#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b53 n LEU 2 N 0.00 0.00 0.00 -3.43 -0.00 -1.26 -5.16 117.00 107.15 1b53 n LEU 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1b53 n LEU 2 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1b53 n LEU 2 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.39 177.39 1b53 n ALA 3 N -3.00 0.00 -1.03 1.47 0.00 -1.26 -4.82 120.51 111.88 1b53 n ALA 3 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1b53 n ALA 3 Cb 0.00 0.00 0.32 0.00 0.00 0.00 0.00 19.45 19.77 1b53 n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b53 n ALA 4 N -3.00 4.19 -2.50 0.00 0.00 -1.26 -4.90 120.51 113.04 1b53 n ALA 4 Ca 0.00 -2.29 -0.43 0.00 0.00 0.00 0.00 53.44 50.72 1b53 n ALA 4 Cb 0.00 -1.12 -0.08 0.00 0.00 0.00 0.00 19.45 18.25 1b53 n ALA 4 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1b53 s ASP 5 N -1.19 6.23 0.00 0.00 -4.77 -1.26 -4.94 116.67 110.74 1b53 s ASP 5 Ca 0.53 -0.54 0.00 0.00 -3.30 0.00 0.00 52.55 49.23 1b53 s ASP 5 Cb 0.42 -2.25 0.00 0.00 -1.09 0.00 0.00 42.92 40.00 1b53 s ASP 5 CO 0.13 -0.62 0.00 0.41 0.70 0.00 0.00 175.17 175.79 1b53 n THR 6 N 5.54 0.00 -2.71 2.11 -1.04 -1.26 -4.96 114.28 111.95 1b53 n THR 6 Ca -0.06 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.53 1b53 n THR 6 Cb 0.48 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.96 1b53 n THR 6 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1b53 s PRO 7 N 0.00 4.11 -0.84 -2.82 0.04 -1.26 -4.92 135.00 129.30 1b53 s PRO 7 Ca 0.00 1.05 -0.21 0.00 0.04 0.00 0.00 61.00 61.88 1b53 s PRO 7 Cb 0.00 -3.70 -0.20 0.00 0.04 0.00 0.00 34.50 30.64 1b53 s PRO 7 CO 0.00 -0.77 2.34 2.41 0.04 0.00 0.00 177.00 181.03 1b53 n THR 8 N 5.63 -0.01 -1.41 1.26 -1.04 -1.26 -4.76 114.28 112.68 1b53 n THR 8 Ca 0.10 -0.50 -0.51 0.00 -2.04 0.00 0.00 64.05 61.10 1b53 n THR 8 Cb 0.47 -1.38 -0.09 0.00 -1.82 0.00 0.00 70.33 67.51 1b53 n THR 8 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1b53 n ALA 9 N 14.29 0.81 -2.81 2.41 0.00 -1.26 -4.90 120.51 129.06 1b53 n ALA 9 Ca 0.54 -0.08 -0.36 0.00 0.00 0.00 0.00 53.44 53.53 1b53 n ALA 9 Cb 0.34 -2.47 -0.08 0.00 0.00 0.00 0.00 19.45 17.24 1b53 n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b53 n PHE 12 N 2.30 0.90 -3.85 0.00 3.72 -1.26 -4.71 117.46 114.56 1b53 n PHE 12 Ca 0.24 0.27 -0.35 0.00 -0.05 0.00 0.00 57.45 57.56 1b53 n PHE 12 Cb 0.37 -0.94 -0.13 0.00 -0.94 0.00 0.00 39.48 37.85 1b53 n PHE 12 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1b53 s SER 13 N -5.34 5.08 0.01 4.37 0.01 -1.26 -5.09 113.70 111.48 1b53 s SER 13 Ca -0.01 -1.72 -0.10 0.00 1.31 0.00 0.00 55.95 55.42 1b53 s SER 13 Cb 0.10 -1.77 -0.05 0.00 0.21 0.00 0.00 66.02 64.51 1b53 s SER 13 CO 0.80 -0.41 0.34 -0.31 0.41 0.00 0.00 173.24 174.07 1b53 s TYR 14 N 1.17 3.63 -0.16 2.43 1.51 -1.26 -4.02 117.35 120.65 1b53 s TYR 14 Ca 0.03 0.78 -0.24 0.00 -1.01 0.00 