#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m97 n GLY 2 N 0.00 0.46 2.76 3.03 0.00 -1.26 -4.81 105.19 105.37 3m97 n GLY 2 Ca 0.00 -1.79 -0.35 0.00 0.00 0.00 0.00 46.02 43.87 3m97 n GLY 2 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3m97 n HIS 3 N 0.61 3.17 -4.47 1.61 8.25 -1.26 -4.95 115.22 118.17 3m97 n HIS 3 Ca 0.00 -2.73 -0.23 0.00 -0.26 0.00 0.00 57.72 54.50 3m97 n HIS 3 Cb 0.00 -0.82 -0.10 0.00 1.12 0.00 0.00 29.99 30.19 3m97 n HIS 3 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3m97 s GLY 4 N -2.01 2.24 0.13 -1.41 0.00 -1.26 -5.11 107.32 99.89 3m97 s GLY 4 Ca 0.49 -1.77 -0.31 0.00 0.00 0.00 0.00 44.72 43.13 3m97 s GLY 4 CO -0.29 -1.83 1.35 0.00 0.00 0.00 0.00 173.10 172.34 3m97 s ALA 5 N -3.28 3.55 0.00 3.20 0.00 -1.26 -4.89 121.76 119.08 3m97 s ALA 5 Ca 0.32 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.37 3m97 s ALA 5 Cb 0.07 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.67 3m97 s ALA 5 CO 0.15 -0.58 0.10 0.39 0.00 0.00 0.00 175.76 175.83 3m97 n GLU 6 N 3.67 0.17 -1.90 0.00 1.02 -1.26 -5.11 120.64 117.23 3m97 n GLU 6 Ca 0.10 -0.10 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 3m97 n GLU 6 Cb 0.43 -0.53 0.02 0.00 -0.02 0.00 0.00 31.44 31.34 3m97 n GLU 6 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3m97 s GLY 7 N -0.05 1.96 -0.05 0.62 0.00 -1.26 -5.05 107.32 103.48 3m97 s GLY 7 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.99 3m97 s GLY 7 CO 0.00 0.58 -0.02 1.85 0.00 0.00 0.00 173.10 175.51 3m97 s GLU 8 N -4.42 0.72 0.00 2.90 2.56 -1.26 -5.01 118.70 114.19 3m97 s GLU 8 Ca 0.61 -0.02 0.22 0.00 0.00 0.00 0.00 54.97 55.79 3m97 s GLU 8 Cb -0.15 -0.87 -0.08 0.00 2.00 0.00 0.00 34.13 35.03 3m97 s GLU 8 CO 0.43 -0.17 1.01 -0.85 -0.56 0.00 0.00 175.26 175.11 3m97 n GLU 9 N 4.48 0.00 -0.42 4.30 0.28 -1.26 -4.34 120.64 123.68 3m97 n GLU 9 Ca -0.18 -0.00 0.12 0.00 -0.16 0.00 0.00 57.16 56.93 3m97 n GLU 9 Cb 0.50 -1.50 0.33 0.00 1.43 0.00 0.00 31.44 32.21 3m97 n GLU 9 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 3m97 n HIS 10 N -1.50 1.08 -1.32 -1.84 8.25 -1.26 -5.22 115.22 113.41 3m97 n HIS 10 Ca 0.04 -0.51 -0.32 0.00 -0.26 0.00 0.00 57.72 56.67 3m97 n HIS 10 Cb 0.33 -0.04 0.09 0.00 1.12 0.00 0.00 29.99 31.49 3m97 n HIS 10 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3m97 s ALA 11 N -1.14 2.21 0.09 -1.41 0.00 -1.26 -4.97 121.76 115.28 3m97 s ALA 11 Ca 0.50 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.86 3m97 s ALA 11 Cb 0.27 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 20.08 3m97 s ALA 11 CO 0.32 -1.77 0.00 -3.47 0.00 0.00 0.00 175.76 170.85 3m97 n ASP 34 N -3.30 -9.26 0.08 0.00 -0.08 -1.26 -5.14 116.55 97.59 3m97 n ASP 34 Ca 0.10 1.67 -0.08 0.00 -1.51 0.00 0.00 54.79 54.96 3m97 n ASP 34 Cb 0.52 -5.10 0.00 0.00 2.34 0.00 0.00 41.12 38.89 3m97 n ASP 34 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 3m97 h PHE 35 N 4.22 0.30 -0.84 -0.67 3.57 -2.02 -2.73 116.94 118.76 3m97 h PHE 35 Ca 0.00 -0.16 0.06 0.00 3.53 0.00 0.00 57.97 61.41 3m97 h PHE 35 Cb 0.00 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 38.64 3m97 h PHE 35 CO 0.00 0.96 0.51 0.00 -2.23 0.00 0.00 178.31 177.55 3m97 h ALA 36 N 0.99 1.15 -0.35 2.41 0.00 -2.01 0.92 119.26 122.37 3m97 h ALA 36 Ca -0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3m97 h ALA 36 Cb 1.47 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 3m97 h ALA 36 CO 0.13 0.24 0.17 1.15 0.00 0.00 0.00 179.25 180.94 3m97 h THR 37 N 0.93 1.17 0.10 0.00 2.02 -1.95 -0.71 112.91 114.47 3m97 h THR 37 Ca 0.37 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 3m97 h THR 37 Cb 0.19 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 67.43 3m97 h THR 37 CO -0.18 0.18 -0.05 0.58 0.37 0.00 0.00 175.52 176.41 3m97 h VAL 38 N 0.43 0.88 -0.72 3.16 2.07 -1.07 -2.85 116.25 118.16 3m97 h VAL 38 Ca 0.12 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.72 