3d69 s TRP 47 Cb -0.09 -2.94 0.00 0.00 -0.00 0.00 0.00 33.47 30.44 3d69 s TRP 47 CO -0.05 0.12 0.00 0.28 -0.00 0.00 0.00 176.95 177.29 3d69 n VAL 48 N 0.48 0.00 -3.68 5.86 0.31 0.22 -4.87 118.33 116.66 3d69 n VAL 48 Ca 0.02 0.23 -0.05 0.00 -0.01 0.00 0.00 64.34 64.53 3d69 n VAL 48 Cb 0.50 -1.17 -0.01 0.00 -0.91 0.00 0.00 33.84 32.25 3d69 n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3d69 n ALA 49 N -2.10 -0.20 -3.64 3.52 0.00 -1.21 -2.42 120.51 114.45 3d69 n ALA 49 Ca 0.00 -0.57 -0.10 0.00 0.00 0.00 0.00 53.44 52.78 3d69 n ALA 49 Cb 0.00 0.46 -0.07 0.00 0.00 0.00 0.00 19.45 19.84 3d69 n ALA 49 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3d69 s ILE 50 N -2.59 0.00 0.08 0.00 2.07 -0.90 -2.66 121.20 117.20 3d69 s ILE 50 Ca 0.10 0.00 0.08 0.00 -1.41 0.00 0.00 60.65 59.42 3d69 s ILE 50 Cb -0.01 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.55 3d69 s ILE 50 CO 0.07 0.00 -0.21 -0.51 -1.91 0.00 0.00 174.94 172.38 3d69 s ILE 51 N 0.64 1.69 0.98 2.00 2.07 -0.65 -1.47 121.20 126.46 3d69 s ILE 51 Ca -0.01 -1.42 -0.12 0.00 -1.41 0.00 0.00 60.65 57.68 3d69 s ILE 51 Cb -0.05 -1.52 0.18 0.00 0.13 0.00 0.00 42.46 41.20 3d69 s ILE 51 CO -0.07 0.03 1.09 -0.94 -1.91 0.00 0.00 174.94 173.14 3d69 s SER 52 N -1.66 2.73 0.12 4.50 1.04 -0.63 -1.53 113.70 118.28 3d69 s SER 52 Ca 0.07 1.38 -0.17 0.00 0.48 0.00 0.00 55.95 57.71 3d69 s SER 52 Cb -0.10 -2.05 -0.02 0.00 0.10 0.00 0.00 66.02 63.95 3d69 s SER 52 CO 0.03 -3.09 1.66 0.10 0.98 0.00 0.00 173.24 172.93 3d69 h TYR 52 N -1.86 0.56 0.00 5.02 -0.00 -1.83 -2.63 116.97 116.22 3d69 h TYR 52 Ca -0.53 -0.05 0.00 0.00 -0.00 0.00 0.00 58.73 58.15 3d69 h TYR 52 Cb 1.31 -0.17 0.00 0.00 -0.00 0.00 0.00 36.73 37.87 3d69 h TYR 52 CO 0.35 0.52 0.00 -0.40 -0.00 0.00 0.00 178.16 178.62 3d69 n ASP 53 N -4.67 0.00 0.00 0.10 5.68 -1.26 -4.78 116.55 111.62 3d69 n ASP 53 Ca -0.01 0.39 0.00 0.00 -0.50 0.00 0.00 54.79 54.67 3d69 n ASP 53 Cb 0.15 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.67 3d69 n ASP 53 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d69 n GLY 54 N 1.11 0.45 0.00 6.12 0.00 -0.99 -5.01 105.19 106.87 3d69 n GLY 54 Ca 0.07 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3d69 n GLY 54 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d69 n SER 55 N 1.30 0.00 -4.84 1.61 7.64 -1.26 -4.90 113.62 113.17 3d69 n SER 55 Ca 0.00 0.01 -0.32 0.00 1.01 0.00 0.00 58.87 59.56 3d69 n SER 55 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 3d69 n SER 55 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 3d69 s LYS 56 N -0.01 4.05 -0.03 1.43 -2.85 -1.26 -4.91 119.74 116.16 3d69 s LYS 56 Ca 0.00 0.78 -0.25 0.00 -1.00 0.00 0.00 55.97 55.49 3d69 s LYS 56 Cb 0.00 -2.36 0.05 0.00 -2.06 0.00 0.00 37.83 33.46 3d69 s LYS 56 CO 0.00 0.10 0.56 -1.59 0.10 0.00 0.00 175.35 174.51 3d69 s LYS 57 N -3.07 0.94 0.02 1.78 -2.85 -1.26 -1.60 119.74 113.70 3d69 s LYS 57 Ca 0.56 0.09 0.08 0.00 -1.00 0.00 0.00 55.97 55.69 3d69 s LYS 57 Cb -0.10 0.44 -0.02 0.00 -2.06 0.00 0.00 37.83 36.08 3d69 s LYS 57 CO 0.17 -0.29 -0.23 0.71 0.10 0.00 0.00 175.35 175.82 3d69 s TYR 58 N -1.32 1.99 0.42 1.78 2.02 -0.54 -5.00 117.35 116.70 3d69 s TYR 58 Ca -0.11 -0.38 0.07 0.00 -0.37 0.00 0.00 57.07 56.27 3d69 s TYR 58 Cb -0.02 -1.22 -0.07 0.00 -0.40 0.00 0.00 41.96 40.25 3d69 s TYR 58 CO 0.07 0.05 0.03 0.71 -1.57 0.00 0.00 175.55 174.85 3d69 s TYR 59 N -0.69 2.50 0.33 2.71 1.51 -1.26 -2.13 117.35 120.32 3d69 s TYR 59 Ca 0.09 -0.67 -0.06 0.00 -1.01 0.00 0.00 57.07 55.42 3d69 s TYR 59 Cb -0.09 -1.79 -0.05 0.00 -0.11 0.00 0.00 41.96 39.92 3d69 s TYR 59 CO 0.01 0.41 0.61 0.00 -1.11 0.00 0.00 175.55 175.47 3d69 s ALA 60 N -2.71 3.56 -0.66 3.71 0.00 -1.02 -4.90 121.76 119.75 3d69 s ALA 60 Ca 0.34 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.79 3d69 s ALA 60 Cb 0.09 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.83 3d69 s ALA 60 CO 0.18 0.13 0.48 -3.47 0.00 0.00 0.00 175.76 173.07 3d69 n ASP 61 N -1.18 1.21 -0.06 0.00 2.03 -1.26 -2.07 116.55 115.21 3d69 n ASP 61 Ca -0.01 -1.43 -0.06 0.00 0.52 0.00 0.00 54.79 53.81 3d69 n ASP 61 Cb 0.54 -0.36 -0.09 0.00 -0.72 0.00 0.00 41.12 40.49 3d69 n ASP 61 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 3d69 n SER 62 N 0.31 2.04 0.00 1.67 7.64 -1.26 -4.73 113.62 119.30 3d69 n SER 62 Ca 0.00 -0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3d69 n SER 62 Cb 0.24 0.76 0.00 0.00 -1.01 0.00 0.00 64.21 64.20 3d69 n SER 62 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 3d69 n VAL 63 N -2.47 0.00 -1.04 0.44 0.24 -0.94 -5.00 118.33 109.57 3d69 n VAL 63 Ca -0.20 -0.36 -0.42 0.00 -2.04 0.00 0.00 64.34 61.31 3d69 n VAL 63 Cb 0.89 0.90 -0.10 0.00 -1.47 0.00 0.00 33.84 34.06 3d69 n VAL 63 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3d69 n LYS 64 N -0.95 0.00 0.00 7.34 5.02 -0.88 -0.44 118.16 128.25 3d69 n LYS 64 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3d69 n LYS 64 Cb 0.00 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 3d69 n LYS 64 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d69 n GLY 65 N 5.63 3.29 0.16 0.72 0.00 -1.26 -4.86 105.19 108.87 3d69 n GLY 65 Ca 0.46 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 45.41 3d69 n GLY 65 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3d69 h ARG 66 N 0.00 0.42 -6.36 1.61 3.08 -1.04 -3.46 114.38 108.63 3d69 h ARG 66 Ca 0.00 -0.45 -0.52 0.00 0.07 0.00 0.00 59.98 59.08 3d69 h ARG 66 Cb 0.00 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 3d69 h ARG 66 CO 0.00 1.11 -0.24 -0.06 -1.07 0.00 0.00 179.97 179.71 3d69 s PHE 67 N -3.27 3.48 -0.14 3.04 0.40 -1.13 -1.46 117.98 118.90 3d69 s PHE 67 Ca -0.06 0.48 -0.04 0.00 -0.60 0.00 0.00 56.93 56.71 3d69 s PHE 67 Cb 0.09 -1.97 0.07 0.00 0.51 