0.00 57.07 56.63 1b53 s TYR 14 Cb -0.21 -2.14 -0.02 0.00 -0.11 0.00 0.00 41.96 39.48 1b53 s TYR 14 CO -0.03 0.61 0.75 -0.08 -1.11 0.00 0.00 175.55 175.69 1b53 s THR 15 N -1.21 4.95 0.26 -0.71 -1.32 -1.26 -4.93 115.64 111.40 1b53 s THR 15 Ca 0.26 1.47 -0.03 0.00 -1.21 0.00 0.00 61.69 62.18 1b53 s THR 15 Cb -0.14 -4.06 0.24 0.00 -1.51 0.00 0.00 72.50 67.02 1b53 s THR 15 CO 0.14 0.08 1.82 0.28 -2.21 0.00 0.00 174.62 174.73 1b53 h SER 16 N 7.31 0.76 -4.08 8.08 0.02 -1.97 -3.41 113.55 120.26 1b53 h SER 16 Ca -0.31 0.05 -0.50 0.00 -0.84 0.00 0.00 61.79 60.18 1b53 h SER 16 Cb 1.14 -0.10 0.05 0.00 0.14 0.00 0.00 62.40 63.63 1b53 h SER 16 CO 0.81 0.43 0.31 -0.60 -1.14 0.00 0.00 176.83 176.63 1b53 s ARG 17 N -6.01 3.61 0.36 3.45 6.06 -1.26 -5.08 118.95 120.08 1b53 s ARG 17 Ca -0.12 0.58 0.05 0.00 -2.50 0.00 0.00 55.73 53.74 1b53 s ARG 17 Cb 0.20 -2.19 0.05 0.00 0.06 0.00 0.00 34.95 33.07 1b53 s ARG 17 CO 0.79 -0.41 0.39 1.04 -2.50 0.00 0.00 175.30 174.61 1b53 n GLN 18 N -2.45 0.86 -3.95 5.12 3.00 -1.26 -5.08 117.38 113.62 1b53 n GLN 18 Ca 0.04 -2.11 -0.16 0.00 -0.01 0.00 0.00 57.00 54.77 1b53 n GLN 18 Cb 0.54 0.04 -0.15 0.00 0.00 0.00 0.00 30.24 30.67 1b53 n GLN 18 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.06 178.02 1b53 s ILE 19 N -1.54 0.16 0.90 5.09 -4.36 -1.26 -5.15 121.20 115.05 1b53 s ILE 19 Ca 0.29 0.02 -0.14 0.00 -0.26 0.00 0.00 60.65 60.57 1b53 s ILE 19 Cb -0.02 -0.21 0.14 0.00 1.25 0.00 0.00 42.46 43.62 1b53 s ILE 19 CO 0.19 0.10 1.22 -2.16 0.24 0.00 0.00 174.94 174.53 1b53 s PRO 20 N 0.60 1.17 0.43 0.37 0.04 -1.26 -4.84 135.00 131.50 1b53 s PRO 20 Ca -0.06 -0.06 0.16 0.00 0.04 0.00 0.00 61.00 61.08 1b53 s PRO 20 Cb -0.09 -1.88 0.95 0.00 0.04 0.00 0.00 34.50 33.53 1b53 s PRO 20 CO -0.01 -2.11 1.92 1.96 0.04 0.00 0.00 177.00 178.80 1b53 h GLN 21 N -1.43 0.00 0.00 4.56 4.20 -1.95 -1.37 115.11 119.12 1b53 h GLN 21 Ca -0.46 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.24 1b53 h GLN 21 Cb 1.29 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.07 1b53 h GLN 21 CO 0.53 0.26 -0.06 -0.91 -0.67 0.00 0.00 178.83 177.99 1b53 h ASN 22 N 0.00 0.00 -0.38 1.46 2.35 -2.05 -2.75 115.58 114.21 1b53 h ASN 22 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1b53 h ASN 22 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1b53 h ASN 22 CO 0.03 0.06 0.00 0.33 -1.65 0.00 0.00 177.43 176.20 1b53 n PHE 23 N -3.16 0.50 -4.42 1.19 -0.00 -0.64 -4.81 117.46 106.13 1b53 n PHE 23 Ca 0.01 -0.42 -0.20 0.00 -0.00 0.00 0.00 57.45 56.84 1b53 n PHE 23 Cb 0.38 -0.02 -0.10 0.00 -0.00 0.00 0.00 39.48 39.74 1b53 n PHE 23 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 1b53 s ILE 24 N -1.03 1.35 0.00 -2.13 1.01 -0.61 -3.57 121.20 116.21 1b53 s ILE 24 Ca 0.28 -2.06 0.00 0.00 0.00 0.00 0.00 60.65 58.87 1b53 s ILE 24 Cb 0.15 -2.55 0.00 0.00 0.01 0.00 0.00 42.46 40.07 1b53 s ILE 24 CO 0.20 -0.20 0.00 0.00 