#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2or7 n GLU 2 N 0.00 0.00 0.00 0.03 -0.00 -1.26 -5.01 120.64 114.40 2or7 n GLU 2 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 57.16 57.14 2or7 n GLU 2 Cb 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 31.44 31.47 2or7 n GLU 2 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2or7 n SER 3 N -0.18 0.00 -1.20 -1.84 3.41 -1.26 -5.21 113.62 107.34 2or7 n SER 3 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 2or7 n SER 3 Cb 0.01 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.96 2or7 n SER 3 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2or7 n HIS 4 N -0.30 -0.28 -4.55 7.33 8.25 -1.26 -4.83 115.22 119.58 2or7 n HIS 4 Ca 0.00 -0.25 -0.31 0.00 -0.26 0.00 0.00 57.72 56.90 2or7 n HIS 4 Cb 0.00 0.04 -0.17 0.00 1.12 0.00 0.00 29.99 30.98 2or7 n HIS 4 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2or7 s THR 5 N -2.28 1.87 -1.23 1.59 2.01 -1.04 -4.91 115.64 111.65 2or7 s THR 5 Ca 0.03 -0.86 -0.18 0.00 0.31 0.00 0.00 61.69 60.99 2or7 s THR 5 Cb 0.00 -1.67 0.08 0.00 0.01 0.00 0.00 72.50 70.92 2or7 s THR 5 CO 0.02 0.51 1.63 0.00 -0.69 0.00 0.00 174.62 176.10 2or7 s ALA 6 N 0.93 3.31 0.26 7.40 0.00 -1.26 -0.55 121.76 131.84 2or7 s ALA 6 Ca -0.06 -2.86 -0.30 0.00 0.00 0.00 0.00 51.96 48.74 2or7 s ALA 6 Cb -0.15 -4.54 -0.09 0.00 0.00 0.00 0.00 23.12 18.34 2or7 s ALA 6 CO -0.03 -3.27 1.01 0.08 0.00 0.00 0.00 175.76 173.55 2or7 s VAL 7 N 3.95 3.82 -0.14 0.00 1.01 -0.65 -4.91 120.40 123.49 2or7 s VAL 7 Ca 0.50 1.83 -0.02 0.00 0.00 0.00 0.00 61.98 64.29 2or7 s VAL 7 Cb 0.02 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 2or7 s VAL 7 CO 0.03 0.44 -0.06 -1.10 0.00 0.00 0.00 175.10 174.41 2or7 s GLN 8 N -1.28 3.50 0.27 2.72 -1.52 -1.26 -0.91 119.66 121.18 2or7 s GLN 8 Ca 0.43 -0.55 0.05 0.00 -1.95 0.00 0.00 55.36 53.33 2or7 s GLN 8 Cb -0.29 -2.82 -0.06 0.00 -0.22 0.00 0.00 33.01 29.63 2or7 s GLN 8 CO 0.36 0.29 -0.03 0.20 -0.25 0.00 0.00 175.29 175.87 2or7 s GLY 9 N 0.20 1.78 -0.13 3.09 0.00 0.10 -4.96 107.32 107.40 2or7 s GLY 9 Ca -0.03 -1.88 0.02 0.00 0.00 0.00 0.00 44.72 42.83 2or7 s GLY 9 CO 0.03 -1.78 -0.20 -2.27 0.00 0.00 0.00 173.10 168.88 2or7 s LEU 10 N -3.41 1.99 0.19 0.66 2.96 -1.26 -0.93 118.68 118.89 2or7 s LEU 10 Ca 0.30 -0.55 -0.32 0.00 -0.22 0.00 0.00 54.13 53.33 2or7 s LEU 10 Cb 0.05 -1.34 -0.15 0.00 0.50 0.00 0.00 46.19 45.25 2or7 s LEU 10 CO 0.11 0.06 1.29 0.00 -1.32 0.00 0.00 176.35 176.49 2or7 n ALA 11 N 4.13 0.06 -0.34 5.97 0.00 0.52 -1.25 120.51 129.60 2or7 n ALA 11 Ca -0.20 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2or7 n ALA 11 Cb 0.51 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.82 2or7 n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2or7 n GLY 12 N 2.17 0.91 3.33 0.00 0.00 0.18 -4.51 105.19 107.26 2or7 n GLY 12 Ca 0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 2or7 n GLY 12 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2or7 s HIS 13 N -2.81 1.61 0.60 1.61 3.76 -0.38 -4.64 115.29 115.04 2or7 s HIS 13 Ca 0.00 -0.64 -0.13 0.00 -0.15 0.00 0.00 55.06 54.14 2or7 s HIS 13 Cb 0.00 -0.78 -0.04 0.00 1.11 0.00 0.00 32.58 32.87 2or7 s HIS 13 CO 0.00 0.28 1.03 -1.25 -0.85 0.00 0.00 174.74 173.94 2or7 s PRO 14 N -3.68 3.55 0.01 8.40 0.04 -1.26 -2.48 135.00 139.57 2or7 s PRO 14 Ca 0.22 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.16 2or7 s PRO 14 Cb 0.01 -2.07 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 2or7 s PRO 14 CO 0.06 -0.61 -0.01 0.54 0.04 0.00 0.00 177.00 177.01 2or7 s VAL 15 N -2.91 0.05 -0.08 -0.36 0.11 -0.62 -4.76 120.40 111.83 2or7 s VAL 15 Ca 