#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyp s SER 2 N 0.00 -0.79 -0.75 1.61 0.01 -1.26 -5.05 113.70 107.47 1nyp s SER 2 Ca 0.00 -0.06 -0.26 0.00 1.31 0.00 0.00 55.95 56.93 1nyp s SER 2 Cb 0.00 1.33 -0.23 0.00 0.21 0.00 0.00 66.02 67.33 1nyp s SER 2 CO 0.00 -0.13 1.90 0.23 0.41 0.00 0.00 173.24 175.65 1nyp n MET 3 N 4.79 0.64 0.00 12.44 2.00 -1.26 -4.81 117.12 130.93 1nyp n MET 3 Ca 0.08 -1.71 0.00 0.00 0.00 0.00 0.00 57.70 56.07 1nyp n MET 3 Cb 0.58 -3.32 0.00 0.00 0.00 0.00 0.00 33.22 30.48 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 5.47 0.89 2.15 3.03 0.00 -1.26 -5.00 105.19 110.47 1nyp n GLY 4 Ca 0.45 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00-11.98 -1.90 1.61 0.31 -1.26 -4.96 118.33 100.15 1nyp n VAL 5 Ca 0.00 2.97 -0.30 0.00 -0.01 0.00 0.00 64.34 67.00 1nyp n VAL 5 Cb 0.00 -5.17 0.05 0.00 -0.91 0.00 0.00 33.84 27.81 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 -0.48 2.84 -0.06 5.55 0.05 -1.26 -4.85 135.00 136.79 1nyp s PRO 6 Ca 0.00 0.44 -0.01 0.00 0.05 0.00 0.00 61.00 61.48 1nyp s PRO 6 Cb 0.00 -2.03 0.03 0.00 0.05 0.00 0.00 34.50 32.55 1nyp s PRO 6 CO 0.00 -1.04 -0.00 0.42 0.05 0.00 0.00 177.00 176.43 1nyp s ILE 7 N -3.35 0.36 -0.05 0.56 1.01 -1.26 0.23 121.20 118.69 1nyp s ILE 7 Ca 0.58 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 61.02 1nyp s ILE 7 Cb -0.11 -0.49 -0.07 0.00 0.01 0.00 0.00 42.46 41.81 1nyp s ILE 7 CO 0.51 0.24 1.88 0.00 0.00 0.00 0.00 174.94 177.57 1nyp n GLY 9 N 4.62 -0.31 0.11 0.00 0.00 0.15 0.17 105.19 109.94 1nyp n GLY 9 Ca 0.20 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 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 2.59 0.42 0.00 4.61 0.00 -1.87 -3.39 119.26 121.62 1nyp h ALA 10 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 54.91 53.65 1nyp h ALA 10 Cb 0.00 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1nyp h ALA 10 CO 0.00 1.28 0.00 0.00 0.00 0.00 0.00 179.25 180.53 1nyp n ARG 12 N -0.10 -5.66 -4.92 0.00 3.00 0.44 -4.96 116.66 104.47 1nyp n ARG 12 Ca 0.00 0.62 -0.32 0.00 -0.01 0.00 0.00 57.85 58.14 1nyp n ARG 12 Cb 0.24 -5.48 -0.13 0.00 0.00 0.00 0.00 32.46 27.08 1nyp n ARG 12 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1nyp s ARG 13 N -6.52 2.37 -0.21 5.56 0.52 -1.20 -4.85 118.95 114.63 1nyp s ARG 13 Ca 0.58 -0.78 -0.33 0.00 -0.52 0.00 0.00 55.73 54.68 1nyp s ARG 13 Cb -0.29 -2.30 -0.10 0.00 0.52 0.00 0.00 34.95 32.79 1nyp s ARG 13 CO 0.82 0.60 2.08 -2.30 0.02 0.00 0.00 175.30 176.52 1nyp n PRO 14 N 2.20 