0.00 0.00 0.00 174.94 174.94 1b53 n ALA 25 N -0.59 0.98 -2.47 9.38 0.00 -1.24 -4.68 120.51 121.89 1b53 n ALA 25 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1b53 n ALA 25 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1b53 n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b53 n ALA 26 N -1.36 0.00 0.00 0.00 0.00 -1.26 -4.92 120.51 112.96 1b53 n ALA 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1b53 n ALA 26 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1b53 n ALA 26 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1b53 n TYR 27 N 0.00 0.00 -1.31 0.00 4.11 -1.25 -4.56 117.16 114.15 1b53 n TYR 27 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.90 57.92 1b53 n TYR 27 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 39.34 39.33 1b53 n TYR 27 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.86 178.05 1b53 n PHE 28 N 0.00 -1.79 -2.56 -3.48 3.01 -1.26 -2.44 117.46 108.95 1b53 n PHE 28 Ca 0.00 0.23 -0.02 0.00 1.01 0.00 0.00 57.45 58.67 1b53 n PHE 28 Cb 0.00 -0.35 0.09 0.00 -0.01 0.00 0.00 39.48 39.21 1b53 n PHE 28 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1b53 n GLU 29 N -1.10 0.98 0.00 -1.08 0.28 -1.26 -4.38 120.64 114.07 1b53 n GLU 29 Ca 0.00 -0.94 0.00 0.00 -0.16 0.00 0.00 57.16 56.06 1b53 n GLU 29 Cb 0.08 0.36 0.00 0.00 1.43 0.00 0.00 31.44 33.31 1b53 n GLU 29 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1b53 n THR 30 N -1.11 0.00 -3.50 3.84 -2.24 -1.26 -4.94 114.28 105.07 1b53 n THR 30 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1b53 n THR 30 Cb 0.78 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1b53 n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1b53 n SER 31 N -2.47 0.00 -3.92 3.42 7.64 -1.26 -4.80 113.62 112.23 1b53 n SER 31 Ca 0.00 -0.61 -0.30 0.00 1.01 0.00 0.00 58.87 58.97 1b53 n SER 31 Cb 0.00 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.42 1b53 n SER 31 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1b53 s SER 32 N 0.17 2.05 0.00 6.43 0.01 -1.26 -3.93 113.70 117.18 1b53 s SER 32 Ca 0.00 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.63 1b53 s SER 32 Cb 0.00 -0.46 0.00 0.00 0.21 0.00 0.00 66.02 65.77 1b53 s SER 32 CO 0.00 -3.40 0.00 0.00 0.41 0.00 0.00 173.24 170.25 1b53 n GLN 33 N -4.23 0.00 -4.10 12.44 1.13 -1.26 -4.91 117.38 116.45 1b53 n GLN 33 Ca 0.15 0.00 -0.31 0.00 -1.94 0.00 0.00 57.00 54.90 1b53 n GLN 33 Cb 0.59 -0.19 -0.16 0.00 0.11 0.00 0.00 30.24 30.60 1b53 n GLN 33 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1b53 n SER 35 N 4.67 2.16 -3.89 0.00 2.88 -1.26 -4.72 113.62 113.46 1b53 n SER 35 Ca -0.18 0.66 -0.31 0.00 -1.33 0.00 0.00 58.87 57.70 1b53 n SER 35 Cb 0.50 -1.20 -0.09 0.00 -0.75 0.00 0.00 64.21 62.67 1b53 n SER 35 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1b53 n LYS 36 N 7.26 2.34 -0.18 -1.46 0.00 -1.26 -4.46 118.16 120.40 1b53 n LYS 36 