#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r23 n ALA 19 N 0.00 0.13 -0.22 1.57 0.00 -1.26 -4.88 120.51 115.84 1r23 n ALA 19 Ca 0.00 0.01 0.01 0.00 0.00 0.00 0.00 53.44 53.46 1r23 n ALA 19 Cb 0.00 -2.10 0.09 0.00 0.00 0.00 0.00 19.45 17.44 1r23 n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r23 h ALA 20 N 0.50 0.54 -0.38 0.00 0.00 -2.09 -2.72 119.26 115.11 1r23 h ALA 20 Ca -0.48 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1r23 h ALA 20 Cb 1.36 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1r23 h ALA 20 CO 0.51 -0.42 0.00 0.44 0.00 0.00 0.00 179.25 179.78 1r23 n ILE 21 N -5.39 2.41 -0.35 0.00 -5.35 -1.26 -4.67 119.36 104.76 1r23 n ILE 21 Ca 0.09 -1.69 0.12 0.00 -0.27 0.00 0.00 62.75 61.00 1r23 n ILE 21 Cb 0.37 -0.24 0.32 0.00 -1.74 0.00 0.00 39.64 38.34 1r23 n ILE 21 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1r23 h ALA 22 N 2.59 1.67 0.00 -1.28 0.00 -1.84 -0.23 119.26 120.18 1r23 h ALA 22 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1r23 h ALA 22 Cb 1.61 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1r23 h ALA 22 CO 0.31 -0.01 0.00 0.66 0.00 0.00 0.00 179.25 180.21 1r23 h SER 23 N 0.80 0.00 0.22 0.00 4.64 -1.83 -2.97 113.55 114.41 1r23 h SER 23 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 1r23 h SER 23 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1r23 h SER 23 CO -0.34 0.00 -0.49 -0.62 -0.87 0.00 0.00 176.83 174.51 1r23 n GLU 24 N -2.63 0.54 -3.88 4.77 -0.58 -0.10 -4.96 120.64 113.80 1r23 n GLU 24 Ca 0.01 -0.38 -0.22 0.00 -0.42 0.00 0.00 57.16 56.16 1r23 n GLU 24 Cb 0.26 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.62 1r23 n GLU 24 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1r23 s LEU 25 N -2.71 4.28 -0.15 -4.62 1.43 -1.12 -5.12 118.68 110.66 1r23 s LEU 25 Ca 0.17 0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 53.21 1r23 s LEU 25 Cb 0.18 -2.93 0.05 0.00 0.03 0.00 0.00 46.19 43.52 1r23 s LEU 25 CO 0.64 -0.10 0.50 0.00 0.23 0.00 0.00 176.35 177.62 1r23 s GLN 26 N -4.00 0.67 0.85 1.70 -2.07 -1.26 -5.05 119.66 110.50 1r23 s GLN 26 Ca 0.35 0.51 -0.11 0.00 -1.82 0.00 0.00 55.36 54.29 1r23 s GLN 26 Cb -0.09 0.32 0.10 0.00 -1.09 0.00 0.00 33.01 32.25 1r23 s GLN 26 CO 0.30 -0.12 1.09 0.00 -1.32 0.00 0.00 175.29 175.24 1r23 s ALA 27 N -0.17 1.80 0.61 2.60 0.00 -1.26 -4.99 121.76 120.36 1r23 s ALA 27 Ca -0.04 0.04 -0.18 0.00 0.00 0.00 0.00 51.96 51.79 1r23 s ALA 27 Cb -0.03 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 1r23 s ALA 27 CO 0.02 -2.14 1.20 0.96 0.00 0.00 0.00 175.76 175.80 1r23 s ILE 28 N -2.93 2.64 0.66 0.00 -4.36 -1.26 -4.95 121.20 111.00 1r23 s ILE 28 Ca 0.63 0.38 -0.18 0.00 -0.26 0.00 0.00 60.65 61.22 1r23 s ILE 28 Cb -0.18 -3.10 -0.00 0.00 1.25 0.00 0.00 42.46 40.43 1r23 s ILE 28 CO 0.57 -0.11 1.28 0.00 0.24 0.00 0.00 174.94 176.92 1r23 s ALA 29 N -1.70 2.33 0.39 2.27 0.00 -1.26 -4.76 121.76 119.03 1r23 s ALA 29 Ca 0.76 1.17 0.08 0.00 0.00 0.00 0.00 51.96 53.97 1r23 s ALA 29 Cb -0.29 -3.54 0.83 0.00 0.00 0.00 0.00 23.12 20.12 1r23 s ALA 29 CO 0.35 -1.64 1.98 -1.00 0.00 0.00 0.00 175.76 175.45 1r23 h PRO 30 N 0.42 0.62 -0.51 0.00 0.13 -1.99 -1.23 132.00 129.44 1r23 h PRO 30 Ca -0.50 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.50 1r23 h PRO 30 Cb 1.33 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1r23 h PRO 30 CO 0.53 0.41 -0.02 1.05 -0.23 0.00 0.00 178.00 179.73 1r23 h GLU 31 N 0.63 0.87 -0.23 0.86 9.09 -1.99 -0.79 114.58 123.02 1r23 h GLU 31 Ca 0.27 -0.25 -0.11 0.00 0.05 0.00 0.00 59.36 59.32 1r23 h GLU 31 Cb 0.27 -0.09 -0.00 0.00 -1.65 0.00 0.00 28.75 27.27 1r23 h GLU 31 CO -0.08 0.88 -0.27 0.28 0.05 0.00 0.00 179.01 179.86 1r23 h VAL 32 N 0.80 1.32 -0.32 -1.06 2.07 -1.70 -2.16 116.25 115.20 1r23 h VAL 32 Ca 0.15 -1.46 -0.04 0.00 0.82 0.00 0.00 66.70 66.17 1r23 h VAL 32 Cb 0.51 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 1r23 h VAL 32 CO 0.03 0.45 0.03 0.00 0.02 0.00 0.00 177.57 178.10 1r23 h ALA 33 N 0.65 1.46 -0.29 1.67 0.00 -1.13 -0.21 119.26 121.41 1r23 h ALA 33 Ca 0.03 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1r23 h ALA 33 Cb 0.84 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1r23 h ALA 33 CO 0.07 0.39 -0.04 0.37 0.00 0.00 0.00 179.25 180.04 1r23 h GLN 34 N 0.47 0.54 -0.21 0.00 5.75 -1.01 -0.48 115.11 120.17 1r23 h GLN 34 Ca 0.11 -0.19 -0.08 0.00 -0.15 0.00 0.00 58.65 58.33 1r23 h GLN 34 Cb 0.26 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1r23 h GLN 34 CO 0.00 0.72 -0.22 0.77 -2.65 0.00 0.00 178.83 177.45 1r23 h SER 35 N 0.32 0.38 -0.13 -0.69 0.02 -0.90 -1.80 113.55 110.74 1r23 h SER 35 Ca 0.08 -0.12 -0.19 0.00 -0.84 0.00 0.00 61.79 60.72 1r23 h SER 35 Cb 0.50 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1r23 h SER 35 CO 0.02 0.61 -0.63 0.25 -1.14 0.00 0.00 176.83 175.95 1r23 h LEU 36 N 0.35 0.85 -0.57 5.07 5.85 -0.90 -2.26 115.31 123.70 1r23 h LEU 36 Ca 0.06 -0.49 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 1r23 h LEU 36 Cb 0.59 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1r23 h LEU 36 CO 0.04 1.27 0.27 0.00 -0.34 0.00 0.00 178.44 179.68 1r23 h ALA 37 N 0.74 0.73 -0.56 1.25 0.00 -0.82 -1.53 119.26 119.07 1r23 h ALA 37 Ca -0.01 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1r23 h ALA 37 Cb 1.22 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1r23 h ALA 37 CO 0.13 0.30 0.23 0.93 0.00 0.00 0.00 179.25 180.84 1r23 h GLU 38 N 0.77 0.80 -0.18 0.00 5.08 -1.24 -0.23 114.58 119.58 1r23 h GLU 38 Ca 0.19 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1r23 h GLU 38 Cb 0.12 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1r23 h GLU 38 CO -0.02 0.65 0.10 0.35 -1.00 0.00 0.00 179.01 179.09 1r23 h PHE 39 N 0.79 0.25 -0.06 4.33 3.57 -0.77 -1.67 116.94 123.38 1r23 h PHE 39 Ca 0.19 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 1r23 h PHE 39 Cb 0.14 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1r23 h PHE 39 CO 0.01 0.25 -0.26 0.74 -2.23 0.00 0.00 178.31 176.82 1r23 h PHE 40 N 0.19 0.11 -0.38 0.41 0.04 -0.81 -2.03 116.94 114.47 1r23 h PHE 40 Ca 0.06 -0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.76 1r23 h PHE 40 Cb 0.08 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.18 1r23 h PHE 40 CO -0.04 0.36 -0.00 0.00 -0.60 0.00 0.00 178.31 178.03 1r23 h ALA 41 N 1.64 1.29 -0.30 2.45 0.00 -0.50 -1.91 119.26 121.94 1r23 h ALA 41 Ca 0.02 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1r23 h ALA 41 Cb 0.51 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1r23 h ALA 41 CO 0.04 0.48 0.03 0.28 0.00 0.00 0.00 179.25 180.08 1r23 h VAL 42 N 0.57 1.17 0.00 0.00 2.07 -0.57 -2.66 116.25 116.83 1r23 h VAL 42 Ca 0.12 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1r23 h VAL 42 Cb 0.37 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1r23 h VAL 42 CO 0.01 0.22 -0.31 0.18 0.02 0.00 0.00 177.57 177.70 1r23 n LEU 43 N -4.33 0.68 -3.30 2.57 4.77 -0.77 -4.39 117.00 112.23 1r23 n LEU 43 Ca 0.01 0.38 -0.38 0.00 -0.03 0.00 0.00 56.01 55.99 1r23 n LEU 43 Cb 0.20 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 1r23 n LEU 43 CO 0.38 -0.09 3.35 0.00 -1.33 0.00 0.00 177.39 179.69 