0.58 -0.37 0.05 0.00 -2.93 0.00 0.00 61.98 59.30 2or7 s VAL 15 Cb -0.12 -0.12 -0.01 0.00 -1.53 0.00 0.00 36.38 34.60 2or7 s VAL 15 CO 0.46 -0.20 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.91 2or7 s THR 16 N -0.59 2.21 -0.36 5.04 2.01 -1.26 -0.56 115.64 122.13 2or7 s THR 16 Ca -0.06 -0.99 -0.07 0.00 0.31 0.00 0.00 61.69 60.87 2or7 s THR 16 Cb -0.04 -1.83 0.05 0.00 0.01 0.00 0.00 72.50 70.69 2or7 s THR 16 CO -0.00 0.56 0.15 -0.76 -0.69 0.00 0.00 174.62 173.88 2or7 s LEU 17 N 0.03 4.61 0.18 4.42 1.43 0.89 -4.97 118.68 125.27 2or7 s LEU 17 Ca -0.09 -1.28 -0.31 0.00 -1.03 0.00 0.00 54.13 51.42 2or7 s LEU 17 Cb -0.15 -1.90 -0.10 0.00 0.03 0.00 0.00 46.19 44.07 2or7 s LEU 17 CO 0.05 -0.40 1.52 -2.16 0.23 0.00 0.00 176.35 175.60 2or7 s PRO 18 N 1.40 4.24 -0.20 1.29 0.04 -1.26 -1.67 135.00 138.83 2or7 s PRO 18 Ca 0.00 2.32 -0.04 0.00 0.04 0.00 0.00 61.00 63.32 2or7 s PRO 18 Cb -0.21 -3.15 0.10 0.00 0.04 0.00 0.00 34.50 31.28 2or7 s PRO 18 CO 0.02 -0.55 0.31 0.00 0.04 0.00 0.00 177.00 176.82 2or7 s ILE 20 N 2.46 0.12 0.06 0.00 1.01 -1.26 -1.10 121.20 122.48 2or7 s ILE 20 Ca 0.07 -0.86 -0.12 0.00 0.00 0.00 0.00 60.65 59.74 2or7 s ILE 20 Cb -0.14 -0.26 0.01 0.00 0.01 0.00 0.00 42.46 42.08 2or7 s ILE 20 CO -0.13 -0.46 0.26 -0.72 0.00 0.00 0.00 174.94 173.89 2or7 s TYR 21 N -1.36 -0.01 -0.30 3.97 -0.85 -0.69 -5.01 117.35 113.09 2or7 s TYR 21 Ca -0.15 -0.22 -0.29 0.00 -0.52 0.00 0.00 57.07 55.89 2or7 s TYR 21 Cb -0.09 0.04 0.02 0.00 0.38 0.00 0.00 41.96 42.30 2or7 s TYR 21 CO -0.01 -0.51 1.06 0.45 -1.52 0.00 0.00 175.55 175.02 2or7 s SER 22 N -2.31 6.97 0.44 -0.18 0.15 -1.26 -4.36 113.70 113.14 2or7 s SER 22 Ca -0.02 1.13 0.24 0.00 0.70 0.00 0.00 55.95 57.99 2or7 s SER 22 Cb 0.01 -2.54 0.51 0.00 -1.71 0.00 0.00 66.02 62.28 2or7 s SER 22 CO -0.06 -0.82 1.66 0.71 1.20 0.00 0.00 173.24 175.93 2or7 h THR 23 N 5.66 0.15 -0.11 6.45 1.35 -1.82 -1.10 112.91 123.49 2or7 h THR 23 Ca -0.20 -1.09 -0.13 0.00 -0.55 0.00 0.00 66.41 64.44 2or7 h THR 23 Cb 1.06 1.96 -0.01 0.00 -1.73 0.00 0.00 68.15 69.43 2or7 h THR 23 CO 1.02 0.08 -0.52 0.45 -0.25 0.00 0.00 175.52 176.30 2or7 h HIS 24 N 0.00 0.37 0.02 4.73 3.86 -1.91 0.24 115.15 122.47 2or7 h HIS 24 Ca -0.00 -0.12 -0.32 0.00 -1.16 0.00 0.00 60.37 58.77 2or7 h HIS 24 Cb 0.96 -0.07 -0.05 0.00 1.06 0.00 0.00 27.41 29.31 2or7 h HIS 24 CO 0.00 0.76 -1.89 1.28 0.86 0.00 0.00 177.93 178.93 2or7 n LEU 25 N -3.95 1.15 -0.47 2.43 7.99 -1.18 -4.45 117.00 118.53 2or7 n LEU 25 Ca -0.02 0.29 0.06 0.00 -0.01 0.00 0.00 56.01 56.33 2or7 n LEU 25 Cb 0.56 -0.06 0.06 0.00 -0.11 0.00 0.00 43.42 43.87 2or7 n LEU 25 CO 0.44 0.51 0.45 0.61 -1.51 0.00 0.00 177.39 177.89 2or7 n GLY 26 N 1.69 0.05 0.82 -0.72 0.00 -0.42 -5.10 105.19 101.51 2or7 n GLY 26 Ca -0.23 -0.33 0.03 0.00 0.00 0.00 0.00 46.02 45.50 2or7 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2or7 n GLY 27 N 0.61 -2.17 3.42 -0.02 0.00 0.85 -4.65 105.19 103.22 2or7 n GLY 27 Ca 0.07 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.21 2or7 n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2or7 s ILE 28 N -1.14 5.05 0.26 -0.61 1.01 -1.26 -4.39 121.20 120.12 2or7 s ILE 28 Ca 0.00 -0.78 0.07 0.00 0.00 0.00 0.00 60.65 59.94 2or7 s ILE 28 Cb 0.00 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 2or7 s ILE 28 CO 0.00 -0.33 -0.08 0.68 0.00 0.00 0.00 174.94 175.22 2or7 s VAL 29 N 1.64 1.62 0.68 2.92 -7.23 -1.26 -4.85 120.40 113.91 2or7 s VAL 29 Ca 0.04 -2.14 -0.16 0.00 -1.81 0.00 0.00 61.98 57.91 2or7 s VAL 29 Cb -0.20 -2.33 0.01 0.00 0.56 0.00 0.00 36.38 34.42 2or7 s VAL 29 CO 0.09 -0.38 1.17 -2.84 -0.31 0.00 0.00 175.10 172.82 