Ca 0.37 -4.53 -0.03 0.00 -0.00 0.00 0.00 58.31 54.13 1b53 n LYS 36 Cb 0.18 -2.34 0.02 0.00 -0.00 0.00 0.00 35.03 32.89 1b53 n LYS 36 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1b53 n PRO 37 N 1.85 1.14 -1.69 -1.58 -0.04 -1.26 -4.84 135.00 128.58 1b53 n PRO 37 Ca 0.23 -0.33 -0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1b53 n PRO 37 Cb 0.37 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 1b53 n PRO 37 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1b53 n GLY 38 N 0.42 1.27 3.11 0.55 0.00 -1.25 0.56 105.19 109.86 1b53 n GLY 38 Ca 0.06 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 1b53 n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b53 s VAL 39 N -2.54 0.51 0.53 1.61 0.11 -0.66 -4.74 120.40 115.22 1b53 s VAL 39 Ca 0.03 -1.64 0.05 0.00 -2.93 0.00 0.00 61.98 57.48 1b53 s VAL 39 Cb -0.00 -1.30 0.04 0.00 -1.53 0.00 0.00 36.38 33.59 1b53 s VAL 39 CO 0.01 -0.76 0.73 -0.63 -3.33 0.00 0.00 175.10 171.12 1b53 s ILE 40 N -3.02 2.64 0.26 7.04 1.01 -1.02 -0.78 121.20 127.33 1b53 s ILE 40 Ca 0.04 -0.82 -0.11 0.00 0.00 0.00 0.00 60.65 59.75 1b53 s ILE 40 Cb 0.01 -2.81 -0.00 0.00 0.01 0.00 0.00 42.46 39.66 1b53 s ILE 40 CO -0.04 0.00 0.46 -0.36 0.00 0.00 0.00 174.94 175.00 1b53 s PHE 41 N -2.65 0.48 -0.43 3.97 0.08 0.30 -3.87 117.98 115.86 1b53 s PHE 41 Ca 0.58 -0.83 0.10 0.00 0.12 0.00 0.00 56.93 56.90 1b53 s PHE 41 Cb -0.09 0.13 0.35 0.00 -0.57 0.00 0.00 43.02 42.84 1b53 s PHE 41 CO 0.37 -1.00 0.79 1.28 -0.10 0.00 0.00 175.22 176.56 1b53 n LEU 42 N -0.40 1.81 -4.06 -0.37 4.77 -1.26 -3.12 117.00 114.37 1b53 n LEU 42 Ca -0.01 -5.19 -0.36 0.00 -0.03 0.00 0.00 56.01 50.42 1b53 n LEU 42 Cb 0.62 0.38 0.05 0.00 -2.33 0.00 0.00 43.42 42.14 1b53 n LEU 42 CO 0.24 2.31 -1.15 0.35 -1.33 0.00 0.00 177.39 177.81 1b53 n THR 43 N 0.14 0.02 0.16 -5.08 -2.24 -1.25 -3.69 114.28 102.34 1b53 n THR 43 Ca 0.27 -0.46 0.08 0.00 -2.27 0.00 0.00 64.05 61.67 1b53 n THR 43 Cb 0.59 -0.08 0.41 0.00 -2.10 0.00 0.00 70.33 69.15 1b53 n THR 43 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1b53 n LYS 44 N 1.92 0.10 -0.50 -0.78 4.76 -1.23 -1.49 118.16 120.94 1b53 n LYS 44 Ca -0.00 0.56 -0.05 0.00 -2.87 0.00 0.00 58.31 55.95 1b53 n LYS 44 Cb 0.55 -1.81 0.12 0.00 -1.84 0.00 0.00 35.03 32.06 1b53 n LYS 44 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1b53 n ARG 45 N -2.03 2.06 -1.89 1.97 5.12 -1.26 -4.82 116.66 115.81 1b53 n ARG 45 Ca -0.00 -1.39 -0.06 0.00 -1.93 0.00 0.00 57.85 54.47 1b53 n ARG 45 Cb 0.05 -1.66 -0.01 0.00 -1.16 0.00 0.00 32.46 29.68 1b53 n ARG 45 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1b53 n SER 46 N -0.03 -2.08 -4.22 0.55 2.88 -0.56 -4.84 113.62 105.32 1b53 n SER 46 Ca 0.21 0.26 -0.41 0.00 -1.33 0.00 0.00 58.87 57.60 1b53 n SER 46 Cb 0.89 -1.99 -0.07 0.00 -0.75 0.00 0.00 64.21 62.28 1b53 n SER 46 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1b53 s