#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bv2 n THR 2 N 0.00 0.00 0.77 9.51 -2.24 -1.26 -4.95 114.28 116.11 1bv2 n THR 2 Ca 0.00 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1bv2 n THR 2 Cb 0.00 -0.29 -0.08 0.00 -2.10 0.00 0.00 70.33 67.86 1bv2 n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bv2 h GLY 4 N 3.83 -0.05 0.50 0.00 0.00 -1.99 -0.77 103.07 104.58 1bv2 h GLY 4 Ca 0.00 0.02 0.15 0.00 0.00 0.00 0.00 47.33 47.50 1bv2 h GLY 4 CO 0.00 -0.02 0.58 1.46 0.00 0.00 0.00 176.54 178.56 1bv2 h GLN 5 N -0.67 0.68 0.37 4.80 4.20 -1.99 -0.09 115.11 122.41 1bv2 h GLN 5 Ca -0.01 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1bv2 h GLN 5 Cb 0.60 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1bv2 h GLN 5 CO 0.01 0.45 -0.18 0.28 -0.67 0.00 0.00 178.83 178.72 1bv2 h VAL 6 N 0.70 0.61 -0.64 -0.54 2.07 -1.64 0.48 116.25 117.29 1bv2 h VAL 6 Ca 0.46 -0.47 0.12 0.00 0.82 0.00 0.00 66.70 67.64 1bv2 h VAL 6 Cb 0.73 0.83 -0.09 0.00 -1.52 0.00 0.00 31.29 31.24 1bv2 h VAL 6 CO -0.21 0.08 0.15 0.78 0.02 0.00 0.00 177.57 178.39 1bv2 h ASN 7 N -0.77 0.01 0.06 0.57 2.35 -0.14 -0.19 115.58 117.47 1bv2 h ASN 7 Ca -0.05 0.12 0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1bv2 h ASN 7 Cb 0.52 0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.02 1bv2 h ASN 7 CO 0.08 0.00 -0.18 0.28 -1.65 0.00 0.00 177.43 175.97 1bv2 h SER 8 N 0.27 -0.50 -0.48 5.81 0.02 -0.90 0.20 113.55 117.97 1bv2 h SER 8 Ca 0.34 0.06 0.09 0.00 -0.84 0.00 0.00 61.79 61.45 1bv2 h SER 8 Cb 0.53 0.20 -0.08 0.00 0.14 0.00 0.00 62.40 63.18 1bv2 h SER 8 CO -0.43 -0.25 -0.03 0.00 -1.14 0.00 0.00 176.83 174.98 1bv2 h ALA 9 N 0.54 0.41 0.00 3.77 0.00 0.58 0.11 119.26 124.68 1bv2 h ALA 9 Ca 0.04 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1bv2 h ALA 9 Cb 0.36 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1bv2 h ALA 9 CO -0.12 -0.41 0.00 1.33 0.00 0.00 0.00 179.25 180.05 1bv2 n VAL 10 N -5.26 0.47 -0.24 0.00 0.24 -0.23 -4.23 118.33 109.07 1bv2 n VAL 10 Ca 0.05 -0.02 0.11 0.00 -2.04 0.00 0.00 64.34 62.43 1bv2 n VAL 10 Cb 0.26 -0.70 0.21 0.00 -1.47 0.00 0.00 33.84 32.14 1bv2 n VAL 10 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bv2 n GLY 11 N 0.99 -0.95 0.19 7.63 0.00 0.67 0.45 105.19 114.17 1bv2 n GLY 11 Ca 0.05 0.68 -0.13 0.00 0.00 0.00 0.00 46.02 46.62 1bv2 n GLY 11 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bv2 h PRO 12 N 0.00 0.56 -0.12 1.61 0.11 -1.75 -3.37 132.00 129.03 1bv2 h PRO 12 Ca 0.42 -0.48 -0.19 0.00 0.11 0.00 0.00 66.00 65.87 1bv2 h PRO 12 Cb 0.88 0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 1bv2 h PRO 12 CO -0.66 1.11 -0.69 0.00 -0.21 0.00 0.00 178.00 177.55 1bv2 h LEU 14 N 0.38 0.14 0.50 0.00 8.10 -1.07 -0.08 115.31 123.28 1bv2 h LEU 14 Ca -0.02 0.06 -0.02 