#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ny4 s ALA 2 N 0.00 2.87 -0.37 3.04 0.00 -1.26 -5.11 121.76 120.93 1ny4 s ALA 2 Ca 0.00 -1.89 -0.11 0.00 0.00 0.00 0.00 51.96 49.95 1ny4 s ALA 2 Cb 0.00 -0.30 0.02 0.00 0.00 0.00 0.00 23.12 22.84 1ny4 s ALA 2 CO 0.00 0.23 0.21 -1.21 0.00 0.00 0.00 175.76 174.99 1ny4 s GLU 3 N -3.56 2.94 0.00 0.00 2.02 -1.26 -4.81 118.70 114.03 1ny4 s GLU 3 Ca 0.31 -1.01 0.01 0.00 0.02 0.00 0.00 54.97 54.30 1ny4 s GLU 3 Cb -0.04 -3.74 0.01 0.00 0.10 0.00 0.00 34.13 30.47 1ny4 s GLU 3 CO 0.16 -0.66 0.71 -0.25 0.02 0.00 0.00 175.26 175.25 1ny4 n ASP 4 N 5.02 -0.03 -4.13 -0.19 9.92 -1.26 -5.05 116.55 120.83 1ny4 n ASP 4 Ca -0.12 -1.41 -0.37 0.00 -0.53 0.00 0.00 54.79 52.36 1ny4 n ASP 4 Cb 0.47 -0.05 -0.11 0.00 -0.64 0.00 0.00 41.12 40.78 1ny4 n ASP 4 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1ny4 s GLU 5 N 0.00 2.06 0.00 -1.24 0.41 -1.26 -5.01 118.70 113.66 1ny4 s GLU 5 Ca 0.01 -1.84 0.00 0.00 -0.41 0.00 0.00 54.97 52.73 1ny4 s GLU 5 Cb 0.01 -3.62 0.00 0.00 -1.78 0.00 0.00 34.13 28.74 1ny4 s GLU 5 CO -0.01 -1.09 0.00 0.41 -0.49 0.00 0.00 175.26 174.09 1ny4 n GLY 6 N 4.58 5.41 2.98 -1.39 0.00 -1.26 -5.09 105.19 110.42 1ny4 n GLY 6 Ca -0.02 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 1ny4 n GLY 6 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ny4 s TYR 7 N 2.69 3.68 0.72 1.61 1.51 -1.03 -4.80 117.35 121.74 1ny4 s TYR 7 Ca 0.00 -3.21 -0.11 0.00 -1.01 0.00 0.00 57.07 52.74 1ny4 s TYR 7 Cb 0.00 -2.93 0.02 0.00 -0.11 0.00 0.00 41.96 38.95 1ny4 s TYR 7 CO 0.00 -0.63 1.07 -1.25 -1.11 0.00 0.00 175.55 173.63 1ny4 s PRO 8 N -1.35 2.73 0.06 -1.71 0.04 -1.26 -2.02 135.00 131.50 1ny4 s PRO 8 Ca 0.25 0.87 0.05 0.00 0.04 0.00 0.00 61.00 62.22 1ny4 s PRO 8 Cb -0.07 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 1ny4 s PRO 8 CO -0.14 -1.22 -0.15 0.00 0.04 0.00 0.00 177.00 175.53 1ny4 s ALA 9 N -3.07 1.26 -0.11 8.56 0.00 0.61 -1.84 121.76 127.16 1ny4 s ALA 9 Ca 0.59 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.59 1ny4 s ALA 9 Cb -0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1ny4 s ALA 9 CO 0.55 0.21 -0.12 -2.00 0.00 0.00 0.00 175.76 174.40 1ny4 s GLU 10 N -1.52 3.15 0.06 0.00 2.12 0.15 -1.44 118.70 121.21 1ny4 s GLU 10 Ca 0.00 -0.67 -0.31 0.00 0.36 0.00 0.00 54.97 54.36 1ny4 s GLU 10 Cb -0.09 -2.59 -0.08 0.00 0.26 0.00 0.00 34.13 31.63 1ny4 s GLU 10 CO 0.02 0.34 1.62 0.08 -0.54 0.00 0.00 175.26 176.79 1ny4 s VAL 11 N 0.02 3.12 -0.11 3.70 1.01 -0.28 0.09 120.40 127.94 1ny4 s VAL 11 Ca -0.04 0.56 0.07 0.00 0.00 0.00 0.00 61.98 62.57 1ny4 s VAL 11 Cb -0.14 -3.36 -0.11 0.00 0.00 0.00 0.00 36.38 32.77 1ny4 s VAL 11 CO 0.04 -0.00 -0.00 2.30 0.00 0.00 0.00 175.10 177.43 1ny4 n ILE 12 N 4.72 0.69 -3.60 2.22 -0.00 -0.43 -2.60 119.36 120.37 