#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyp n SER 2 N 0.00 -2.49 -4.61 1.61 7.64 -1.26 -5.10 113.62 109.41 1nyp n SER 2 Ca 0.00 0.54 -0.50 0.00 1.01 0.00 0.00 58.87 59.92 1nyp n SER 2 Cb 0.00 2.51 -0.05 0.00 -1.01 0.00 0.00 64.21 65.66 1nyp n SER 2 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1nyp n MET 3 N -3.07 1.38 0.00 1.43 -0.00 -1.26 -4.61 117.12 110.99 1nyp n MET 3 Ca 0.00 0.50 0.00 0.00 -0.00 0.00 0.00 57.70 58.20 1nyp n MET 3 Cb 0.00 -2.13 0.00 0.00 -0.00 0.00 0.00 33.22 31.09 1nyp n MET 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1nyp n GLY 4 N 2.53 -0.80 1.90 3.17 0.00 -1.26 -5.15 105.19 105.58 1nyp n GLY 4 Ca 0.17 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1nyp n GLY 4 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nyp n VAL 5 N 0.00 -5.88 -1.59 1.61 0.31 -1.26 -4.92 118.33 106.60 1nyp n VAL 5 Ca 0.00 2.46 -0.30 0.00 -0.01 0.00 0.00 64.34 66.49 1nyp n VAL 5 Cb 0.00 -3.28 0.07 0.00 -0.91 0.00 0.00 33.84 29.73 1nyp n VAL 5 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1nyp s PRO 6 N -1.76 2.41 -0.08 5.55 0.04 -1.26 -4.82 135.00 135.08 1nyp s PRO 6 Ca 0.00 0.71 -0.01 0.00 0.04 0.00 0.00 61.00 61.74 1nyp s PRO 6 Cb 0.00 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.62 1nyp s PRO 6 CO 0.00 -1.41 -0.00 0.42 0.04 0.00 0.00 177.00 176.04 1nyp s ILE 7 N -3.14 0.42 -0.12 0.56 1.01 -1.26 0.24 121.20 118.90 1nyp s ILE 7 Ca 0.60 0.08 -0.30 0.00 0.00 0.00 0.00 60.65 61.02 1nyp s ILE 7 Cb -0.14 -0.58 -0.08 0.00 0.01 0.00 0.00 42.46 41.67 1nyp s ILE 7 CO 0.54 0.26 2.09 0.00 0.00 0.00 0.00 174.94 177.83 1nyp n GLY 9 N 5.21 -0.25 0.06 0.00 0.00 0.18 0.16 105.19 110.55 1nyp n GLY 9 Ca 0.26 -0.01 -0.04 0.00 0.00 0.00 0.00 46.02 46.24 1nyp n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyp h ALA 10 N 2.12 0.01 -0.02 4.61 0.00 -1.86 -3.39 119.26 120.73 1nyp h ALA 10 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1nyp h ALA 10 Cb 0.01 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1nyp h ALA 10 CO 0.00 0.26 -0.16 0.00 0.00 0.00 0.00 179.25 179.35 1nyp n ARG 12 N 0.87 -6.58 -4.40 0.00 5.12 0.42 -4.98 116.66 107.12 1nyp n ARG 12 Ca 0.12 0.77 -0.29 0.00 -1.93 0.00 0.00 57.85 56.52 1nyp n ARG 12 Cb 0.55 -5.74 -0.12 0.00 -1.16 0.00 0.00 32.46 25.99 1nyp n ARG 12 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1nyp s ARG 13 N -6.26 1.64 -0.16 5.56 1.81 -1.22 -4.85 118.95 115.47 1nyp s ARG 13 Ca 0.55 -1.23 -0.29 0.00 -1.72 0.00 0.00 55.73 53.03 1nyp s ARG 13 Cb -0.25 -2.02 -0.07 0.00 -0.45 0.00 0.00 34.95 32.16 1nyp s ARG 13 CO 0.67 0.47 2.15 -2.30 -0.68 0.00 0.00 175.30 175.61 1nyp n PRO 14 N 