0.00 0.11 0.00 0.00 57.88 58.00 1bv2 h LEU 14 Cb 1.27 0.04 -0.01 0.00 -0.44 0.00 0.00 40.66 41.52 1bv2 h LEU 14 CO 0.13 -0.05 -0.41 0.74 -4.11 0.00 0.00 178.44 174.74 1bv2 h THR 15 N 0.09 0.00 0.17 0.15 2.02 -1.83 0.86 112.91 114.37 1bv2 h THR 15 Ca 0.75 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.94 1bv2 h THR 15 Cb 2.63 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 69.01 1bv2 h THR 15 CO -0.18 0.00 -0.32 0.22 0.37 0.00 0.00 175.52 175.61 1bv2 h TYR 16 N -0.88 -0.86 -0.92 3.16 5.03 -1.18 0.55 116.97 121.87 1bv2 h TYR 16 Ca -0.06 0.02 0.26 0.00 2.58 0.00 0.00 58.73 61.52 1bv2 h TYR 16 Cb 0.74 0.35 -0.14 0.00 1.55 0.00 0.00 36.73 39.23 1bv2 h TYR 16 CO -0.16 -0.43 0.37 0.00 -1.32 0.00 0.00 178.16 176.62 1bv2 h ALA 17 N 0.06 1.52 -0.04 1.82 0.00 -0.85 -1.03 119.26 120.73 1bv2 h ALA 17 Ca 0.02 0.20 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 1bv2 h ALA 17 Cb 0.58 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.60 1bv2 h ALA 17 CO -0.15 -0.46 -0.47 0.00 0.00 0.00 0.00 179.25 178.16 1bv2 h ARG 18 N 0.30 0.40 0.00 0.00 3.08 -0.45 -2.11 114.38 115.60 1bv2 h ARG 18 Ca 0.61 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1bv2 h ARG 18 Cb 1.26 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.40 1bv2 h ARG 18 CO -0.61 1.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.73 1bv2 n GLY 19 N 0.88 -0.51 0.00 0.04 0.00 -0.34 -3.42 105.19 101.85 1bv2 n GLY 19 Ca -0.09 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1bv2 n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bv2 n GLY 20 N 0.00 5.34 3.95 -0.02 0.00 0.04 -4.94 105.19 109.56 1bv2 n GLY 20 Ca 0.00 -1.89 -0.25 0.00 0.00 0.00 0.00 46.02 43.88 1bv2 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bv2 s ALA 21 N -2.00 3.27 0.00 4.61 0.00 -1.26 -4.42 121.76 121.96 1bv2 s ALA 21 Ca 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.81 1bv2 s ALA 21 Cb 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 23.12 20.68 1bv2 s ALA 21 CO 0.00 -1.35 0.00 0.41 0.00 0.00 0.00 175.76 174.82 1bv2 n GLY 22 N -2.90 0.75 3.91 0.00 0.00 -1.26 -3.34 105.19 102.36 1bv2 n GLY 22 Ca 0.10 -2.14 -0.27 0.00 0.00 0.00 0.00 46.02 43.70 1bv2 n GLY 22 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1bv2 s PRO 23 N -0.95 2.30 0.37 1.61 0.02 -1.26 -5.04 135.00 132.05 1bv2 s PRO 23 Ca 0.00 -0.03 0.09 0.00 0.02 0.00 0.00 61.00 61.07 1bv2 s PRO 23 Cb 0.00 -2.10 -0.07 0.00 0.02 0.00 0.00 34.50 32.35 1bv2 s PRO 23 CO 0.00 -1.25 -0.03 -1.12 -0.33 0.00 0.00 177.00 174.27 1bv2 s SER 24 N -4.49 3.88 0.16 2.53 0.01 -1.26 -4.98 113.70 109.56 1bv2 s SER 24 Ca 0.60 -1.22 -0.26 0.00 1.31 0.00 0.00 55.95 56.38 1bv2 s SER 24 Cb -0.11 -0.40 0.02 0.00 0.21 0.00 0.00 66.02 65.74 1bv2 s SER 24 CO 0.47 -0.31 1.57 0.00 0.41 0.00 0.00 173.24 