0.00 0.00 43.02 41.72 3d69 s PHE 67 CO 0.87 0.27 0.24 0.99 0.70 0.00 0.00 175.22 178.29 3d69 s THR 68 N -1.99 -0.38 -0.20 0.64 2.01 0.26 -4.92 115.64 111.05 3d69 s THR 68 Ca 0.41 0.20 -0.05 0.00 0.31 0.00 0.00 61.69 62.55 3d69 s THR 68 Cb -0.11 -0.48 -0.03 0.00 0.01 0.00 0.00 72.50 71.89 3d69 s THR 68 CO 0.30 0.05 0.01 -0.51 -0.69 0.00 0.00 174.62 173.77 3d69 s ILE 69 N 2.39 4.04 0.10 1.82 2.07 -1.26 0.14 121.20 130.50 3d69 s ILE 69 Ca 0.03 -0.28 0.01 0.00 -1.41 0.00 0.00 60.65 59.00 3d69 s ILE 69 Cb -0.13 -2.83 -0.01 0.00 0.13 0.00 0.00 42.46 39.62 3d69 s ILE 69 CO -0.09 0.42 0.05 -1.54 -1.91 0.00 0.00 174.94 171.87 3d69 n SER 70 N 4.26 0.69 -3.64 4.50 3.41 -1.18 -4.97 113.62 116.67 3d69 n SER 70 Ca -0.17 -1.58 -0.03 0.00 -0.26 0.00 0.00 58.87 56.84 3d69 n SER 70 Cb 0.52 0.32 -0.07 0.00 -0.26 0.00 0.00 64.21 64.72 3d69 n SER 70 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d69 s ARG 71 N -2.40 0.37 -1.05 4.33 1.70 -1.26 -0.99 118.95 119.65 3d69 s ARG 71 Ca 0.07 0.63 -0.02 0.00 -0.47 0.00 0.00 55.73 55.93 3d69 s ARG 71 Cb 0.00 0.08 0.32 0.00 -0.57 0.00 0.00 34.95 34.78 3d69 s ARG 71 CO 0.05 -0.08 1.67 -3.47 -1.08 0.00 0.00 175.30 172.39 3d69 n ASP 72 N 3.57 6.92 -0.11 -2.89 2.03 -0.88 -4.88 116.55 120.30 3d69 n ASP 72 Ca -0.18 -3.56 0.09 0.00 0.52 0.00 0.00 54.79 51.65 3d69 n ASP 72 Cb 0.57 -1.21 0.16 0.00 -0.72 0.00 0.00 41.12 39.92 3d69 n ASP 72 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3d69 n ASN 73 N 0.57 0.06 -0.13 1.67 3.02 -1.26 0.24 115.26 119.44 3d69 n ASN 73 Ca 0.37 0.56 -0.04 0.00 -0.03 0.00 0.00 54.58 55.44 3d69 n ASN 73 Cb 0.29 -0.25 0.04 0.00 -0.61 0.00 0.00 39.78 39.26 3d69 n ASN 73 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3d69 h SER 74 N 0.00 0.01 -0.58 6.41 4.64 -1.93 -1.71 113.55 120.39 3d69 h SER 74 Ca 0.26 0.07 -0.25 0.00 -0.47 0.00 0.00 61.79 61.39 3d69 h SER 74 Cb 0.64 0.10 -0.15 0.00 -0.31 0.00 0.00 62.40 62.67 3d69 h SER 74 CO -0.28 0.04 0.32 0.29 -0.87 0.00 0.00 176.83 176.34 3d69 n LYS 75 N -5.10 2.23 -2.24 4.77 5.02 0.67 -4.89 118.16 118.63 3d69 n LYS 75 Ca 0.03 -1.97 -0.08 0.00 -2.02 0.00 0.00 58.31 54.27 3d69 n LYS 75 Cb 0.20 -1.82 -0.02 0.00 -0.02 0.00 0.00 35.03 33.37 3d69 n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3d69 n ASN 76 N -0.33 -0.78 -4.62 4.39 3.02 -0.65 -4.84 115.26 111.46 3d69 n ASN 76 Ca 0.34 -0.02 -0.27 0.00 -0.03 0.00 0.00 54.58 54.60 3d69 n ASN 76 Cb 1.17 -0.73 -0.09 0.00 -0.61 0.00 0.00 39.78 39.52 3d69 n ASN 76 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3d69 s THR 77 N -1.59 3.47 0.06 3.41 2.01 -1.25 -2.51 115.64 119.24 3d69 s THR 77 Ca 0.16 -1.51 0.08 0.00 0.31 0.00 0.00 61.69 60.73 3d69 s THR 77 Cb -0.09 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.66 3d69 s THR 77 CO 0.19 -0.09 -0.22 -0.22 -0.69 0.00 0.00 174.62 173.60 3d69 s LEU 78 N -2.83 2.21 0.42 4.42 2.96 0.27 -2.08 118.68 124.04 3d69 s LEU 78 Ca 0.26 -0.58 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 3d69 s LEU 78 Cb -0.09 -0.99 -0.04 0.00 0.50 0.00 0.00 46.19 45.57 3d69 s LEU 78 CO 0.17 0.15 0.06 -0.31 -1.32 0.00 0.00 176.35 175.09 3d69 s TYR 79 N -0.90 1.96 -0.30 5.38 2.02 -0.16 0.48 117.35 125.83 3d69 s TYR 79 Ca 0.08 -1.03 -0.12 0.00 -0.37 0.00 0.00 57.07 55.63 3d69 s TYR 79 Cb -0.09 -1.40 0.16 0.00 -0.40 0.00 0.00 41.96 40.22 3d69 s TYR 79 CO 0.03 0.03 0.88 -1.17 -1.57 0.00 0.00 175.55 173.74 3d69 s LEU 80 N -3.67 -0.78 -0.24 -1.29 2.96 -1.05 -3.13 118.68 111.49 3d69 s LEU 80 Ca 0.23 0.91 -0.06 0.00 -0.22 0.00 0.00 54.13 54.99 3d69 s LEU 80 Cb 0.05 1.83 -0.02 0.00 0.50 0.00 0.00 46.19 48.54 3d69 s LEU 80 CO 0.12 -0.15 0.04 -1.58 -1.32 0.00 0.00 176.35 173.46 3d69 s GLN 81 N 2.66 3.59 -0.14 1.98 2.00 0.38 -1.34 119.66 128.79 3d69 s GLN 81 Ca -0.00 -0.51 0.01 0.00 -2.00 0.00 0.00 55.36 52.85 3d69 s GLN 81 Cb -0.09 -3.23 -0.00 0.00 0.80 0.00 0.00 33.01 30.48 3d69 s GLN 81 CO -0.17 -0.17 -0.16 -1.64 -0.50 0.00 0.00 175.29 172.65 3d69 s MET 82 N 1.52 3.22 0.09 1.67 -1.94 -0.76 0.89 119.30 123.99 3d69 s MET 82 Ca 0.06 -0.76 0.07 0.00 -1.71 0.00 0.00 55.69 53.35 3d69 s MET 82 Cb -0.15 -2.58 -0.03 0.00 2.01 0.00 0.00 34.83 34.08 3d69 s MET 82 CO 0.02 0.08 -0.18 -0.80 -0.01 0.00 0.00 175.02 174.13 3d69 s ASN 82 N 0.66 2.15 -0.79 3.03 -0.87 -0.53 -2.35 114.94 116.23 3d69 s ASN 82 Ca -0.08 -0.66 -0.03 0.00 -1.57 0.00 0.00 52.86 50.52 3d69 s ASN 82 Cb -0.16 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.25 40.94 3d69 s ASN 82 CO 0.02 -0.01 0.71 -1.20 -2.57 0.00 0.00 177.10 174.06 3d69 n SER 82 N 1.14 -6.48 -4.64 -1.22 7.64 -0.58 -4.70 113.62 104.78 3d69 n SER 82 Ca -0.20 -0.37 -0.43 0.00 1.01 0.00 0.00 58.87 58.88 3d69 n SER 82 Cb 0.54 -4.66 -0.02 0.00 -1.01 0.00 0.00 64.21 59.06 3d69 n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3d69 s LEU 82 N -4.47 3.99 -0.16 -3.43 1.02 -1.26 -4.65 118.68 109.72 3d69 s LEU 82 Ca 0.22 1.31 -0.19 0.00 0.02 0.00 0.00 54.13 55.49 3d69 s LEU 82 Cb -0.03 -3.54 -0.04 0.00 0.02 0.00 0.00 46.19 42.61 3d69 s LEU 82 CO 0.65 -0.92 0.54 -0.13 0.02 0.00 0.00 176.35 176.50 3d69 s ARG 83 N 3.81 4.28 0.35 1.70 0.52 -1.26 -2.39 118.95 125.96 3d69 s ARG 83 Ca 0.53 0.51 0.29 0.00 -0.52 0.00 0.00 55.73 56.53 3d69 s ARG 83 Cb -0.17 -3.51 1.12 0.00 0.52 0.00 0.00 34.95 32.92 3d69 s ARG 83 CO 0.18 -0.03 1.08 0.00 0.02 0.00 0.00 175.30 176.56 3d69 n ALA 84 N 4.31 1.14 -0.10 2.13 0.00 -1.26 0.18 120.51 126.91 3d69 n ALA 84 Ca -0.05 0.53 0.26 0.00 0.00 0.00 0.00 53.44 54.18 3d69 n ALA 84 Cb 0.51 -0.77 0.71 0.00 0.00 0.00 0.00 19.45 19.90 3d69 n ALA 84 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3d69 h GLU 85 N 0.00 0.00 -0.02 0.00 5.08 -1.94 0.49 114.58 118.18 3d69 h GLU 85 Ca 0.63 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.88 3d69 h GLU 85 Cb 2.