#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bv2 s THR 2 N 0.00 1.97 0.26 9.51 -4.23 -1.26 -4.95 115.64 116.94 1bv2 s THR 2 Ca 0.00 -2.18 -0.05 0.00 -1.18 0.00 0.00 61.69 58.28 1bv2 s THR 2 Cb 0.00 -2.06 0.24 0.00 1.34 0.00 0.00 72.50 72.02 1bv2 s THR 2 CO 0.00 -0.46 1.92 0.00 -0.54 0.00 0.00 174.62 175.54 1bv2 h GLY 4 N 1.25 -0.15 0.49 0.00 0.00 -1.99 0.22 103.07 102.89 1bv2 h GLY 4 Ca 0.33 0.41 0.05 0.00 0.00 0.00 0.00 47.33 48.13 1bv2 h GLY 4 CO -0.07 -0.21 -0.04 1.46 0.00 0.00 0.00 176.54 177.69 1bv2 h GLN 5 N -0.20 0.04 -0.39 4.80 4.20 -1.82 -0.62 115.11 121.12 1bv2 h GLN 5 Ca 0.21 -0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.98 1bv2 h GLN 5 Cb 0.54 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.25 1bv2 h GLN 5 CO -0.61 0.03 0.03 0.28 -0.67 0.00 0.00 178.83 177.88 1bv2 h VAL 6 N 0.04 0.74 -0.20 -0.54 2.07 -0.34 0.63 116.25 118.65 1bv2 h VAL 6 Ca 0.14 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.67 1bv2 h VAL 6 Cb 0.20 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.49 1bv2 h VAL 6 CO -0.26 0.02 -0.21 0.78 0.02 0.00 0.00 177.57 177.92 1bv2 h ASN 7 N 0.14 -0.66 -0.21 0.57 -0.26 0.16 0.40 115.58 115.71 1bv2 h ASN 7 Ca 0.19 0.12 0.06 0.00 -0.56 0.00 0.00 56.30 56.11 1bv2 h ASN 7 Cb 0.26 0.32 -0.06 0.00 -1.06 0.00 0.00 38.32 37.77 1bv2 h ASN 7 CO -0.29 -0.25 -0.19 -1.28 -1.06 0.00 0.00 177.43 174.35 1bv2 h SER 8 N -0.23 -0.62 -0.29 5.81 0.87 -0.18 -0.13 113.55 118.78 1bv2 h SER 8 Ca 0.12 0.12 0.06 0.00 -1.23 0.00 0.00 61.79 60.86 1bv2 h SER 8 Cb 0.42 0.30 -0.06 0.00 -0.44 0.00 0.00 62.40 62.62 1bv2 h SER 8 CO -0.34 -0.24 -0.08 0.00 -0.53 0.00 0.00 176.83 175.64 1bv2 h ALA 9 N 0.88 0.17 0.00 6.23 0.00 0.20 -2.94 119.26 123.79 1bv2 h ALA 9 Ca 0.13 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1bv2 h ALA 9 Cb 0.40 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1bv2 h ALA 9 CO -0.33 -0.48 -0.37 -0.39 0.00 0.00 0.00 179.25 177.68 1bv2 h VAL 10 N -0.02 0.72 -0.38 0.00 -1.51 -0.61 -3.38 116.25 111.08 1bv2 h VAL 10 Ca 0.14 -1.73 0.03 0.00 -1.23 0.00 0.00 66.70 63.92 1bv2 h VAL 10 Cb 0.23 2.14 -0.05 0.00 -2.13 0.00 0.00 31.29 31.48 1bv2 h VAL 10 CO -0.31 0.36 -0.22 0.61 -1.23 0.00 0.00 177.57 176.79 1bv2 n GLY 11 N 0.77 -1.08 0.43 5.19 0.00 -0.09 0.39 105.19 110.80 1bv2 n GLY 11 Ca 0.01 0.47 0.25 0.00 0.00 0.00 0.00 46.02 46.75 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 0.00 0.10 1.61 0.11 -1.79 -1.08 132.00 130.95 1bv2 h PRO 12 Ca 0.06 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.83 1bv2 h PRO 12 Cb 0.