1r23 n ALA 44 N -1.76 7.39 -3.53 -1.18 0.00 -0.88 -4.72 120.51 115.84 1r23 n ALA 44 Ca 0.05 -3.43 -0.18 0.00 0.00 0.00 0.00 53.44 49.88 1r23 n ALA 44 Cb 0.42 -3.35 -0.13 0.00 0.00 0.00 0.00 19.45 16.38 1r23 n ALA 44 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1r23 s ASP 45 N 2.26 1.25 0.29 0.00 -1.08 -1.26 -5.04 116.67 113.07 1r23 s ASP 45 Ca 0.68 -0.10 0.02 0.00 -0.52 0.00 0.00 52.55 52.63 1r23 s ASP 45 Cb 0.17 0.38 0.57 0.00 -1.46 0.00 0.00 42.92 42.58 1r23 s ASP 45 CO -0.06 -0.31 1.84 -0.65 0.52 0.00 0.00 175.17 176.51 1r23 h PRO 46 N 8.32 0.95 -0.30 4.34 0.11 -1.98 -0.79 132.00 142.65 1r23 h PRO 46 Ca -0.16 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.84 1r23 h PRO 46 Cb 1.14 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 1r23 h PRO 46 CO 0.25 0.63 -0.02 -0.91 -0.21 0.00 0.00 178.00 177.75 1r23 h ASN 47 N 0.98 0.53 -0.53 -2.05 2.35 -1.97 -1.39 115.58 113.50 1r23 h ASN 47 Ca 0.49 -0.32 -0.02 0.00 -0.55 0.00 0.00 56.30 55.90 1r23 h ASN 47 Cb 0.49 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.69 1r23 h ASN 47 CO -0.25 0.73 0.26 0.03 -1.65 0.00 0.00 177.43 176.55 1r23 h ARG 48 N 0.33 0.77 -0.34 0.81 3.08 -1.81 -2.60 114.38 114.60 1r23 h ARG 48 Ca 0.08 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 1r23 h ARG 48 Cb 0.47 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1r23 h ARG 48 CO 0.02 0.63 0.06 -0.07 -1.07 0.00 0.00 179.97 179.53 1r23 h LEU 49 N 0.72 0.47 -0.59 3.04 3.38 -1.02 -0.16 115.31 121.14 1r23 h LEU 49 Ca 0.18 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 1r23 h LEU 49 Cb 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1r23 h LEU 49 CO -0.02 0.49 0.05 0.03 0.09 0.00 0.00 178.44 179.08 1r23 h ARG 50 N 0.50 1.00 -0.53 1.13 3.08 -0.93 0.45 114.38 119.08 1r23 h ARG 50 Ca 0.11 -0.29 -0.07 0.00 0.07 0.00 0.00 59.98 59.80 1r23 h ARG 50 Cb 0.23 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1r23 h ARG 50 CO 0.00 0.97 0.05 -0.07 -1.07 0.00 0.00 179.97 179.85 1r23 h LEU 51 N 0.89 0.87 -1.24 3.04 3.38 -1.03 -2.63 115.31 118.60 1r23 h LEU 51 Ca 0.17 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1r23 h LEU 51 Cb 0.48 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1r23 h LEU 51 CO 0.02 0.93 -0.38 -0.07 0.09 0.00 0.00 178.44 179.03 1r23 h LEU 52 N 0.77 0.00 -1.33 1.67 3.38 -0.83 -2.27 115.31 116.70 1r23 h LEU 52 Ca 0.16 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 1r23 h LEU 52 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1r23 h LEU 52 CO 0.02 0.38 -0.33 0.77 0.09 0.00 0.00 178.44 179.36 1r23 h SER 53 N 0.00 0.00 0.09 -0.43 4.64 -0.55 -0.41 113.55 116.89 1r23 h SER 53 Ca -0.00 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 1r23 h SER 53 Cb 0.69 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.80 1r23 h SER 53 CO 0.05 0.33 -0.88 -0.07 -0.87 0.00 0.00 176.83 175.39 1r23 h LEU 54 N 0.00 0.62 -1.29 5.97 3.38 -1.23 -3.26 115.31 119.50 1r23 h LEU 54 Ca -0.00 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.12 1r23 h LEU 54 Cb 0.62 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1r23 h LEU 54 CO 0.04 1.40 0.00 -0.07 0.09 0.00 0.00 178.44 179.91 1r23 h LEU 55 N -0.08 0.00 -1.27 1.67 3.38 -1.19 -2.37 115.31 115.45 1r23 h LEU 55 Ca -0.13 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1r23 h LEU 55 Cb 1.62 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.36 1r23 h LEU 55 CO 0.17 0.00 -0.28 0.00 0.09 0.00 0.00 178.44 178.42 1r23 h ALA 56 N 2.06 1.13 0.00 1.53 0.00 -1.12 -3.19 119.26 119.67 1r23 h ALA 56 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1r23 