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.55 3d69 h GLU 85 CO -0.16 0.00 -0.53 -0.44 -1.00 0.00 0.00 179.01 176.88 3d69 h ASP 86 N 0.00 0.07 -0.93 1.42 3.32 0.15 -3.45 116.42 117.01 3d69 h ASP 86 Ca 0.36 -0.04 -0.82 0.00 0.02 0.00 0.00 57.03 56.55 3d69 h ASP 86 Cb 1.66 -0.02 0.01 0.00 0.22 0.00 0.00 39.33 41.20 3d69 h ASP 86 CO -0.00 0.59 0.65 0.41 -1.72 0.00 0.00 179.24 179.17 3d69 n THR 87 N -3.92 0.00 -1.28 0.35 -1.04 0.17 -4.76 114.28 103.80 3d69 n THR 87 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 3d69 n THR 87 Cb 0.54 -0.47 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 3d69 n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3d69 n ALA 88 N 3.78 0.00 -2.68 2.41 0.00 -0.73 -4.56 120.51 118.74 3d69 n ALA 88 Ca 0.29 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.36 3d69 n ALA 88 Cb -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.33 3d69 n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3d69 s VAL 89 N -2.39 5.25 -0.52 0.00 1.01 -0.63 -1.79 120.40 121.33 3d69 s VAL 89 Ca 0.00 0.55 -0.06 0.00 0.00 0.00 0.00 61.98 62.47 3d69 s VAL 89 Cb 0.00 -3.57 0.13 0.00 0.00 0.00 0.00 36.38 32.94 3d69 s VAL 89 CO 0.00 0.58 0.36 -0.31 0.00 0.00 0.00 175.10 175.73 3d69 s TYR 90 N -0.91 3.49 0.09 5.22 1.51 -0.56 -0.26 117.35 125.93 3d69 s TYR 90 Ca 0.19 -2.23 -0.27 0.00 -1.01 0.00 0.00 57.07 53.75 3d69 s TYR 90 Cb -0.14 -3.38 -0.06 0.00 -0.11 0.00 0.00 41.96 38.26 3d69 s TYR 90 CO 0.09 -0.95 0.85 0.71 -1.11 0.00 0.00 175.55 175.13 3d69 s TYR 91 N 0.87 3.80 -0.25 2.71 2.02 0.55 -2.48 117.35 124.57 3d69 s TYR 91 Ca 0.10 1.64 -0.10 0.00 -0.37 0.00 0.00 57.07 58.34 3d69 s TYR 91 Cb -0.23 -2.91 -0.05 0.00 -0.40 0.00 0.00 41.96 38.38 3d69 s TYR 91 CO -0.03 0.29 0.15 0.00 -1.57 0.00 0.00 175.55 174.39 3d69 s ALA 93 N 1.37 1.08 -0.02 0.00 0.00 -0.92 -2.89 121.76 120.39 3d69 s ALA 93 Ca 0.07 -0.64 -0.15 0.00 0.00 0.00 0.00 51.96 51.24 3d69 s ALA 93 Cb -0.15 -0.23 -0.06 0.00 0.00 0.00 0.00 23.12 22.68 3d69 s ALA 93 CO 0.07 0.24 0.41 0.50 0.00 0.00 0.00 175.76 176.98 3d69 s ARG 94 N -0.59 3.97 -0.18 0.00 3.52 -0.34 0.12 118.95 125.44 3d69 s ARG 94 Ca 0.04 0.40 -0.12 0.00 -0.13 0.00 0.00 55.73 55.92 3d69 s ARG 94 Cb -0.06 -3.25 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 3d69 s ARG 94 CO 0.00 0.63 0.23 0.00 -0.81 0.00 0.00 175.30 175.35 3d69 s ALA 95 N -0.87 3.63 0.33 6.12 0.00 -1.04 -1.20 121.76 128.74 3d69 s ALA 95 Ca 0.24 -0.55 -0.22 0.00 0.00 0.00 0.00 51.96 51.43 3d69 s ALA 95 Cb -0.16 -2.30 -0.15 0.00 0.00 0.00 0.00 23.12 20.51 3d69 s ALA 95 CO 0.13 0.12 0.18 0.45 0.00 0.00 0.00 175.76 176.64 3d69 n SER 96 N 3.54 -2.34 -0.04 0.00 2.88 0.27 -4.21 113.62 113.73 3d69 n SER 96 Ca -0.14 0.84 -0.13 0.00 -1.33 0.00 0.00 58.87 58.11 3d69 n SER 96 Cb 0.52 -0.85 -0.08 0.00 -0.75 0.00 0.00 64.21 63.05 3d69 n SER 96 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 3d69 h ILE 97 N 0.46 1.38 0.00 2.46 -0.00 -1.96 -2.97 117.51 116.88 3d69 h ILE 97 Ca -0.33 -1.33 -0.09 0.00 -0.00 0.00 0.00 64.86 63.11 3d69 h ILE 97 Cb 1.36 2.07 -0.01 0.00 -0.00 0.00 0.00 36.82 40.24 3d69 h ILE 97 CO 0.47 0.37 -0.44 0.00 -0.00 0.00 0.00 178.15 178.55 3d69 h ALA 98 N 0.54 1.04 -3.13 0.18 0.00 -1.99 -3.42 119.26 112.48 3d69 h ALA 98 Ca 0.01 -0.40 -0.35 0.00 0.00 0.00 0.00 54.91 54.17 3d69 h ALA 98 Cb 0.65 -0.07 -0.38 0.00 0.00 0.00 0.00 17.79 18.00 3d69 h ALA 98 CO 0.03 0.55 -0.69 0.00 0.00 0.00 0.00 179.25 179.14 3d69 s ALA 99 N -3.69 0.06 -0.02 0.00 0.00 -1.13 -4.99 121.76 112.00 3d69 s ALA 99 Ca -0.01 0.28 0.22 0.00 0.00 0.00 0.00 51.96 52.45 3d69 s ALA 99 Cb 0.12 -0.80 0.62 0.00 0.00 0.00 0.00 23.12 23.06 3d69 s ALA 99 CO 0.71 -0.66 1.70 0.00 0.00 0.00 0.00 175.76 177.51 3d69 h ALA 100 N 8.40 0.92 0.00 0.00 0.00 -1.81 -1.34 119.26 125.42 3d69 h ALA 100 Ca -0.13 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3d69 h ALA 100 Cb 1.12 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3d69 h ALA 100 CO 0.17 0.34 0.00 2.89 0.00 0.00 0.00 179.25 182.65 3d69 n ARG 100 N -3.30 0.85 -4.05 0.00 1.85 -1.26 -4.62 116.66 106.14 3d69 n ARG 100 Ca 0.01 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.56 3d69 n ARG 100 Cb 0.52 -1.28 -0.16 0.00 -1.05 0.00 0.00 32.46 30.49 3d69 n ARG 100 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3d69 s VAL 100 N -2.00 1.64 -0.41 8.89 1.01 -1.10 -5.04 120.40 123.39 3d69 s VAL 100 Ca 0.23 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.35 3d69 s VAL 100 Cb 0.10 -1.53 0.02 0.00 0.00 0.00 0.00 36.38 34.97 3d69 s VAL 100 CO 0.17 0.47 0.49 -0.76 0.00 0.00 0.00 175.10 175.47 3d69 s LEU 100 N 1.45 4.69 0.19 3.92 1.43 -1.26 0.96 118.68 130.06 3d69 s LEU 100 Ca 0.05 -0.49 0.23 0.00 -1.03 0.00 0.00 54.13 52.88 3d69 s LEU 100 Cb -0.13 -2.48 -0.01 0.00 0.03 0.00 0.00 46.19 43.60 3d69 s LEU 100 CO -0.11 -0.60 1.03 -0.90 0.23 0.00 0.00 176.35 176.00 3d69 n ASP 101 N 5.75 0.82 -3.72 2.29 3.85 -0.34 -4.91 116.55 120.30 3d69 n ASP 101 Ca -0.06 0.31 -0.15 0.00 -0.71 0.00 0.00 54.79 54.18 3d69 n ASP 101 Cb 0.48 0.50 -0.15 0.00 -1.35 0.00 0.00 41.12 40.59 3d69 n ASP 101 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 3d69 s TYR 102 N -3.37 -0.15 0.06 2.11 2.02 -1.24 -5.01 117.35 111.78 3d69 s TYR 102 Ca -0.01 0.50 0.08 0.00 -0.37 0.00 0.00 57.07 57.27 3d69 s TYR 102 Cb 0.10 -0.18 -0.03 0.00 -0.40 0.00 0.00 41.96 41.45 3d69 s TYR 102 CO 0.79 -0.20 -0.22 -1.58 -1.57 0.00 0.00 175.55 172.77 3d69 s TRP 103 N 1.63 1.90 0.15 2.71 0.52 -1.26 -1.20 118.94 123.39 3d69 s TRP 103 Ca -0.04 -0.39 0.07 0.00 0.02 0.00 0.00 56.10 55.77 3d69 s TRP 103 Cb -0.12 -1.11 -0.04 0.00 -1.15 0.00 0.00 33.47 31.05 3d69 s TRP 103 CO -0.06 0.14 -0.05 0.20 0.02 0.00 0.00 176.95 177.20 3d69 s GLY 104 N -1.40 1.76 -0.32 0.98 0.00 -1.14 -4.95 107.32 102.25 3d69 s GLY 104 Ca 0.08 -1.34 -0.29 0.00 0.00 0.00 0.00 44.72 43.17 3d69 s GLY 104 CO 0.03 -1.35 2.28 0.54 0.00 0.00 0.00 173.10 174.60 3d69 n ARG 105 N 0.19 1.57 0.00 2.90 1.74 -1.26 -4.27 116.66 117.53 3d69 n ARG 105 Ca -0.11 0.36 0.00 0.00 -0.77 0.00 0.00 57.85 57.33 3d69 n ARG 105 Cb 0.54 -3.13 0.00 0.00 -1.02 0.00 0.00 32.46 28.85 3d69 n ARG 105 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d69 n GLY 106 N 5.97 -1.06 2.90 -0.13 0.00 -1.26 -4.46 105.19 107.15 3d69 n GLY 106 Ca 0.34 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 3d69 n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3d69 s THR 107 N 0.00 0.29 0.12 2.61 -1.32 -1.04 -4.64 115.64 111.67 3d69 s THR 107 Ca 0.00 -0.09 -0.31 0.00 -1.21 0.00 0.00 61.69 60.09 3d69 s THR 107 Cb 0.00 -0.29 -0.08 0.00 -1.51 0.00 0.00 72.50 70.62 3d69 s THR 107 CO 0.00 0.12 1.33 -0.32 -2.21 0.00 0.00 174.62 173.54 3d69 s MET 108 N 0.34 4.36 -0.04 7.08 1.75 -1.26 -1.50 119.30 130.03 3d69 s MET 108 Ca -0.03 2.00 0.02 0.00 -1.25 0.00 0.00 55.69 56.43 3d69 s MET 108 Cb -0.06 -3.26 0.01 0.00 2.84 0.00 0.00 34.83 34.36 3d69 s MET 108 CO -0.01 -0.35 -0.08 0.08 -0.65 0.00 0.00 175.02 174.01 3d69 s VAL 109 N 0.87 0.78 -0.11 10.11 1.01 -0.74 -2.19 120.40 130.13 3d69 s VAL 109 Ca 0.61 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.28 3d69 s VAL 109 Cb -0.35 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.33 3d69 s VAL 109 CO 0.32 0.26 -0.07 -0.89 0.00 0.00 0.00 175.10 174.72 3d69 s THR 110 N 0.54 0.94 -0.37 3.92 2.01 0.14 -1.77 115.64 121.04 3d69 s THR 110 Ca -0.09 -0.23 -0.20 0.00 0.31 0.00 0.00 61.69 61.49 3d69 s THR 110 Cb -0.12 -0.97 0.01 0.00 0.01 0.00 0.00 72.50 71.42 3d69 s THR 110 CO 0.01 0.35 0.60 -0.69 -0.69 0.00 0.00 174.62 174.20 3d69 s VAL 111 N 1.74 4.92 -0.03 3.82 1.01 -1.26 0.92 120.40 131.53 3d69 s VAL 111 Ca 0.05 0.40 -0.30 0.00 0.00 0.00 0.00 61.98 62.13 3d69 s VAL 111 Cb -0.12 -4.07 0.08 0.00 0.00 0.00 0.00 36.38 32.26 3d69 s VAL 111 CO -0.08 -0.35 0.70 -0.55 0.00 0.00 0.00 175.10 174.83 3d69 s SER 112 N 1.83 -0.61 -0.09 3.32 0.15 -0.02 -4.81 113.70 113.46 3d69 s SER 112 Ca 0.22 0.56 0.15 0.00 0.70 0.00 0.00 55.95 57.58 3d69 s SER 112 Cb -0.15 0.52 -0.22 0.00 -1.71 0.00 0.00 66.02 64.47 3d69 s SER 112 CO 0.15 -0.64 0.19 -1.54 1.20 0.00 0.00 173.24 172.60 3d69 n SER 113 N 0.66 1.24 -4.57 5.45 3.41 -1.26 -2.35 113.62 116.19 3d69 n SER 113 Ca -0.18 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.03 3d69 n SER 113 Cb 0.58 1.27 0.02 0.00 -0.26 0.00 0.00 64.21 65.82 3d69 n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d69 n ALA 114 N -2.34 -0.19 -2.95 7.33 0.00 -1.26 -4.99 120.51 116.09 3d69 n ALA 114 Ca -0.15 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3d69 n ALA 114 Cb 0.74 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3d69 n ALA 114 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3d69 n SER 115 N 0.51 0.00 -4.55 0.00 7.64 -1.26 -5.04 113.62 110.91 3d69 n SER 115 Ca 0.10 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.56 3d69 n SER 115 Cb 0.40 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.57 3d69 n SER 115 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3d69 s THR 116 N 3.83 4.15 0.17 0.44 2.01 -1.26 -4.39 115.64 120.60 3d69 s THR 116 Ca 0.00 0.62 0.10 0.00 0.31 0.00 0.00 61.69 62.72 3d69 s THR 116 Cb 0.00 -4.66 -0.04 0.00 0.01 0.00 0.00 72.50 67.80 3d69 s THR 116 CO 0.00 -1.28 -0.19 -0.75 -0.69 0.00 0.00 174.62 171.71 3d69 s LYS 117 N 4.58 1.71 0.33 4.92 2.20 -1.26 -4.93 119.74 127.29 3d69 s LYS 117 Ca 0.37 -1.38 0.07 0.00 -0.36 0.00 0.00 55.97 54.67 3d69 s LYS 117 Cb -0.10 -1.99 -0.02 0.00 -1.51 0.00 0.00 37.83 34.22 3d69 s LYS 117 CO 0.22 0.43 0.41 0.20 -0.36 0.00 0.00 175.35 176.25 3d69 s GLY 118 N -2.58 1.66 0.00 5.54 0.00 -1.26 -3.78 107.32 106.90 3d69 s GLY 118 Ca 0.21 -1.53 0.00 0.00 0.00 0.00 0.00 44.72 43.40 3d69 s GLY 118 CO 0.11 -1.45 0.00 -1.55 0.00 0.00 0.00 173.10 170.21 3d69 n PRO 119 N -1.55 -0.26 -2.70 2.90 -0.04 -1.26 -4.40 135.00 127.70 3d69 n PRO 119 Ca -0.01 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.41 3d69 n PRO 119 Cb 0.59 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 34.09 3d69 n PRO 119 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3d69 n SER 120 N -1.40 -1.98 -4.78 3.54 7.64 -1.16 -4.94 113.62 110.54 3d69 n SER 120 Ca 0.00 -1.88 -0.33 0.00 1.01 0.00 0.00 58.87 57.67 3d69 n SER 120 Cb 0.00 1.07 0.02 0.00 -1.01 0.00 0.00 64.21 64.29 3d69 n SER 120 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3d69 s VAL 121 N 0.67 3.43 0.29 0.44 1.01 -1.26 -3.98 120.40 121.01 3d69 s VAL 121 Ca 0.27 0.72 -0.08 0.00 0.00 0.00 0.00 61.98 62.89 3d69 s VAL 121 Cb 0.14 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.28 3d69 s VAL 121 CO -0.11 -0.36 0.48 -0.36 0.00 0.00 0.00 175.10 174.75 3d69 s PHE 122 N -2.24 0.68 0.37 5.22 0.08 -1.02 -5.04 117.98 116.03 3d69 s PHE 122 Ca 0.67 -1.01 0.07 0.00 0.12 0.00 0.00 56.93 56.79 3d69 s PHE 122 Cb -0.20 0.08 -0.01 0.00 -0.57 0.00 0.00 43.02 42.33 3d69 s PHE 122 CO 0.36 -1.07 0.44 -1.25 -0.10 0.00 0.00 175.22 173.60 3d69 s PRO 123 N -3.50 2.84 -0.61 0.24 0.04 -1.26 -3.03 135.00 129.72 3d69 s PRO 123 Ca 0.26 -1.24 0.04 0.00 0.04 0.00 0.00 61.00 60.11 3d69 s PRO 123 Cb -0.00 -2.65 0.16 0.00 0.04 0.00 0.00 34.50 32.05 3d69 s PRO 123 CO 0.14 -0.07 0.41 -0.51 0.04 0.00 0.00 177.00 177.01 3d69 s LEU 124 N -4.18 4.08 -0.38 -3.56 1.43 0.84 -4.73 118.68 112.18 3d69 s LEU 124 Ca 0.47 -3.51 -0.42 0.00 -1.03 0.00 0.00 54.13 49.65 3d69 s LEU 124 Cb -0.08 -1.42 -0.17 0.00 0.03 0.00 0.00 46.19 44.56 3d69 s LEU 124 CO 0.30 -0.13 1.82 0.00 0.23 0.00 0.00 176.35 178.57 3d69 n ALA 125 N 2.41 -0.28 -1.77 4.21 0.00 -1.26 -2.60 120.51 121.20 3d69 n ALA 125 Ca 0.18 0.33 -0.37 0.00 0.00 0.00 0.00 53.44 53.58 3d69 n ALA 125 Cb 0.36 -2.16 -0.02 0.00 0.00 0.00 0.00 19.45 17.63 3d69 n ALA 125 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3d69 s PRO 126 N 4.10 3.91 0.05 0.00 0.04 -1.22 -4.86 135.00 137.02 3d69 s PRO 126 Ca 1.05 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.78 3d69 s PRO 126 Cb -1.22 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 30.85 3d69 s PRO 126 CO 0.68 -0.40 0.00 -1.13 0.04 0.00 0.00 177.00 176.19 3d69 n SER 127 N -0.31 -3.11 0.00 6.66 3.41 -1.16 -4.31 113.62 114.80 3d69 n SER 127 Ca 0.06 0.21 0.04 0.00 -0.26 0.00 0.00 58.87 58.92 3d69 n SER 127 Cb 0.48 -0.74 0.23 0.00 -0.26 0.00 0.00 64.21 63.92 3d69 n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d69 n GLY 134 N -0.04 -0.80 0.00 5.00 0.00 -1.26 -5.07 105.19 103.02 3d69 n GLY 134 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 3d69 n GLY 134 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3d69 n THR 135 N -0.65 0.00 -3.15 2.61 -1.04 -1.26 -4.94 114.28 105.86 3d69 n THR 135 Ca 0.06 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.13 3d69 n THR 135 Cb 0.03 -0.20 -0.01 0.00 -1.82 0.00 0.00 70.33 68.33 3d69 n THR 135 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3d69 s ALA 136 N -2.00 -4.33 -0.34 2.41 0.00 -1.24 -2.48 121.76 113.78 3d69 s ALA 136 Ca 0.00 1.39 -0.20 0.00 0.00 0.00 0.00 51.96 53.15 3d69 s ALA 136 Cb 0.00 -2.83 -0.00 0.00 0.00 0.00 0.00 23.12 20.28 3d69 s ALA 136 CO 0.00 -1.97 0.59 0.00 0.00 0.00 0.00 175.76 174.39 3d69 s ALA 137 N 2.99 3.49 -0.18 0.00 0.00 -1.26 -3.87 121.76 122.93 3d69 s ALA 137 Ca 0.20 -0.83 -0.35 0.00 0.00 0.00 0.00 51.96 50.98 3d69 s ALA 137 Cb -0.02 -3.10 0.14 0.00 0.00 0.00 0.00 23.12 20.14 3d69 s ALA 137 CO -0.17 -1.21 1.19 -0.48 0.00 0.00 0.00 175.76 175.08 3d69 s LEU 138 N 2.58 -0.15 0.00 0.00 0.05 -1.21 -2.99 118.68 116.95 3d69 s LEU 138 Ca 0.23 0.00 -0.06 0.00 0.05 0.00 0.00 54.13 54.36 3d69 s LEU 138 Cb -0.15 1.43 0.02 0.00 -2.05 0.00 0.00 46.19 45.44 3d69 s LEU 138 CO 0.13 -0.26 0.26 0.61 -0.55 0.00 0.00 176.35 176.55 3d69 n GLY 139 N -0.08 0.57 3.28 -3.48 0.00 -1.07 -0.58 105.19 103.83 3d69 n GLY 139 Ca -0.00 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 3d69 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d69 s LEU 141 N 0.03 3.24 0.15 0.00 2.96 -1.17 -2.04 118.68 121.85 3d69 s LEU 141 Ca -0.08 0.00 0.08 0.00 -0.22 0.00 0.00 54.13 53.90 3d69 s LEU 141 Cb -0.15 -1.71 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 3d69 s LEU 141 CO 0.05 0.36 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.58 3d69 s VAL 142 N -0.77 1.67 0.11 1.68 1.01 -0.06 -2.45 120.40 121.59 3d69 s VAL 142 Ca 0.12 -1.88 -0.26 0.00 0.00 0.00 0.00 61.98 59.96 3d69 s VAL 142 Cb -0.11 -1.77 0.07 0.00 0.00 0.00 0.00 36.38 34.58 3d69 s VAL 142 CO 0.02 -0.36 0.88 -1.59 0.00 0.00 0.00 175.10 174.04 3d69 s LYS 143 N -2.81 1.12 -0.21 2.72 -2.85 -1.26 -2.67 119.74 113.78 3d69 s LYS 143 Ca 0.14 -0.54 -0.02 0.00 -1.00 0.00 0.00 55.97 54.55 3d69 s LYS 143 Cb -0.05 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.16 3d69 s LYS 143 CO 0.05 -0.50 0.05 -0.25 0.10 0.00 0.00 175.35 174.80 3d69 n ASP 144 N -0.38 -7.47 -3.52 0.03 9.92 -1.23 -3.00 116.55 110.90 3d69 n ASP 144 Ca -0.08 0.99 -0.08 0.00 -0.53 0.00 0.00 54.79 55.09 3d69 n ASP 144 Cb 0.61 -3.95 -0.02 0.00 -0.64 0.00 0.00 41.12 37.13 3d69 n ASP 144 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 3d69 s TYR 145 N -1.46 -0.33 -0.08 1.24 -0.85 -1.20 -4.01 117.35 110.66 3d69 s TYR 145 Ca 0.02 0.18 -0.00 0.00 -0.52 0.00 0.00 57.07 56.75 3d69 s TYR 145 Cb -0.00 0.55 -0.05 0.00 0.38 0.00 0.00 41.96 42.83 3d69 s TYR 145 CO 0.52 -0.57 -0.08 0.34 -1.52 0.00 0.00 175.55 174.25 3d69 n PHE 146 N -0.26 0.00 -1.73 -3.49 7.35 -1.25 0.14 117.46 118.22 3d69 n PHE 146 Ca -0.09 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.20 3d69 n PHE 146 Cb 0.62 -0.30 0.02 0.00 0.35 0.00 0.00 39.48 40.16 3d69 n PHE 146 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 3d69 n PRO 147 N -2.83 2.06 0.09 -7.13 -0.02 -1.26 -4.87 135.00 121.04 3d69 n PRO 147 Ca -0.14 0.74 -0.16 0.00 -2.02 0.00 0.00 63.50 61.91 3d69 n PRO 147 Cb 0.64 -2.50 -0.10 0.00 -0.02 0.00 0.00 33.50 31.52 3d69 n PRO 147 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3d69 h GLU 148 N 2.14 0.39 -6.45 -0.52 4.39 -1.99 -3.46 114.58 109.08 3d69 h GLU 148 Ca -0.49 -0.54 -0.53 0.00 0.34 0.00 0.00 59.36 58.13 3d69 h GLU 148 Cb 1.28 0.18 0.02 0.00 -0.10 0.00 0.00 28.75 30.14 3d69 h GLU 148 CO 0.60 1.22 0.99 -2.14 -1.16 0.00 0.00 179.01 178.52 3d69 s PRO 149 N -2.93 4.20 -0.23 2.33 0.02 -1.26 -5.00 135.00 132.13 3d69 s PRO 149 Ca -0.06 2.32 -0.03 0.00 0.02 0.00 0.00 61.00 63.25 3d69 s PRO 149 Cb 0.07 -3.60 0.11 0.00 0.02 0.00 0.00 34.50 31.11 3d69 s PRO 149 CO 0.89 -0.73 0.27 0.08 -0.33 0.00 0.00 177.00 177.18 3d69 s VAL 150 N 2.63 -0.41 0.39 3.83 1.01 -1.26 -3.89 120.40 122.70 3d69 s VAL 150 Ca 0.74 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 62.55 3d69 s VAL 150 Cb -0.40 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 3d69 s VAL 150 CO 0.32 -0.24 0.58 0.28 0.00 0.00 0.00 175.10 176.04 3d69 s THR 151 N 2.39 4.27 0.10 3.92 -1.32 -0.41 -4.99 115.64 119.60 3d69 s THR 151 Ca 0.09 -0.65 -0.16 0.00 -1.21 0.00 0.00 61.69 59.76 3d69 s THR 151 Cb -0.15 -3.54 0.03 0.00 -1.51 0.00 0.00 72.50 67.33 3d69 s THR 151 CO -0.18 -0.32 0.39 -0.69 -2.21 0.00 0.00 174.62 171.61 3d69 s VAL 152 N -2.39 0.07 0.19 5.08 1.01 -1.26 -1.71 120.40 121.39 3d69 s VAL 152 Ca 0.45 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.67 3d69 s VAL 152 Cb -0.10 -1.12 0.04 0.00 0.00 0.00 0.00 36.38 35.20 3d69 s VAL 152 CO 0.35 -0.32 