1ny4 n ILE 12 Ca 0.16 -0.38 -0.13 0.00 -0.00 0.00 0.00 62.75 62.39 1ny4 n ILE 12 Cb 0.41 -0.79 -0.07 0.00 -0.00 0.00 0.00 39.64 39.19 1ny4 n ILE 12 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 1ny4 s GLU 13 N -2.24 0.78 -0.03 6.28 2.12 -1.22 -4.99 118.70 119.40 1ny4 s GLU 13 Ca -0.08 0.67 -0.15 0.00 0.36 0.00 0.00 54.97 55.78 1ny4 s GLU 13 Cb 0.03 0.38 -0.05 0.00 0.26 0.00 0.00 34.13 34.75 1ny4 s GLU 13 CO 0.38 -0.14 0.39 0.42 -0.54 0.00 0.00 175.26 175.77 1ny4 s ILE 14 N -0.11 5.09 -0.05 -3.70 1.01 -1.26 0.02 121.20 122.20 1ny4 s ILE 14 Ca -0.02 0.80 -0.00 0.00 0.00 0.00 0.00 60.65 61.43 1ny4 s ILE 14 Cb -0.04 -3.70 -0.00 0.00 0.01 0.00 0.00 42.46 38.73 1ny4 s ILE 14 CO 0.01 0.54 -0.01 0.40 0.00 0.00 0.00 174.94 175.89 1ny4 h ILE 15 N 3.89 0.00 0.00 2.92 2.04 -1.86 -3.47 117.51 121.04 1ny4 h ILE 15 Ca -0.50 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 64.87 1ny4 h ILE 15 Cb 1.21 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1ny4 h ILE 15 CO 0.64 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.40 1ny4 n GLY 16 N 1.88 3.04 3.78 5.37 0.00 -1.19 -5.06 105.19 113.01 1ny4 n GLY 16 Ca -0.00 0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1ny4 n GLY 16 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ny4 s ARG 17 N -0.10 3.18 0.00 1.61 1.04 -1.26 -4.09 118.95 119.33 1ny4 s ARG 17 Ca 0.00 1.38 0.00 0.00 -1.04 0.00 0.00 55.73 56.07 1ny4 s ARG 17 Cb 0.00 -2.00 0.00 0.00 -2.04 0.00 0.00 34.95 30.91 1ny4 s ARG 17 CO 0.00 -0.94 0.00 -2.37 -0.04 0.00 0.00 175.30 171.95 1ny4 n THR 18 N -1.89 0.00 -1.15 4.99 5.66 -1.15 -4.96 114.28 115.78 1ny4 n THR 18 Ca 0.10 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.23 1ny4 n THR 18 Cb 0.52 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.25 1ny4 n THR 18 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ny4 n GLY 19 N 0.53 -1.81 0.25 1.09 0.00 -1.26 -2.85 105.19 101.14 1ny4 n GLY 19 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1ny4 n GLY 19 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ny4 h THR 20 N -1.28 0.85 0.00 2.61 1.35 -1.98 -3.35 112.91 111.11 1ny4 h THR 20 Ca -0.07 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1ny4 h THR 20 Cb 1.23 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1ny4 h THR 20 CO 0.03 0.10 -0.96 0.41 -0.25 0.00 0.00 175.52 174.86 1ny4 n THR 21 N -4.88 0.00 0.00 6.82 -1.04 -1.26 -5.02 114.28 108.89 1ny4 n THR 21 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1ny4 n THR 21 Cb 0.25 -0.60 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 1ny4 n THR 21 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ny4 n GLY 22 N 3.29 0.00 0.04 3.41 0.00 -1.13 -5.04 105.19 105.76 1ny4 n GLY 22 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1ny4 