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 1bv2 h PRO 12 CO -0.35 0.00 -1.84 0.00 -0.21 0.00 0.00 178.00 175.60 1bv2 h LEU 14 N -0.18 -0.63 -0.52 0.00 5.85 0.52 0.28 115.31 120.64 1bv2 h LEU 14 Ca -0.41 0.27 0.10 0.00 0.84 0.00 0.00 57.88 58.68 1bv2 h LEU 14 Cb 1.87 0.51 -0.09 0.00 0.37 0.00 0.00 40.66 43.32 1bv2 h LEU 14 CO 0.02 -0.32 -0.02 0.00 -0.34 0.00 0.00 178.44 177.78 1bv2 h THR 15 N 0.02 0.57 -0.07 1.05 1.03 -1.74 0.29 112.91 114.05 1bv2 h THR 15 Ca 0.52 -0.03 -0.01 0.00 -0.01 0.00 0.00 66.41 66.87 1bv2 h THR 15 Cb 0.95 0.46 -0.00 0.00 -1.07 0.00 0.00 68.15 68.49 1bv2 h THR 15 CO -0.91 0.02 -0.01 0.22 -0.01 0.00 0.00 175.52 174.83 1bv2 h TYR 16 N 0.10 0.15 -0.86 0.00 3.20 -0.80 0.26 116.97 119.01 1bv2 h TYR 16 Ca 0.26 -0.03 0.24 0.00 3.14 0.00 0.00 58.73 62.34 1bv2 h TYR 16 Cb 0.40 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 1bv2 h TYR 16 CO -0.34 0.43 0.61 0.00 -1.64 0.00 0.00 178.16 177.22 1bv2 h ALA 17 N 0.70 2.71 0.00 1.82 0.00 0.14 -0.41 119.26 124.22 1bv2 h ALA 17 Ca 0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bv2 h ALA 17 Cb 0.38 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1bv2 h ALA 17 CO 0.01 -0.96 -0.03 -0.09 0.00 0.00 0.00 179.25 178.18 1bv2 h ARG 18 N 0.07 0.00 0.00 0.00 9.65 -0.20 0.88 114.38 124.78 1bv2 h ARG 18 Ca 0.42 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.30 1bv2 h ARG 18 Cb 1.56 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.14 1bv2 h ARG 18 CO -0.03 0.79 0.00 0.41 2.80 0.00 0.00 179.97 183.93 1bv2 n GLY 19 N 1.64 -0.58 3.77 2.80 0.00 -0.10 -3.70 105.19 109.02 1bv2 n GLY 19 Ca -0.08 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1bv2 n GLY 19 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bv2 s GLY 20 N 0.00 2.99 -1.26 -0.02 0.00 -0.15 -4.92 107.32 103.95 1bv2 s GLY 20 Ca 0.00 -0.42 -0.08 0.00 0.00 0.00 0.00 44.72 44.22 1bv2 s GLY 20 CO 0.00 -2.19 1.90 0.00 0.00 0.00 0.00 173.10 172.81 1bv2 n ALA 21 N -1.29 5.54 -3.08 3.20 0.00 -1.26 -4.66 120.51 118.95 1bv2 n ALA 21 Ca -0.18 -4.35 0.00 0.00 0.00 0.00 0.00 53.44 48.91 1bv2 n ALA 21 Cb 0.67 -2.88 0.00 0.00 0.00 0.00 0.00 19.45 17.24 1bv2 n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bv2 n GLY 22 N 2.46 7.17 3.56 0.00 0.00 -1.26 -4.93 105.19 112.18 1bv2 n GLY 22 Ca 0.41 -1.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.20 1bv2 n GLY 22 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bv2 n PRO 23 N 0.00 -1.30 -4.35 1.61 -0.02 -1.26 -5.04 135.00 124.64 1bv2 n PRO 23 Ca 0.00 -1.89 -0.18 0.00 -2.02 0.00 0.00 63.50 59.41 1bv2 n PRO 23 Cb 0.00 -1.28 -0.10 0.00 -0.02 0.00 0.00 33.50 32.09 1bv2 n PRO 23 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1bv2 s SER 24 N -5.44 1.92 0.48 2.55 0.15 -1.26 -5.00 113.70 107.10 1bv2 s SER 24 Ca 0.70 -1.25 0.16 0.00 0.70 0.00 0.00 55.95 56.26 1bv2 