0.95 2.14 -1.26 3.54 -0.02 -1.26 -0.62 135.00 138.47 1nyp n PRO 14 Ca -0.17 0.66 -0.31 0.00 -2.02 0.00 0.00 63.50 61.66 1nyp n PRO 14 Cb 0.53 -3.10 0.09 0.00 -0.02 0.00 0.00 33.50 31.00 1nyp n PRO 14 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1nyp s ILE 15 N 7.10 3.30 -0.39 4.25 1.01 0.65 -4.86 121.20 132.25 1nyp s ILE 15 Ca 0.98 0.42 0.01 0.00 0.00 0.00 0.00 60.65 62.06 1nyp s ILE 15 Cb -0.41 -2.91 0.26 0.00 0.01 0.00 0.00 42.46 39.40 1nyp s ILE 15 CO 0.39 -0.55 1.10 -1.84 0.00 0.00 0.00 174.94 174.03 1nyp n GLU 16 N -3.54 0.37 0.00 2.79 0.28 -1.26 -4.28 120.64 115.01 1nyp n GLU 16 Ca 0.09 -1.10 0.00 0.00 -0.16 0.00 0.00 57.16 55.99 1nyp n GLU 16 Cb 0.53 -0.70 0.00 0.00 1.43 0.00 0.00 31.44 32.70 1nyp n GLU 16 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1nyp n GLY 17 N 1.62 0.39 2.78 -1.84 0.00 -1.26 -5.10 105.19 101.78 1nyp n GLY 17 Ca 0.05 0.14 -0.16 0.00 0.00 0.00 0.00 46.02 46.05 1nyp n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nyp s ARG 18 N 0.00 0.03 0.13 1.61 0.52 -1.26 -5.12 118.95 114.86 1nyp s ARG 18 Ca 0.00 0.17 0.08 0.00 -0.52 0.00 0.00 55.73 55.46 1nyp s ARG 18 Cb 0.00 -0.30 -0.04 0.00 0.52 0.00 0.00 34.95 35.13 1nyp s ARG 18 CO 0.00 -0.17 -0.18 0.08 0.02 0.00 0.00 175.30 175.05 1nyp s VAL 19 N 1.10 1.62 -0.16 3.52 1.01 -1.26 -3.62 120.40 122.60 1nyp s VAL 19 Ca -0.09 -1.70 -0.00 0.00 0.00 0.00 0.00 61.98 60.19 1nyp s VAL 19 Cb -0.13 -1.62 0.04 0.00 0.00 0.00 0.00 36.38 34.67 1nyp s VAL 19 CO -0.03 -0.25 -0.08 -0.69 0.00 0.00 0.00 175.10 174.05 1nyp s VAL 20 N -1.72 1.30 -0.55 2.92 1.01 0.56 -4.77 120.40 119.16 1nyp s VAL 20 Ca 0.10 -0.68 -0.24 0.00 0.00 0.00 0.00 61.98 61.16 1nyp s VAL 20 Cb -0.07 -1.39 0.04 0.00 0.00 0.00 0.00 36.38 34.96 1nyp s VAL 20 CO 0.05 0.22 0.92 0.20 0.00 0.00 0.00 175.10 176.48 1nyp s ASN 21 N 1.56 6.33 0.09 3.32 0.02 -1.26 0.01 114.94 125.01 1nyp s ASN 21 Ca 0.01 -0.40 -0.08 0.00 -1.02 0.00 0.00 52.86 51.36 1nyp s ASN 21 Cb -0.15 -2.43 -0.00 0.00 0.02 0.00 0.00 41.25 38.69 1nyp s ASN 21 CO -0.08 -1.21 0.18 0.00 0.02 0.00 0.00 177.10 176.02 1nyp s ALA 22 N 3.85 -0.21 -1.65 0.60 0.00 -0.96 -4.81 121.76 118.58 1nyp s ALA 22 Ca 0.29 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1nyp s ALA 22 Cb -0.13 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.47 1nyp s ALA 22 CO 0.18 -0.51 0.00 -1.33 0.00 0.00 0.00 175.76 174.11 1nyp n MET 23 N -0.05 -1.50 -1.55 0.00 2.81 -1.26 0.14 117.12 115.70 1nyp n MET 23 Ca -0.15 0.99 -0.11 0.00 -1.81 0.00 0.00 57.70 56.62 1nyp n MET 23 Cb 0.62 -5.32 -0.03 0.00 -0.71 0.00 0.00 33.22 27.78 1nyp n MET 23 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nyp