2or7 s PRO 30 N -3.72 2.53 0.11 4.82 0.02 -1.26 -3.72 135.00 133.78 2or7 s PRO 30 Ca 0.28 1.62 -0.07 0.00 0.02 0.00 0.00 61.00 62.85 2or7 s PRO 30 Cb 0.03 -1.89 -0.01 0.00 0.02 0.00 0.00 34.50 32.64 2or7 s PRO 30 CO 0.10 -1.51 0.18 0.00 -0.33 0.00 0.00 177.00 175.44 2or7 s MET 31 N -3.88 0.91 0.03 5.54 0.23 -1.25 -1.30 119.30 119.57 2or7 s MET 31 Ca 0.72 -1.09 -0.09 0.00 -1.03 0.00 0.00 55.69 54.20 2or7 s MET 31 Cb -0.26 0.33 0.00 0.00 -1.53 0.00 0.00 34.83 33.37 2or7 s MET 31 CO 0.42 -0.29 0.17 0.00 -2.03 0.00 0.00 175.02 173.29 2or7 s TRP 33 N -2.23 2.74 0.10 0.00 0.52 -0.65 -1.05 118.94 118.37 2or7 s TRP 33 Ca -0.08 -0.32 0.03 0.00 0.02 0.00 0.00 56.10 55.76 2or7 s TRP 33 Cb -0.03 -1.70 -0.04 0.00 -1.15 0.00 0.00 33.47 30.55 2or7 s TRP 33 CO -0.02 0.06 -0.08 0.20 0.02 0.00 0.00 176.95 177.12 2or7 s GLY 34 N -0.37 0.83 0.06 0.98 0.00 -0.10 -0.08 107.32 108.63 2or7 s GLY 34 Ca 0.04 -1.27 -0.27 0.00 0.00 0.00 0.00 44.72 43.22 2or7 s GLY 34 CO 0.02 -1.36 0.84 1.08 0.00 0.00 0.00 173.10 173.68 2or7 s LEU 35 N -2.75 4.45 0.00 0.66 1.43 -0.82 -1.37 118.68 120.28 2or7 s LEU 35 Ca 0.09 1.55 0.00 0.00 -1.03 0.00 0.00 54.13 54.74 2or7 s LEU 35 Cb 0.01 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.87 2or7 s LEU 35 CO -0.02 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.14 2or7 n GLY 36 N 2.42 0.83 3.79 -3.19 0.00 0.50 -4.69 105.19 104.85 2or7 n GLY 36 Ca -0.00 -2.11 -0.33 0.00 0.00 0.00 0.00 46.02 43.58 2or7 n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2or7 s GLU 37 N -1.34 3.18 0.42 1.61 2.02 -1.26 -2.53 118.70 120.81 2or7 s GLU 37 Ca 0.00 1.29 -0.26 0.00 0.02 0.00 0.00 54.97 56.01 2or7 s GLU 37 Cb 0.00 -2.01 -0.09 0.00 0.10 0.00 0.00 34.13 32.13 2or7 s GLU 37 CO 0.00 -0.93 1.43 0.00 0.02 0.00 0.00 175.26 175.78 2or7 n ARG 39 N 0.07 -1.80 0.00 0.00 5.12 -1.26 -4.49 116.66 114.31 2or7 n ARG 39 Ca 0.03 1.37 0.00 0.00 -1.93 0.00 0.00 57.85 57.32 2or7 n ARG 39 Cb 0.41 -3.41 0.00 0.00 -1.16 0.00 0.00 32.46 28.31 2or7 n ARG 39 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2or7 n HIS 40 N -1.21 0.00 -3.09 -1.55 8.25 -1.24 -4.87 115.22 111.50 2or7 n HIS 40 Ca -0.11 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.13 2or7 n HIS 40 Cb 0.62 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.69 2or7 n HIS 40 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2or7 n SER 41 N 0.00 2.61 -1.87 0.41 2.88 -0.45 -4.72 113.62 112.48 2or7 n SER 41 Ca 0.00 -3.33 -0.08 0.00 -1.33 0.00 0.00 58.87 54.13 2or7 n SER 41 Cb 0.00 -0.60 -0.12 0.00 -0.75 0.00 0.00 64.21 62.74 2or7 n SER 41 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2or7 n TYR 42 N 0.12 0.00 -2.67 0.66 9.36 -1.26 -4.35 117.16 119.01 2or7 n TYR 42 Ca 0.28 -1.33 -0.05 0.00 3.32 0.00 0.00 57.90 60.11 2or7 n TYR 42 Cb 0.52 -1.27 0.02 0.00 -0.63 0.00 0.00 39.34 37.98 2or7 n TYR 42 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2or7 h ILE 44 N -0.54 1.25 -2.63 0.00 6.09 -1.85 -3.04 117.51 116.80 2or7 h ILE 44 Ca -0.13 -1.18 -0.62 0.00 -1.37 0.00 0.00 64.86 61.57 2or7 h ILE 44 Cb 1.08 1.34 -0.41 0.00 0.47 0.00 0.00 36.82 39.30 2or7 h ILE 44 CO 0.13 0.37 -0.53 0.54 -3.07 0.00 0.00 178.15 175.58 2or7 n ARG 45 N -4.15 2.29 -2.01 2.19 5.12 -1.26 -5.09 116.66 113.75 2or7 n ARG 45 Ca -0.00 -4.59 -0.40 0.00 -1.93 0.00 0.00 57.85 50.92 2or7 n ARG 45 Cb 0.38 -2.28 -0.01 0.00 -1.16 0.00 0.00 32.46 29.39 2or7 n ARG 45 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2or7 s SER 46 N -1.96 6.37 -0.10 0.55 0.15 -1.15 -1.95 113.70 115.60 2or7 s SER 46 Ca 0.33 2.73 0.05 0.00 0.70 0.00 0.00 55.95 59.76 2or7 s SER 46 Cb 0.06 -2.65 -0.10 