s SER 24 Cb -0.02 -0.00 1.14 0.00 -1.71 0.00 0.00 66.02 65.42 1bv2 s SER 24 CO 0.49 -0.53 2.06 0.00 1.20 0.00 0.00 173.24 176.47 1bv2 h ALA 25 N 2.41 1.81 -0.31 5.45 0.00 -1.99 0.58 119.26 127.21 1bv2 h ALA 25 Ca -0.39 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1bv2 h ALA 25 Cb 1.23 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1bv2 h ALA 25 CO 0.65 0.13 -0.01 0.00 0.00 0.00 0.00 179.25 180.02 1bv2 h ALA 26 N 1.90 0.42 0.21 0.00 0.00 -1.96 0.24 119.26 120.07 1bv2 h ALA 26 Ca -0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1bv2 h ALA 26 Cb 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1bv2 h ALA 26 CO 0.01 0.18 -0.17 0.00 0.00 0.00 0.00 179.25 179.27 1bv2 h SER 29 N -0.53 -0.26 0.07 0.00 0.02 -0.66 0.21 113.55 112.39 1bv2 h SER 29 Ca 0.02 0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1bv2 h SER 29 Cb 0.60 0.35 0.00 0.00 0.14 0.00 0.00 62.40 63.49 1bv2 h SER 29 CO -0.34 -0.21 -0.03 1.23 -1.14 0.00 0.00 176.83 176.33 1bv2 h GLY 30 N 0.12 -0.09 0.91 -3.77 0.00 0.37 0.64 103.07 101.24 1bv2 h GLY 30 Ca 0.51 0.03 0.02 0.00 0.00 0.00 0.00 47.33 47.89 1bv2 h GLY 30 CO -0.73 -0.03 0.39 -2.08 0.00 0.00 0.00 176.54 174.09 1bv2 h VAL 31 N -0.16 1.10 0.00 4.60 2.07 0.12 0.11 116.25 124.08 1bv2 h VAL 31 Ca -0.01 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.28 1bv2 h VAL 31 Cb 0.13 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 1bv2 h VAL 31 CO 0.01 0.14 -0.35 0.03 0.02 0.00 0.00 177.57 177.42 1bv2 h ARG 32 N 0.77 -0.49 -0.50 1.57 3.08 -0.38 -0.58 114.38 117.84 1bv2 h ARG 32 Ca 0.24 0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.34 1bv2 h ARG 32 Cb -0.01 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1bv2 h ARG 32 CO -0.09 -0.33 0.31 0.66 -1.07 0.00 0.00 179.97 179.45 1bv2 h SER 33 N -0.51 0.51 -0.48 7.04 4.64 -0.34 -0.17 113.55 124.24 1bv2 h SER 33 Ca 0.06 -0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.42 1bv2 h SER 33 Cb 0.59 -0.11 -0.07 0.00 -0.31 0.00 0.00 62.40 62.50 1bv2 h SER 33 CO -0.28 0.36 -0.41 0.25 -0.87 0.00 0.00 176.83 175.88 1bv2 h LEU 34 N 0.62 -1.42 0.17 5.97 5.85 0.17 0.25 115.31 126.92 1bv2 h LEU 34 Ca 0.20 0.20 0.00 0.00 0.84 0.00 0.00 57.88 59.12 1bv2 h LEU 34 Cb -0.01 0.60 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1bv2 h LEU 34 CO -0.08 -0.23 -0.15 0.11 -0.34 0.00 0.00 178.44 177.75 1bv2 h LYS 35 N -0.16 -0.32 -0.83 1.25 1.79 -0.90 0.22 116.57 117.61 1bv2 h LYS 35 Ca 0.08 0.02 0.13 0.00 -2.18 0.00 0.00 60.65 58.71 1bv2 h LYS 35 Cb 0.36 0.07 -0.14 0.00 -1.58 0.00 0.00 32.23 30.95 1bv2 h LYS 35 CO -0.53 -0.21 -0.36 0.00 -1.08 0.00 0.00 179.45 177.26 1bv2 h ALA 36 N 0.47 0.09 -0.15 3.86 0.00 0.01 0.40 119.26 123.94 1bv2 