h ALA 56 Cb 0.49 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1r23 h ALA 56 CO 0.00 0.35 -1.96 0.54 0.00 0.00 0.00 179.25 178.18 1r23 n ARG 57 N -3.61 0.64 -3.59 0.00 1.74 -0.93 -5.03 116.66 105.87 1r23 n ARG 57 Ca -0.01 -0.18 -0.09 0.00 -0.77 0.00 0.00 57.85 56.80 1r23 n ARG 57 Cb 0.41 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.31 1r23 n ARG 57 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1r23 s SER 58 N -4.43 -0.33 0.33 0.55 0.15 -0.95 -5.13 113.70 103.89 1r23 s SER 58 Ca -0.08 0.40 -0.27 0.00 0.70 0.00 0.00 55.95 56.70 1r23 s SER 58 Cb 0.13 0.32 -0.09 0.00 -1.71 0.00 0.00 66.02 64.67 1r23 s SER 58 CO 0.85 -0.28 1.10 -1.83 1.20 0.00 0.00 173.24 174.28 1r23 s GLU 59 N -0.94 4.44 0.04 5.44 -1.05 -1.26 -4.06 118.70 121.31 1r23 s GLU 59 Ca 0.00 1.73 -0.09 0.00 -0.15 0.00 0.00 54.97 56.46 1r23 s GLU 59 Cb -0.01 -2.95 0.00 0.00 -0.44 0.00 0.00 34.13 30.73 1r23 s GLU 59 CO -0.01 0.05 0.18 -0.51 0.95 0.00 0.00 175.26 175.93 1r23 s LEU 60 N -1.90 1.42 0.50 1.83 1.43 -0.74 -4.90 118.68 116.31 1r23 s LEU 60 Ca 0.50 -0.39 -0.04 0.00 -1.03 0.00 0.00 54.13 53.17 1r23 s LEU 60 Cb -0.29 0.92 -0.02 0.00 0.03 0.00 0.00 46.19 46.83 1r23 s LEU 60 CO 0.37 -0.55 0.78 0.00 0.23 0.00 0.00 176.35 177.17 1r23 h VAL 62 N 0.18 0.90 -0.39 0.00 2.07 -1.98 -1.30 116.25 115.74 1r23 h VAL 62 Ca -0.47 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 1r23 h VAL 62 Cb 1.23 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1r23 h VAL 62 CO 0.60 0.07 0.19 1.23 0.02 0.00 0.00 177.57 179.69 1r23 h GLY 63 N 0.39 0.59 1.06 2.17 0.00 -1.94 -0.53 103.07 104.81 1r23 h GLY 63 Ca 0.26 -0.29 -0.10 0.00 0.00 0.00 0.00 47.33 47.21 1r23 h GLY 63 CO -0.07 0.27 -0.07 -0.55 0.00 0.00 0.00 176.54 176.12 1r23 h ASP 64 N 0.49 0.97 -0.11 0.19 3.32 -1.65 -2.43 116.42 117.20 1r23 h ASP 64 Ca 0.13 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 1r23 h ASP 64 Cb 0.10 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 1r23 h ASP 64 CO -0.02 1.08 0.04 -0.07 -1.72 0.00 0.00 179.24 178.55 1r23 h LEU 65 N 0.84 0.16 -0.78 1.55 3.38 -1.18 -1.94 115.31 117.33 1r23 h LEU 65 Ca 0.14 -0.20 0.08 0.00 0.09 0.00 0.00 57.88 57.99 1r23 h LEU 65 Cb 0.63 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 1r23 h LEU 65 CO 0.04 0.31 0.45 0.00 0.09 0.00 0.00 178.44 179.33 1r23 h ALA 66 N 0.85 1.09 -0.59 1.53 0.00 -1.04 -0.94 119.26 120.17 1r23 h ALA 66 Ca 0.04 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1r23 h ALA 66 Cb 0.21 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1r23 h ALA 66 CO -0.00 0.11 0.01 1.96 0.00 0.00 0.00 179.25 181.32 1r23 h GLN 67 N 0.78 1.02 -0.18 0.00 4.20 -1.30 0.13 115.11 119.76 1r23 h GLN 67 Ca 0.37 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 1r23 h GLN 67 Cb 0.29 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1r23 h GLN 67 CO -0.22 1.00 -0.01 0.00 -0.67 0.00 0.00 178.83 178.93 1r23 h ALA 68 N 1.05 0.25 0.00 3.87 0.00 -0.61 -3.15 119.26 120.68 1r23 h ALA 68 Ca 0.17 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1r23 h ALA 68 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1r23 h ALA 68 CO 0.03 -0.02 -0.10 0.82 0.00 0.00 0.00 179.25 179.98 1r23 h ILE 69 N 0.08 0.00 -0.82 0.00 2.04 -1.19 -3.48 117.51 114.14 1r23 h ILE 69 Ca 0.05 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 1r23 h ILE 69 Cb 0.41 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1r23 h ILE 69 CO 0.01 0.00 -0.04 0.61 0.00 0.00 0.00 178.15 178.73 1r23 n GLY 70 N 1.19 0.62 3.38 5.37 0.00 0.35 -5.07 105.19 111.03 1r23 n GLY 70 Ca 