n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ny4 n ASP 23 N 0.00 3.10 -4.80 1.61 9.92 -1.26 -4.97 116.55 120.15 1ny4 n ASP 23 Ca 0.00 0.00 -0.34 0.00 -0.53 0.00 0.00 54.79 53.92 1ny4 n ASP 23 Cb 0.00 0.74 -0.05 0.00 -0.64 0.00 0.00 41.12 41.17 1ny4 n ASP 23 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1ny4 s VAL 24 N -2.22 4.08 -0.32 2.53 1.01 -1.26 -2.52 120.40 121.70 1ny4 s VAL 24 Ca -0.04 1.39 0.01 0.00 0.00 0.00 0.00 61.98 63.34 1ny4 s VAL 24 Cb 0.03 -3.62 0.14 0.00 0.00 0.00 0.00 36.38 32.92 1ny4 s VAL 24 CO 0.32 -0.18 0.32 -0.89 0.00 0.00 0.00 175.10 174.67 1ny4 s THR 25 N -1.96 -0.37 0.23 3.92 2.01 0.15 -2.94 115.64 116.67 1ny4 s THR 25 Ca 0.61 -0.67 -0.29 0.00 0.31 0.00 0.00 61.69 61.65 1ny4 s THR 25 Cb -0.15 -0.90 -0.09 0.00 0.01 0.00 0.00 72.50 71.38 1ny4 s THR 25 CO 0.19 -0.51 0.91 -1.10 -0.69 0.00 0.00 174.62 173.42 1ny4 s GLN 26 N 2.05 4.81 0.08 4.92 -0.21 -1.26 -1.26 119.66 128.80 1ny4 s GLN 26 Ca 0.12 1.44 -0.13 0.00 0.02 0.00 0.00 55.36 56.80 1ny4 s GLN 26 Cb -0.15 -3.28 0.02 0.00 1.00 0.00 0.00 33.01 30.61 1ny4 s GLN 26 CO -0.23 0.53 0.30 0.14 -2.12 0.00 0.00 175.29 173.91 1ny4 s VAL 27 N -1.17 0.09 -0.17 1.09 -7.23 0.04 -2.93 120.40 110.12 1ny4 s VAL 27 Ca 0.40 -0.77 -0.12 0.00 -1.81 0.00 0.00 61.98 59.69 1ny4 s VAL 27 Cb -0.26 -1.10 -0.05 0.00 0.56 0.00 0.00 36.38 35.54 1ny4 s VAL 27 CO 0.31 -0.42 0.22 -0.54 -0.31 0.00 0.00 175.10 174.35 1ny4 s LYS 28 N -3.19 4.16 -0.04 4.82 1.02 0.10 -0.47 119.74 126.14 1ny4 s LYS 28 Ca -0.00 -0.05 0.03 0.00 0.02 0.00 0.00 55.97 55.97 1ny4 s LYS 28 Cb 0.01 -3.40 0.01 0.00 -0.52 0.00 0.00 37.83 33.93 1ny4 s LYS 28 CO -0.07 0.32 -0.11 0.14 -0.92 0.00 0.00 175.35 174.70 1ny4 s VAL 29 N 0.27 0.98 -0.01 3.17 -7.23 -0.03 -1.31 120.40 116.24 1ny4 s VAL 29 Ca 0.13 -0.45 -0.03 0.00 -1.81 0.00 0.00 61.98 59.82 1ny4 s VAL 29 Cb -0.12 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.90 1ny4 s VAL 29 CO 0.02 0.30 0.19 -0.60 -0.31 0.00 0.00 175.10 174.69 1ny4 s ARG 30 N 0.30 3.45 -0.06 4.82 3.52 0.11 -1.14 118.95 129.94 1ny4 s ARG 30 Ca -0.06 -0.30 -0.30 0.00 -0.13 0.00 0.00 55.73 54.94 1ny4 s ARG 30 Cb -0.11 -3.10 -0.05 0.00 -1.56 0.00 0.00 34.95 30.13 1ny4 s ARG 30 CO 0.01 0.68 1.59 0.42 -0.81 0.00 0.00 175.30 177.20 1ny4 s ILE 31 N -1.31 3.66 0.14 4.11 1.01 0.07 0.29 121.20 129.16 1ny4 s ILE 31 Ca 0.27 0.82 -0.05 0.00 0.00 0.00 0.00 60.65 61.68 1ny4 s ILE 31 Cb -0.13 -3.53 -0.15 0.00 0.01 0.00 0.00 42.46 38.66 1ny4 s ILE 31 CO 0.18 -0.07 1.34 -0.07 0.00 0.00 0.00 174.94 176.32 1ny4 h LEU 32 N 10.04 0.61 -7.93 2.97 3.38 -1.72 0.18 115.31 122.84 1ny4 h LEU 32 Ca -0.38 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.19 1ny4 h LEU 32 Cb 1.17 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.67 1ny4 h LEU 32 CO 0.95 1.22 0.17 -0.70 0.09 0.00 0.00 178.44 