h ALA 36 Ca -0.00 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1bv2 h ALA 36 Cb 0.31 0.91 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1bv2 h ALA 36 CO -0.02 -0.64 0.02 0.00 0.00 0.00 0.00 179.25 178.61 1bv2 h ALA 37 N 1.23 0.19 -1.92 0.00 0.00 -0.84 -3.27 119.26 114.66 1bv2 h ALA 37 Ca 0.30 -0.16 -0.80 0.00 0.00 0.00 0.00 54.91 54.25 1bv2 h ALA 37 Cb 0.58 -0.05 -0.26 0.00 0.00 0.00 0.00 17.79 18.05 1bv2 h ALA 37 CO -0.86 -0.15 0.87 0.00 0.00 0.00 0.00 179.25 179.11 1bv2 n ALA 38 N -2.28 5.01 -0.06 0.00 0.00 0.05 -4.62 120.51 118.62 1bv2 n ALA 38 Ca -0.05 -4.72 0.03 0.00 0.00 0.00 0.00 53.44 48.69 1bv2 n ALA 38 Cb 0.18 -2.45 0.07 0.00 0.00 0.00 0.00 19.45 17.25 1bv2 n ALA 38 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bv2 n SER 39 N 1.91 2.36 -4.46 0.00 3.41 -0.55 -4.17 113.62 112.12 1bv2 n SER 39 Ca 0.27 -1.93 -0.26 0.00 -0.26 0.00 0.00 58.87 56.70 1bv2 n SER 39 Cb 0.35 -0.10 -0.11 0.00 -0.26 0.00 0.00 64.21 64.08 1bv2 n SER 39 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1bv2 s THR 40 N -0.95 2.49 0.02 6.66 2.01 -1.26 -4.95 115.64 119.67 1bv2 s THR 40 Ca 0.11 -2.15 -0.04 0.00 0.31 0.00 0.00 61.69 59.92 1bv2 s THR 40 Cb 0.06 -2.25 -0.01 0.00 0.01 0.00 0.00 72.50 70.31 1bv2 s THR 40 CO 0.08 -0.23 0.68 0.41 -0.69 0.00 0.00 174.62 174.86 1bv2 n THR 41 N -0.13 -0.10 0.19 -0.82 -1.04 -1.26 -0.41 114.28 110.71 1bv2 n THR 41 Ca -0.09 1.03 -0.15 0.00 -2.04 0.00 0.00 64.05 62.80 1bv2 n THR 41 Cb 0.58 -1.34 -0.07 0.00 -1.82 0.00 0.00 70.33 67.67 1bv2 n THR 41 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bv2 h ALA 42 N -0.39 -0.66 -0.18 2.41 0.00 -1.99 -1.28 119.26 117.16 1bv2 h ALA 42 Ca 0.02 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1bv2 h ALA 42 Cb 0.06 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1bv2 h ALA 42 CO -0.13 -0.91 -0.19 -0.44 0.00 0.00 0.00 179.25 177.57 1bv2 h ASP 43 N -0.65 -0.61 -0.17 0.00 5.19 -1.75 0.56 116.42 118.98 1bv2 h ASP 43 Ca -0.01 0.11 0.05 0.00 -0.62 0.00 0.00 57.03 56.57 1bv2 h ASP 43 Cb 0.61 0.29 -0.07 0.00 0.18 0.00 0.00 39.33 40.34 1bv2 h ASP 43 CO -0.10 -0.24 -0.37 -0.09 -3.12 0.00 0.00 179.24 175.32 1bv2 h ARG 44 N -0.22 -0.41 -0.23 3.56 2.43 -0.53 0.96 114.38 119.94 1bv2 h ARG 44 Ca 0.12 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.36 1bv2 h ARG 44 Cb 0.39 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.99 1bv2 h ARG 44 CO -0.31 -0.27 -0.07 0.00 -1.51 0.00 0.00 179.97 177.80 1bv2 h ARG 45 N -0.42 -0.02 -0.14 0.20 3.08 -0.73 -0.11 114.38 116.23 1bv2 h ARG 45 Ca 0.10 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.19 1bv2 h ARG 45 Cb 0.59 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.57 1bv2 h