0.04 -0.71 -0.19 0.00 0.00 0.00 0.00 46.02 45.16 1r23 n GLY 70 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r23 s VAL 71 N -2.60 1.05 0.71 1.61 -7.23 -0.57 -5.03 120.40 108.32 1r23 s VAL 71 Ca 0.02 -2.02 -0.13 0.00 -1.81 0.00 0.00 61.98 58.04 1r23 s VAL 71 Cb -0.01 -2.57 0.02 0.00 0.56 0.00 0.00 36.38 34.39 1r23 s VAL 71 CO 0.03 -0.15 1.10 -0.94 -0.31 0.00 0.00 175.10 174.83 1r23 s SER 72 N -3.38 4.84 0.38 4.85 1.04 -1.26 -4.41 113.70 115.77 1r23 s SER 72 Ca 0.33 1.94 0.10 0.00 0.48 0.00 0.00 55.95 58.80 1r23 s SER 72 Cb 0.07 -2.54 0.77 0.00 0.10 0.00 0.00 66.02 64.42 1r23 s SER 72 CO 0.12 -1.81 1.90 -0.33 0.98 0.00 0.00 173.24 174.11 1r23 h GLU 73 N -0.44 0.22 -0.59 4.02 5.08 -1.92 -2.11 114.58 118.84 1r23 h GLU 73 Ca -0.45 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 57.77 1r23 h GLU 73 Cb 1.24 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1r23 h GLU 73 CO 0.53 0.38 0.06 1.03 -1.00 0.00 0.00 179.01 180.01 1r23 h SER 74 N 0.20 0.96 -0.31 1.42 0.87 -1.96 0.06 113.55 114.79 1r23 h SER 74 Ca 0.04 -0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.29 1r23 h SER 74 Cb 0.41 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 1r23 h SER 74 CO 0.03 1.00 0.07 0.00 -0.53 0.00 0.00 176.83 177.40 1r23 h ALA 75 N 1.00 0.40 -0.30 6.23 0.00 -1.81 -1.15 119.26 123.64 1r23 h ALA 75 Ca 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1r23 h ALA 75 Cb 0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1r23 h ALA 75 CO 0.02 0.07 0.07 0.28 0.00 0.00 0.00 179.25 179.68 1r23 h VAL 76 N 0.33 1.22 -0.98 0.00 2.07 -1.29 -1.59 116.25 116.02 1r23 h VAL 76 Ca 0.10 -0.74 0.10 0.00 0.82 0.00 0.00 66.70 66.98 1r23 h VAL 76 Cb 0.29 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 31.12 1r23 h VAL 76 CO 0.00 0.25 0.61 -1.28 0.02 0.00 0.00 177.57 177.17 1r23 h SER 77 N 0.32 0.92 -0.27 0.57 0.87 -0.86 0.18 113.55 115.28 1r23 h SER 77 Ca 0.09 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.62 1r23 h SER 77 Cb 0.30 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 1r23 h SER 77 CO 0.00 0.52 -0.11 -0.74 -0.53 0.00 0.00 176.83 175.97 1r23 h HIS 78 N 1.01 0.62 -0.53 2.24 6.17 -0.89 -2.47 115.15 121.30 1r23 h HIS 78 Ca 0.47 -0.15 -0.05 0.00 0.71 0.00 0.00 60.37 61.35 1r23 h HIS 78 Cb 0.40 -0.15 -0.02 0.00 2.52 0.00 0.00 27.41 30.16 1r23 h HIS 78 CO -0.01 0.79 0.12 1.96 0.71 0.00 0.00 177.93 181.49 1r23 h GLN 79 N 0.28 0.82 0.00 5.26 4.20 -0.49 -2.32 115.11 122.86 1r23 h GLN 79 Ca 0.06 -0.17 -0.04 0.00 0.06 0.00 0.00 58.65 58.56 1r23 h GLN 79 Cb 0.61 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1r23 h GLN 79 CO 0.04 0.75 -0.19 -0.07 -0.67 0.00 0.00 178.83 178.69 1r23 h LEU 80 N 0.79 0.00 -0.01 1.46 3.38 -0.56 -2.81 115.31 117.56 1r23 h LEU 80 Ca 0.17 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 1r23 h LEU 80 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1r23 h LEU 80 CO 0.00 0.19 0.00 -0.09 0.09 0.00 0.00 178.44 178.63 1r23 h ARG 81 N 0.00 0.02 -0.33 1.13 2.43 -0.93 0.15 114.38 116.85 1r23 h ARG 81 Ca -0.00 -0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1r23 h ARG 81 Cb 0.53 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1r23 h ARG 81 CO 0.02 0.18 -0.20 0.66 -1.51 0.00 0.00 179.97 179.13 1r23 h SER 82 N -0.15 0.61 -0.71 -3.80 4.64 -1.60 -0.48 113.55 112.06 1r23 h SER 82 Ca 0.00 -0.20 -0.01 0.00 -0.47 0.00 0.00 61.79 61.11 1r23 h SER 82 Cb 0.17 -0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 62.06 1r23 h SER 82 CO -0.00 0.81 0.40 -0.07 -0.87 0.00 0.00 176.83 177.10 1r23 h LEU 83 N 0.55 0.90 -0.11 5.97 