1.78 -1.53 3.54 -0.02 -1.26 -0.58 135.00 139.14 1nyp n PRO 14 Ca -0.17 0.57 -0.32 0.00 -2.02 0.00 0.00 63.50 61.56 1nyp n PRO 14 Cb 0.52 -2.77 0.06 0.00 -0.02 0.00 0.00 33.50 31.30 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 6.34 3.55 -0.46 4.25 1.01 0.63 -4.85 121.20 131.67 1nyp s ILE 15 Ca 1.00 0.57 0.06 0.00 0.00 0.00 0.00 60.65 62.29 1nyp s ILE 15 Cb -0.64 -3.13 0.32 0.00 0.01 0.00 0.00 42.46 39.02 1nyp s ILE 15 CO 0.46 -0.59 1.11 -1.84 0.00 0.00 0.00 174.94 174.08 1nyp n GLU 16 N -3.03 1.02 0.00 2.79 -0.00 -1.26 -4.22 120.64 115.94 1nyp n GLU 16 Ca 0.09 -1.97 0.00 0.00 -0.00 0.00 0.00 57.16 55.28 1nyp n GLU 16 Cb 0.53 -1.02 0.00 0.00 -0.00 0.00 0.00 31.44 30.94 1nyp n GLU 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1nyp n GLY 17 N 0.33 -1.25 3.37 -1.84 0.00 -1.26 -5.10 105.19 99.45 1nyp n GLY 17 Ca 0.06 0.71 -0.35 0.00 0.00 0.00 0.00 46.02 46.44 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 1.23 3.48 0.20 1.61 0.52 -1.26 -5.10 118.95 119.62 1nyp s ARG 18 Ca 0.00 -0.58 0.02 0.00 -0.52 0.00 0.00 55.73 54.65 1nyp s ARG 18 Cb 0.00 -3.03 -0.04 0.00 0.52 0.00 0.00 34.95 32.41 1nyp s ARG 18 CO 0.00 -0.09 0.35 0.08 0.02 0.00 0.00 175.30 175.66 1nyp s VAL 19 N 1.24 5.26 -0.25 3.52 1.01 -1.26 -3.58 120.40 126.33 1nyp s VAL 19 Ca 0.03 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.42 1nyp s VAL 19 Cb -0.14 -3.77 0.05 0.00 0.00 0.00 0.00 36.38 32.52 1nyp s VAL 19 CO -0.00 -0.19 -0.11 -0.69 0.00 0.00 0.00 175.10 174.10 1nyp s VAL 20 N -1.86 2.25 -0.53 2.92 1.01 -0.72 -4.89 120.40 118.58 1nyp s VAL 20 Ca 0.36 -1.47 -0.24 0.00 0.00 0.00 0.00 61.98 60.63 1nyp s VAL 20 Cb -0.11 -2.25 0.04 0.00 0.00 0.00 0.00 36.38 34.06 1nyp s VAL 20 CO 0.29 0.07 0.90 0.20 0.00 0.00 0.00 175.10 176.56 1nyp s ASN 21 N 1.15 6.35 0.08 3.32 0.02 -1.26 -0.36 114.94 124.24 1nyp s ASN 21 Ca -0.06 -0.33 -0.08 0.00 -1.02 0.00 0.00 52.86 51.37 1nyp s ASN 21 Cb -0.19 -2.42 -0.01 0.00 0.02 0.00 0.00 41.25 38.66 1nyp s ASN 21 CO -0.06 -1.16 0.16 0.00 0.02 0.00 0.00 177.10 176.07 1nyp s ALA 22 N 3.77 -0.15 -1.30 0.60 0.00 -1.05 -4.80 121.76 118.83 1nyp s ALA 22 Ca 0.30 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1nyp s ALA 22 Cb -0.13 0.44 0.00 0.00 0.00 0.00 0.00 23.12 23.43 1nyp s ALA 22 CO 0.20 -0.48 0.00 -1.33 0.00 0.00 0.00 175.76 174.15 1nyp n MET 23 N 0.04 -1.63 -2.06 0.00 2.81 -1.26 0.92 117.12 115.95 1nyp n MET 23 Ca -0.15 0.89 -0.09 0.00 -1.81 0.00 0.00 57.70 56.53 1nyp n MET 23 Cb 0.62 -5.23 -0.01 0.00 -0.71 0.00 0.00 