n GLY 24 N -0.15 0.86 0.00 3.03 0.00 -1.26 -4.96 105.19 102.71 1nyp n GLY 24 Ca -0.16 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1nyp n GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nyp n LYS 25 N -2.51 2.13 -4.22 1.61 5.02 0.37 -5.15 118.16 115.40 1nyp n LYS 25 Ca -0.11 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.01 1nyp n LYS 25 Cb 0.42 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 35.29 1nyp n LYS 25 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1nyp s GLN 26 N 1.38 0.61 -0.03 1.97 -0.21 -1.26 -2.27 119.66 119.86 1nyp s GLN 26 Ca 0.00 -0.46 -0.02 0.00 0.02 0.00 0.00 55.36 54.90 1nyp s GLN 26 Cb 0.00 -0.54 0.01 0.00 1.00 0.00 0.00 33.01 33.48 1nyp s GLN 26 CO 0.00 0.14 0.07 -1.58 -2.12 0.00 0.00 175.29 171.80 1nyp s TRP 27 N -0.58 -0.08 0.36 0.91 0.52 0.10 0.47 118.94 120.65 1nyp s TRP 27 Ca -0.01 0.19 -0.28 0.00 0.02 0.00 0.00 56.10 56.02 1nyp s TRP 27 Cb -0.05 0.03 -0.12 0.00 -1.15 0.00 0.00 33.47 32.17 1nyp s TRP 27 CO 0.00 -0.04 1.28 0.72 0.02 0.00 0.00 176.95 178.93 1nyp n HIS 28 N 3.03 2.24 0.32 -1.98 8.25 -1.26 -0.32 115.22 125.50 1nyp n HIS 28 Ca -0.12 0.54 0.21 0.00 -0.26 0.00 0.00 57.72 58.09 1nyp n HIS 28 Cb 0.59 -2.41 1.10 0.00 1.12 0.00 0.00 29.99 30.40 1nyp n HIS 28 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1nyp h VAL 29 N 2.46 0.00 0.00 1.59 2.07 -1.86 0.15 116.25 120.66 1nyp h VAL 29 Ca -0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1nyp h VAL 29 Cb 1.29 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1nyp h VAL 29 CO 0.62 0.00 -1.03 -1.84 0.02 0.00 0.00 177.57 175.34 1nyp n GLU 30 N -2.96 0.17 0.00 1.57 0.28 -1.26 -3.71 120.64 114.72 1nyp n GLU 30 Ca -0.03 -0.02 0.07 0.00 -0.16 0.00 0.00 57.16 57.03 1nyp n GLU 30 Cb 0.11 -1.54 -0.07 0.00 1.43 0.00 0.00 31.44 31.38 1nyp n GLU 30 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1nyp n HIS 31 N -1.75 0.00 -2.62 -1.84 8.25 0.38 -4.73 115.22 112.92 1nyp n HIS 31 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.07 1nyp n HIS 31 Cb 0.39 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.47 1nyp n HIS 31 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1nyp s PHE 32 N -2.31 2.52 0.44 4.41 5.36 -0.27 -4.86 117.98 123.27 1nyp s PHE 32 Ca 0.08 0.15 0.03 0.00 -0.96 0.00 0.00 56.93 56.22 1nyp s PHE 32 Cb 0.12 -4.49 -0.02 0.00 -0.34 0.00 0.00 43.02 38.28 1nyp s PHE 32 CO 0.57 -1.74 0.08 0.14 -1.46 0.00 0.00 175.22 172.82 1nyp s VAL 33 N 5.06 0.86 0.54 3.12 -7.23 -1.26 -2.72 120.40 118.77 1nyp s VAL 33 Ca 0.37 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.34 1nyp s VAL 33 Cb -0.09 