180.17 1ny4 s GLU 33 N -3.48 1.69 0.00 1.13 2.12 -1.26 -4.69 118.70 114.21 1ny4 s GLU 33 Ca -0.07 -0.97 0.00 0.00 0.36 0.00 0.00 54.97 54.29 1ny4 s GLU 33 Cb 0.09 0.58 0.00 0.00 0.26 0.00 0.00 34.13 35.07 1ny4 s GLU 33 CO 0.87 -0.76 0.00 0.41 -0.54 0.00 0.00 175.26 175.24 1ny4 n GLY 34 N -0.44 0.41 5.15 -1.50 0.00 -1.26 -4.46 105.19 103.09 1ny4 n GLY 34 Ca -0.05 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1ny4 n GLY 34 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ny4 n ARG 35 N 0.00 0.00 -0.03 1.61 0.63 -1.26 -3.78 116.66 113.83 1ny4 n ARG 35 Ca 0.00 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.84 1ny4 n ARG 35 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.88 1ny4 n ARG 35 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1ny4 h ASP 36 N 0.00 -0.09 -4.65 6.15 5.19 -1.98 -3.47 116.42 117.58 1ny4 h ASP 36 Ca 0.00 0.04 -0.04 0.00 -0.62 0.00 0.00 57.03 56.41 1ny4 h ASP 36 Cb 0.00 0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1ny4 h ASP 36 CO 0.00 -0.02 -0.69 2.29 -3.12 0.00 0.00 179.24 177.70 1ny4 n LYS 37 N -5.14 -0.34 0.00 3.56 2.85 -1.25 -4.65 118.16 113.19 1ny4 n LYS 37 Ca -0.03 0.57 0.00 0.00 -1.05 0.00 0.00 58.31 57.80 1ny4 n LYS 37 Cb 0.10 -0.75 0.00 0.00 -0.65 0.00 0.00 35.03 33.73 1ny4 n LYS 37 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ny4 n GLY 38 N 0.84 0.58 3.12 2.58 0.00 0.61 -4.91 105.19 108.02 1ny4 n GLY 38 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1ny4 n GLY 38 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ny4 s ARG 39 N 0.00 2.44 -0.07 1.61 3.52 -1.26 -4.84 118.95 120.36 1ny4 s ARG 39 Ca 0.00 -1.23 -0.27 0.00 -0.13 0.00 0.00 55.73 54.10 1ny4 s ARG 39 Cb 0.00 -2.95 -0.03 0.00 -1.56 0.00 0.00 34.95 30.41 1ny4 s ARG 39 CO 0.00 -0.53 0.86 0.54 -0.81 0.00 0.00 175.30 175.36 1ny4 s VAL 40 N 1.19 4.92 0.27 7.11 0.11 -1.26 -0.75 120.40 131.98 1ny4 s VAL 40 Ca -0.05 1.76 0.02 0.00 -2.93 0.00 0.00 61.98 60.77 1ny4 s VAL 40 Cb -0.19 -4.19 -0.05 0.00 -1.53 0.00 0.00 36.38 30.43 1ny4 s VAL 40 CO -0.05 0.15 0.11 0.27 -3.33 0.00 0.00 175.10 172.25 1ny4 s ILE 41 N 1.29 0.51 -0.45 7.04 -4.36 -0.30 -4.96 121.20 119.97 1ny4 s ILE 41 Ca 0.44 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.78 1ny4 s ILE 41 Cb -0.19 -2.61 0.12 0.00 1.25 0.00 0.00 42.46 41.03 1ny4 s ILE 41 CO 0.20 0.00 0.27 0.00 0.24 0.00 0.00 174.94 175.65 1ny4 s ARG 42 N -4.00 2.20 -0.10 0.37 3.03 -1.26 -0.85 118.95 118.34 1ny4 s ARG 42 Ca 0.37 -1.85 -0.08 0.00 2.03 0.00 0.00 55.73 56.20 1ny4 s ARG 42 Cb 0.07 -3.71 -0.04 0.00 -1.03 0.00 0.00 34.95 30.24 1ny4 s ARG 42 CO 0.14 -1.12 0.17 0.50 -1.13 0.00 0.00 175.30 173.86 1ny4 s ARG 43 N 1.14 3.50 -0.30 3.89 6.06 0.38 -4.93 118.95 128.69 1ny4 s ARG 43 Ca 0.08 -0.06 -0.11 0.00 -2.50 0.00 0.00 55.73 53.14 1ny4 s ARG 