3m97 h VAL 38 Cb 0.13 0.88 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 3m97 h VAL 38 CO -0.01 0.00 0.39 0.25 0.02 0.00 0.00 177.57 178.21 3m97 h LEU 39 N -0.15 0.55 -2.29 2.57 5.85 -0.77 -2.49 115.31 118.58 3m97 h LEU 39 Ca -0.01 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3m97 h LEU 39 Cb 0.12 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 3m97 h LEU 39 CO 0.02 0.33 -0.05 0.00 -0.34 0.00 0.00 178.44 178.40 3m97 h ALA 40 N 1.40 1.38 -0.44 1.25 0.00 -0.89 -1.99 119.26 119.97 3m97 h ALA 40 Ca 0.34 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 3m97 h ALA 40 Cb 0.29 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 3m97 h ALA 40 CO -0.23 0.06 0.06 0.43 0.00 0.00 0.00 179.25 179.57 3m97 n SER 41 N -3.69 4.29 -4.69 0.00 7.64 -0.97 -5.05 113.62 111.16 3m97 n SER 41 Ca -0.02 -3.15 -0.29 0.00 1.01 0.00 0.00 58.87 56.42 3m97 n SER 41 Cb 0.14 -0.63 0.17 0.00 -1.01 0.00 0.00 64.21 62.88 3m97 n SER 41 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3m97 s ALA 42 N -2.91 1.08 -0.30 -0.43 0.00 -0.75 -5.02 121.76 113.42 3m97 s ALA 42 Ca 0.48 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.16 3m97 s ALA 42 Cb 0.39 -3.13 0.07 0.00 0.00 0.00 0.00 23.12 20.45 3m97 s ALA 42 CO 0.10 -2.74 -0.02 0.34 0.00 0.00 0.00 175.76 173.44 3m97 s ASP 43 N -3.45 4.69 0.38 0.00 3.68 -1.26 -4.98 116.67 115.72 3m97 s ASP 43 Ca 0.65 -1.60 0.15 0.00 2.13 0.00 0.00 52.55 53.88 3m97 s ASP 43 Cb -0.18 -1.63 0.76 0.00 -1.45 0.00 0.00 42.92 40.42 3m97 s ASP 43 CO 0.57 -0.28 1.82 1.55 0.13 0.00 0.00 175.17 178.97 3m97 h PRO 44 N 7.80 0.00 -0.06 4.34 0.13 -1.91 -1.32 132.00 141.00 3m97 h PRO 44 Ca -0.15 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.87 3m97 h PRO 44 Cb 1.04 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 3m97 h PRO 44 CO 0.51 0.37 -0.46 0.00 -0.23 0.00 0.00 178.00 178.18 3m97 h ALA 45 N 1.63 1.12 -0.41 -0.56 0.00 -1.94 0.98 119.26 120.08 3m97 h ALA 45 Ca -0.00 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 3m97 h ALA 45 Cb 0.70 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3m97 h ALA 45 CO 0.05 0.61 -0.10 0.00 0.00 0.00 0.00 179.25 179.81 3m97 h ALA 46 N 1.42 1.05 -0.77 0.00 0.00 -1.64 -2.85 119.26 116.48 3m97 h ALA 46 Ca 0.01 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 3m97 h ALA 46 Cb 0.86 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 3m97 h ALA 46 CO 0.07 0.58 0.27 0.78 0.00 0.00 0.00 179.25 180.95 3m97 h GLY 47 N 0.97 1.26 1.26 0.00 0.00 -0.60 -1.25 103.07 104.70 3m97 h GLY 47 Ca 0.12 -0.71 0.05 0.00 0.00 0.00 0.00 47.33 46.79 3m97 h GLY 47 CO 0.03 0.67 0.37 -2.09 0.00 0.00 0.00 176.54 175.52 3m97 h GLU 48 N 1.13 0.53 -0.05 4.80 4.81 -0.61 -0.12 114.58 125.07 3m97 h GLU 48 Ca 0.25 -0.03 -0.21 0.00 -0.13 0.00 0.00 59.36 59.24 3m97 h GLU 48 Cb 0.27 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.54 3m97 h GLU 48 CO -0.01 0.35 -0.80 0.87 -0.73 0.00 0.00 179.01 178.69 3m97 h LYS 49 N 0.54 0.63 -0.81 1.92 1.79 -1.06 -3.19 116.57 116.39 3m97 h LYS 49 Ca 0.24 -0.61 0.15 0.00 -2.18 0.00 0.00 60.65 58.25 3m97 h LYS 49 Cb 0.25 0.16 -0.06 0.00 -1.58 0.00 0.00 32.23 31.00 3m97 h LYS 49 CO -0.07 1.22 0.53 0.28 -1.08 0.00 0.00 179.45 180.34 3m97 h VAL 50 N 0.26 0.80 0.00 0.50 2.07 -0.74 -1.43 116.25 117.71 3m97 h VAL 50 Ca -0.09 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 3m97 h VAL 50 Cb 1.46 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 3m97 h VAL 50 CO 0.16 0.09 -0.00 0.15 0.02 0.00 0.00 177.57 177.99 3m97 h PHE 51 N 0.51 0.00 -1.02 1.57 3.04 -1.02 -0.61 116.94 119.40 3m97 h PHE 51 Ca 0.40 0.00 0.30 0.00 3.98 0.00 0.00 57.97 62.65 3m97 h PHE 51 Cb 0.82 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 39.29 3m97 h PHE 51 CO -0.00 0.00 0.74 0.78 -2.02 0.00 0.00 178.31 177.82 3m97 h GLY 52 N 1.17 0.00 1.71 2.40 0.00 -1.36 0.23 103.07 107.22 3m97 h GLY 52 