0.54 -0.94 0.00 0.00 0.00 175.10 174.73 3d69 s SER 153 N -2.61 -0.32 -0.09 3.32 1.04 -1.24 -4.97 113.70 108.82 3d69 s SER 153 Ca 0.01 -0.37 0.03 0.00 0.48 0.00 0.00 55.95 56.11 3d69 s SER 153 Cb 0.01 0.58 0.01 0.00 0.10 0.00 0.00 66.02 66.72 3d69 s SER 153 CO -0.10 -1.03 -0.19 0.26 0.98 0.00 0.00 173.24 173.16 3d69 s TRP 154 N -3.84 2.15 -1.45 5.02 0.52 -1.26 0.14 118.94 120.22 3d69 s TRP 154 Ca 0.07 -0.89 -0.01 0.00 0.02 0.00 0.00 56.10 55.29 3d69 s TRP 154 Cb -0.01 -1.48 0.01 0.00 -1.15 0.00 0.00 33.47 30.83 3d69 s TRP 154 CO -0.05 -0.39 0.33 -1.71 0.02 0.00 0.00 176.95 175.14 3d69 n ASN 155 N 3.73 -0.10 0.00 2.95 2.85 0.29 0.12 115.26 125.10 3d69 n ASN 155 Ca -0.20 -1.07 0.00 0.00 -0.11 0.00 0.00 54.58 53.19 3d69 n ASN 155 Cb 0.52 -2.69 0.00 0.00 1.24 0.00 0.00 39.78 38.85 3d69 n ASN 155 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3d69 n SER 156 N -2.95 0.00 0.00 1.20 3.41 -1.26 -2.74 113.62 111.27 3d69 n SER 156 Ca -0.30 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.31 3d69 n SER 156 Cb 0.68 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3d69 n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d69 n GLY 157 N -1.55 0.85 3.55 5.00 0.00 0.33 -5.03 105.19 108.33 3d69 n GLY 157 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3d69 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d69 s ALA 158 N -0.85 2.38 -0.28 4.61 0.00 -0.92 -4.32 121.76 122.38 3d69 s ALA 158 Ca 0.00 -1.02 -0.21 0.00 0.00 0.00 0.00 51.96 50.73 3d69 s ALA 158 Cb 0.00 -4.31 0.03 0.00 0.00 0.00 0.00 23.12 18.84 3d69 s ALA 158 CO 0.00 -3.70 0.39 -0.11 0.00 0.00 0.00 175.76 172.34 3d69 n LEU 159 N 11.40 -3.74 -0.48 0.00 -0.00 -1.26 -4.78 117.00 118.14 3d69 n LEU 159 Ca 0.15 0.20 0.00 0.00 -0.00 0.00 0.00 56.01 56.36 3d69 n LEU 159 Cb 0.51 -1.88 0.00 0.00 -0.00 0.00 0.00 43.42 42.05 3d69 n LEU 159 CO 0.70 -0.92 0.17 0.35 -0.00 0.00 0.00 177.39 177.69 3d69 n THR 160 N 0.37 0.00 -2.36 1.96 -2.24 -1.26 -4.86 114.28 105.89 3d69 n THR 160 Ca -0.03 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.42 3d69 n THR 160 Cb 0.56 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 3d69 n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3d69 s SER 161 N -0.39 6.31 -0.27 3.42 0.01 -1.26 -3.42 113.70 118.10 3d69 s SER 161 Ca 0.00 1.75 0.00 0.00 1.31 0.00 0.00 55.95 59.01 3d69 s SER 161 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 3d69 s SER 161 CO 0.00 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 173.46 3d69 n GLY 162 N -0.96 0.28 2.80 3.44 0.00 -1.26 -4.72 105.19 104.76 3d69 n GLY 162 Ca 0.08 -0.78 -0.16 0.00 0.00 0.00 0.00 46.02 45.17 3d69 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d69 s VAL 163 N -2.15 -0.08 -0.03 1.61 1.01 -1.22 -3.16 120.40 116.38 3d69 s VAL 163 Ca 0.00 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.24 3d69 s VAL 163 Cb 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 36.38 36.25 3d69 s VAL 163 CO 0.00 0.10 -0.02 -2.28 0.00 0.00 0.00 175.10 172.90 3d69 s HIS 164 N 1.37 0.45 -0.25 5.22 2.46 -1.26 -5.02 115.29 118.27 3d69 s HIS 164 Ca -0.06 -0.07 -0.08 0.00 0.47 0.00 0.00 55.06 55.31 3d69 s HIS 164 Cb -0.12 -0.45 -0.04 0.00 -0.13 0.00 0.00 32.58 31.84 3d69 s HIS 164 CO -0.04 -0.12 0.10 0.99 -2.47 0.00 0.00 174.74 173.20 3d69 s THR 165 N 0.74 4.65 0.65 0.89 2.01 -1.26 -3.42 115.64 119.90 3d69 s THR 165 Ca -0.08 -0.06 -0.16 0.00 0.31 0.00 0.00 61.69 61.70 3d69 s THR 165 Cb -0.11 -3.17 -0.01 0.00 0.01 0.00 0.00 72.50 69.21 3d69 s THR 165 CO -0.01 0.33 1.12 -0.36 -0.69 0.00 0.00 174.62 175.02 3d69 s PHE 166 N 1.46 2.57 0.22 4.92 0.40 -1.04 -5.00 117.98 121.51 3d69 s PHE 166 Ca 0.06 1.55 -0.30 0.00 -0.60 0.00 0.00 56.93 57.65 3d69 s PHE 166 Cb -0.15 -3.22 -0.09 0.00 0.51 0.00 0.00 43.02 40.07 3d69 s PHE 166 CO 0.05 -1.77 1.16 -1.25 0.70 0.00 0.00 175.22 174.12 3d69 s PRO 167 N -3.93 4.54 0.00 0.24 0.04 -1.26 -4.41 135.00 130.22 3d69 s PRO 167 Ca 0.69 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.58 3d69 s PRO 167 Cb -0.22 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.10 3d69 s PRO 167 CO 0.39 0.01 0.00 0.00 0.04 0.00 0.00 177.00 177.44 3d69 n ALA 168 N 2.02 0.00 -3.32 8.56 0.00 -1.26 -4.83 120.51 121.68 3d69 n ALA 168 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.33 3d69 n ALA 168 Cb 0.45 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.85 3d69 n ALA 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3d69 s VAL 169 N -0.71 0.02 -0.41 0.00 0.11 -0.46 -4.86 120.40 114.09 3d69 s VAL 169 Ca 0.00 -0.19 -0.17 0.00 -2.93 0.00 0.00 61.98 58.69 3d69 s VAL 169 Cb 0.00 -1.01 0.02 0.00 -1.53 0.00 0.00 36.38 33.86 3d69 s VAL 169 CO 0.00 -0.11 0.40 -0.22 -3.33 0.00 0.00 175.10 171.84 3d69 s LEU 170 N -2.18 4.89 0.82 2.54 2.96 -1.26 -2.18 118.68 124.26 3d69 s LEU 170 Ca -0.03 -0.69 -0.10 0.00 -0.22 0.00 0.00 54.13 53.09 3d69 s LEU 170 Cb -0.00 -2.33 0.12 0.00 0.50 0.00 0.00 46.19 44.48 3d69 s LEU 170 CO -0.05 -0.53 1.15 -1.10 -1.32 0.00 0.00 176.35 174.50 3d69 s GLN 171 N 2.02 1.51 0.19 1.98 -0.21 -1.21 -4.80 119.66 119.15 3d69 s GLN 171 Ca 0.10 -0.39 -0.12 0.00 0.02 0.00 0.00 55.36 54.97 3d69 s GLN 171 Cb -0.17 -2.04 0.22 0.00 1.00 0.00 0.00 33.01 32.01 3d69 s GLN 171 CO 0.13 -1.76 1.69 1.03 -2.12 0.00 0.00 175.29 174.26 3d69 h SER 172 N -1.04 -0.12 0.00 5.90 0.87 -1.98 2.07 113.55 119.25 3d69 h SER 172 Ca -0.43 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 3d69 h SER 172 Cb 1.28 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.42 3d69 h SER 172 CO 0.50 -0.04 0.00 -1.54 -0.53 0.00 0.00 176.83 175.22 3d69 n SER 173 N -5.19 0.00 -3.69 6.23 3.41 -1.26 -4.85 113.62 108.26 3d69 n SER 173 Ca 0.06 -0.56 -0.26 0.00 -0.26 0.00 0.00 58.87 57.86 3d69 n SER 173 Cb 0.28 