4.07 -1.25 0.34 115.31 125.79 1r23 h LEU 83 Ca 0.08 -0.07 -0.03 0.00 0.08 0.00 0.00 57.88 57.94 1r23 h LEU 83 Cb 0.65 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 42.15 1r23 h LEU 83 CO 0.05 0.73 -0.06 0.03 -1.08 0.00 0.00 178.44 178.10 1r23 h ARG 84 N 1.02 0.23 -0.64 1.13 3.08 -0.11 -1.15 114.38 117.95 1r23 h ARG 84 Ca 0.26 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1r23 h ARG 84 Cb 0.03 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1r23 h ARG 84 CO -0.04 0.60 0.41 -0.91 -1.07 0.00 0.00 179.97 178.96 1r23 h ASN 85 N -0.14 0.74 0.12 7.04 2.35 -0.56 -1.44 115.58 123.70 1r23 h ASN 85 Ca 0.02 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1r23 h ASN 85 Cb 0.53 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1r23 h ASN 85 CO 0.02 0.54 0.00 0.18 -1.65 0.00 0.00 177.43 176.52 1r23 n LEU 86 N -4.43 0.00 -3.29 1.61 4.77 0.12 -4.91 117.00 110.86 1r23 n LEU 86 Ca 0.06 0.07 -0.22 0.00 -0.03 0.00 0.00 56.01 55.89 1r23 n LEU 86 Cb 0.05 -0.07 0.07 0.00 -2.33 0.00 0.00 43.42 41.14 1r23 n LEU 86 CO 0.36 -0.00 0.20 0.54 -1.33 0.00 0.00 177.39 177.15 1r23 n ARG 87 N -1.07 -7.00 -0.07 3.23 5.12 -0.54 -4.90 116.66 111.42 1r23 n ARG 87 Ca 0.21 0.78 -0.05 0.00 -1.93 0.00 0.00 57.85 56.86 1r23 n ARG 87 Cb 0.13 -5.63 -0.14 0.00 -1.16 0.00 0.00 32.46 25.66 1r23 n ARG 87 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1r23 n LEU 88 N -4.55 0.00 -4.18 0.55 4.77 -0.47 -4.72 117.00 108.40 1r23 n LEU 88 Ca -0.01 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.86 1r23 n LEU 88 Cb 0.56 0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 41.91 1r23 n LEU 88 CO 0.58 0.35 -0.39 0.68 -1.33 0.00 0.00 177.39 177.28 1r23 s VAL 89 N -2.61 0.74 0.34 4.08 -7.23 -1.16 -0.52 120.40 114.03 1r23 s VAL 89 Ca -0.08 -1.94 0.08 0.00 -1.81 0.00 0.00 61.98 58.23 1r23 s VAL 89 Cb 0.07 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.29 1r23 s VAL 89 CO 0.74 -0.86 0.28 -1.54 -0.31 0.00 0.00 175.10 173.41 1r23 n SER 90 N -0.04 -0.61 -3.94 4.85 3.41 0.02 -4.38 113.62 112.94 1r23 n SER 90 Ca -0.12 -3.20 -0.10 0.00 -0.26 0.00 0.00 58.87 55.19 1r23 n SER 90 Cb 0.61 1.65 -0.06 0.00 -0.26 0.00 0.00 64.21 66.14 1r23 n SER 90 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1r23 s TYR 91 N -3.35 0.34 0.01 7.33 1.13 -1.26 -0.81 117.35 120.74 1r23 s TYR 91 Ca 0.39 -0.69 -0.00 0.00 -1.41 0.00 0.00 57.07 55.35 1r23 s TYR 91 Cb 0.02 0.03 -0.01 0.00 -1.10 0.00 0.00 41.96 40.89 1r23 s TYR 91 CO 0.28 -0.78 -0.01 -0.98 -2.51 0.00 0.00 175.55 171.54 1r23 s ARG 92 N -3.97 0.26 -0.15 -3.49 1.70 -0.31 -4.99 118.95 108.01 1r23 s ARG 92 Ca 0.17 -0.47 -0.04 0.00 -0.47 0.00 0.00 55.73 54.92 1r23 s ARG 92 Cb 0.02 0.09 -0.03 0.00 -0.57 0.00 0.00 34.95 34.46 1r23 s ARG 92 CO 0.01 -0.04 -0.00 0.15 -1.08 0.00 0.00 175.30 174.34 1r23 s LYS 93 N -1.16 3.61 -0.19 3.89 1.02 -1.26 -1.11 119.74 124.54 1r23 s LYS 93 Ca -0.13 -0.45 -0.04 0.00 0.02 0.00 0.00 55.97 55.37 1r23 s LYS 93 Cb -0.08 -2.97 0.06 0.00 -0.52 0.00 0.00 37.83 34.33 1r23 s LYS 93 CO -0.01 0.35 0.07 -1.14 -0.92 0.00 0.00 175.35 173.70 1r23 s GLN 94 N 0.10 0.32 7.87 1.68 2.00 -0.11 -5.02 119.66 126.50 1r23 s GLN 94 Ca 0.01 -0.26 0.00 0.00 -2.00 0.00 0.00 55.36 53.11 1r23 s GLN 94 Cb -0.13 -1.92 0.00 0.00 0.80 0.00 0.00 33.01 31.76 1r23 s GLN 94 CO 0.02 -0.68 0.00 0.41 -0.50 0.00 0.00 175.29 174.54 1r23 n GLY 95 N 5.18 3.89 1.01 2.59 0.00 -1.26 -1.23 105.19 115.38 1r23 n GLY 95 Ca -0.08 0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1r23 n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r23 n ARG 96 N 12.78 