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3m97 h GLY 52 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 3m97 n LYS 53 N -4.20 0.15 0.00 4.80 5.02 -0.24 -3.38 118.16 120.32 3m97 n LYS 53 Ca 0.22 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 3m97 n LYS 53 Cb 1.09 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.60 3m97 n LYS 53 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3m97 h LYS 55 N 0.00 0.00 0.00 0.00 1.57 -1.50 0.02 116.57 116.66 3m97 h LYS 55 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 3m97 h LYS 55 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 3m97 h LYS 55 CO 0.00 0.00 -0.22 0.00 -0.57 0.00 0.00 179.45 178.66 3m97 h ALA 56 N 2.09 1.28 0.00 3.86 0.00 -1.85 -3.29 119.26 121.36 3m97 h ALA 56 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3m97 h ALA 56 Cb 0.38 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3m97 h ALA 56 CO 0.00 0.27 -1.15 0.00 0.00 0.00 0.00 179.25 178.38 3m97 s HIS 58 N -2.12 1.30 0.39 0.00 3.76 -0.12 -0.45 115.29 118.06 3m97 s HIS 58 Ca -0.01 -0.44 0.08 0.00 -0.15 0.00 0.00 55.06 54.53 3m97 s HIS 58 Cb 0.01 -0.96 -0.04 0.00 1.11 0.00 0.00 32.58 32.70 3m97 s HIS 58 CO 0.10 -0.23 0.27 0.15 -0.85 0.00 0.00 174.74 174.18 3m97 s LYS 59 N 0.59 2.42 -0.11 1.40 -0.14 -1.26 -4.10 119.74 118.55 3m97 s LYS 59 Ca -0.12 -1.61 0.16 0.00 -1.36 0.00 0.00 55.97 53.04 3m97 s LYS 59 Cb -0.14 -2.22 0.25 0.00 -1.68 0.00 0.00 37.83 34.03 3m97 s LYS 59 CO 0.03 -0.09 1.13 1.28 -0.76 0.00 0.00 175.35 176.94 3m97 n LEU 60 N -1.36 2.04 -0.51 3.17 4.77 -1.26 -0.84 117.00 123.00 3m97 n LEU 60 Ca 0.00 -2.81 0.09 0.00 -0.03 0.00 0.00 56.01 53.27 3m97 n LEU 60 Cb 0.62 -0.37 0.20 0.00 -2.33 0.00 0.00 43.42 41.55 3m97 n LEU 60 CO 0.44 0.65 0.64 -0.90 -1.33 0.00 0.00 177.39 176.88 3m97 n ASP 61 N -1.24 3.13 0.00 -1.43 5.68 -1.26 -4.54 116.55 116.88 3m97 n ASP 61 Ca 0.14 -3.07 0.00 0.00 -0.50 0.00 0.00 54.79 51.36 3m97 n ASP 61 Cb 0.65 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 3m97 n ASP 61 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3m97 n GLY 62 N -0.96 1.81 3.80 6.12 0.00 -1.26 -5.03 105.19 109.66 3m97 n GLY 62 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3m97 n GLY 62 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3m97 s ASN 63 N -3.41 7.19 0.05 1.61 -0.87 -1.26 -4.73 114.94 113.51 3m97 s ASN 63 Ca 0.00 1.60 0.03 0.00 -1.57 0.00 0.00 52.86 52.92 3m97 s ASN 63 Cb 0.00 -2.49 -0.04 0.00 -0.02 0.00 0.00 41.25 38.70 3m97 s ASN 63 CO 0.00 -0.00 -0.00 -1.81 -2.57 0.00 0.00 177.10 172.71 3m97 s ASP 64 N -1.62 5.03 0.00 -1.22 1.01 -1.26 -3.22 116.67 115.39 3m97 s ASP 64 Ca 0.46 -0.10 0.00 0.00 0.71 0.00 0.00 52.55 53.61 3m97 s ASP 64 Cb -0.18 -1.25 0.00 0.00 1.01 0.00 0.00 42.92 42.51 3m97 s ASP 64 CO 0.22 0.23 0.00 0.61 0.21 0.00 0.00 175.17 176.44 3m97 n GLY 65 N 0.98 3.62 0.33 0.21 0.00 -1.26 -4.98 105.19 104.09 3m97 n GLY 65 Ca -0.13 -0.26 -0.02 0.00 0.00 0.00 0.00 46.02 45.62 3m97 n GLY 65 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3m97 h VAL 66 N 0.00 1.18 -1.17 1.61 2.07 -1.86 -3.43 116.25 114.66 3m97 h VAL 66 Ca 0.00 -0.39 -0.61 0.00 0.82 0.00 0.00 66.70 66.51 3m97 h VAL 66 Cb 0.00 -0.06 -0.10 0.00 -1.52 0.00 0.00 31.29 29.61 3m97 h VAL 66 CO 0.00 0.21 -0.50 -0.83 0.02 0.00 0.00 177.57 176.46 3m97 s GLY 67 N -3.05 2.56 0.55 2.17 0.00 0.40 -5.05 107.32 104.91 3m97 s GLY 67 Ca -0.13 -1.62 -0.11 0.00 0.00 0.00 0.00 44.72 42.86 3m97 s GLY 67 CO 0.80 -2.04 0.96 2.56 0.00 0.00 0.00 173.10 175.38 3m97 s PRO 68 N -3.89 3.69 0.57 2.90 0.04 -1.26 -4.62 135.00 132.43 3m97 s PRO 68 Ca 0.30 0.69 -0.20 0.00 0.04 0.00 0.00 61.00 61.83 3m97 s PRO 68 Cb 0.04 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 3m97 s PRO 68 CO 0.16 -0.40 1.13 -2.39 0.04 0.00 0.00 177.00 175.55 3m97 n HIS 69 N -2.26 1.44 0.25 0.56 1.44 -1.20 -4.46 115.22 110.99 3m97 n HIS 69 Ca 0.05 0.45 0.05 0.00 -2.01 0.00 0.00 57.72 56.25 3m97 n HIS 69 Cb 0.54 -2.23 0.06 0.00 0.12 0.00 0.00 29.99 28.48 3m97 n HIS 69 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3m97 n LEU 70 N -0.86 2.00 -4.70 2.39 4.77 -0.02 -4.84 117.00 115.74 3m97 n LEU 70 Ca 0.13 -1.24 -0.42 0.00 -0.03 0.00 0.00 56.01 54.44 3m97 n LEU 70 Cb 0.46 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 3m97 n LEU 70 CO 0.51 0.43 1.00 0.54 -1.33 0.00 0.00 177.39 178.54 3m97 s ASN 71 N -0.82 6.95 -0.14 -1.43 4.22 -1.25 -1.52 114.94 120.96 3m97 s ASN 71 Ca 0.13 2.09 0.00 0.00 -2.14 0.00 0.00 52.86 52.94 3m97 s ASN 71 Cb 0.08 -2.57 0.00 0.00 1.28 0.00 0.00 41.25 40.04 3m97 s ASN 71 CO 0.12 -0.60 0.00 0.61 -2.04 0.00 0.00 177.10 175.19 3m97 n GLY 72 N 3.42 0.49 0.25 0.45 0.00 0.22 -4.90 105.19 105.11 3m97 n GLY 72 Ca 0.11 -0.92 -0.03 0.00 0.00 0.00 0.00 46.02 45.18 3m97 n GLY 72 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3m97 h VAL 73 N 0.00 1.24 -2.62 1.61 3.04 -1.54 -3.36 116.25 114.64 3m97 h VAL 73 Ca -0.03 -1.12 -0.56 0.00 -1.01 0.00 0.00 66.70 63.98 3m97 h VAL 73 Cb 0.09 1.22 -0.01 0.00 -2.01 0.00 0.00 31.29 30.57 3m97 h VAL 73 CO 0.04 0.36 1.16 -0.69 -1.01 0.00 0.00 177.57 177.43 3m97 s VAL 74 N -4.65 3.54 0.00 1.51 1.01 -1.26 -0.80 120.40 119.76 3m97 s VAL 74 Ca -0.07 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.54 3m97 s VAL 74 Cb 0.14 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 33.01 3m97 s VAL 74 CO 0.78 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.32 3m97 n GLY 75 N 4.59 1.21 3.79 4.51 0.00 0.37 -5.00 105.19 114.66 3m97 n GLY 75 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3m97 n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m97 s ARG 76 N -0.49 4.09 0.21 1.61 3.52 0.02 -4.52 118.95 123.39 3m97 s ARG 76 Ca 0.00 1.36 -0.31 0.00 -0.13 0.00 0.00 55.73 56.65 3m97 s ARG 76 Cb 0.00 -2.34 -0.15 0.00 -1.56 0.00 0.00 34.95 30.90 3m97 s ARG 76 CO 0.00 -0.18 1.16 2.41 -0.81 0.00 0.00 175.30 177.88 3m97 n THR 77 N -0.44 1.18 -2.06 4.11 -1.04 -1.26 -0.77 114.28 114.01 3m97 n THR 77 Ca 0.07 -0.30 -0.41 0.00 -2.04 0.00 0.00 64.05 61.37 3m97 n THR 77 Cb 0.52 -0.99 -0.02 0.00 -1.82 0.00 0.00 70.33 68.02 3m97 n THR 77 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3m97 s VAL 78 N -0.39 2.66 -1.27 12.58 1.01 -0.58 -2.79 120.40 131.63 3m97 s VAL 78 Ca 0.69 0.62 -0.03 0.00 0.00 0.00 0.00 61.98 63.26 3m97 s VAL 78 Cb -0.78 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.21 3m97 s VAL 78 CO 0.54 0.13 1.01 0.00 0.00 0.00 0.00 175.10 176.78 3m97 n ALA 79 N 1.37 -1.81 0.28 5.51 0.00 -1.26 -4.72 120.51 119.88 3m97 n ALA 79 Ca 0.03 0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.59 3m97 n ALA 79 Cb 0.41 -3.25 -0.09 0.00 0.00 0.00 0.00 19.45 16.53 3m97 n ALA 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m97 n GLY 80 N -1.43 -0.40 3.69 0.00 0.00 -1.12 -4.92 105.19 101.01 3m97 n GLY 80 Ca -0.20 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 3m97 n GLY 80 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m97 s VAL 81 N -2.56 3.77 0.31 1.61 1.01 -1.26 -4.90 120.40 118.37 3m97 s VAL 81 Ca -0.00 1.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.83 3m97 s VAL 81 Cb 0.09 -3.74 -0.12 0.00 0.00 0.00 0.00 36.38 32.61 3m97 s VAL 81 CO 0.53 0.00 1.57 0.47 0.00 0.00 0.00 175.10 177.66 3m97 n ASP 82 N 5.31 3.78 0.00 3.32 9.92 -1.26 -2.19 116.55 135.43 3m97 n ASP 82 Ca 0.13 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.55 3m97 n ASP 82 Cb 0.44 -1.59 0.00 0.00 -0.64 0.00 0.00 41.12 39.33 3m97 n ASP 82 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3m97 n GLY 83 N 1.85 2.49 3.73 0.44 0.00 -1.26 -5.01 105.19 107.43 3m97 n GLY 83 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 3m97 n GLY 83 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3m97 s PHE 84 N -2.79 3.60 -1.01 1.61 5.36 -0.93 -5.00 117.98 118.83 3m97 s PHE 84 Ca 