0.00 -1.71 0.00 0.00 66.02 61.62 2or7 s SER 46 CO -0.08 -0.82 -0.02 0.18 1.20 0.00 0.00 173.24 173.70 2or7 n LEU 47 N 0.27 1.22 -3.81 3.45 4.77 0.89 -4.51 117.00 119.28 2or7 n LEU 47 Ca 0.03 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 2or7 n LEU 47 Cb 0.43 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.38 2or7 n LEU 47 CO 0.58 0.42 -0.09 -0.63 -1.33 0.00 0.00 177.39 176.34 2or7 s ILE 48 N -2.23 0.04 -0.01 -0.08 -1.09 -1.17 -1.06 121.20 115.60 2or7 s ILE 48 Ca -0.09 -0.34 0.00 0.00 -2.23 0.00 0.00 60.65 57.99 2or7 s ILE 48 Cb 0.03 -0.43 0.01 0.00 -1.58 0.00 0.00 42.46 40.48 2or7 s ILE 48 CO 0.34 -0.18 -0.00 0.26 -1.23 0.00 0.00 174.94 174.12 2or7 s TRP 49 N -0.70 0.12 0.32 3.97 0.52 -0.41 -1.63 118.94 121.12 2or7 s TRP 49 Ca -0.08 0.00 0.06 0.00 0.02 0.00 0.00 56.10 56.10 2or7 s TRP 49 Cb -0.04 -0.13 -0.06 0.00 -1.15 0.00 0.00 33.47 32.09 2or7 s TRP 49 CO 0.02 -0.03 -0.01 0.95 0.02 0.00 0.00 176.95 177.90 2or7 s THR 50 N 0.23 1.58 -0.47 2.01 -4.23 -0.57 0.01 115.64 114.20 2or7 s THR 50 Ca -0.02 -2.06 0.15 0.00 -1.18 0.00 0.00 61.69 58.58 2or7 s THR 50 Cb -0.04 -2.68 0.51 0.00 1.34 0.00 0.00 72.50 71.64 2or7 s THR 50 CO -0.01 -0.14 1.42 -0.46 -0.54 0.00 0.00 174.62 174.90 2or7 n ASN 51 N -0.70 3.86 0.00 3.99 6.94 -0.91 -3.82 115.26 124.62 2or7 n ASN 51 Ca -0.04 -2.70 0.00 0.00 -0.02 0.00 0.00 54.58 51.82 2or7 n ASN 51 Cb 0.65 -0.48 0.00 0.00 -2.36 0.00 0.00 39.78 37.59 2or7 n ASN 51 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2or7 n GLY 52 N -0.01 2.93 0.00 4.83 0.00 -1.24 -4.36 105.19 107.34 2or7 n GLY 52 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2or7 n GLY 52 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2or7 n TYR 53 N -0.70 0.00 -3.90 1.61 4.02 -1.26 -3.91 117.16 113.01 2or7 n TYR 53 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 2or7 n TYR 53 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.24 2or7 n TYR 53 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2or7 s THR 54 N -1.94 0.15 -0.05 -0.72 -4.23 -1.26 -4.21 115.64 103.38 2or7 s THR 54 Ca 0.00 -1.22 -0.30 0.00 -1.18 0.00 0.00 61.69 58.99 2or7 s THR 54 Cb 0.00 -1.23 -0.04 0.00 1.34 0.00 0.00 72.50 72.56 2or7 s THR 54 CO 0.00 -0.67 1.37 -0.69 -0.54 0.00 0.00 174.62 174.09 2or7 s VAL 55 N -3.48 3.92 -0.77 2.29 1.01 -1.26 -2.14 120.40 119.96 2or7 s VAL 55 Ca 0.02 1.23 0.16 0.00 0.00 0.00 0.00 61.98 63.39 2or7 s VAL 55 Cb 0.04 -3.79 -0.18 0.00 0.00 0.00 0.00 36.38 32.45 2or7 s VAL 55 CO -0.09 -0.04 0.70 0.35 0.00 0.00 0.00 175.10 176.02 2or7 n THR 56 N 4.93 0.00 -3.63 3.92 -2.24 0.10 -4.96 114.28 112.40 2or7 n THR 56 Ca 0.13 -0.11 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 2or7 n THR 56 Cb 0.44 1.00 -0.07 0.00 -2.10 0.00 0.00 70.33 69.60 2or7 n THR 56 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2or7 s HIS 57 N -2.55 -0.82 -0.03 4.78 5.65 -1.11 -4.97 115.29 116.25 2or7 s HIS 57 Ca 0.06 1.95 -0.02 0.00 0.25 0.00 0.00 55.06 57.30 2or7 s HIS 57 Cb 0.12 0.31 0.02 0.00 -1.18 0.00 0.00 32.58 31.85 2or7 s HIS 57 CO 0.67 -0.40 0.07 1.14 -0.65 0.00 0.00 174.74 175.58 2or7 s GLN 58 N 0.52 0.05 0.18 2.88 -2.07 -1.26 -1.29 119.66 118.68 2or7 s GLN 58 Ca -0.01 0.18 -0.13 0.00 -1.82 0.00 0.00 55.36 53.58 2or7 s GLN 58 Cb -0.05 -0.08 0.13 0.00 -1.09 0.00 0.00 33.01 31.91 2or7 s GLN 58 CO -0.01 -0.08 1.81 -0.09 -1.32 0.00 0.00 175.29 175.59 2or7 h ARG 59 N 6.63 0.59 -2.79 9.60 2.43 -1.33 -3.46 114.38 126.05 2or7 h ARG 59 Ca -0.34 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 58.89 2or7 h ARG 59 Cb 1.17 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.54 2or7 h ARG 59 CO 0.46 