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.47 1nyp s VAL 33 CO 0.20 0.00 1.17 0.00 -0.31 0.00 0.00 175.10 176.16 1nyp n ALA 35 N -1.21 3.97 0.00 0.00 0.00 0.91 -2.18 120.51 121.99 1nyp n ALA 35 Ca 0.11 -1.52 0.00 0.00 0.00 0.00 0.00 53.44 52.04 1nyp n ALA 35 Cb 0.50 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1nyp n ALA 35 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1nyp n LYS 36 N -0.15 1.24 0.00 0.00 3.00 -1.26 -4.91 118.16 116.09 1nyp n LYS 36 Ca 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.59 1nyp n LYS 36 Cb 1.06 -0.65 0.00 0.00 0.00 0.00 0.00 35.03 35.44 1nyp n LYS 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1nyp n GLU 38 N -0.44 -3.02 -3.53 0.00 4.71 -0.93 -4.95 120.64 112.49 1nyp n GLU 38 Ca 0.00 0.36 -0.41 0.00 -0.01 0.00 0.00 57.16 57.10 1nyp n GLU 38 Cb 0.00 -3.93 -0.11 0.00 -1.01 0.00 0.00 31.44 26.39 1nyp n GLU 38 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 1nyp s LYS 39 N -4.92 3.16 0.18 3.49 1.02 -1.26 -4.73 119.74 116.69 1nyp s LYS 39 Ca 0.09 -0.87 -0.30 0.00 0.02 0.00 0.00 55.97 54.91 1nyp s LYS 39 Cb -0.04 -3.83 -0.08 0.00 -0.52 0.00 0.00 37.83 33.36 1nyp s LYS 39 CO 0.31 -0.60 1.24 -1.25 -0.92 0.00 0.00 175.35 174.14 1nyp s PRO 40 N 1.66 4.45 -1.20 -1.68 0.04 -1.26 -2.67 135.00 134.33 1nyp s PRO 40 Ca 0.05 1.94 -0.04 0.00 0.04 0.00 0.00 61.00 62.99 1nyp s PRO 40 Cb -0.18 -3.23 0.17 0.00 0.04 0.00 0.00 34.50 31.30 1nyp s PRO 40 CO 0.09 -0.17 2.25 1.19 0.04 0.00 0.00 177.00 180.40 1nyp n PHE 41 N 2.65 2.61 -0.36 0.56 3.72 -1.10 -4.79 117.46 120.76 1nyp n PHE 41 Ca 0.05 -2.71 -0.05 0.00 -0.05 0.00 0.00 57.45 54.70 1nyp n PHE 41 Cb 0.44 -1.64 -0.01 0.00 -0.94 0.00 0.00 39.48 37.34 1nyp n PHE 41 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1nyp h LEU 42 N 5.10 -1.62 -2.78 4.37 4.07 -1.87 -2.65 115.31 119.94 1nyp h LEU 42 Ca 0.65 0.30 -0.03 0.00 0.08 0.00 0.00 57.88 58.88 1nyp h LEU 42 Cb 0.32 0.79 -0.06 0.00 1.08 0.00 0.00 40.66 42.79 1nyp h LEU 42 CO 1.37 -0.28 -0.39 0.61 -1.08 0.00 0.00 178.44 178.67 1nyp n GLY 43 N -1.41 3.42 3.71 0.83 0.00 -1.26 -4.91 105.19 105.57 1nyp n GLY 43 Ca 0.07 -0.89 -0.25 0.00 0.00 0.00 0.00 46.02 44.95 1nyp n GLY 43 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1nyp s HIS 44 N -1.92 2.60 0.48 1.61 3.76 -1.00 -5.13 115.29 115.69 1nyp s HIS 44 Ca 0.27 -0.55 -0.11 0.00 -0.15 0.00 0.00 55.06 54.52 1nyp s HIS 44 Cb 0.26 -1.84 -0.06 0.00 1.11 0.00 0.00 32.58 32.05 1nyp s HIS 44 CO -0.03 0.27 0.86 0.50 -0.85 0.00 0.00 174.74 175.49 1nyp s ARG 45 N -3.85 3.73 0.40 1.40 3.52 -1.26 -4.77 118.95 118.12 1nyp s ARG 45 Ca 0.39 0.56 0.07 0.00 -0.13 0.00 0.00 55.73 56.62 1nyp s ARG 