2.33 -4.29 1.61 1.74 -1.26 -4.97 116.66 124.60 1r23 n ARG 96 Ca 0.00 -2.14 -0.32 0.00 -0.77 0.00 0.00 57.85 54.62 1r23 n ARG 96 Cb 0.00 -1.45 -0.09 0.00 -1.02 0.00 0.00 32.46 29.90 1r23 n ARG 96 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1r23 s HIS 97 N -1.35 3.05 -0.24 -1.55 3.76 -0.36 -5.10 115.29 113.51 1r23 s HIS 97 Ca 0.34 0.06 -0.00 0.00 -0.15 0.00 0.00 55.06 55.31 1r23 s HIS 97 Cb 0.20 -1.66 0.03 0.00 1.11 0.00 0.00 32.58 32.26 1r23 s HIS 97 CO 0.28 0.46 -0.09 0.08 -0.85 0.00 0.00 174.74 174.61 1r23 s VAL 98 N -1.09 2.61 -0.19 -0.90 1.01 -1.26 -0.93 120.40 119.65 1r23 s VAL 98 Ca 0.20 -1.12 -0.08 0.00 0.00 0.00 0.00 61.98 60.98 1r23 s VAL 98 Cb -0.11 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 1r23 s VAL 98 CO 0.11 0.21 0.08 -0.31 0.00 0.00 0.00 175.10 175.19 1r23 s TYR 99 N 1.28 3.30 0.18 5.22 2.02 -0.26 -4.22 117.35 124.86 1r23 s TYR 99 Ca -0.01 0.15 -0.02 0.00 -0.37 0.00 0.00 57.07 56.83 1r23 s TYR 99 Cb -0.17 -2.10 -0.05 0.00 -0.40 0.00 0.00 41.96 39.25 1r23 s TYR 99 CO -0.06 0.21 0.38 0.71 -1.57 0.00 0.00 175.55 175.21 1r23 s TYR 100 N 0.33 3.48 0.21 2.71 1.51 0.96 -1.16 117.35 125.39 1r23 s TYR 100 Ca 0.05 0.40 -0.12 0.00 -1.01 0.00 0.00 57.07 56.38 1r23 s TYR 100 Cb -0.12 -1.89 -0.00 0.00 -0.11 0.00 0.00 41.96 39.84 1r23 s TYR 100 CO -0.00 0.40 0.41 1.14 -1.11 0.00 0.00 175.55 176.39 1r23 s GLN 101 N -3.09 1.37 0.46 -0.62 -2.07 0.01 -1.80 119.66 113.92 1r23 s GLN 101 Ca 0.39 -1.16 -0.23 0.00 -1.82 0.00 0.00 55.36 52.54 1r23 s GLN 101 Cb -0.11 0.44 -0.07 0.00 -1.09 0.00 0.00 33.01 32.17 1r23 s GLN 101 CO 0.28 -0.55 1.14 -0.51 -1.32 0.00 0.00 175.29 174.33 1r23 s LEU 102 N -2.98 4.00 0.18 2.60 1.43 -1.26 -0.80 118.68 121.85 1r23 s LEU 102 Ca 0.19 2.25 -0.17 0.00 -1.03 0.00 0.00 54.13 55.36 1r23 s LEU 102 Cb 0.01 -4.27 0.14 0.00 0.03 0.00 0.00 46.19 42.10 1r23 s LEU 102 CO 0.04 -0.88 1.63 -0.61 0.23 0.00 0.00 176.35 176.76 1r23 h GLN 103 N 2.03 -0.07 0.00 1.70 5.75 -1.06 -3.40 115.11 120.05 1r23 h GLN 103 Ca -0.49 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 57.98 1r23 h GLN 103 Cb 1.24 0.02 0.01 0.00 1.07 0.00 0.00 27.48 29.82 1r23 h GLN 103 CO 0.60 -0.05 0.25 -0.40 -2.65 0.00 0.00 178.83 176.58 1r23 n ASP 104 N -5.39 -2.13 0.26 -0.69 5.68 -1.26 -4.84 116.55 108.18 1r23 n ASP 104 Ca 0.04 -2.49 0.13 0.00 -0.50 0.00 0.00 54.79 51.97 1r23 n ASP 104 Cb 0.30 3.55 0.70 0.00 -1.14 0.00 0.00 41.12 44.52 1r23 n ASP 104 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 1r23 h HIS 105 N 1.92 0.00 -0.78 2.11 2.07 -2.01 -2.54 115.15 115.93 1r23 h HIS 105 Ca -0.31 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.18 1r23 h HIS 105 Cb 1.15 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.10 1r23 h HIS 105 CO 0.00 0.12 0.39 0.45 -3.07 0.00 0.00 177.93 175.82 1r23 h HIS 106 N 0.00 1.11 -0.49 6.12 3.86 -1.99 -1.22 115.15 122.55 1r23 h HIS 106 Ca -0.00 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1r23 h HIS 106 Cb 0.42 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 1r23 h HIS 106 CO 0.00 0.81 0.26 0.82 0.86 0.00 0.00 177.93 180.68 1r23 h ILE 107 N 1.10 1.17 -0.26 2.45 1.08 -1.84 -0.47 117.51 120.74 1r23 h ILE 107 Ca 0.27 -0.46 -0.16 0.00 -0.39 0.00 0.00 64.86 64.13 1r23 h ILE 107 Cb 0.10 0.58 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 1r23 h ILE 107 CO -0.04 0.19 -0.47 1.62 -0.69 0.00 0.00 178.15 178.76 1r23 h VAL 108 N 0.65 1.30 -0.15 1.67 3.04 -1.54 -2.04 116.25 119.18 1r23 h VAL 108 Ca 0.17 -1.67 -0.01 0.00 -1.01 0.00 0.00 66.70 64.18 1r23 h VAL 108 Cb 0.06 1.60 -0.01 0.00 -2.01 0.00 0.00 31.29 30.94 1r23 h VAL 108 CO -0.03 0.53 0.05 0.00 -1.01 0.00 0.00 177.57 177.12 1r23 h ALA 109 N 0.93 0.19 -0.07 3.17 0.00 -0.99 0.18 119.26 122.67 1r23 h ALA 109 Ca 0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1r23 h ALA 109 Cb 1.