0.39 0.33 0.54 -1.51 0.00 0.00 179.97 180.18 2or7 s ASN 60 N -5.57 -0.18 0.09 -3.80 2.20 -1.26 -5.04 114.94 101.37 2or7 s ASN 60 Ca -0.13 -0.63 0.08 0.00 -0.94 0.00 0.00 52.86 51.24 2or7 s ASN 60 Cb 0.14 0.67 0.41 0.00 -2.00 0.00 0.00 41.25 40.47 2or7 s ASN 60 CO 0.74 -1.26 1.26 -1.54 -2.94 0.00 0.00 177.10 173.37 2or7 n SER 61 N -0.64 0.17 0.23 3.54 3.41 -1.26 -2.39 113.62 116.68 2or7 n SER 61 Ca -0.05 0.57 0.15 0.00 -0.26 0.00 0.00 58.87 59.28 2or7 n SER 61 Cb 0.60 -0.60 0.49 0.00 -0.26 0.00 0.00 64.21 64.44 2or7 n SER 61 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2or7 h ARG 62 N 0.00 0.00 -4.84 4.33 3.08 -1.94 -3.42 114.38 111.59 2or7 h ARG 62 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.39 2or7 h ARG 62 Cb 0.06 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 29.90 2or7 h ARG 62 CO 0.00 0.00 -0.55 0.71 -1.07 0.00 0.00 179.97 179.06 2or7 s TYR 63 N -3.45 3.18 0.05 3.04 1.51 -1.01 -0.49 117.35 120.19 2or7 s TYR 63 Ca 0.04 -0.30 0.04 0.00 -1.01 0.00 0.00 57.07 55.84 2or7 s TYR 63 Cb 0.08 -2.36 -0.02 0.00 -0.11 0.00 0.00 41.96 39.55 2or7 s TYR 63 CO 0.57 -0.34 -0.12 -0.65 -1.11 0.00 0.00 175.55 173.90 2or7 s GLN 64 N 1.67 0.72 -0.41 -0.62 -1.52 -0.16 -4.89 119.66 114.45 2or7 s GLN 64 Ca 0.06 -0.80 -0.04 0.00 -1.95 0.00 0.00 55.36 52.63 2or7 s GLN 64 Cb -0.16 -0.65 0.11 0.00 -0.22 0.00 0.00 33.01 32.09 2or7 s GLN 64 CO 0.08 0.14 0.22 -0.51 -0.25 0.00 0.00 175.29 174.97 2or7 s LEU 65 N -1.47 5.27 0.00 2.90 1.43 -1.26 -0.15 118.68 125.41 2or7 s LEU 65 Ca -0.04 -2.00 0.25 0.00 -1.03 0.00 0.00 54.13 51.32 2or7 s LEU 65 Cb -0.09 -1.85 0.54 0.00 0.03 0.00 0.00 46.19 44.82 2or7 s LEU 65 CO 0.01 -0.55 1.43 0.29 0.23 0.00 0.00 176.35 177.76 2or7 n LYS 66 N 4.63 0.27 -1.77 1.70 5.02 -1.26 -4.95 118.16 121.80 2or7 n LYS 66 Ca -0.03 -0.16 -0.17 0.00 -2.02 0.00 0.00 58.31 55.92 2or7 n LYS 66 Cb 0.41 -1.50 0.10 0.00 -0.02 0.00 0.00 35.03 34.03 2or7 n LYS 66 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2or7 n GLY 67 N 1.45 0.07 3.53 0.72 0.00 -1.26 -4.98 105.19 104.72 2or7 n GLY 67 Ca 0.07 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 2or7 n GLY 67 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2or7 s ASN 68 N -3.98 6.41 0.14 1.61 3.04 -1.25 -4.89 114.94 116.02 2or7 s ASN 68 Ca 0.48 -1.28 -0.22 0.00 0.04 0.00 0.00 52.86 51.87 2or7 s ASN 68 Cb -0.02 -2.52 -0.01 0.00 -1.54 0.00 0.00 41.25 37.16 2or7 s ASN 68 CO 0.32 -1.50 1.66 0.40 -3.04 0.00 0.00 177.10 174.94 2or7 h ILE 69 N 6.37 0.54 0.00 -5.21 2.04 -1.83 -1.96 117.51 117.47 2or7 h ILE 69 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 2or7 h ILE 69 Cb 1.03 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 2or7 h ILE 69 CO 1.31 0.00 0.00 0.77 0.00 0.00 0.00 178.15 180.23 2or7 h SER 70 N -0.20 0.00 -0.40 1.72 4.64 -1.73 0.01 113.55 117.58 2or7 h SER 70 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2or7 h SER 70 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2or7 h SER 70 CO -0.28 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.06 2or7 n GLU 71 N -2.52 2.33 0.00 4.77 1.02 -0.80 -4.94 120.64 120.50 2or7 n GLU 71 Ca -0.01 -2.03 0.00 0.00 -0.02 0.00 0.00 57.16 55.10 2or7 n GLU 71 Cb 0.10 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2or7 n GLU 71 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2or7 n GLY 72 N 1.43 0.37 3.40 0.62 0.00 -0.01 -4.63 105.19 106.37 2or7 n GLY 72 Ca 0.19 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.76 2or7 n GLY 72 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2or7 s ASN 73 N -2.63 6.39 -0.38 1.61 3.04 -0.81 -1.71 114.94 120.46 2or7 s ASN 73 Ca 