45 Cb 0.03 -2.28 -0.08 0.00 -1.56 0.00 0.00 34.95 31.07 1nyp s ARG 45 CO 0.22 -0.21 0.01 -3.38 -0.81 0.00 0.00 175.30 171.13 1nyp s HIS 46 N -2.64 2.45 -0.02 5.12 -3.43 -1.26 -4.69 115.29 110.81 1nyp s HIS 46 Ca 0.53 -0.71 0.01 0.00 -0.80 0.00 0.00 55.06 54.09 1nyp s HIS 46 Cb -0.10 -1.73 0.01 0.00 -1.43 0.00 0.00 32.58 29.33 1nyp s HIS 46 CO 0.38 0.40 -0.05 0.71 -2.00 0.00 0.00 174.74 174.18 1nyp s TYR 47 N -2.77 0.56 -0.05 0.38 1.51 -0.81 -4.93 117.35 111.24 1nyp s TYR 47 Ca 0.34 -0.12 0.01 0.00 -1.01 0.00 0.00 57.07 56.30 1nyp s TYR 47 Cb 0.10 -0.45 -0.03 0.00 -0.11 0.00 0.00 41.96 41.46 1nyp s TYR 47 CO 0.17 -0.08 -0.07 -1.21 -1.11 0.00 0.00 175.55 173.25 1nyp s GLU 48 N 0.36 2.70 -0.08 -0.62 2.02 -1.26 0.20 118.70 122.03 1nyp s GLU 48 Ca -0.04 -0.59 -0.06 0.00 0.02 0.00 0.00 54.97 54.30 1nyp s GLU 48 Cb -0.08 -2.57 0.03 0.00 0.10 0.00 0.00 34.13 31.61 1nyp s GLU 48 CO -0.00 0.65 0.19 0.50 0.02 0.00 0.00 175.26 176.62 1nyp s ARG 49 N -0.97 0.19 -1.08 1.61 3.52 0.47 -4.82 118.95 117.87 1nyp s ARG 49 Ca 0.14 0.33 0.00 0.00 -0.13 0.00 0.00 55.73 56.07 1nyp s ARG 49 Cb -0.11 0.02 0.00 0.00 -1.56 0.00 0.00 34.95 33.30 1nyp s ARG 49 CO 0.03 -0.08 0.00 1.63 -0.81 0.00 0.00 175.30 176.07 1nyp n LYS 50 N 3.42 -1.50 -1.75 5.12 4.76 -1.26 0.17 118.16 127.12 1nyp n LYS 50 Ca -0.17 0.60 0.00 0.00 -2.87 0.00 0.00 58.31 55.87 1nyp n LYS 50 Cb 0.56 -4.89 0.00 0.00 -1.84 0.00 0.00 35.03 28.86 1nyp n LYS 50 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nyp n GLY 51 N -0.34 0.62 2.91 0.72 0.00 -1.26 -5.05 105.19 102.78 1nyp n GLY 51 Ca -0.11 -0.76 -0.11 0.00 0.00 0.00 0.00 46.02 45.04 1nyp n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nyp s LEU 52 N -0.05 2.06 0.49 0.99 1.43 0.45 -4.88 118.68 119.16 1nyp s LEU 52 Ca 0.00 -0.14 -0.19 0.00 -1.03 0.00 0.00 54.13 52.76 1nyp s LEU 52 Cb 0.00 0.04 -0.09 0.00 0.03 0.00 0.00 46.19 46.18 1nyp s LEU 52 CO 0.00 -0.09 1.00 0.00 0.23 0.00 0.00 176.35 177.49 1nyp s ALA 53 N -0.44 2.94 -0.18 4.21 0.00 -1.26 0.18 121.76 127.21 1nyp s ALA 53 Ca -0.05 0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.20 1nyp s ALA 53 Cb -0.03 -3.19 0.05 0.00 0.00 0.00 0.00 23.12 19.95 1nyp s ALA 53 CO -0.00 -0.22 0.47 0.71 0.00 0.00 0.00 175.76 176.72 1nyp s TYR 54 N -2.23 -0.58 1.26 0.00 2.02 0.53 0.31 117.35 118.65 1nyp s TYR 54 Ca 0.63 1.34 -0.18 0.00 -0.37 0.00 0.00 57.07 58.50 1nyp s TYR 54 Cb -0.13 0.23 0.28 0.00 -0.40 0.00 0.00 41.96 41.95 1nyp s TYR 54 CO 0.22 -0.30 0.71 0.00 -1.57 0.00 0.00 175.55 174.61 1nyp h GLU 56 N -2.92 0.58 0.10 0.00 4.81 -1.92 0.11 114.58 115.35 1nyp h GLU 56 Ca -0.51 -0.04 -0.28 0.00 -0.13 0.00 0.00 59.36 