33.22 27.89 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 0.10 0.13 0.00 3.03 0.00 -1.26 -4.97 105.19 102.21 1nyp n GLY 24 Ca -0.12 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.02 0.83 -4.20 1.61 5.02 0.26 -5.16 118.16 114.50 1nyp n LYS 25 Ca -0.11 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.02 1nyp n LYS 25 Cb 0.55 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.43 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 1.56 0.65 -0.05 1.97 -0.21 -1.26 -2.53 119.66 119.79 1nyp s GLN 26 Ca 0.00 -0.59 -0.03 0.00 0.02 0.00 0.00 55.36 54.76 1nyp s GLN 26 Cb 0.00 -0.57 0.02 0.00 1.00 0.00 0.00 33.01 33.46 1nyp s GLN 26 CO 0.00 0.14 0.12 -1.58 -2.12 0.00 0.00 175.29 171.84 1nyp s TRP 27 N -0.82 -0.13 0.25 0.91 0.52 0.51 0.35 118.94 120.53 1nyp s TRP 27 Ca -0.02 0.35 -0.31 0.00 0.02 0.00 0.00 56.10 56.14 1nyp s TRP 27 Cb -0.07 -0.02 -0.14 0.00 -1.15 0.00 0.00 33.47 32.10 1nyp s TRP 27 CO 0.01 -0.10 1.33 0.72 0.02 0.00 0.00 176.95 178.93 1nyp n HIS 28 N 3.50 2.00 0.31 -1.98 8.25 -1.26 -1.75 115.22 124.29 1nyp n HIS 28 Ca -0.18 0.50 0.17 0.00 -0.26 0.00 0.00 57.72 57.95 1nyp n HIS 28 Cb 0.56 -2.42 0.88 0.00 1.12 0.00 0.00 29.99 30.14 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 2.86 0.06 0.00 1.59 2.07 -1.90 0.22 116.25 121.14 1nyp h VAL 29 Ca -0.44 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 1nyp h VAL 29 Cb 1.29 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1nyp h VAL 29 CO 0.72 0.00 -1.58 -1.84 0.02 0.00 0.00 177.57 174.89 1nyp n GLU 30 N -3.04 0.64 0.00 1.57 0.28 -1.26 -4.14 120.64 114.68 1nyp n GLU 30 Ca -0.01 0.04 0.11 0.00 -0.16 0.00 0.00 57.16 57.14 1nyp n GLU 30 Cb 0.34 -1.69 0.07 0.00 1.43 0.00 0.00 31.44 31.59 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 -2.62 0.00 -2.67 -1.84 8.25 0.58 -4.74 115.22 112.18 1nyp n HIS 31 Ca -0.08 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.96 1nyp n HIS 31 Cb 0.71 -0.07 -0.03 0.00 1.12 0.00 0.00 29.99 31.72 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 -2.74 2.57 0.44 4.41 5.36 -0.15 -4.86 117.98 123.01 1nyp s PHE 32 Ca 0.15 0.07 0.03 0.00 -0.96 0.00 0.00 56.93 56.22 1nyp s PHE 32 Cb 0.18 -4.42 -0.02 0.00 -0.34 0.00 0.00 43.02 38.42 1nyp s PHE 32 CO 0.68 -1.67 0.10 0.14 -1.46 0.00 0.00 175.22 173.01 1nyp s VAL 33 N 4.83 0.72 0.52 3.12 -7.23 -1.26 -3.10 120.40 118.00 1nyp s VAL 33 Ca 0.35 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 58.32 1nyp s VAL 33 Cb -0.10 -2.27 -0.06 0.00 0.56 0.00 0.00 36.38 34.51 1nyp