0.00 -1.72 0.06 0.00 0.04 0.00 0.00 52.86 51.24 2or7 s ASN 73 Cb 0.00 -2.33 0.50 0.00 -1.54 0.00 0.00 41.25 37.88 2or7 s ASN 73 CO 0.00 -1.08 1.55 1.33 -3.04 0.00 0.00 177.10 175.86 2or7 n VAL 74 N 5.37 2.81 -1.99 -5.21 0.24 -0.26 -3.32 118.33 115.96 2or7 n VAL 74 Ca 0.04 -3.07 -0.41 0.00 -2.04 0.00 0.00 64.34 58.87 2or7 n VAL 74 Cb 0.45 -0.67 -0.01 0.00 -1.47 0.00 0.00 33.84 32.14 2or7 n VAL 74 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2or7 s SER 75 N -2.56 6.60 -0.11 -1.34 0.01 -0.95 -4.58 113.70 110.77 2or7 s SER 75 Ca 0.51 2.82 -0.15 0.00 1.31 0.00 0.00 55.95 60.44 2or7 s SER 75 Cb 0.43 -2.65 -0.05 0.00 0.21 0.00 0.00 66.02 63.96 2or7 s SER 75 CO 0.01 -0.67 0.39 -0.22 0.41 0.00 0.00 173.24 173.15 2or7 s LEU 76 N -1.78 4.31 -0.17 2.44 2.96 -0.67 -4.21 118.68 121.56 2or7 s LEU 76 Ca 0.51 0.73 -0.02 0.00 -0.22 0.00 0.00 54.13 55.14 2or7 s LEU 76 Cb -0.42 -2.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.72 2or7 s LEU 76 CO 0.56 0.12 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.72 2or7 s THR 77 N 0.12 3.07 -0.29 3.68 2.01 0.79 -0.07 115.64 124.95 2or7 s THR 77 Ca 0.22 -0.62 -0.09 0.00 0.31 0.00 0.00 61.69 61.50 2or7 s THR 77 Cb -0.15 -2.34 -0.02 0.00 0.01 0.00 0.00 72.50 70.01 2or7 s THR 77 CO 0.09 0.49 0.13 -0.63 -0.69 0.00 0.00 174.62 174.00 2or7 s ILE 78 N 0.93 4.55 0.43 1.82 1.01 0.27 -0.99 121.20 129.21 2or7 s ILE 78 Ca -0.02 -0.30 -0.13 0.00 0.00 0.00 0.00 60.65 60.20 2or7 s ILE 78 Cb -0.15 -3.25 -0.07 0.00 0.01 0.00 0.00 42.46 39.00 2or7 s ILE 78 CO -0.00 0.17 0.83 -1.61 0.00 0.00 0.00 174.94 174.32 2or7 s GLU 79 N 1.62 3.85 -1.09 2.79 0.41 0.36 -1.59 118.70 125.05 2or7 s GLU 79 Ca 0.05 0.63 -0.30 0.00 -0.41 0.00 0.00 54.97 54.94 2or7 s GLU 79 Cb -0.16 -2.32 0.04 0.00 -1.78 0.00 0.00 34.13 29.90 2or7 s GLU 79 CO 0.06 -0.08 0.62 -1.71 -0.49 0.00 0.00 175.26 173.66 2or7 n ASN 80 N -1.27 -3.85 -4.74 -0.19 5.15 -1.26 -4.87 115.26 104.24 2or7 n ASN 80 Ca 0.04 -1.19 -0.33 0.00 -0.60 0.00 0.00 54.58 52.50 2or7 n ASN 80 Cb 0.54 -1.46 0.09 0.00 -0.53 0.00 0.00 39.78 38.41 2or7 n ASN 80 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2or7 s THR 81 N -3.56 2.70 0.17 -0.44 -4.23 -1.03 -4.62 115.64 104.62 2or7 s THR 81 Ca 0.41 0.30 0.06 0.00 -1.18 0.00 0.00 61.69 61.29 2or7 s THR 81 Cb -0.23 -2.77 -0.04 0.00 1.34 0.00 0.00 72.50 70.80 2or7 s THR 81 CO 0.90 -0.22 -0.13 0.68 -0.54 0.00 0.00 174.62 175.31 2or7 s VAL 82 N -2.31 1.46 0.40 2.29 -7.23 -1.26 0.48 120.40 114.22 2or7 s VAL 82 Ca 0.69 -2.07 0.12 0.00 -1.81 0.00 0.00 61.98 58.91 2or7 s VAL 82 Cb -0.24 -1.88 0.33 0.00 0.56 0.00 0.00 36.38 35.15 2or7 s VAL 82 CO 0.47 -0.62 1.91 0.58 -0.31 0.00 0.00 175.10 177.14 2or7 h VAL 83 N 2.81 0.85 0.00 1.32 2.07 -1.90 -0.04 116.25 121.36 2or7 h VAL 83 Ca -0.38 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2or7 h VAL 83 Cb 1.20 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2or7 h VAL 83 CO 0.61 0.10 0.00 0.61 0.02 0.00 0.00 177.57 178.91 2or7 n GLY 84 N -1.48 -0.54 0.03 2.17 0.00 -1.26 -1.59 105.19 102.52 2or7 n GLY 84 Ca 0.14 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.27 2or7 n GLY 84 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2or7 n ASP 85 N -1.32 0.21 -4.69 1.61 8.00 -0.03 -4.93 116.55 115.40 2or7 n ASP 85 Ca 0.03 -0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.20 2or7 n ASP 85 Cb 0.06 -0.22 0.14 0.00 -0.02 0.00 0.00 41.12 41.08 2or7 n ASP 85 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2or7 s GLY 86 N -2.80 1.93 0.00 0.44 0.00 -0.62 -4.91 107.32 101.36 2or7 s GLY 86 Ca 0.19 0.71 0.00 0.00 0.00 0.00 0.00 44.72 45.62 2or7 s GLY 86 