175.38 1bv2 h ALA 25 N 1.88 -0.37 -0.42 1.44 0.00 -2.01 -0.41 119.26 119.37 1bv2 h ALA 25 Ca -0.43 0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.65 1bv2 h ALA 25 Cb 1.25 0.90 -0.09 0.00 0.00 0.00 0.00 17.79 19.84 1bv2 h ALA 25 CO 0.73 -0.84 -0.28 0.00 0.00 0.00 0.00 179.25 178.86 1bv2 h ALA 26 N 0.53 -0.07 0.44 0.00 0.00 -1.98 0.83 119.26 119.03 1bv2 h ALA 26 Ca 0.16 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1bv2 h ALA 26 Cb 0.57 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1bv2 h ALA 26 CO -0.61 -0.66 -0.37 0.00 0.00 0.00 0.00 179.25 177.60 1bv2 h SER 29 N -0.51 0.38 0.13 0.00 0.87 -0.72 0.21 113.55 113.90 1bv2 h SER 29 Ca 0.06 0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 1bv2 h SER 29 Cb 0.60 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1bv2 h SER 29 CO -0.29 0.09 -0.06 1.23 -0.53 0.00 0.00 176.83 177.27 1bv2 h GLY 30 N 0.48 -0.18 0.57 5.77 0.00 0.98 0.96 103.07 111.65 1bv2 h GLY 30 Ca 0.50 0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.93 1bv2 h GLY 30 CO -0.45 -0.07 -0.10 -2.08 0.00 0.00 0.00 176.54 173.84 1bv2 h VAL 31 N -0.24 0.70 -0.55 4.60 2.07 0.87 0.18 116.25 123.88 1bv2 h VAL 31 Ca -0.02 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.60 1bv2 h VAL 31 Cb 0.19 0.70 -0.11 0.00 -1.52 0.00 0.00 31.29 30.55 1bv2 h VAL 31 CO 0.03 0.00 -0.32 0.03 0.02 0.00 0.00 177.57 177.33 1bv2 h ARG 32 N -0.11 -0.16 -0.09 1.57 3.08 -0.38 0.37 114.38 118.65 1bv2 h ARG 32 Ca 0.08 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.15 1bv2 h ARG 32 Cb 0.24 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1bv2 h ARG 32 CO -0.20 -0.11 0.03 0.77 -1.07 0.00 0.00 179.97 179.39 1bv2 h SER 33 N -0.17 0.04 -0.49 7.04 0.02 0.11 0.21 113.55 120.30 1bv2 h SER 33 Ca 0.23 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.24 1bv2 h SER 33 Cb 0.54 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.00 1bv2 h SER 33 CO -0.65 0.04 -0.52 0.25 -1.14 0.00 0.00 176.83 174.81 1bv2 h LEU 34 N 0.08 -1.79 -0.01 5.07 5.85 0.10 0.03 115.31 124.64 1bv2 h LEU 34 Ca 0.04 0.24 0.02 0.00 0.84 0.00 0.00 57.88 59.03 1bv2 h LEU 34 Cb 0.02 0.75 -0.06 0.00 0.37 0.00 0.00 40.66 41.74 1bv2 h LEU 34 CO -0.04 -0.34 -0.53 0.50 -0.34 0.00 0.00 178.44 177.69 1bv2 h LYS 35 N -0.29 -0.64 -0.53 1.25 3.11 -0.79 0.13 116.57 118.81 1bv2 h LYS 35 Ca 0.08 0.04 0.10 0.00 -2.81 0.00 0.00 60.65 58.06 1bv2 h LYS 35 Cb 0.52 0.14 -0.11 0.00 -1.00 0.00 0.00 32.23 31.79 1bv2 h LYS 35 CO -0.62 -0.42 -0.33 0.00 -2.81 0.00 0.00 179.45 175.27 1bv2 h ALA 36 N -0.37 -0.08 -0.33 5.00 0.00 -0.00 -2.42 119.26 121.07 1bv2 h ALA 36 Ca 0.02 0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1bv2 h ALA 36 Cb 0.72 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1bv2 h ALA 36 CO -0.36 -0.69 -0.23 