s VAL 33 CO 0.19 0.00 1.15 0.00 -0.31 0.00 0.00 175.10 176.13 1nyp n ALA 35 N -1.04 3.67 0.00 0.00 0.00 0.85 -2.06 120.51 121.92 1nyp n ALA 35 Ca 0.10 -1.22 0.00 0.00 0.00 0.00 0.00 53.44 52.32 1nyp n ALA 35 Cb 0.50 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 -0.04 0.65 0.00 0.00 3.00 -1.26 -4.90 118.16 115.62 1nyp n LYS 36 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.54 1nyp n LYS 36 Cb 0.92 -0.60 0.00 0.00 0.00 0.00 0.00 35.03 35.35 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 -0.40 -7.34 -3.40 0.00 4.71 -0.88 -4.93 120.64 108.40 1nyp n GLU 38 Ca 0.00 0.80 -0.43 0.00 -0.01 0.00 0.00 57.16 57.52 1nyp n GLU 38 Cb 0.03 -5.82 -0.09 0.00 -1.01 0.00 0.00 31.44 24.55 1nyp n GLU 38 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 1nyp s LYS 39 N -6.12 3.00 0.35 3.49 2.20 -1.26 -4.74 119.74 116.67 1nyp s LYS 39 Ca 0.44 -1.05 -0.28 0.00 -0.36 0.00 0.00 55.97 54.72 1nyp s LYS 39 Cb -0.20 -4.03 -0.10 0.00 -1.51 0.00 0.00 37.83 31.99 1nyp s LYS 39 CO 0.74 -0.87 1.35 -1.25 -0.36 0.00 0.00 175.35 174.97 1nyp s PRO 40 N 1.81 4.24 -1.15 4.03 0.04 -1.26 -3.10 135.00 139.61 1nyp s PRO 40 Ca 0.07 2.30 -0.03 0.00 0.04 0.00 0.00 61.00 63.37 1nyp s PRO 40 Cb -0.20 -3.00 0.24 0.00 0.04 0.00 0.00 34.50 31.58 1nyp s PRO 40 CO 0.10 -0.32 2.00 1.19 0.04 0.00 0.00 177.00 180.01 1nyp n PHE 41 N 0.62 2.67 -0.38 0.56 3.72 -1.18 -4.83 117.46 118.64 1nyp n PHE 41 Ca 0.01 -2.66 -0.04 0.00 -0.05 0.00 0.00 57.45 54.70 1nyp n PHE 41 Cb 0.41 -1.46 -0.00 0.00 -0.94 0.00 0.00 39.48 37.49 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 4.94 -1.64 -2.81 4.37 4.07 -1.89 -2.78 115.31 119.58 1nyp h LEU 42 Ca 0.56 0.31 -0.05 0.00 0.08 0.00 0.00 57.88 58.78 1nyp h LEU 42 Cb 0.35 0.81 -0.12 0.00 1.08 0.00 0.00 40.66 42.78 1nyp h LEU 42 CO 1.32 -0.27 -0.57 0.61 -1.08 0.00 0.00 178.44 178.44 1nyp n GLY 43 N -1.41 2.97 3.55 0.83 0.00 -1.26 -4.95 105.19 104.92 1nyp n GLY 43 Ca 0.07 -0.89 -0.24 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.58 2.49 0.65 1.61 3.76 -1.05 -5.12 115.29 116.04 1nyp s HIS 44 Ca 0.28 -0.28 -0.12 0.00 -0.15 0.00 0.00 55.06 54.80 1nyp s HIS 44 Cb 0.29 -1.09 -0.02 0.00 1.11 0.00 0.00 32.58 32.87 1nyp s HIS 44 CO -0.07 0.67 1.04 -0.98 -0.85 0.00 0.00 174.74 174.55 1nyp s ARG 45 N -3.56 3.27 0.45 1.40 1.70 -1.26 -4.75 118.95 116.20 1nyp s ARG 45 Ca 0.30 0.90 0.06 0.00 -0.47 0.00 0.00 55.73 56.52 1nyp s ARG 45 Cb -0.06 -2.04 -0.04 0.00 -0.57 0.00 0.00 34.95 32.24 1nyp s ARG 45 CO 0.17 -0.83 0.10 -3.38 -1.08 0.00 0.00 