CO 0.54 1.12 0.00 0.61 0.00 0.00 0.00 173.10 175.37 2or7 n GLY 87 N 0.29 0.46 3.77 0.20 0.00 0.08 -4.93 105.19 105.05 2or7 n GLY 87 Ca 0.13 -2.27 -0.39 0.00 0.00 0.00 0.00 46.02 43.49 2or7 n GLY 87 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2or7 s PRO 88 N -0.44 4.47 0.07 1.61 0.04 -1.26 -0.52 135.00 138.97 2or7 s PRO 88 Ca 0.00 1.69 0.01 0.00 0.04 0.00 0.00 61.00 62.75 2or7 s PRO 88 Cb 0.00 -2.96 -0.03 0.00 0.04 0.00 0.00 34.50 31.55 2or7 s PRO 88 CO 0.00 0.09 -0.06 0.71 0.04 0.00 0.00 177.00 177.77 2or7 s TYR 89 N -1.34 0.72 -0.02 0.56 1.51 -0.19 -0.37 117.35 118.23 2or7 s TYR 89 Ca 0.49 -0.75 0.01 0.00 -1.01 0.00 0.00 57.07 55.82 2or7 s TYR 89 Cb -0.28 -0.44 0.01 0.00 -0.11 0.00 0.00 41.96 41.14 2or7 s TYR 89 CO 0.36 -0.15 -0.04 0.00 -1.11 0.00 0.00 175.55 174.61 2or7 s VAL 92 N 0.29 1.18 -0.28 0.00 1.01 -0.22 -1.69 120.40 120.69 2or7 s VAL 92 Ca -0.03 -0.54 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 2or7 s VAL 92 Cb -0.14 -1.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 2or7 s VAL 92 CO 0.03 0.25 0.09 -0.69 0.00 0.00 0.00 175.10 174.78 2or7 s VAL 93 N 1.62 4.21 -1.55 2.92 1.01 0.12 -1.07 120.40 127.66 2or7 s VAL 93 Ca 0.03 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 2or7 s VAL 93 Cb -0.14 -3.08 -0.06 0.00 0.00 0.00 0.00 36.38 33.09 2or7 s VAL 93 CO -0.08 0.18 2.76 -0.62 0.00 0.00 0.00 175.10 177.34 2or7 n GLU 94 N 4.91 3.42 -2.65 2.72 1.02 -0.42 -1.75 120.64 127.88 2or7 n GLU 94 Ca -0.15 -2.24 -0.43 0.00 -0.02 0.00 0.00 57.16 54.31 2or7 n GLU 94 Cb 0.50 -2.89 -0.02 0.00 -0.02 0.00 0.00 31.44 29.00 2or7 n GLU 94 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2or7 s ILE 95 N 2.49 4.28 -0.15 -3.67 1.01 -1.26 -4.64 121.20 119.25 2or7 s ILE 95 Ca 0.63 1.14 -0.38 0.00 0.00 0.00 0.00 60.65 62.04 2or7 s ILE 95 Cb 0.17 -4.56 -0.15 0.00 0.01 0.00 0.00 42.46 37.92 2or7 s ILE 95 CO -0.06 -0.95 1.66 -2.65 0.00 0.00 0.00 174.94 172.94 2or7 n PRO 96 N 7.65 1.31 -0.77 2.79 -0.02 -1.26 -0.66 135.00 144.03 2or7 n PRO 96 Ca 0.11 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2or7 n PRO 96 Cb 0.49 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2or7 n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2or7 n GLY 97 N 3.79 1.40 2.69 -1.23 0.00 -1.26 -4.82 105.19 105.76 2or7 n GLY 97 Ca 0.24 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.17 2or7 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2or7 n ALA 98 N 0.79 0.41 -1.68 4.61 0.00 0.16 -5.13 120.51 119.67 2or7 n ALA 98 Ca 0.00 -1.55 -0.42 0.00 0.00 0.00 0.00 53.44 51.48 2or7 n ALA 98 Cb 0.00 -1.07 0.01 0.00 0.00 0.00 0.00 19.45 18.39 2or7 n ALA 98 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2or7 n PHE 99 N -0.08 1.95 -4.07 0.00 3.01 -0.86 -4.46 117.46 112.95 2or7 n PHE 99 Ca 0.03 0.53 -0.35 0.00 1.01 0.00 0.00 57.45 58.68 2or7 n PHE 99 Cb 0.77 -2.35 -0.12 0.00 -0.01 0.00 0.00 39.48 37.77 2or7 n PHE 99 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2or7 s HIS 100 N -1.18 3.08 0.02 1.38 5.65 -0.72 -4.94 115.29 118.58 2or7 s HIS 100 Ca 0.60 -0.33 0.08 0.00 0.25 0.00 0.00 55.06 55.66 2or7 s HIS 100 Cb -0.54 -2.09 -0.02 0.00 -1.18 0.00 0.00 32.58 28.75 2or7 s HIS 100 CO 0.59 -0.16 -0.24 -0.06 -0.65 0.00 0.00 174.74 174.22 2or7 s PHE 101 N 0.88 2.13 -0.05 3.88 0.08 -1.26 -0.71 117.98 122.93 2or7 s PHE 101 Ca 0.02 -0.40 0.00 0.00 0.12 0.00 0.00 56.93 56.67 2or7 s PHE 101 Cb -0.14 -1.30 0.03 0.00 -0.57 0.00 0.00 43.02 41.03 2or7 s PHE 101 CO 0.02 0.07 -0.02 0.08 -0.10 0.00 0.00 175.22 175.27 2or7 s VAL 102 N -0.72 0.39 -0.26 -0.44 1.01 -0.68 -4.98 120.40 114.71 2or7 s VAL 102 Ca 0.10 0.