0.00 1.15 -0.19 0.00 -0.96 0.00 0.00 56.93 56.93 3m97 s PHE 84 Cb 0.00 -2.68 0.12 0.00 -0.34 0.00 0.00 43.02 40.11 3m97 s PHE 84 CO 0.00 0.20 1.27 1.21 -1.46 0.00 0.00 175.22 176.44 3m97 s ASN 85 N 0.42 6.67 0.62 6.13 2.47 -1.26 -4.93 114.94 125.06 3m97 s ASN 85 Ca 0.33 -2.06 -0.15 0.00 0.42 0.00 0.00 52.86 51.40 3m97 s ASN 85 Cb -0.17 -2.45 -0.02 0.00 -1.45 0.00 0.00 41.25 37.16 3m97 s ASN 85 CO 0.16 -1.12 1.06 -0.31 -3.72 0.00 0.00 177.10 173.17 3m97 s TYR 86 N 3.11 2.97 0.94 0.43 2.02 -1.26 -5.04 117.35 120.52 3m97 s TYR 86 Ca 0.38 1.50 -0.10 0.00 -0.37 0.00 0.00 57.07 58.48 3m97 s TYR 86 Cb -0.03 -3.00 0.16 0.00 -0.40 0.00 0.00 41.96 38.70 3m97 s TYR 86 CO -0.07 -1.19 1.13 -1.54 -1.57 0.00 0.00 175.55 172.31 3m97 s SER 87 N -2.96 2.67 0.20 2.29 1.04 -1.26 -4.77 113.70 110.90 3m97 s SER 87 Ca 0.63 2.12 -0.10 0.00 0.48 0.00 0.00 55.95 59.08 3m97 s SER 87 Cb -0.16 -2.54 0.17 0.00 0.10 0.00 0.00 66.02 63.59 3m97 s SER 87 CO 0.41 -3.25 1.85 0.44 0.98 0.00 0.00 173.24 173.67 3m97 h ASP 88 N -1.97 0.74 0.66 7.02 3.45 -1.96 -0.86 116.42 123.48 3m97 h ASP 88 Ca -0.45 -0.01 -0.09 0.00 0.43 0.00 0.00 57.03 56.91 3m97 h ASP 88 Cb 1.28 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.87 3m97 h ASP 88 CO 0.42 0.52 -0.45 1.55 -1.57 0.00 0.00 179.24 179.71 3m97 h PRO 89 N 0.87 0.00 -0.20 3.56 0.13 -1.86 -1.99 132.00 132.51 3m97 h PRO 89 Ca 0.27 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.37 3m97 h PRO 89 Cb -0.02 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.11 3m97 h PRO 89 CO -0.09 0.45 -0.02 1.98 -0.23 0.00 0.00 178.00 180.09 3m97 h MET 90 N 0.00 0.37 -0.39 0.86 4.05 -1.84 -2.53 114.93 115.45 3m97 h MET 90 Ca -0.00 -0.13 -0.03 0.00 -0.28 0.00 0.00 59.70 59.26 3m97 h MET 90 Cb 0.90 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.65 3m97 h MET 90 CO 0.06 0.59 0.13 -0.22 0.23 0.00 0.00 176.91 177.70 3m97 h LYS 91 N 0.12 0.55 -0.01 0.39 3.64 -0.90 -2.46 116.57 117.91 3m97 h LYS 91 Ca 0.06 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3m97 h LYS 91 Cb 0.43 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 3m97 h LYS 91 CO 0.01 0.48 -0.21 0.00 -2.27 0.00 0.00 179.45 177.46 3m97 n ALA 92 N -2.47 2.98 -0.01 5.00 0.00 -0.77 -4.33 120.51 120.90 3m97 n ALA 92 Ca 0.02 -0.34 -0.13 0.00 0.00 0.00 0.00 53.44 53.00 3m97 n ALA 92 Cb 0.16 -1.22 -0.10 0.00 0.00 0.00 0.00 19.45 18.29 3m97 n ALA 92 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3m97 h HIS 93 N 0.83 -0.01 0.00 0.00 2.76 -0.99 -3.50 115.15 114.24 3m97 h HIS 93 Ca 0.00 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3m97 h HIS 93 Cb 0.45 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.42 3m97 h HIS 93 CO 0.00 0.46 0.00 0.41 -1.30 0.00 0.00 177.93 177.50 3m97 n GLY 94 N 0.19 -1.15 7.00 5.26 0.00 -1.26 -5.07 105.19 110.16 3m97 n GLY 94 Ca -0.08 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.32 3m97 n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m97 n GLY 95 N -1.30 -1.80 3.20 -0.02 0.00 -1.26 -4.69 105.19 99.32 3m97 n GLY 95 Ca 0.00 -1.35 -0.13 0.00 0.00 0.00 0.00 46.02 44.54 3m97 n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3m97 s ASP 96 N -4.00 1.42 -1.38 1.61 1.01 -1.26 -1.52 116.67 112.54 3m97 s ASP 96 Ca 0.00 -0.97 -0.15 0.00 0.71 0.00 0.00 52.55 52.14 3m97 s ASP 96 Cb 0.00 0.04 0.07 0.00 1.01 0.00 0.00 42.92 44.04 3m97 s ASP 96 CO 0.00 -0.38 2.01 0.79 0.21 0.00 0.00 175.17 177.80 3m97 n TRP 97 N 0.03 3.91 -1.17 4.23 7.02 0.05 -4.82 117.44 126.68 3m97 n TRP 97 Ca -0.12 -2.94 -0.30 0.00 -1.02 0.00 0.00 57.50 53.12 3m97 n TRP 97 Cb 0.60 -2.52 0.14 0.00 -2.42 0.00 0.00 31.31 27.12 3m97 n TRP 97 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 3m97 s THR 98 N 3.22 2.60 0.38 -0.99 -4.23 -1.26 -0.48 115.64 114.88 3m97 s THR 98 Ca 0.48 0.19 0.09 0.00 -1.18 0.00 0.00 61.69 61.28 3m97 s THR 98 Cb 0.10 -2.66 0.31 0.00 1.34 0.00 0.00 72.50 71.59 3m97 s