0.00 0.00 0.00 0.00 179.25 177.97 1bv2 h ALA 37 N 0.93 0.47 -1.49 0.00 0.00 -0.81 -3.34 119.26 115.02 1bv2 h ALA 37 Ca 0.21 -0.38 -0.76 0.00 0.00 0.00 0.00 54.91 53.99 1bv2 h ALA 37 Cb 0.54 -0.11 -0.19 0.00 0.00 0.00 0.00 17.79 18.04 1bv2 h ALA 37 CO -0.63 0.44 1.48 0.00 0.00 0.00 0.00 179.25 180.53 1bv2 n ALA 38 N -2.48 4.63 0.03 0.00 0.00 0.45 -4.59 120.51 118.55 1bv2 n ALA 38 Ca -0.03 -4.37 -0.01 0.00 0.00 0.00 0.00 53.44 49.03 1bv2 n ALA 38 Cb 0.44 -2.90 -0.00 0.00 0.00 0.00 0.00 19.45 16.99 1bv2 n ALA 38 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bv2 n SER 39 N 4.22 1.22 -4.48 0.00 7.64 -1.22 -4.15 113.62 116.85 1bv2 n SER 39 Ca 0.36 0.16 -0.46 0.00 1.01 0.00 0.00 58.87 59.94 1bv2 n SER 39 Cb 0.39 -0.39 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1bv2 n SER 39 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1bv2 n THR 40 N -3.62 1.98 -0.25 0.44 -1.04 -1.26 -4.14 114.28 106.39 1bv2 n THR 40 Ca -0.02 -0.50 -0.03 0.00 -2.04 0.00 0.00 64.05 61.46 1bv2 n THR 40 Cb 0.07 -0.45 -0.01 0.00 -1.82 0.00 0.00 70.33 68.13 1bv2 n THR 40 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1bv2 n THR 41 N 0.05 -0.37 0.37 12.58 -2.24 -1.26 -0.47 114.28 122.94 1bv2 n THR 41 Ca 0.14 1.50 -0.19 0.00 -2.27 0.00 0.00 64.05 63.24 1bv2 n THR 41 Cb 0.29 -1.94 -0.10 0.00 -2.10 0.00 0.00 70.33 66.48 1bv2 n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bv2 h ALA 42 N 0.67 -1.15 -0.64 6.98 0.00 -1.87 -0.12 119.26 123.13 1bv2 h ALA 42 Ca 0.18 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.94 1bv2 h ALA 42 Cb 0.34 0.61 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1bv2 h ALA 42 CO -0.62 -1.17 0.31 -0.44 0.00 0.00 0.00 179.25 177.34 1bv2 h ASP 43 N -1.08 0.42 0.17 0.00 3.32 -1.29 -0.00 116.42 117.95 1bv2 h ASP 43 Ca -0.08 0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.03 1bv2 h ASP 43 Cb 0.89 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 40.39 1bv2 h ASP 43 CO 0.04 0.26 -0.33 -0.09 -1.72 0.00 0.00 179.24 177.41 1bv2 h ARG 44 N 0.56 -0.56 -0.27 3.56 2.43 -0.57 0.21 114.38 119.75 1bv2 h ARG 44 Ca 0.30 0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.57 1bv2 h ARG 44 Cb 0.28 0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 29.89 1bv2 h ARG 44 CO -0.23 -0.37 -0.15 0.00 -1.51 0.00 0.00 179.97 177.70 1bv2 h ARG 45 N -0.58 -0.12 0.06 0.20 3.08 -0.52 -0.24 114.38 116.26 1bv2 h ARG 45 Ca 0.02 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.09 1bv2 h ARG 45 Cb 0.59 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.62 1bv2 h ARG 45 CO -0.16 -0.08 -0.53 1.15 -1.07 0.00 0.00 179.97 179.28 1bv2 h THR 46 N -0.12 0.00 -0.12 2.04 2.02 -0.40 -0.65 112.91 115.68 1bv2 h THR 46 Ca 0.14 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.37 1bv2 h THR 46 Cb 