ARG 45 CO -0.40 -0.02 -0.45 1.15 -1.07 0.00 0.00 179.97 179.18 1bv2 h THR 46 N -0.02 0.10 -0.15 2.04 2.02 0.19 -0.69 112.91 116.40 1bv2 h THR 46 Ca 0.11 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.34 1bv2 h THR 46 Cb 0.20 0.10 -0.07 0.00 -1.74 0.00 0.00 68.15 66.65 1bv2 h THR 46 CO -0.25 0.00 -0.33 0.00 0.37 0.00 0.00 175.52 175.31 1bv2 h ALA 47 N 0.03 -0.38 -0.95 6.16 0.00 -0.47 0.14 119.26 123.78 1bv2 h ALA 47 Ca 0.07 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.11 1bv2 h ALA 47 Cb 0.64 0.64 -0.12 0.00 0.00 0.00 0.00 17.79 18.95 1bv2 h ALA 47 CO -0.42 -0.81 -0.51 0.00 0.00 0.00 0.00 179.25 177.52 1bv2 h ASN 49 N 0.00 -0.88 -0.96 0.00 2.35 -0.40 -0.11 115.58 115.58 1bv2 h ASN 49 Ca 0.20 0.03 0.29 0.00 -0.55 0.00 0.00 56.30 56.27 1bv2 h ASN 49 Cb 0.44 0.23 -0.17 0.00 0.05 0.00 0.00 38.32 38.87 1bv2 h ASN 49 CO -0.91 -0.61 0.17 0.00 -1.65 0.00 0.00 177.43 174.43 1bv2 h LEU 51 N 0.06 -0.34 -0.92 0.00 3.38 -0.48 0.68 115.31 117.69 1bv2 h LEU 51 Ca 0.63 -0.20 0.26 0.00 0.09 0.00 0.00 57.88 58.66 1bv2 h LEU 51 Cb 1.36 0.09 -0.16 0.00 0.09 0.00 0.00 40.66 42.04 1bv2 h LEU 51 CO -0.82 0.12 0.19 0.50 0.09 0.00 0.00 178.44 178.52 1bv2 h LYS 52 N -0.90 0.12 0.05 1.13 3.64 0.98 -0.11 116.57 121.49 1bv2 h LYS 52 Ca -0.04 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1bv2 h LYS 52 Cb 0.51 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1bv2 h LYS 52 CO 0.07 0.08 -0.03 -0.97 -2.27 0.00 0.00 179.45 176.33 1bv2 h ASN 53 N 0.12 -0.06 -0.71 4.20 -0.73 -0.78 -3.35 115.58 114.27 1bv2 h ASN 53 Ca 0.59 -0.56 0.16 0.00 1.87 0.00 0.00 56.30 58.35 1bv2 h ASN 53 Cb 1.25 0.02 -0.13 0.00 0.27 0.00 0.00 38.32 39.73 1bv2 h ASN 53 CO -0.75 0.65 -0.05 0.00 -0.37 0.00 0.00 177.43 176.92 1bv2 h ALA 54 N -0.23 0.66 0.00 1.57 0.00 0.24 -1.08 119.26 120.43 1bv2 h ALA 54 Ca -0.01 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1bv2 h ALA 54 Cb 0.62 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1bv2 h ALA 54 CO 0.01 -0.42 0.00 0.00 0.00 0.00 0.00 179.25 178.84 1bv2 n ALA 55 N -2.98 2.86 -0.04 0.00 0.00 -0.16 -3.21 120.51 116.99 1bv2 n ALA 55 Ca 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.51 1bv2 n ALA 55 Cb 0.42 -1.16 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1bv2 n ALA 55 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1bv2 n ARG 56 N 1.21 0.38 -2.14 0.00 0.63 -0.41 -4.12 116.66 112.22 1bv2 n ARG 56 Ca 0.00 0.04 -0.26 0.00 -0.92 0.00 0.00 57.85 56.71 1bv2 n ARG 56 Cb 0.36 -1.15 0.02 0.00 0.45 0.00 0.00 32.46 32.15 1bv2 n ARG 56 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1bv2 n GLY 57 N 3.12 6.23 2.75 5.14 0.00 -1.20 -4.79 105.19 116.45 1bv2 n GLY 57 Ca -0.13 -2.68 -0.35 