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.26 3d69 n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d69 n GLY 174 N -0.11 -0.66 2.93 5.00 0.00 0.70 -4.85 105.19 108.21 3d69 n GLY 174 Ca 0.08 0.32 -0.22 0.00 0.00 0.00 0.00 46.02 46.20 3d69 n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d69 s LEU 175 N -6.52 1.41 0.10 0.99 1.43 -1.26 -4.73 118.68 110.10 3d69 s LEU 175 Ca 0.25 -0.18 -0.30 0.00 -1.03 0.00 0.00 54.13 52.86 3d69 s LEU 175 Cb -0.08 -0.57 -0.06 0.00 0.03 0.00 0.00 46.19 45.51 3d69 s LEU 175 CO 0.84 -0.03 1.03 -0.31 0.23 0.00 0.00 176.35 178.10 3d69 s TYR 176 N 0.88 3.69 0.03 0.29 1.51 0.12 -3.30 117.35 120.58 3d69 s TYR 176 Ca -0.11 1.67 0.04 0.00 -1.01 0.00 0.00 57.07 57.66 3d69 s TYR 176 Cb -0.15 -3.16 -0.02 0.00 -0.11 0.00 0.00 41.96 38.52 3d69 s TYR 176 CO 0.01 -0.20 -0.11 -1.12 -1.11 0.00 0.00 175.55 173.01 3d69 s SER 177 N 0.31 1.30 0.19 2.29 0.01 -0.93 -3.23 113.70 113.64 3d69 s SER 177 Ca 0.50 -0.42 -0.05 0.00 1.31 0.00 0.00 55.95 57.28 3d69 s SER 177 Cb -0.25 -0.07 0.02 0.00 0.21 0.00 0.00 66.02 65.94 3d69 s SER 177 CO 0.31 -0.02 0.35 0.00 0.41 0.00 0.00 173.24 174.29 3d69 n LEU 178 N 1.96 0.00 -3.63 2.44 -0.00 -1.09 -1.35 117.00 115.33 3d69 n LEU 178 Ca -0.18 -1.34 -0.11 0.00 -0.00 0.00 0.00 56.01 54.38 3d69 n LEU 178 Cb 0.55 1.73 -0.07 0.00 -0.00 0.00 0.00 43.42 45.63 3d69 n LEU 178 CO 0.23 -0.40 0.64 -0.44 -0.00 0.00 0.00 177.39 177.41 3d69 s SER 179 N -2.05 -0.55 0.05 1.45 0.01 -1.26 -0.88 113.70 110.47 3d69 s SER 179 Ca 0.10 1.04 0.02 0.00 1.31 0.00 0.00 55.95 58.43 3d69 s SER 179 Cb -0.02 1.06 -0.04 0.00 0.21 0.00 0.00 66.02 67.23 3d69 s SER 179 CO 0.07 -0.19 0.06 -0.55 0.41 0.00 0.00 173.24 173.04 3d69 s SER 180 N 0.24 5.43 0.27 2.44 0.15 -0.87 -2.49 113.70 118.88 3d69 s SER 180 Ca 0.02 0.00 0.07 0.00 0.70 0.00 0.00 55.95 56.74 3d69 s SER 180 Cb -0.05 -1.46 -0.06 0.00 -1.71 0.00 0.00 66.02 62.75 3d69 s SER 180 CO -0.04 0.21 -0.06 0.68 1.20 0.00 0.00 173.24 175.23 3d69 s VAL 181 N -1.29 1.62 0.07 4.45 -7.23 -1.22 -1.63 120.40 115.18 3d69 s VAL 181 Ca 0.26 -2.13 -0.06 0.00 -1.81 0.00 0.00 61.98 58.24 3d69 s VAL 181 Cb -0.12 -2.42 -0.02 0.00 0.56 0.00 0.00 36.38 34.38 3d69 s VAL 181 CO 0.18 -0.32 0.10 0.54 -0.31 0.00 0.00 175.10 175.29 3d69 s VAL 182 N -3.03 0.17 -0.03 1.32 0.11 0.25 -4.09 120.40 115.10 3d69 s VAL 182 Ca 0.29 -1.42 0.02 0.00 -2.93 0.00 0.00 61.98 57.94 3d69 s VAL 182 Cb 0.03 -1.39 0.01 0.00 -1.53 0.00 0.00 36.38 33.50 3d69 s VAL 182 CO 0.11 -0.78 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.14 3d69 s THR 183 N -3.85 0.67 0.34 5.04 2.01 -1.19 -3.35 115.64 115.31 3d69 s THR 183 Ca 0.05 -0.26 -0.05 0.00 0.31 0.00 0.00 61.69 61.75 3d69 s THR 183 Cb 0.06 -0.63 0.02 0.00 0.01 0.00 0.00 72.50 71.96 3d69 s THR 183 CO -0.10 0.23 0.52 1.33 -0.69 0.00 0.00 174.62 175.91 3d69 n VAL 184 N 3.58 0.00 -2.53 3.82 0.24 -1.25 -4.89 118.33 117.30 3d69 n VAL 184 Ca -0.21 -1.49 -0.42 0.00 -2.04 0.00 0.00 64.34 60.18 3d69 n VAL 184 Cb 0.53 1.00 -0.03 0.00 -1.47 0.00 0.00 33.84 33.87 3d69 n VAL 184 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 3d69 s PRO 185 N -2.59 4.53 0.00 7.34 0.02 -1.26 -3.68 135.00 139.36 3d69 s PRO 185 Ca 0.24 1.66 0.14 0.00 0.02 0.00 0.00 61.00 63.07 3d69 s PRO 185 Cb -0.02 -3.35 0.81 0.00 0.02 0.00 0.00 34.50 31.97 3d69 s PRO 185 CO 0.18 -0.07 1.33 -1.13 -0.33 0.00 0.00 177.00 176.97 3d69 n SER 186 N 3.32 0.00 -0.07 2.53 3.41 -1.03 -3.44 113.62 118.35 3d69 n SER 186 Ca 0.06 -0.25 -0.05 0.00 -0.26 0.00 0.00 58.87 58.37 3d69 n SER 186 Cb 0.47 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.28 3d69 n SER 186 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3d69 h SER 187 N 0.00 0.00 -0.00 4.04 0.02 -1.88 -3.36 113.55 112.36 3d69 h SER 187 Ca 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 3d69 h SER 187 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3d69 h SER 187 CO 0.00 0.75 0.00 -1.54 -1.14 0.00 0.00 176.83 174.90 3d69 n SER 188 N -4.66 0.84 -4.84 3.07 3.41 -1.22 -4.85 113.62 105.38 3d69 n SER 188 Ca -0.07 -2.00 -0.32 0.00 -0.26 0.00 0.00 58.87 56.22 3d69 n SER 188 Cb 0.23 -0.42 -0.02 0.00 -0.26 0.00 0.00 64.21 63.74 3d69 n SER 188 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3d69 s LEU 189 N -0.17 3.53 0.00 1.04 2.96 -1.23 -3.23 118.68 121.58 3d69 s LEU 189 Ca 0.00 1.59 0.00 0.00 -0.22 0.00 0.00 54.13 55.50 3d69 s LEU 189 Cb 0.00 -4.51 0.00 0.00 0.50 0.00 0.00 46.19 42.18 3d69 s LEU 189 CO 0.00 -0.75 0.00 0.61 -1.32 0.00 0.00 176.35 174.89 3d69 n GLY 190 N -1.66 1.98 2.63 7.98 0.00 -1.26 -4.72 105.19 110.15 3d69 n GLY 190 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 3d69 n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d69 n THR 191 N -1.18 2.52 0.00 2.61 -2.24 -1.20 -4.95 114.28 109.83 3d69 n THR 191 Ca 0.00 -5.33 0.00 0.00 -2.27 0.00 0.00 64.05 56.45 3d69 n THR 191 Cb 0.00 -1.73 0.00 0.00 -2.10 0.00 0.00 70.33 66.50 3d69 n THR 191 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3d69 n GLN 192 N 0.36 0.00 -2.92 -0.78 -0.06 -1.25 -4.90 117.38 107.84 3d69 n GLN 192 Ca 0.30 0.00 -0.42 0.00 -2.00 0.00 0.00 57.00 54.88 3d69 n GLN 192 Cb 0.41 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.55 3d69 n GLN 192 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 3d69 s THR 193 N 0.00 4.76 -0.18 1.69 2.01 -1.26 -4.96 115.64 117.70 3d69 s THR 193 Ca 0.00 1.19 -0.07 0.00 0.31 0.00 0.00 61.69 63.12 3d69 s THR 193 Cb 0.00 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 3d69 s THR 193 CO 0.00 -0.30 0.05 -0.31 -0.69 0.00 0.00 174.62 173.36 3d69 s TYR 194 N 3.05 3.22 0.19 4.92 2.02 -1.26 -4.97 117.35 124.52 3d69 s TYR 194 Ca 0.33 0.02 -0.18 0.00 -0.37 0.00 0.00 57.07 56.87 3d69 s TYR 194 Cb -0.14 -2.05 0.03 0.00 -0.40 0.00 0.00 