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1r23 h ALA 109 CO 0.10 -0.20 -0.34 1.37 0.00 0.00 0.00 179.25 180.18 1r23 h LEU 110 N 0.07 0.13 0.22 0.00 8.10 -1.10 0.24 115.31 122.98 1r23 h LEU 110 Ca 0.05 -0.04 -0.01 0.00 0.11 0.00 0.00 57.88 57.98 1r23 h LEU 110 Cb 0.20 -0.04 0.00 0.00 -0.44 0.00 0.00 40.66 40.39 1r23 h LEU 110 CO -0.00 0.47 -0.10 0.22 -4.11 0.00 0.00 178.44 174.91 1r23 h TYR 111 N 0.11 -0.27 -0.78 0.17 3.20 -1.11 -1.89 116.97 116.40 1r23 h TYR 111 Ca 0.01 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 1r23 h TYR 111 Cb 0.66 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.99 1r23 h TYR 111 CO 0.01 0.10 0.35 0.37 -1.64 0.00 0.00 178.16 177.35 1r23 h GLN 112 N -0.72 1.15 -0.64 1.82 5.75 -0.54 -1.97 115.11 119.97 1r23 h GLN 112 Ca -0.03 -0.18 -0.09 0.00 -0.15 0.00 0.00 58.65 58.19 1r23 h GLN 112 Cb 0.49 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.82 1r23 h GLN 112 CO 0.05 0.90 0.04 -0.91 -2.65 0.00 0.00 178.83 176.26 1r23 h ASN 113 N 1.12 1.06 -0.43 -0.69 2.35 -1.00 0.02 115.58 118.01 1r23 h ASN 113 Ca 0.27 -0.29 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 1r23 h ASN 113 Cb 0.16 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 1r23 h ASN 113 CO -0.03 1.09 0.19 0.00 -1.65 0.00 0.00 177.43 177.03 1r23 h ALA 114 N 1.02 0.56 -0.06 -0.83 0.00 -1.11 0.22 119.26 119.06 1r23 h ALA 114 Ca 0.19 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1r23 h ALA 114 Cb 0.52 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1r23 h ALA 114 CO 0.02 0.14 0.02 1.25 0.00 0.00 0.00 179.25 180.68 1r23 h LEU 115 N 0.55 0.09 -1.15 0.00 6.46 -1.18 -2.41 115.31 117.66 1r23 h LEU 115 Ca 0.15 -0.21 0.04 0.00 -0.12 0.00 0.00 57.88 57.74 1r23 h LEU 115 Cb 0.15 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.00 1r23 h LEU 115 CO -0.02 0.27 0.58 0.44 -0.62 0.00 0.00 178.44 179.09 1r23 h ASP 116 N -0.10 0.95 0.30 1.25 3.32 -0.88 -1.42 116.42 119.83 1r23 h ASP 116 Ca 0.02 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1r23 h ASP 116 Cb 0.21 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1r23 h ASP 116 CO -0.00 0.65 -0.23 -0.74 -1.72 0.00 0.00 179.24 177.20 1r23 h HIS 117 N 1.10 -0.60 0.00 4.55 -0.00 -0.70 -0.15 115.15 119.34 1r23 h HIS 117 Ca 0.35 -0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.70 1r23 h HIS 117 Cb 0.03 0.23 -0.00 0.00 -0.00 0.00 0.00 27.41 27.66 1r23 h HIS 117 CO -0.00 -0.35 -0.11 1.37 -0.00 0.00 0.00 177.93 178.84 1r23 h LEU 118 N -0.53 0.00 -0.68 0.26 8.10 -1.08 -0.43 115.31 120.95 1r23 h LEU 118 Ca -0.02 0.00 -0.11 0.00 0.11 0.00 0.00 57.88 57.86 1r23 h LEU 118 Cb 0.47 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.67 1r23 h LEU 118 CO -0.01 0.11 -0.53 1.56 -4.11 0.00 0.00 178.44 175.46 1r23 h GLN 119 N 0.00 0.00 -2.27 0.17 4.20 -0.78 -3.28 115.11 113.15 1r23 h GLN 119 Ca -0.00 0.00 -0.79 0.00 0.06 0.00 0.00 58.65 57.92 1r23 h GLN 119 Cb 0.43 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 27.96 1r23 h GLN 119 CO 0.01 0.53 1.20 0.39 -0.67 0.00 0.00 178.83 180.30 1r23 n GLU 120 N -3.57 5.04 0.00 1.46 1.02 -0.11 -5.09 120.64 119.39 1r23 n GLU 120 Ca -0.00 -4.37 0.00 0.00 -0.02 0.00 0.00 57.16 52.76 1r23 n GLU 120 Cb 0.61 -2.46 0.00 0.00 -0.02 0.00 0.00 31.44 29.57 1r23 n GLU 120 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31