THR 98 CO -0.02 -0.25 1.94 -0.65 -0.54 0.00 0.00 174.62 175.09 3m97 h PRO 99 N -1.60 0.62 0.03 3.99 0.11 -1.98 0.71 132.00 133.88 3m97 h PRO 99 Ca -0.50 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 3m97 h PRO 99 Cb 1.29 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3m97 h PRO 99 CO 0.54 0.41 -0.01 1.49 -0.21 0.00 0.00 178.00 180.22 3m97 h GLU 100 N 0.64 -0.04 -0.91 1.05 4.57 -1.98 0.04 114.58 117.95 3m97 h GLU 100 Ca 0.35 0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.63 3m97 h GLU 100 Cb 0.49 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 29.01 3m97 h GLU 100 CO -0.13 0.21 0.55 0.00 -1.18 0.00 0.00 179.01 178.46 3m97 h ALA 101 N 0.69 1.32 0.07 2.92 0.00 -1.75 -1.09 119.26 121.42 3m97 h ALA 101 Ca -0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3m97 h ALA 101 Cb 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3m97 h ALA 101 CO 0.01 0.19 -0.03 -0.07 0.00 0.00 0.00 179.25 179.35 3m97 h LEU 102 N 0.92 -0.08 -1.20 0.00 3.38 -0.52 -0.27 115.31 117.54 3m97 h LEU 102 Ca 0.44 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 3m97 h LEU 102 Cb 0.38 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 3m97 h LEU 102 CO -0.24 0.20 -0.15 0.06 0.09 0.00 0.00 178.44 178.39 3m97 h GLN 103 N -0.36 0.00 -0.05 1.13 -0.00 -0.82 -1.89 115.11 113.12 3m97 h GLN 103 Ca -0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.62 3m97 h GLN 103 Cb 0.31 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.79 3m97 h GLN 103 CO 0.02 0.15 -0.05 0.93 -0.00 0.00 0.00 178.83 179.88 3m97 h GLU 104 N 0.00 0.12 -0.68 0.06 5.08 -0.82 -1.93 114.58 116.41 3m97 h GLU 104 Ca -0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3m97 h GLU 104 Cb 0.68 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 3m97 h GLU 104 CO 0.02 0.57 0.44 0.35 -1.00 0.00 0.00 179.01 179.38 3m97 h PHE 105 N -0.32 0.87 0.00 4.33 3.57 -0.92 -2.60 116.94 121.86 3m97 h PHE 105 Ca 0.01 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3m97 h PHE 105 Cb 0.55 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.00 3m97 h PHE 105 CO 0.09 0.56 0.00 -0.07 -2.23 0.00 0.00 178.31 176.66 3m97 h LEU 106 N 0.92 0.00 -0.36 0.59 3.38 -1.22 -2.24 115.31 116.38 3m97 h LEU 106 Ca 0.25 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.26 3m97 h LEU 106 Cb -0.08 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 3m97 h LEU 106 CO -0.05 0.00 0.13 0.74 0.09 0.00 0.00 178.44 179.35 3m97 h THR 107 N 0.00 0.90 -0.69 0.22 2.02 -0.94 0.32 112.91 114.74 3m97 h THR 107 Ca 0.00 -0.10 0.02 0.00 0.77 0.00 0.00 66.41 67.10 3m97 h THR 107 Cb 0.45 0.60 -0.18 0.00 -1.74 0.00 0.00 68.15 67.27 3m97 h THR 107 CO 0.00 0.05 -0.31 0.21 0.37 0.00 0.00 175.52 175.84 3m97 s ASN 108 N -5.36 -1.06 0.19 4.18 3.84 -1.04 -3.92 114.94 111.77 3m97 s ASN 108 Ca -0.13 -0.50 -0.14 0.00 0.21 0.00 0.00 52.86 52.30 3m97 s ASN 108 Cb 0.12 1.38 0.20 0.00 -0.55 0.00 0.00 41.25 42.39 3m97 s ASN 108 CO 0.71 -0.12 1.66 -0.65 -2.79 0.00 0.00 177.10 175.91 3m97 h PRO 109 N 6.44 0.05 0.00 0.43 0.11 -1.61 -0.52 132.00 136.90 3m97 h PRO 109 Ca 0.01 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 3m97 h PRO 109 Cb 1.20 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3m97 h PRO 109 CO 0.03 0.03 -0.07 0.87 -0.21 0.00 0.00 178.00 178.65 3m97 h LYS 110 N 0.05 0.00 0.09 1.05 1.79 -1.82 -0.79 116.57 116.94 3m97 h LYS 110 Ca 0.26 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.44 3m97 h LYS 110 Cb 0.41 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.04 3m97 h LYS 110 CO -0.50 0.07 -1.47 0.00 -1.08 0.00 0.00 179.45 176.48 3m97 h ALA 111 N 1.93 0.34 0.07 3.86 0.00 -1.70 -3.35 119.26 120.41 3m97 h ALA 111 Ca -0.00 -1.12 -0.26 0.00 0.00 0.00 0.00 54.91 53.53 3m97 h ALA 111 Cb 0.23 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3m97 h ALA 111 CO 0.01 1.21 -1.29 0.28 0.00 0.00 0.00 179.25 179.45 3m97 h VAL 112 N 0.05 