ARG 47 N -3.90 2.77 0.29 -1.46 0.52 -1.25 -4.96 118.95 110.95 1b53 s ARG 47 Ca 0.00 -2.09 -0.29 0.00 -0.52 0.00 0.00 55.73 52.82 1b53 s ARG 47 Cb 0.00 -4.01 -0.10 0.00 0.52 0.00 0.00 34.95 31.35 1b53 s ARG 47 CO 0.00 -1.22 1.43 1.14 0.02 0.00 0.00 175.30 176.67 1b53 s GLN 48 N 0.78 4.26 0.15 3.54 1.03 -1.26 -3.82 119.66 124.34 1b53 s GLN 48 Ca 0.11 2.33 0.02 0.00 0.04 0.00 0.00 55.36 57.86 1b53 s GLN 48 Cb -0.21 -3.08 -0.04 0.00 0.03 0.00 0.00 33.01 29.70 1b53 s GLN 48 CO -0.03 -0.40 -0.01 0.08 -2.54 0.00 0.00 175.29 172.39 1b53 s VAL 49 N -0.39 0.64 0.27 3.63 1.01 -1.18 -4.88 120.40 119.50 1b53 s VAL 49 Ca 0.57 -1.96 0.04 0.00 0.00 0.00 0.00 61.98 60.62 1b53 s VAL 49 Cb -0.42 -2.01 0.04 0.00 0.00 0.00 0.00 36.38 33.99 1b53 s VAL 49 CO 0.48 -0.57 0.32 0.00 0.00 0.00 0.00 175.10 175.33 1b53 s ALA 51 N -2.34 -1.71 1.16 0.00 0.00 0.04 -4.13 121.76 114.79 1b53 s ALA 51 Ca 0.24 0.92 -0.14 0.00 0.00 0.00 0.00 51.96 52.98 1b53 s ALA 51 Cb -0.02 0.41 0.24 0.00 0.00 0.00 0.00 23.12 23.75 1b53 s ALA 51 CO 0.15 -0.58 0.72 -0.25 0.00 0.00 0.00 175.76 175.80 1b53 n ASP 52 N 0.18 -1.93 0.00 0.00 8.00 -1.26 -1.66 116.55 119.88 1b53 n ASP 52 Ca -0.16 -0.15 0.02 0.00 0.71 0.00 0.00 54.79 55.21 1b53 n ASP 52 Cb 0.61 -1.17 0.11 0.00 -0.02 0.00 0.00 41.12 40.65 1b53 n ASP 52 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1b53 n PRO 53 N -4.11 0.97 -1.68 -0.24 -0.04 0.19 -3.81 135.00 126.28 1b53 n PRO 53 Ca 0.02 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.46 1b53 n PRO 53 Cb 0.56 -1.06 0.03 0.00 -0.04 0.00 0.00 33.50 32.99 1b53 n PRO 53 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1b53 n SER 54 N -0.56 -0.85 -4.75 3.54 2.88 -1.26 -4.88 113.62 107.74 1b53 n SER 54 Ca 0.03 -1.61 -0.38 0.00 -1.33 0.00 0.00 58.87 55.58 1b53 n SER 54 Cb 0.01 0.35 0.04 0.00 -0.75 0.00 0.00 64.21 63.87 1b53 n SER 54 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1b53 s GLU 55 N 0.05 3.08 0.31 -1.46 0.41 -1.25 -4.88 118.70 114.97 1b53 s GLU 55 Ca 0.04 2.18 0.26 0.00 -0.41 0.00 0.00 54.97 57.04 1b53 s GLU 55 Cb 0.18 -2.20 0.86 0.00 -1.78 0.00 0.00 34.13 31.19 1b53 s GLU 55 CO -0.05 -1.22 1.76 1.49 -0.49 0.00 0.00 175.26 176.75 1b53 h GLU 56 N 1.34 0.00 0.00 1.61 4.81 -2.00 -2.75 114.58 117.59 1b53 h GLU 56 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1b53 h GLU 56 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1b53 h GLU 56 CO 0.57 0.00 -1.44 -2.67 -0.73 0.00 0.00 179.01 174.74 1b53 n TRP 57 N -2.52 0.24 0.36 0.92 4.27 -1.26 -4.00 117.44 115.46 1b53 n TRP 57 Ca 0.04 0.07 0.12 0.00 -3.89 0.00 0.00 57.50 53.83 1b53 n TRP 57 Cb 0.37 -0.51 0.11 0.00 -1.36 0.00 0.00 31.31 29.93 1b53 n TRP 57 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68 1b53 h VAL 58 N 0.00 0.00 0.00 -1.67 2.07 -1.88 -3.25 116.25 111.51 1b53 h VAL 58 Ca 0.00 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1b53 h VAL 58 Cb 