0.34 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.69 1bv2 h THR 46 CO -0.34 0.00 -0.30 0.00 0.37 0.00 0.00 175.52 175.24 1bv2 h ALA 47 N -0.49 -0.34 -0.82 6.16 0.00 -0.58 0.14 119.26 123.33 1bv2 h ALA 47 Ca 0.00 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.02 1bv2 h ALA 47 Cb 0.74 0.57 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 1bv2 h ALA 47 CO -0.33 -0.78 -0.56 0.00 0.00 0.00 0.00 179.25 177.59 1bv2 h ASN 49 N -0.12 -0.54 -0.81 0.00 2.35 -0.66 -0.35 115.58 115.46 1bv2 h ASN 49 Ca 0.15 0.04 0.15 0.00 -0.55 0.00 0.00 56.30 56.09 1bv2 h ASN 49 Cb 0.48 0.17 -0.15 0.00 0.05 0.00 0.00 38.32 38.87 1bv2 h ASN 49 CO -0.84 -0.33 -0.27 0.00 -1.65 0.00 0.00 177.43 174.34 1bv2 h LEU 51 N -0.04 -0.36 -0.79 0.00 3.38 -0.51 0.67 115.31 117.67 1bv2 h LEU 51 Ca 0.35 -0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.40 1bv2 h LEU 51 Cb 0.59 0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.30 1bv2 h LEU 51 CO -0.84 -0.19 -0.39 0.50 0.09 0.00 0.00 178.44 177.61 1bv2 h LYS 52 N -0.50 -0.09 0.42 1.13 3.64 0.79 0.20 116.57 122.16 1bv2 h LYS 52 Ca -0.04 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1bv2 h LYS 52 Cb 0.38 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1bv2 h LYS 52 CO 0.07 -0.06 -0.20 -0.97 -2.27 0.00 0.00 179.45 176.02 1bv2 h ASN 53 N -0.09 -0.48 -0.73 4.20 -1.24 -0.81 -2.16 115.58 114.26 1bv2 h ASN 53 Ca 0.27 -0.02 0.15 0.00 0.71 0.00 0.00 56.30 57.42 1bv2 h ASN 53 Cb 0.57 0.12 -0.14 0.00 0.73 0.00 0.00 38.32 39.60 1bv2 h ASN 53 CO -0.83 -0.30 -0.14 0.00 -1.29 0.00 0.00 177.43 174.87 1bv2 h ALA 54 N -0.07 0.55 0.50 1.57 0.00 0.39 0.78 119.26 122.98 1bv2 h ALA 54 Ca -0.06 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1bv2 h ALA 54 Cb 0.47 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1bv2 h ALA 54 CO 0.10 -0.42 -0.35 0.00 0.00 0.00 0.00 179.25 178.58 1bv2 h ALA 55 N 1.72 -0.84 -1.27 0.00 0.00 -0.89 -1.70 119.26 116.28 1bv2 h ALA 55 Ca 0.36 -0.16 0.37 0.00 0.00 0.00 0.00 54.91 55.48 1bv2 h ALA 55 Cb 0.58 0.45 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 1bv2 h ALA 55 CO -0.73 -0.99 0.89 -0.09 0.00 0.00 0.00 179.25 178.33 1bv2 h ARG 56 N -0.83 0.06 -0.81 0.00 2.43 -0.25 -0.82 114.38 114.16 1bv2 h ARG 56 Ca -0.06 -0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.92 1bv2 h ARG 56 Cb 0.69 -0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 30.11 1bv2 h ARG 56 CO 0.03 0.04 0.24 0.41 -1.51 0.00 0.00 179.97 179.18 1bv2 n GLY 57 N -1.73 3.29 3.54 2.80 0.00 -0.24 -4.93 105.19 107.93 1bv2 n GLY 57 Ca 0.29 -0.81 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 1bv2 n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bv2 s ILE 58 N -2.54 3.07 -0.10 -0.61 1.01 -0.32 -5.04 121.20 116.68 1bv2 s ILE 58 Ca 0.45 -1.62 0.03 0.00 