41.96 39.40 3d69 s TYR 194 CO 0.14 0.14 0.54 0.96 -1.57 0.00 0.00 175.55 175.75 3d69 s ILE 195 N 0.33 0.02 -0.05 2.71 -4.36 -1.26 -3.00 121.20 115.59 3d69 s ILE 195 Ca 0.02 -0.67 0.01 0.00 -0.26 0.00 0.00 60.65 59.75 3d69 s ILE 195 Cb -0.13 -1.49 -0.03 0.00 1.25 0.00 0.00 42.46 42.06 3d69 s ILE 195 CO 0.01 -0.11 -0.06 0.00 0.24 0.00 0.00 174.94 175.01 3d69 n ASN 197 N 2.04 7.01 -4.44 0.00 3.02 0.12 -4.03 115.26 118.99 3d69 n ASN 197 Ca -0.17 -3.74 -0.33 0.00 -0.03 0.00 0.00 54.58 50.31 3d69 n ASN 197 Cb 0.53 -1.04 0.13 0.00 -0.61 0.00 0.00 39.78 38.79 3d69 n ASN 197 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3d69 n VAL 198 N -0.25 0.00 -3.59 2.41 0.31 -1.06 -3.72 118.33 112.43 3d69 n VAL 198 Ca 0.47 -0.18 -0.02 0.00 -0.01 0.00 0.00 64.34 64.60 3d69 n VAL 198 Cb 0.28 -0.67 -0.05 0.00 -0.91 0.00 0.00 33.84 32.49 3d69 n VAL 198 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3d69 s ASN 199 N -2.09 -0.79 -0.27 4.52 2.47 -0.69 -3.15 114.94 114.94 3d69 s ASN 199 Ca 0.58 1.17 0.01 0.00 0.42 0.00 0.00 52.86 55.04 3d69 s ASN 199 Cb -0.21 1.63 0.05 0.00 -1.45 0.00 0.00 41.25 41.27 3d69 s ASN 199 CO 0.66 -0.17 -0.08 -2.28 -3.72 0.00 0.00 177.10 171.51 3d69 s HIS 200 N 2.05 3.22 0.02 0.43 5.65 -0.14 -1.29 115.29 125.24 3d69 s HIS 200 Ca -0.07 -2.08 -0.15 0.00 0.25 0.00 0.00 55.06 53.02 3d69 s HIS 200 Cb -0.07 -2.00 -0.08 0.00 -1.18 0.00 0.00 32.58 29.26 3d69 s HIS 200 CO -0.18 -0.84 1.22 -0.22 -0.65 0.00 0.00 174.74 174.07 3d69 h LYS 201 N 7.87 -0.50 0.00 2.88 1.63 -1.82 -1.78 116.57 124.86 3d69 h LYS 201 Ca -0.22 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.61 3d69 h LYS 201 Cb 1.06 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.80 3d69 h LYS 201 CO 0.50 -0.33 0.00 -2.30 -3.45 0.00 0.00 179.45 173.87 3d69 n PRO 202 N -3.41 0.00 0.00 1.90 -0.02 -1.26 -0.14 135.00 132.07 3d69 n PRO 202 Ca -0.06 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 3d69 n PRO 202 Cb 0.21 -1.35 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 3d69 n PRO 202 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3d69 n SER 203 N -2.24 0.00 -3.64 2.55 3.41 -1.26 -4.78 113.62 107.66 3d69 n SER 203 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 3d69 n SER 203 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3d69 n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3d69 n ASN 204 N -0.29 -4.29 -3.91 4.04 4.13 0.80 -4.91 115.26 110.83 3d69 n ASN 204 Ca 0.00 -0.84 -0.12 0.00 1.68 0.00 0.00 54.58 55.29 3d69 n ASN 204 Cb 0.00 -1.42 -0.14 0.00 -1.54 0.00 0.00 39.78 36.69 3d69 n ASN 204 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3d69 s THR 205 N -2.80 0.12 0.14 3.41 2.01 -0.67 -5.05 115.64 112.81 3d69 s THR 205 Ca 0.02 -0.23 0.04 0.00 0.31 0.00 0.00 61.69 61.83 3d69 s THR 205 Cb -0.00 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.32 3d69 s THR 205 CO 0.80 -0.07 -0.10 -0.54 -0.69 0.00 0.00 174.62 174.03 3d69 s LYS 206 N -0.31 1.04 -0.13 4.92 1.02 -1.26 -0.97 119.74 124.04 3d69 s LYS 206 Ca -0.02 -1.44 -0.21 0.00 0.02 0.00 0.00 55.97 54.31 3d69 s LYS 206 Cb -0.02 -0.57 0.05 0.00 -0.52 0.00 0.00 37.83 36.76 3d69 s LYS 206 CO -0.00 0.06 0.54 0.08 -0.92 0.00 0.00 175.35 175.11 3d69 s VAL 207 N -3.36 0.01 -0.48 3.17 1.01 -1.19 -4.99 120.40 114.57 3d69 s VAL 207 Ca 0.16 -0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.14 3d69 s VAL 207 Cb 0.03 -0.80 0.33 0.00 0.00 0.00 0.00 36.38 35.94 3d69 s VAL 207 CO 0.00 -0.05 0.80 0.47 0.00 0.00 0.00 175.10 176.32 3d69 n ASP 208 N 2.04 2.47 -4.73 3.32 8.00 -1.26 -2.55 116.55 123.85 3d69 n ASP 208 Ca -0.16 -3.29 -0.42 0.00 0.71 0.00 0.00 54.79 51.63 3d69 n ASP 208 Cb 0.56 -0.60 -0.03 0.00 -0.02 0.00 0.00 41.12 41.03 3d69 n ASP 208 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3d69 s LYS 209 N -2.74 4.36 -0.20 -1.24 2.36 -1.26 -4.86 119.74 116.16 3d69 s LYS 209 Ca 0.43 2.06 -0.15 0.00 -2.55 0.00 0.00 55.97 55.76 3d69 s LYS 209 Cb 0.29 -3.22 -0.04 0.00 -1.05 0.00 0.00 37.83 33.81 3d69 s LYS 209 CO -0.10 -0.34 0.37 0.15 1.55 0.00 0.00 175.35 176.99 3d69 s LYS 210 N 0.42 4.17 -0.32 4.03 1.02 -1.26 -3.56 119.74 124.23 3d69 s LYS 210 Ca 0.60 0.16 -0.07 0.00 0.02 0.00 0.00 55.97 56.68 3d69 s LYS 210 Cb -0.37 -3.53 0.02 0.00 -0.52 0.00 0.00 37.83 33.43 3d69 s LYS 210 CO 0.35 -0.02 0.11 0.08 -0.92 0.00 0.00 175.35 174.94 3d69 s VAL 211 N 1.27 3.98 0.29 3.17 1.01 -1.16 -4.85 120.40 124.10 3d69 s VAL 211 Ca 0.18 -0.88 0.11 0.00 0.00 0.00 0.00 61.98 61.40 3d69 s VAL 211 Cb -0.15 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 3d69 s VAL 211 CO 0.08 -0.06 -0.15 -1.61 0.00 0.00 0.00 175.10 173.36 3d69 s GLU 212 N 1.47 1.80 0.29 2.72 0.41 -1.26 -4.52 118.70 119.61 3d69 s GLU 212 Ca 0.01 -1.75 -0.28 0.00 -0.41 0.00 0.00 54.97 52.54 3d69 s GLU 212 Cb -0.18 -1.82 -0.14 0.00 -1.78 0.00 0.00 34.13 30.21 3d69 s GLU 212 CO 0.03 0.29 0.95 -2.30 -0.49 0.00 0.00 175.26 173.75 3d69 n PRO 213 N -0.70 1.21 -2.55 0.39 -0.02 -1.26 -4.63 135.00 127.44 3d69 n PRO 213 Ca -0.05 0.43 -0.43 0.00 -2.02 0.00 0.00 63.50 61.43 3d69 n PRO 213 Cb 0.61 -1.77 -0.02 0.00 -0.02 0.00 0.00 33.50 32.29 3d69 n PRO 213 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3d69 s LYS 214 N -1.54 3.60 0.00 -0.52 2.20 -1.26 -5.00 119.74 117.22 3d69 s LYS 214 Ca 0.59 0.47 0.00 0.00 -0.36 0.00 0.00 55.97 56.67 3d69 s LYS 214 Cb -0.71 -3.97 0.00 0.00 -1.51 0.00 0.00 37.83 31.64 3d69 s LYS 214 CO 0.59 -1.56 0.00 0.45 -0.36 0.00 0.00 175.35 174.48 3d69 n SER 215 N 8.29 0.00 -4.40 1.43 2.88 -1.26 -5.05 113.62 115.50 3d69 n SER 215 Ca 0.11 -0.34 -0.33 0.00 -1.33 0.00 0.00 58.87 56.98 3d69 n SER 215 Cb 0.49 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 64.08 3d69 n SER 215 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81