175.30 170.29 1nyp s HIS 46 N -3.02 2.32 -0.04 5.89 -3.43 -1.26 -4.76 115.29 110.99 1nyp s HIS 46 Ca 0.57 -0.72 0.01 0.00 -0.80 0.00 0.00 55.06 54.12 1nyp s HIS 46 Cb -0.13 -1.82 0.02 0.00 -1.43 0.00 0.00 32.58 29.23 1nyp s HIS 46 CO 0.52 0.22 -0.02 0.71 -2.00 0.00 0.00 174.74 174.17 1nyp s TYR 47 N -2.72 0.54 0.08 0.38 1.51 -0.82 -4.94 117.35 111.39 1nyp s TYR 47 Ca 0.30 -0.11 0.02 0.00 -1.01 0.00 0.00 57.07 56.28 1nyp s TYR 47 Cb 0.05 -0.56 -0.04 0.00 -0.11 0.00 0.00 41.96 41.30 1nyp s TYR 47 CO 0.16 -0.18 0.14 -1.21 -1.11 0.00 0.00 175.55 173.36 1nyp s GLU 48 N 1.07 3.09 -0.06 -0.62 2.02 -1.26 0.25 118.70 123.19 1nyp s GLU 48 Ca -0.09 -0.62 -0.04 0.00 0.02 0.00 0.00 54.97 54.24 1nyp s GLU 48 Cb -0.14 -2.83 0.03 0.00 0.10 0.00 0.00 34.13 31.29 1nyp s GLU 48 CO -0.01 0.57 0.15 0.50 0.02 0.00 0.00 175.26 176.49 1nyp s ARG 49 N -2.54 0.13 0.00 1.61 3.52 0.50 -4.84 118.95 117.33 1nyp s ARG 49 Ca 0.32 0.31 0.00 0.00 -0.13 0.00 0.00 55.73 56.22 1nyp s ARG 49 Cb -0.12 -0.07 0.00 0.00 -1.56 0.00 0.00 34.95 33.20 1nyp s ARG 49 CO 0.24 -0.10 0.00 0.36 -0.81 0.00 0.00 175.30 174.99 1nyp n LYS 50 N 3.71 -1.88 -0.78 5.12 2.85 -1.26 0.29 118.16 126.22 1nyp n LYS 50 Ca -0.21 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.05 1nyp n LYS 50 Cb 0.55 -3.73 0.00 0.00 -0.65 0.00 0.00 35.03 31.20 1nyp n LYS 50 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1nyp n GLY 51 N -0.24 1.34 2.95 2.58 0.00 -1.26 -5.08 105.19 105.49 1nyp n GLY 51 Ca 0.00 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.04 1.71 0.50 0.99 1.43 0.86 -4.89 118.68 119.24 1nyp s LEU 52 Ca 0.00 0.14 -0.20 0.00 -1.03 0.00 0.00 54.13 53.05 1nyp s LEU 52 Cb 0.00 0.27 -0.08 0.00 0.03 0.00 0.00 46.19 46.41 1nyp s LEU 52 CO 0.00 -0.04 1.04 0.00 0.23 0.00 0.00 176.35 177.59 1nyp s ALA 53 N 0.00 2.85 -0.19 4.21 0.00 -1.26 0.19 121.76 127.56 1nyp s ALA 53 Ca -0.00 0.57 -0.16 0.00 0.00 0.00 0.00 51.96 52.37 1nyp s ALA 53 Cb -0.01 -3.25 0.05 0.00 0.00 0.00 0.00 23.12 19.92 1nyp s ALA 53 CO 0.00 -0.39 0.50 0.71 0.00 0.00 0.00 175.76 176.58 1nyp s TYR 54 N -2.05 -0.61 1.29 0.00 2.02 0.69 0.29 117.35 118.98 1nyp s TYR 54 Ca 0.67 1.41 -0.20 0.00 -0.37 0.00 0.00 57.07 58.58 1nyp s TYR 54 Cb -0.16 0.24 0.30 0.00 -0.40 0.00 0.00 41.96 41.94 1nyp s TYR 54 CO 0.23 -0.30 0.68 0.00 -1.57 0.00 0.00 175.55 174.58 1nyp h GLU 56 N -3.22 1.18 0.16 0.00 4.81 -1.92 -0.86 114.58 114.73 1nyp h GLU 56 Ca -0.37 -0.14 -0.34 0.00 -0.13 0.00 0.00 59.36 58.38 1nyp h GLU 56 Cb 1.13 