0.00 0.00 0.00 60.65 59.51 1bv2 s ILE 58 Cb 0.36 -2.49 -0.08 0.00 0.01 0.00 0.00 42.46 40.26 1bv2 s ILE 58 CO 0.11 -0.05 -0.06 1.17 0.00 0.00 0.00 174.94 176.12 1bv2 n LYS 59 N 0.27 0.99 -2.06 2.79 3.00 -1.26 -4.65 118.16 117.24 1bv2 n LYS 59 Ca -0.12 0.04 -0.38 0.00 -0.00 0.00 0.00 58.31 57.85 1bv2 n LYS 59 Cb 0.55 -1.21 0.03 0.00 0.00 0.00 0.00 35.03 34.40 1bv2 n LYS 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1bv2 n GLY 60 N 2.85 5.63 3.88 3.14 0.00 -1.26 -5.00 105.19 114.44 1bv2 n GLY 60 Ca -0.17 -2.54 -0.29 0.00 0.00 0.00 0.00 46.02 43.02 1bv2 n GLY 60 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bv2 s LEU 61 N -4.00 3.78 -0.48 0.99 2.96 -1.26 -4.34 118.68 116.32 1bv2 s LEU 61 Ca 0.51 1.07 -0.05 0.00 -0.22 0.00 0.00 54.13 55.44 1bv2 s LEU 61 Cb 0.42 -3.97 0.13 0.00 0.50 0.00 0.00 46.19 43.26 1bv2 s LEU 61 CO -0.36 -0.44 0.31 0.21 -1.32 0.00 0.00 176.35 174.74 1bv2 s ASN 62 N -3.41 5.42 0.55 3.68 3.84 -0.80 -4.92 114.94 119.30 1bv2 s ASN 62 Ca 0.50 -2.20 0.45 0.00 0.21 0.00 0.00 52.86 51.82 1bv2 s ASN 62 Cb -0.10 -1.90 1.66 0.00 -0.55 0.00 0.00 41.25 40.36 1bv2 s ASN 62 CO 0.35 -0.55 1.66 0.00 -2.79 0.00 0.00 177.10 175.77 1bv2 h ALA 63 N 7.93 3.57 0.00 1.71 0.00 -1.92 0.93 119.26 131.48 1bv2 h ALA 63 Ca -0.12 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1bv2 h ALA 63 Cb 1.03 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1bv2 h ALA 63 CO 0.75 -2.05 -1.31 0.41 0.00 0.00 0.00 179.25 177.05 1bv2 n GLY 64 N -1.85 -0.43 0.09 0.00 0.00 -1.26 -4.45 105.19 97.28 1bv2 n GLY 64 Ca 0.37 -0.29 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1bv2 n GLY 64 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bv2 n ASN 65 N -1.76 0.99 -0.15 1.61 5.15 -0.29 -4.11 115.26 116.71 1bv2 n ASN 65 Ca -0.01 -0.02 -0.12 0.00 -0.60 0.00 0.00 54.58 53.83 1bv2 n ASN 65 Cb 0.27 0.73 0.00 0.00 -0.53 0.00 0.00 39.78 40.26 1bv2 n ASN 65 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1bv2 h ALA 66 N 0.72 0.67 -0.04 5.20 0.00 -0.80 -1.94 119.26 123.08 1bv2 h ALA 66 Ca -0.47 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.03 1bv2 h ALA 66 Cb 2.01 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1bv2 h ALA 66 CO 0.01 0.68 0.00 0.00 0.00 0.00 0.00 179.25 179.94 1bv2 n ALA 67 N -2.52 2.57 0.00 0.00 0.00 -1.25 -3.36 120.51 115.95 1bv2 n ALA 67 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1bv2 n ALA 67 Cb 0.48 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1bv2 n ALA 67 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bv2 n SER 68 N -0.02 4.39 -0.38 0.00 7.64 -0.74 -4.85 113.62 119.67 1bv2 n SER 68 Ca 0.02 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.86 1bv2 n SER 68 Cb 0.27 0.86 -0.00 0.00 -1.01 0.00 0.00 64.21 64.33 1bv2 n SER 68 