58.41 1nyp h GLU 56 Cb 1.28 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1nyp h GLU 56 CO 0.36 0.39 -1.44 1.15 -0.73 0.00 0.00 179.01 178.73 1nyp h THR 57 N 0.60 0.98 -0.37 0.32 2.02 -1.98 -3.13 112.91 111.35 1nyp h THR 57 Ca 0.19 -2.36 -0.09 0.00 0.77 0.00 0.00 66.41 64.92 1nyp h THR 57 Cb 0.01 2.64 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 1nyp h THR 57 CO -0.04 0.68 -0.10 0.45 0.37 0.00 0.00 175.52 176.87 1nyp h HIS 58 N -0.35 0.81 -0.07 3.16 3.86 -1.86 2.87 115.15 123.57 1nyp h HIS 58 Ca -0.32 -0.18 0.04 0.00 -1.16 0.00 0.00 60.37 58.75 1nyp h HIS 58 Cb 1.73 -0.20 -0.06 0.00 1.06 0.00 0.00 27.41 29.94 1nyp h HIS 58 CO 0.12 0.87 -0.34 -0.92 0.86 0.00 0.00 177.93 178.52 1nyp h TYR 59 N 0.52 -0.95 -0.31 2.45 3.20 -1.14 1.89 116.97 122.64 1nyp h TYR 59 Ca 0.09 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 1nyp h TYR 59 Cb 0.62 0.43 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 1nyp h TYR 59 CO 0.05 -0.42 0.03 -0.91 -1.64 0.00 0.00 178.16 175.27 1nyp h ASN 60 N -0.45 0.50 -0.98 -2.11 2.35 -1.43 0.98 115.58 114.44 1nyp h ASN 60 Ca 0.08 -0.28 0.16 0.00 -0.55 0.00 0.00 56.30 55.71 1nyp h ASN 60 Cb 0.57 -0.13 -0.09 0.00 0.05 0.00 0.00 38.32 38.72 1nyp h ASN 60 CO -0.32 0.65 0.61 -0.61 -1.65 0.00 0.00 177.43 176.12 1nyp h GLN 61 N 0.33 0.77 -0.26 0.81 4.15 0.63 0.39 115.11 121.93 1nyp h GLN 61 Ca 0.09 -0.05 -0.19 0.00 0.77 0.00 0.00 58.65 59.28 1nyp h GLN 61 Cb 0.38 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.90 1nyp h GLN 61 CO 0.01 0.51 -0.57 -0.07 -1.93 0.00 0.00 178.83 176.78 1nyp h LEU 62 N 0.79 0.95 0.00 -2.39 4.07 0.38 -3.47 115.31 115.65 1nyp h LEU 62 Ca 0.52 -0.55 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1nyp h LEU 62 Cb 0.76 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.23 1nyp h LEU 62 CO -0.29 1.33 0.00 0.49 -1.08 0.00 0.00 178.44 178.88 1nyp n PHE 63 N -4.02 0.00 -0.98 1.13 3.01 0.33 -5.05 117.46 111.87 1nyp n PHE 63 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.41 1nyp n PHE 63 Cb 0.64 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.11 1nyp n PHE 63 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1nyp n GLY 64 N -0.21 1.19 3.89 1.37 0.00 -1.16 -4.04 105.19 106.22 1nyp n GLY 64 Ca 0.00 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 1nyp n GLY 64 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nyp n ASP 65 N 0.91 -4.78 0.00 1.61 2.03 -1.26 -5.00 116.55 110.07 1nyp n ASP 65 Ca 0.00 -0.76 0.00 0.00 0.52 0.00 0.00 54.79 54.55 1nyp n ASP 65 Cb 0.24 -3.82 0.00 0.00 -0.72 0.00 0.00 41.12 36.82 1nyp n ASP 65 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83