0.00 0.00 0.00 0.00 46.02 42.86 1bv2 n GLY 57 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bv2 n ILE 58 N -0.64 4.16 -0.04 -0.61 5.41 -1.26 -4.98 119.36 121.41 1bv2 n ILE 58 Ca 0.43 -5.29 0.00 0.00 1.00 0.00 0.00 62.75 58.90 1bv2 n ILE 58 Cb 0.84 -1.39 0.00 0.00 -0.71 0.00 0.00 39.64 38.38 1bv2 n ILE 58 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1bv2 n LYS 59 N -0.30 0.00 0.00 0.38 5.02 -1.26 -1.41 118.16 120.59 1bv2 n LYS 59 Ca 0.44 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.73 1bv2 n LYS 59 Cb 0.35 -0.04 0.00 0.00 -0.02 0.00 0.00 35.03 35.32 1bv2 n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bv2 n GLY 60 N 0.17 0.96 3.91 0.72 0.00 -1.26 -5.14 105.19 104.55 1bv2 n GLY 60 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 3.54 0.29 0.99 2.96 -0.50 -4.65 118.68 121.31 1bv2 s LEU 61 Ca 0.00 0.82 0.02 0.00 -0.22 0.00 0.00 54.13 54.75 1bv2 s LEU 61 Cb 0.00 -3.74 -0.03 0.00 0.50 0.00 0.00 46.19 42.92 1bv2 s LEU 61 CO 0.00 -0.69 0.46 0.21 -1.32 0.00 0.00 176.35 175.00 1bv2 s ASN 62 N -4.16 6.32 -0.14 3.68 3.84 0.30 -4.95 114.94 119.83 1bv2 s ASN 62 Ca 0.49 0.31 -0.14 0.00 0.21 0.00 0.00 52.86 53.73 1bv2 s ASN 62 Cb -0.10 -1.97 -0.12 0.00 -0.55 0.00 0.00 41.25 38.51 1bv2 s ASN 62 CO 0.44 -0.18 0.22 0.00 -2.79 0.00 0.00 177.10 174.80 1bv2 h ALA 63 N 1.10 0.05 -0.84 1.71 0.00 -1.94 -3.36 119.26 115.97 1bv2 h ALA 63 Ca -0.50 -0.48 -0.57 0.00 0.00 0.00 0.00 54.91 53.36 1bv2 h ALA 63 Cb 1.22 0.25 -0.42 0.00 0.00 0.00 0.00 17.79 18.84 1bv2 h ALA 63 CO 0.62 0.24 -0.67 0.41 0.00 0.00 0.00 179.25 179.86 1bv2 n GLY 64 N 1.63 6.32 1.52 0.00 0.00 -1.26 -4.08 105.19 109.32 1bv2 n GLY 64 Ca -0.11 -2.65 0.00 0.00 0.00 0.00 0.00 46.02 43.26 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 -0.70 0.04 -0.03 1.61 5.15 -1.26 -4.44 115.26 115.64 1bv2 n ASN 65 Ca 0.45 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 54.31 1bv2 n ASN 65 Cb 0.91 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 40.10 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 0.00 0.15 -0.12 5.20 0.00 -1.71 -1.20 119.26 121.58 1bv2 h ALA 66 Ca 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1bv2 h ALA 66 Cb 0.44 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1bv2 h ALA 66 CO 0.00 -0.22 0.04 0.00 0.00 0.00 0.00 179.25 179.06 1bv2 n ALA 67 N -2.25 2.83 -0.00 0.00 0.00 -1.25 -3.25 120.51 116.59 1bv2 n ALA 67 Ca -0.06 -0.38 -0.00 0.00 0.00 0.00 0.00 53.44 53.00 1bv2 n ALA 67 Cb 0.15 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.55 1bv2 n ALA 67 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bv2 n SER 68 N 0.14 4.78 -0.34 0.00 2.88 -0.51 -4.78 113.62 115.79 1bv2 n SER 68 Ca 0.06 -0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1bv2 n SER 68 Cb 0.50 0.51 0.05 0.00 -0.75 0.00 0.00 64.21 64.52 1bv2 n SER 68 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1bv2 n ILE 69 N -2.04 -0.46 0.02 2.46 2.08 -0.85 -0.37 119.36 120.21 1bv2 n ILE 69 Ca -0.01 2.09 -0.10 0.00 0.56 0.00 0.00 62.75 65.29 1bv2 n ILE 69 Cb 0.53 -2.78 -0.04 0.00 -0.75 0.00 0.00 39.64 36.60 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 -0.24 -0.37 0.38 0.13 -1.87 -0.30 132.00 129.73 1bv2 h PRO 70 Ca 0.33 0.02 0.05 0.00 -0.87 0.00 0.00 66.00 65.53 1bv2 h PRO 70 Cb 0.55 0.05 -0.05 0.00 0.13 0.00 0.00 31.00 31.68 1bv2 h PRO 70 CO -0.89 -0.16 0.08 1.03 -0.23 0.00 0.00 178.00 177.82 1bv2 h SER 71 N -0.25 0.02 0.19 1.44 0.87 -1.02 1.33 113.55 116.13 1bv2 h SER 71 Ca 0.08 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1bv2 h SER 71 Cb 0.36 0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1bv2 h SER 71 CO -0.22 0.05 -0.11 0.11 -0.53 0.00 0.00 176.83 176.13 1bv2 h LYS 72 N 0.20 -0.28 0.00 2.24 1.79 -0.31 -3.37 116.57 116.85 1bv2 h LYS 72 Ca 0.17 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 1bv2 h LYS 72 Cb 0.20 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1bv2 h LYS 72 CO -0.23 -0.19 -0.19 0.00 -1.08 0.00 0.00 179.45 177.77 1bv2 n GLY 74 N 1.73 0.73 0.59 0.00 0.00 0.46 -5.04 105.19 103.66 1bv2 n GLY 74 Ca -0.03 -0.70 0.06 0.00 0.00 0.00 0.00 46.02 45.35 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 2.19 -2.07 1.61 0.31 -1.25 -5.04 118.33 114.07 1bv2 n VAL 75 Ca 0.00 -2.60 -0.07 0.00 -0.01 0.00 0.00 64.34 61.67 1bv2 n VAL 75 Cb 0.00 -0.26 0.01 0.00 -0.91 0.00 0.00 33.84 32.68 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 -1.13 -3.34 -4.59 4.52 2.88 -1.26 -5.00 113.62 105.71 1bv2 n SER 76 Ca 0.21 0.12 -0.24 0.00 -1.33 0.00 0.00 58.87 57.64 1bv2 n SER 76 Cb 0.78 -0.85 -0.08 0.00 -0.75 0.00 0.00 64.21 63.31 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 -0.61 3.00 -0.48 2.46 -7.23 -1.26 -5.05 120.40 111.24 1bv2 s VAL 77 Ca 0.06 -2.09 0.03 0.00 -1.81 0.00 0.00 61.98 58.18 1bv2 s VAL 77 Cb -0.01 -2.66 0.51 0.00 0.56 0.00 0.00 36.38 34.79 1bv2 s VAL 77 CO 0.14 -0.36 1.75 -0.81 -0.31 0.00 0.00 175.10 175.52 1bv2 n PRO 78 N -0.81 2.58 0.00 4.82 -0.04 -1.26 -4.94 135.00 135.35 1bv2 n PRO 78 Ca -0.06 -3.37 0.00 0.00 -0.04 0.00 0.00 63.50 60.04 1bv2 n PRO 78 Cb 0.60 -2.17 0.00 0.00 -0.04 0.00 0.00 33.50 31.89 1bv2 n PRO 78 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1bv2 n TYR 79 N -0.98 0.00 -4.01 0.54 0.18 -1.26 -5.01 117.16 106.62 1bv2 n TYR 79 Ca 0.53 0.00 -0.01 0.00 1.88 0.00 0.00 57.90 60.30 1bv2 n TYR 79 Cb 1.02 0.00 -0.00 0.00 -0.38 0.00 0.00 39.34 39.97 1bv2 n TYR 79 