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1bv2 n ILE 69 N -1.33 -0.54 -0.15 0.44 2.08 -1.15 -0.33 119.36 118.37 1bv2 n ILE 69 Ca 0.00 2.25 -0.02 0.00 0.56 0.00 0.00 62.75 65.53 1bv2 n ILE 69 Cb 0.01 -2.90 0.06 0.00 -0.75 0.00 0.00 39.64 36.06 1bv2 n ILE 69 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 1bv2 h PRO 70 N 0.00 0.14 -0.13 0.38 0.13 -1.88 -0.70 132.00 129.94 1bv2 h PRO 70 Ca 0.27 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.35 1bv2 h PRO 70 Cb 0.51 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.61 1bv2 h PRO 70 CO -0.93 0.10 -0.10 1.03 -0.23 0.00 0.00 178.00 177.86 1bv2 h SER 71 N 0.15 0.31 -0.33 1.44 0.87 -1.66 0.75 113.55 115.08 1bv2 h SER 71 Ca 0.24 -0.46 0.07 0.00 -1.23 0.00 0.00 61.79 60.41 1bv2 h SER 71 Cb 0.36 -0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 62.16 1bv2 h SER 71 CO -0.38 0.71 -0.15 0.50 -0.53 0.00 0.00 176.83 176.98 1bv2 h LYS 72 N -0.08 -0.09 0.00 2.24 1.63 0.04 -3.28 116.57 117.04 1bv2 h LYS 72 Ca 0.02 0.01 -0.29 0.00 -0.85 0.00 0.00 60.65 59.54 1bv2 h LYS 72 Cb 0.61 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.22 1bv2 h LYS 72 CO 0.03 -0.06 -1.68 0.00 -3.45 0.00 0.00 179.45 174.29 1bv2 n GLY 74 N 1.38 0.62 2.80 0.00 0.00 0.25 -5.04 105.19 105.20 1bv2 n GLY 74 Ca -0.38 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 44.87 1bv2 n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bv2 n VAL 75 N 0.00 2.73 -0.87 1.61 0.31 -0.68 -5.02 118.33 116.41 1bv2 n VAL 75 Ca 0.00 -5.35 -0.12 0.00 -0.01 0.00 0.00 64.34 58.85 1bv2 n VAL 75 Cb 0.00 -1.28 -0.13 0.00 -0.91 0.00 0.00 33.84 31.52 1bv2 n VAL 75 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1bv2 n SER 76 N -0.27 -0.90 -4.65 4.52 2.88 -1.26 -4.89 113.62 109.04 1bv2 n SER 76 Ca 0.32 -0.36 -0.29 0.00 -1.33 0.00 0.00 58.87 57.21 1bv2 n SER 76 Cb 0.47 -0.32 -0.08 0.00 -0.75 0.00 0.00 64.21 63.53 1bv2 n SER 76 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1bv2 s VAL 77 N 0.00 3.76 0.22 2.46 -7.23 -1.26 -5.04 120.40 113.31 1bv2 s VAL 77 Ca 0.73 -1.19 -0.08 0.00 -1.81 0.00 0.00 61.98 59.63 1bv2 s VAL 77 Cb -0.47 -2.81 0.16 0.00 0.56 0.00 0.00 36.38 33.81 1bv2 s VAL 77 CO 0.32 0.05 1.81 1.55 -0.31 0.00 0.00 175.10 178.52 1bv2 h PRO 78 N 3.26 0.71 -5.81 4.82 0.13 -2.03 -3.43 132.00 129.65 1bv2 h PRO 78 Ca -0.48 -0.04 -0.49 0.00 -0.87 0.00 0.00 66.00 64.11 1bv2 h PRO 78 Cb 1.18 -0.16 -0.20 0.00 0.13 0.00 0.00 31.00 31.95 1bv2 h PRO 78 CO 0.57 0.47 -0.79 1.52 -0.23 0.00 0.00 178.00 179.54 1bv2 s TYR 79 N -6.08 1.64 0.08 1.56 -0.85 -1.26 -5.07 117.35 107.36 1bv2 s TYR 79 Ca -0.13 -0.47 0.01 0.00 -0.52 0.00 0.00 57.07 55.96 1bv2 s TYR 79 Cb 0.17 -0.86 -0.01 0.00 0.38 0.00 0.00 41.96 41.64 1bv2 s TYR 79 CO 0.77 0.22 0.05 2.41 -1.52 0.00 0.00 175.55 177.47 1bv2 n THR 80 N 