1.40 -3.19 0.00 2.07 -0.67 -3.36 116.25 112.54 3m97 h VAL 112 Ca -0.21 -3.07 -0.62 0.00 0.82 0.00 0.00 66.70 63.62 3m97 h VAL 112 Cb 1.98 2.80 -0.40 0.00 -1.52 0.00 0.00 31.29 34.15 3m97 h VAL 112 CO 0.15 0.86 -0.71 -0.69 0.02 0.00 0.00 177.57 177.19 3m97 s VAL 113 N -2.66 1.69 0.25 2.57 1.01 -0.34 -5.03 120.40 117.90 3m97 s VAL 113 Ca -0.04 -2.51 -0.30 0.00 0.00 0.00 0.00 61.98 59.13 3m97 s VAL 113 Cb 0.08 -2.20 -0.10 0.00 0.00 0.00 0.00 36.38 34.15 3m97 s VAL 113 CO 0.85 -0.80 1.49 -0.54 0.00 0.00 0.00 175.10 176.10 3m97 s LYS 114 N 0.48 4.23 -0.09 2.72 1.02 -1.26 -0.71 119.74 126.13 3m97 s LYS 114 Ca 0.15 2.37 0.00 0.00 0.02 0.00 0.00 55.97 58.52 3m97 s LYS 114 Cb -0.23 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 33.99 3m97 s LYS 114 CO -0.05 -0.49 0.00 0.41 -0.92 0.00 0.00 175.35 174.30 3m97 n GLY 115 N 2.33 0.49 3.61 -3.33 0.00 -1.26 -4.77 105.19 102.25 3m97 n GLY 115 Ca 0.08 -0.32 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 3m97 n GLY 115 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3m97 n THR 116 N -2.89 3.72 1.23 2.61 5.66 0.11 -4.78 114.28 119.94 3m97 n THR 116 Ca -0.01 -0.50 0.12 0.00 -3.05 0.00 0.00 64.05 60.61 3m97 n THR 116 Cb 0.07 -1.12 0.39 0.00 -1.55 0.00 0.00 70.33 68.12 3m97 n THR 116 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3m97 n LYS 117 N -1.04 1.85 -2.60 1.09 5.02 -1.26 -4.83 118.16 116.39 3m97 n LYS 117 Ca 0.14 -1.26 -0.43 0.00 -2.02 0.00 0.00 58.31 54.74 3m97 n LYS 117 Cb 0.48 -1.45 -0.02 0.00 -0.02 0.00 0.00 35.03 34.01 3m97 n LYS 117 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 3m97 s MET 118 N -1.88 3.65 -1.22 1.97 1.75 -1.26 -4.94 119.30 117.36 3m97 s MET 118 Ca 0.35 0.45 -0.14 0.00 -1.25 0.00 0.00 55.69 55.10 3m97 s MET 118 Cb 0.20 -3.94 0.17 0.00 2.84 0.00 0.00 34.83 34.09 3m97 s MET 118 CO 0.30 -1.48 1.49 0.00 -0.65 0.00 0.00 175.02 174.69 3m97 n ALA 119 N 8.02 3.98 -3.33 4.11 0.00 -1.26 -4.74 120.51 127.29 3m97 n ALA 119 Ca 0.11 -4.23 -0.13 0.00 0.00 0.00 0.00 53.44 49.19 3m97 n ALA 119 Cb 0.49 -3.08 -0.14 0.00 0.00 0.00 0.00 19.45 16.72 3m97 n ALA 119 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3m97 s PHE 120 N 1.61 -0.11 0.24 0.00 2.19 -1.26 -5.06 117.98 115.59 3m97 s PHE 120 Ca 0.43 0.32 0.01 0.00 0.33 0.00 0.00 56.93 58.02 3m97 s PHE 120 Cb -0.02 -0.04 0.27 0.00 -1.31 0.00 0.00 43.02 41.92 3m97 s PHE 120 CO 0.01 -0.09 1.60 0.00 1.83 0.00 0.00 175.22 178.57 3m97 h ALA 121 N 6.58 0.90 0.00 11.12 0.00 -1.96 -3.39 119.26 132.50 3m97 h ALA 121 Ca -0.33 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.12 3m97 h ALA 121 Cb 1.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3m97 h ALA 121 CO 0.44 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.75 3m97 n GLY 122 N 0.01 2.88 3.01 0.00 0.00 -1.26 -4.40 105.19 105.43 3m97 n GLY 122 Ca -0.02 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 43.71 3m97 n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m97 s LEU 123 N 0.00 4.67 0.55 0.99 1.43 0.11 -4.98 118.68 121.46 3m97 s LEU 123 Ca 0.00 -2.89 0.33 0.00 -1.03 0.00 0.00 54.13 50.55 3m97 s LEU 123 Cb 0.00 -1.72 1.43 0.00 0.03 0.00 0.00 46.19 45.94 3m97 s LEU 123 CO 0.00 -0.29 2.01 1.55 0.23 0.00 0.00 176.35 179.85 3m97 h PRO 124 N 6.78 0.00 -6.22 1.29 0.13 -1.83 -3.40 132.00 128.75 3m97 h PRO 124 Ca -0.06 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.51 3m97 h PRO 124 Cb 0.92 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.01 3m97 h PRO 124 CO 0.69 0.03 0.64 0.15 -0.23 0.00 0.00 178.00 179.28 3m97 s LYS 125 N -3.74 4.37 0.26 0.86 1.02 -1.26 -4.91 119.74 116.34 3m97 s LYS 125 Ca 0.00 1.41 -0.04 0.00 0.02 0.00 0.00 55.97 57.37 3m97 s LYS 125 Cb 0.10 -3.57 0.33 0.00 -0.52 0.00 0.00 37.83 34.17 3m97 s LYS 125 CO 0.54 -0.41 1.85 0.97 -0.92 0.00 0.00 175.35 177.38 3m97 h ILE 126 N 5.18 1.23 -0.00 2.17 2.10 -1.98 -0.63 117.51 125.59 3m97 h ILE 126 Ca -0.28 -0.70 -0.11 0.00 1.08 0.00 0.00 64.86 64.85 3m97 h ILE 126 Cb 1.13 0.37 -0.02 0.00 -1.09 0.00 0.00 36.82 37.21 3m97 h ILE 126 CO 0.89 0.29 -0.50 1.05 -1.08 0.00 0.00 178.15 178.79 3m97 h GLU 127 N 1.01 0.01 -0.27 2.19 9.09 -1.93 -1.01 114.58 123.67 3m97 h GLU 127 Ca 0.24 -0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.61 3m97 h GLU 127 Cb 0.15 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.24 3m97 h GLU 127 CO -0.03 0.51 0.03 -0.44 0.05 0.00 0.00 179.01 179.14 3m97 h ASP 128 N 0.01 0.43 -0.21 3.06 3.45 -1.49 0.14 116.42 121.81 3m97 h ASP 128 Ca -0.00 -0.27 0.04 0.00 0.43 0.00 0.00 57.03 57.22 3m97 h ASP 128 Cb 0.90 -0.11 -0.04 0.00 -0.56 0.00 0.00 39.33 39.51 3m97 h ASP 128 CO 0.07 0.59 -0.04 0.03 -1.57 0.00 0.00 179.24 178.32 3m97 h ARG 129 N 0.25 0.01 -0.55 3.56 3.08 -1.21 -0.11 114.38 119.42 3m97 h ARG 129 Ca 0.08 -0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.02 3m97 h ARG 129 Cb 0.35 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 3m97 h ARG 129 CO 0.01 0.01 -0.08 0.00 -1.07 0.00 0.00 179.97 178.83 3m97 h ALA 130 N 1.20 0.82 -0.40 0.04 0.00 -1.09 -0.62 119.26 119.21 3m97 h ALA 130 Ca 0.10 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 3m97 h ALA 130 Cb 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3m97 h ALA 130 CO -0.21 0.66 -0.29 -0.91 0.00 0.00 0.00 179.25 178.50 3m97 h ASN 131 N 0.90 0.95 -0.73 0.00 2.35 -0.66 -0.26 115.58 118.13 3m97 h ASN 131 Ca 0.15 -0.44 -0.01 0.00 -0.55 0.00 0.00 56.30 55.45 3m97 h ASN 131 Cb 0.64 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.71 3m97 h ASN 131 CO 0.04 1.19 0.41 0.25 -1.65 0.00 0.00 177.43 177.67 3m97 h LEU 132 N 0.72 0.91 -0.98 1.61 5.85 -0.87 -1.34 115.31 121.21 3m97 h LEU 132 Ca 0.08 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 3m97 h LEU 132 Cb 0.88 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 3m97 h LEU 132 CO 0.08 0.73 -0.01 0.40 -0.34 0.00 0.00 178.44 179.30 3m97 h ILE 133 N 1.01 1.24 -0.50 4.05 2.04 -0.90 0.05 117.51 124.49 3m97 h ILE 133 Ca 0.26 -0.98 -0.11 0.00 1.00 0.00 0.00 64.86 65.03 3m97 h ILE 133 Cb 0.02 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3m97 h ILE 133 CO -0.04 0.34 -0.12 0.00 0.00 0.00 0.00 178.15 178.33 3m97 h ALA 134 N 1.31 0.69 -0.57 1.87 0.00 -0.70 -0.09 119.26 121.77 3m97 h ALA 134 Ca 0.13 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 3m97 h ALA 134 Cb 0.44 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3m97 h ALA 134 CO 0.02 0.61 0.19 -0.92 0.00 0.00 0.00 179.25 179.14 3m97 h TYR 135 N 0.83 0.91 -0.14 0.00 3.20 -0.68 -2.86 116.97 118.22 3m97 h TYR 135 Ca 0.13 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 3m97 h TYR 135 Cb 0.68 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 3m97 h TYR 135 CO 0.05 0.76 -0.18 -0.07 -1.64 0.00 0.00 178.16 177.07 3m97 h LEU 136 N 0.80 0.23 -2.03 2.82 3.38 -0.30 -0.88 115.31 119.32 3m97 h LEU 136 Ca 0.19 -0.06 0.13 0.00 0.09 0.00 0.00 57.88 58.23 3m97 h LEU 136 Cb 0.27 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3m97 h LEU 136 CO -0.01 0.43 0.39 -0.33 0.09 0.00 0.00 178.44 179.01 3m97 h GLU 137 N 0.22 0.00 -0.25 1.13 5.08 -0.80 -0.45 114.58 119.51 3m97 h GLU 137 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3m97 h GLU 137 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3m97 h GLU 137 CO 0.03 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.45 3m97 n GLY 138 N -1.54 1.36 2.72 -3.84 0.00 -0.35 -4.43 105.19 99.12 3m97 n GLY 138 Ca 0.08 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 45.06 3m97 n GLY 138 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m97 n GLN 139 N 1.33 3.71 0.00 1.61 1.13 -0.18 -5.10 117.38 119.88 3m97 n GLN 139 Ca 0.18 -4.67 0.13 0.00 -1.94 0.00 0.00 57.00 50.70 3m97 n GLN 139 Cb 0.58 -2.37 0.30 0.00 0.11 0.00 0.00 30.24 28.86 3m97 n GLN 139 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66