CO 0.00 0.00 0.00 2.41 -2.08 0.00 0.00 176.86 177.19 1bv2 n THR 80 N -0.73 0.00 -2.02 -3.48 -1.04 -1.26 -5.01 114.28 100.74 1bv2 n THR 80 Ca 0.00 -0.06 -0.42 0.00 -2.04 0.00 0.00 64.05 61.53 1bv2 n THR 80 Cb 0.00 0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 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 -0.02 3.77 -4.46 12.58 5.41 -1.26 -4.51 119.36 130.87 1bv2 n ILE 81 Ca 0.00 -3.55 -0.32 0.00 1.00 0.00 0.00 62.75 59.88 1bv2 n ILE 81 Cb 0.01 -2.51 -0.11 0.00 -0.71 0.00 0.00 39.64 36.33 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 2.67 4.51 -0.05 4.38 0.15 -1.26 -3.86 113.70 120.23 1bv2 s SER 82 Ca 0.46 -0.20 0.21 0.00 0.70 0.00 0.00 55.95 57.11 1bv2 s SER 82 Cb 0.11 -1.00 0.70 0.00 -1.71 0.00 0.00 66.02 64.12 1bv2 s SER 82 CO -0.04 0.27 1.59 0.00 1.20 0.00 0.00 173.24 176.26 1bv2 n ALA 83 N 1.47 2.73 -2.69 5.45 0.00 -1.26 -4.29 120.51 121.91 1bv2 n ALA 83 Ca -0.15 -1.45 -0.09 0.00 0.00 0.00 0.00 53.44 51.75 1bv2 n ALA 83 Cb 0.52 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 19.04 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 1.44 0.88 -4.54 0.00 3.41 -1.26 -4.98 113.62 108.57 1bv2 n SER 84 Ca 0.26 -2.69 -0.26 0.00 -0.26 0.00 0.00 58.87 55.92 1bv2 n SER 84 Cb 0.76 -0.28 -0.11 0.00 -0.26 0.00 0.00 64.21 64.32 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 -2.57 2.09 0.27 -1.33 1.10 -1.26 -5.13 121.20 114.38 1bv2 s ILE 85 Ca 0.27 -2.16 0.08 0.00 -0.51 0.00 0.00 60.65 58.34 1bv2 s ILE 85 Cb 0.44 -2.68 -0.06 0.00 0.15 0.00 0.00 42.46 40.32 1bv2 s ILE 85 CO 0.01 -0.18 -0.11 -0.62 -2.11 0.00 0.00 174.94 171.94 1bv2 s ASP 86 N -3.60 3.04 -0.26 4.50 2.15 -1.26 -4.95 116.67 116.29 1bv2 s ASP 86 Ca 0.33 -1.13 -0.02 0.00 0.43 0.00 0.00 52.55 52.16 1bv2 s ASP 86 Cb 0.04 -0.22 0.15 0.00 -0.30 0.00 0.00 42.92 42.59 1bv2 s ASP 86 CO 0.16 -0.21 0.42 0.00 -0.17 0.00 0.00 175.17 175.37 1bv2 s SER 88 N 2.60 0.50 -0.67 0.00 1.04 -1.26 -4.91 113.70 110.99 1bv2 s SER 88 Ca 0.14 -2.10 -0.14 0.00 0.48 0.00 0.00 55.95 54.33 1bv2 s SER 88 Cb -0.15 0.62 0.02 0.00 0.10 0.00 0.00 66.02 66.61 1bv2 s SER 88 CO -0.18 -0.17 0.63 -2.11 0.98 0.00 0.00 173.24 172.39 1bv2 n ARG 89 N 3.44 -1.71 -0.55 4.02 1.85 -1.26 -4.75 116.66 117.71 1bv2 n ARG 89 Ca 0.19 1.13 -0.02 0.00 -1.00 0.00 0.00 57.85 58.16 1bv2 n ARG 89 Cb 0.49 -2.73 -0.00 0.00 -1.05 0.00 0.00 32.46 29.17 1bv2 n ARG 89 CO 0.00 0.00 0.00 1.55 -0.01 0.00 0.00 177.63 179.17 1bv2 n VAL 90 N -1.59 2.10 -0.61 8.89 3.14 -1.26 -5.10 118.33 123.89 1bv2 n VAL 90 Ca -0.19 -0.63 0.00 0.00 -2.96 0.00 0.00 64.34 60.57 1bv2 n VAL 90 Cb 0.66 -1.51 0.00 0.00 -1.06 0.00 0.00 33.84 31.93 1bv2 n VAL 90 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17