0.71 0.00 -2.28 -3.49 -1.04 -1.26 -5.03 114.28 101.89 1bv2 n THR 80 Ca -0.17 -0.54 -0.43 0.00 -2.04 0.00 0.00 64.05 60.88 1bv2 n THR 80 Cb 0.56 0.24 0.00 0.00 -1.82 0.00 0.00 70.33 69.30 1bv2 n THR 80 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1bv2 n ILE 81 N -0.17 3.83 -3.98 12.58 5.41 -1.26 -4.67 119.36 131.10 1bv2 n ILE 81 Ca 0.00 -3.79 -0.27 0.00 1.00 0.00 0.00 62.75 59.69 1bv2 n ILE 81 Cb 0.14 -2.46 -0.01 0.00 -0.71 0.00 0.00 39.64 36.60 1bv2 n ILE 81 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1bv2 s SER 82 N 3.40 4.57 -0.22 4.38 0.15 -1.26 -3.92 113.70 120.79 1bv2 s SER 82 Ca 0.49 -1.33 -0.05 0.00 0.70 0.00 0.00 55.95 55.76 1bv2 s SER 82 Cb 0.08 0.54 -0.12 0.00 -1.71 0.00 0.00 66.02 64.81 1bv2 s SER 82 CO 0.00 -1.14 -0.25 0.00 1.20 0.00 0.00 173.24 173.06 1bv2 n ALA 83 N -1.76 1.52 -2.49 5.45 0.00 -1.26 -4.72 120.51 117.25 1bv2 n ALA 83 Ca -0.04 -0.92 -0.33 0.00 0.00 0.00 0.00 53.44 52.15 1bv2 n ALA 83 Cb 0.65 0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.20 1bv2 n ALA 83 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bv2 n SER 84 N -3.60 5.92 -4.90 0.00 3.41 -1.26 -5.01 113.62 108.18 1bv2 n SER 84 Ca -0.42 -3.74 -0.25 0.00 -0.26 0.00 0.00 58.87 54.20 1bv2 n SER 84 Cb 0.87 -0.79 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1bv2 n SER 84 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1bv2 s ILE 85 N -4.91 5.06 0.16 -1.33 1.10 -1.26 -5.12 121.20 114.89 1bv2 s ILE 85 Ca 0.47 -0.87 0.10 0.00 -0.51 0.00 0.00 60.65 59.85 1bv2 s ILE 85 Cb 0.34 -3.63 -0.04 0.00 0.15 0.00 0.00 42.46 39.28 1bv2 s ILE 85 CO -0.22 -0.14 -0.19 -1.81 -2.11 0.00 0.00 174.94 170.46 1bv2 s ASP 86 N -3.34 3.73 0.15 4.50 1.01 -1.26 -5.08 116.67 116.39 1bv2 s ASP 86 Ca 0.33 -0.70 -0.01 0.00 0.71 0.00 0.00 52.55 52.88 1bv2 s ASP 86 Cb -0.10 -0.44 -0.04 0.00 1.01 0.00 0.00 42.92 43.35 1bv2 s ASP 86 CO 0.27 0.14 0.08 0.00 0.21 0.00 0.00 175.17 175.88 1bv2 n SER 88 N -0.14 0.00 -3.54 0.00 7.64 -1.26 -4.65 113.62 111.66 1bv2 n SER 88 Ca -0.04 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.44 1bv2 n SER 88 Cb 0.64 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.85 1bv2 n SER 88 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1bv2 n ARG 89 N 0.00 4.95 -0.06 1.43 0.63 -1.26 -3.98 116.66 118.36 1bv2 n ARG 89 Ca 0.00 -3.97 -0.10 0.00 -0.92 0.00 0.00 57.85 52.86 1bv2 n ARG 89 Cb 0.00 -2.56 -0.05 0.00 0.45 0.00 0.00 32.46 30.30 1bv2 n ARG 89 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1bv2 n VAL 90 N 0.95 0.70 0.00 5.15 3.14 -1.26 -5.04 118.33 121.96 1bv2 n VAL 90 Ca 0.56 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.70 1bv2 n VAL 90 Cb 0.25 -1.16 0.00 0.00 -1.06 0.00 0.00 33.84 31.88 1bv2 n VAL 90 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83