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1nyp h GLU 56 CO 0.23 0.87 -1.71 1.15 -0.73 0.00 0.00 179.01 178.83 1nyp h THR 57 N 1.18 0.91 -0.28 0.32 2.02 -1.98 -3.11 112.91 111.97 1nyp h THR 57 Ca 0.29 -2.46 -0.06 0.00 0.77 0.00 0.00 66.41 64.95 1nyp h THR 57 Cb 0.05 2.72 -0.01 0.00 -1.74 0.00 0.00 68.15 69.17 1nyp h THR 57 CO -0.05 0.83 -0.07 0.45 0.37 0.00 0.00 175.52 177.05 1nyp h HIS 58 N 0.00 0.61 -0.06 3.16 3.86 -1.87 2.78 115.15 123.63 1nyp h HIS 58 Ca -0.35 -0.13 0.04 0.00 -1.16 0.00 0.00 60.37 58.77 1nyp h HIS 58 Cb 2.01 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 30.28 1nyp h HIS 58 CO 0.10 0.74 -0.35 -0.92 0.86 0.00 0.00 177.93 178.37 1nyp h TYR 59 N 0.30 -0.98 -0.29 2.45 3.20 -1.31 1.62 116.97 121.95 1nyp h TYR 59 Ca 0.07 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 1nyp h TYR 59 Cb 0.55 0.44 -0.01 0.00 1.54 0.00 0.00 36.73 39.25 1nyp h TYR 59 CO 0.05 -0.43 0.09 -0.91 -1.64 0.00 0.00 178.16 175.32 1nyp h ASN 60 N -0.47 0.43 -0.84 -2.11 2.35 -1.43 1.68 115.58 115.19 1nyp h ASN 60 Ca 0.07 -0.20 0.17 0.00 -0.55 0.00 0.00 56.30 55.79 1nyp h ASN 60 Cb 0.59 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.78 1nyp h ASN 60 CO -0.32 0.52 0.56 -0.61 -1.65 0.00 0.00 177.43 175.93 1nyp h GLN 61 N 0.32 0.44 0.10 0.81 4.15 0.61 0.24 115.11 121.77 1nyp h GLN 61 Ca 0.09 -0.03 -0.28 0.00 0.77 0.00 0.00 58.65 59.21 1nyp h GLN 61 Cb 0.24 -0.10 0.03 0.00 0.21 0.00 0.00 27.48 27.86 1nyp h GLN 61 CO -0.00 0.29 -1.15 -0.07 -1.93 0.00 0.00 178.83 175.97 1nyp h LEU 62 N 0.45 0.85 0.00 -2.39 4.07 0.39 -3.48 115.31 115.20 1nyp h LEU 62 Ca 0.43 -0.81 0.00 0.00 0.08 0.00 0.00 57.88 57.57 1nyp h LEU 62 Cb 0.97 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.45 1nyp h LEU 62 CO -0.16 1.57 0.00 0.49 -1.08 0.00 0.00 178.44 179.26 1nyp n PHE 63 N -3.85 0.00 0.00 1.13 3.01 0.56 -4.98 117.46 113.33 1nyp n PHE 63 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.33 1nyp n PHE 63 Cb 0.94 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.41 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 -0.16 1.24 0.00 1.37 0.00 -1.18 -4.07 105.19 102.40 1nyp n GLY 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nyp n GLY 64 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1nyp n ASP 65 N 0.00 0.00 0.00 1.61 5.68 -1.26 -5.00 116.55 117.58 1nyp n ASP 65 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1nyp n ASP 65 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1nyp n ASP 65 CO 0.00 0.00 0.00 0.55 -1.33 0.00 0.00 177.20 176.42