0.87 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1b53 h VAL 58 CO 0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 1b53 n GLN 59 N -2.42 0.06 -0.10 1.57 1.13 -1.05 -2.34 117.38 114.23 1b53 n GLN 59 Ca 0.02 0.10 -0.17 0.00 -1.94 0.00 0.00 57.00 55.00 1b53 n GLN 59 Cb 0.49 -1.57 -0.08 0.00 0.11 0.00 0.00 30.24 29.19 1b53 n GLN 59 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1b53 n LYS 60 N -1.68 0.54 0.06 -1.09 3.00 -1.23 -1.83 118.16 115.93 1b53 n LYS 60 Ca 0.06 0.47 0.07 0.00 -0.00 0.00 0.00 58.31 58.92 1b53 n LYS 60 Cb 0.33 -1.66 0.33 0.00 0.00 0.00 0.00 35.03 34.03 1b53 n LYS 60 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1b53 n TYR 61 N -4.45 0.33 -0.09 5.64 4.01 -1.24 -2.29 117.16 119.07 1b53 n TYR 61 Ca -0.28 0.15 -0.11 0.00 -0.16 0.00 0.00 57.90 57.50 1b53 n TYR 61 Cb 0.59 -0.74 -0.12 0.00 -0.31 0.00 0.00 39.34 38.77 1b53 n TYR 61 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1b53 n VAL 62 N -1.82 1.18 0.13 -0.72 0.31 -0.99 -2.77 118.33 113.66 1b53 n VAL 62 Ca 0.02 -0.62 0.03 0.00 -0.01 0.00 0.00 64.34 63.76 1b53 n VAL 62 Cb 0.13 -0.82 0.17 0.00 -0.91 0.00 0.00 33.84 32.40 1b53 n VAL 62 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1b53 n SER 63 N -2.82 0.12 0.00 4.52 2.88 -0.76 -2.47 113.62 115.09 1b53 n SER 63 Ca -0.31 0.55 0.00 0.00 -1.33 0.00 0.00 58.87 57.77 1b53 n SER 63 Cb 0.99 -0.57 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 1b53 n SER 63 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1b53 n ASP 64 N -1.65 2.48 -2.95 -3.46 -0.08 -1.19 -4.88 116.55 104.82 1b53 n ASP 64 Ca 0.00 0.00 -0.17 0.00 -1.51 0.00 0.00 54.79 53.12 1b53 n ASP 64 Cb 0.04 0.47 -0.01 0.00 2.34 0.00 0.00 41.12 43.97 1b53 n ASP 64 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1b53 n LEU 65 N -0.79 1.73 -0.10 -2.67 4.77 -1.11 -4.83 117.00 114.00 1b53 n LEU 65 Ca 0.00 -4.71 0.12 0.00 -0.03 0.00 0.00 56.01 51.39 1b53 n LEU 65 Cb 0.02 0.40 0.20 0.00 -2.33 0.00 0.00 43.42 41.71 1b53 n LEU 65 CO 0.00 2.07 0.41 1.21 -1.33 0.00 0.00 177.39 179.75 1b53 n GLU 66 N 0.06 0.30 0.00 3.23 2.13 -1.03 -4.65 120.64 120.67 1b53 n GLU 66 Ca 0.22 -0.19 0.00 0.00 0.66 0.00 0.00 57.16 57.84 1b53 n GLU 66 Cb 0.68 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.89 1b53 n GLU 66 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1b53 n LEU 67 N -1.18 0.00 -0.31 4.31 7.94 -1.26 -4.92 117.00 121.58 1b53 n LEU 67 Ca 0.07 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 55.05 1b53 n LEU 67 Cb 0.35 0.00 0.36 0.00 0.53 0.00 0.00 43.42 44.66 1b53 n LEU 67 CO 0.34 0.00 0.75 -1.54 -1.11 0.00 0.00 177.39 175.83 1b53 n SER 68 N 0.00 0.91 0.00 1.96 3.41 -1.26 -5.22 113.62 113.42 1b53 n SER 68 Ca 0.00 -1.68 0.14 0.00 -0.26 0.00 0.00 58.87 57.07 1b53 n SER 68 Cb 0.00 -0.07 0.83 0.00 -0.26 0.00 0.00 64.21 64.71 1b53 n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88