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.99 2or7 s VAL 102 Cb -0.09 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 2or7 s VAL 102 CO 0.01 0.22 0.17 -1.81 0.00 0.00 0.00 175.10 173.69 2or7 s ASP 103 N 1.33 6.01 0.09 3.32 1.01 -1.26 -1.51 116.67 125.65 2or7 s ASP 103 Ca -0.05 0.03 0.08 0.00 0.71 0.00 0.00 52.55 53.33 2or7 s ASP 103 Cb -0.13 -2.10 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 2or7 s ASP 103 CO -0.02 0.01 -0.18 -0.31 0.21 0.00 0.00 175.17 174.88 2or7 s TYR 104 N 1.42 2.55 -0.27 4.23 1.51 -0.08 -2.49 117.35 124.23 2or7 s TYR 104 Ca 0.07 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 55.90 2or7 s TYR 104 Cb -0.15 -1.39 0.07 0.00 -0.11 0.00 0.00 41.96 40.38 2or7 s TYR 104 CO 0.08 0.34 -0.06 1.41 -1.11 0.00 0.00 175.55 176.20 2or7 s MET 105 N -1.90 1.91 -0.17 -0.62 -2.45 0.28 -1.02 119.30 115.33 2or7 s MET 105 Ca 0.17 -1.34 -0.18 0.00 -1.25 0.00 0.00 55.69 53.09 2or7 s MET 105 Cb -0.11 -2.84 -0.04 0.00 1.25 0.00 0.00 34.83 33.10 2or7 s MET 105 CO 0.09 -0.65 0.49 -1.17 1.05 0.00 0.00 175.02 174.82 2or7 s LEU 106 N 1.16 4.19 -0.28 4.11 2.96 0.32 -1.63 118.68 129.51 2or7 s LEU 106 Ca -0.04 0.69 -0.06 0.00 -0.22 0.00 0.00 54.13 54.50 2or7 s LEU 106 Cb -0.19 -2.67 0.01 0.00 0.50 0.00 0.00 46.19 43.83 2or7 s LEU 106 CO -0.06 -0.11 0.04 -0.70 -1.32 0.00 0.00 176.35 174.20 2or7 s GLU 107 N 1.26 3.09 -0.29 1.98 2.12 -0.08 -0.74 118.70 126.04 2or7 s GLU 107 Ca 0.24 -0.85 -0.08 0.00 0.36 0.00 0.00 54.97 54.64 2or7 s GLU 107 Cb -0.15 -3.27 -0.01 0.00 0.26 0.00 0.00 34.13 30.97 2or7 s GLU 107 CO 0.09 -0.40 0.10 0.08 -0.54 0.00 0.00 175.26 174.59 2or7 s VAL 108 N 1.47 4.28 0.14 3.70 1.01 -1.26 0.03 120.40 129.77 2or7 s VAL 108 Ca 0.02 -0.46 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 2or7 s VAL 108 Cb -0.17 -3.15 -0.07 0.00 0.00 0.00 0.00 36.38 33.00 2or7 s VAL 108 CO 0.01 0.14 0.56 -0.54 0.00 0.00 0.00 175.10 175.27 2or7 s LYS 109 N 1.57 4.03 0.65 2.72 1.02 -0.10 -4.63 119.74 125.00 2or7 s LYS 109 Ca 0.04 0.55 -0.14 0.00 0.02 0.00 0.00 55.97 56.44 2or7 s LYS 109 Cb -0.17 -2.98 -0.01 0.00 -0.52 0.00 0.00 37.83 34.16 2or7 s LYS 109 CO 0.04 0.50 1.08 -1.25 -0.92 0.00 0.00 175.35 174.80 2or7 s PRO 110 N -1.82 2.98 0.58 -1.68 0.04 -1.26 -0.36 135.00 133.49 2or7 s PRO 110 Ca 0.37 1.25 0.32 0.00 0.04 0.00 0.00 61.00 62.97 2or7 s PRO 110 Cb -0.16 -1.98 1.77 0.00 0.04 0.00 0.00 34.50 34.17 2or7 s PRO 110 CO 0.19 -1.09 2.19 0.93 0.04 0.00 0.00 177.00 179.27 2or7 h GLU 111 N 0.02 0.00 -3.37 4.56 5.08 -1.95 -3.40 114.58 115.52 2or7 h GLU 111 Ca -0.46 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.62 2or7 h GLU 111 Cb 1.23 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.15 2or7 h GLU 111 CO 0.55 0.05 -0.67 -1.17 -1.00 0.00 0.00 179.01 176.77 2or7 s LEU 112 N -7.19 0.80 -0.50 1.33 2.96 -1.26 -5.10 118.68 109.72 2or7 s LEU 112 Ca -0.04 0.17 -0.22 0.00 -0.22 0.00 0.00 54.13 53.83 2or7 s LEU 112 Cb 0.14 0.14 0.04 0.00 0.50 0.00 0.00 46.19 47.00 2or7 s LEU 112 CO 0.54 -0.15 0.76 -0.69 -1.32 0.00 0.00 176.35 175.48 2or7 s VAL 113 N 1.25 4.67 0.42 1.68 1.01 -1.26 -5.01 120.40 123.16 2or7 s VAL 113 Ca -0.08 0.03 -0.22 0.00 0.00 0.00 0.00 61.98 61.72 2or7 s VAL 113 Cb -0.12 -4.36 -0.13 0.00 0.00 0.00 0.00 36.38 31.77 2or7 s VAL 113 CO -0.04 -0.85 0.43 -2.65 0.00 0.00 0.00 175.10 171.99 2or7 n PRO 114 N 6.69 0.42 -0.72 2.72 -0.02 -1.26 -5.18 135.00 137.65 2or7 n PRO 114 Ca -0.01 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 2or7 n PRO 114 Cb 0.47 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 2or7 n PRO 114 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02