43 Cb -0.24 -3.19 -0.03 0.00 0.06 0.00 0.00 34.95 31.55 1ny4 s ARG 43 CO -0.03 0.77 0.19 0.54 -2.50 0.00 0.00 175.30 174.27 1ny4 s ASN 44 N -1.04 5.89 0.09 -2.12 4.22 -1.26 -0.78 114.94 119.94 1ny4 s ASN 44 Ca 0.16 -0.20 0.07 0.00 -2.14 0.00 0.00 52.86 50.75 1ny4 s ASN 44 Cb -0.13 -2.09 -0.03 0.00 1.28 0.00 0.00 41.25 40.28 1ny4 s ASN 44 CO 0.05 -0.12 -0.18 -0.69 -2.04 0.00 0.00 177.10 174.12 1ny4 s VAL 45 N 1.72 1.45 -0.12 3.54 1.01 -0.39 -4.96 120.40 122.66 1ny4 s VAL 45 Ca 0.06 -1.43 -0.19 0.00 0.00 0.00 0.00 61.98 60.43 1ny4 s VAL 45 Cb -0.16 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 1ny4 s VAL 45 CO 0.10 -0.12 0.49 -0.13 0.00 0.00 0.00 175.10 175.44 1ny4 s ARG 46 N -1.82 4.34 0.00 2.72 0.52 -1.26 0.30 118.95 123.75 1ny4 s ARG 46 Ca 0.03 0.48 0.00 0.00 -0.52 0.00 0.00 55.73 55.72 1ny4 s ARG 46 Cb -0.10 -3.44 0.00 0.00 0.52 0.00 0.00 34.95 31.93 1ny4 s ARG 46 CO 0.03 0.14 0.00 0.41 0.02 0.00 0.00 175.30 175.90 1ny4 n GLY 47 N 3.27 0.92 3.78 -3.53 0.00 -1.05 -4.91 105.19 103.68 1ny4 n GLY 47 Ca -0.07 -2.13 -0.37 0.00 0.00 0.00 0.00 46.02 43.45 1ny4 n GLY 47 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ny4 s PRO 48 N -1.33 4.17 0.29 1.61 0.04 -1.26 -4.49 135.00 134.03 1ny4 s PRO 48 Ca 0.00 1.53 0.11 0.00 0.04 0.00 0.00 61.00 62.68 1ny4 s PRO 48 Cb 0.00 -2.56 -0.05 0.00 0.04 0.00 0.00 34.50 31.93 1ny4 s PRO 48 CO 0.00 -0.14 -0.16 0.08 0.04 0.00 0.00 177.00 176.81 1ny4 s VAL 49 N -1.64 2.35 -0.09 -0.36 1.01 -1.26 -5.14 120.40 115.26 1ny4 s VAL 49 Ca 0.58 -2.33 -0.04 0.00 0.00 0.00 0.00 61.98 60.18 1ny4 s VAL 49 Cb -0.23 -2.39 0.04 0.00 0.00 0.00 0.00 36.38 33.81 1ny4 s VAL 49 CO 0.28 -0.35 0.21 -0.13 0.00 0.00 0.00 175.10 175.11 1ny4 s ARG 50 N -3.55 0.16 -0.07 2.72 0.52 -1.26 -5.10 118.95 112.37 1ny4 s ARG 50 Ca 0.30 0.49 -0.41 0.00 -0.52 0.00 0.00 55.73 55.59 1ny4 s ARG 50 Cb -0.02 -0.14 -0.19 0.00 0.52 0.00 0.00 34.95 35.11 1ny4 s ARG 50 CO 0.15 -0.17 1.20 0.28 0.02 0.00 0.00 175.30 176.78 1ny4 n VAL 51 N 4.29 0.01 0.00 3.52 0.31 -1.26 -0.99 118.33 124.21 1ny4 n VAL 51 Ca -0.25 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1ny4 n VAL 51 Cb 0.52 -0.22 0.00 0.00 -0.91 0.00 0.00 33.84 33.24 1ny4 n VAL 51 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ny4 n GLY 52 N 2.09 2.09 3.67 2.92 0.00 -1.07 -4.99 105.19 109.89 1ny4 n GLY 52 Ca 0.22 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.77 1ny4 n GLY 52 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ny4 n ASP 53 N 0.00 3.07 -4.35 1.61 -0.08 -0.16 -4.65 116.55 111.99 1ny4 n ASP 53 Ca 0.00 1.07 -0.33 0.00 -1.51 0.00 0.00 54.79 54.02 1ny4 n ASP 53 Cb 0.00 -1.40 -0.15 0.00 2.34 0.00 0.00 41.12 41.91 1ny4 n ASP 53 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1ny4 s ILE 54 N 1.45 2.89 -0.06 5.18 -1.09 -1.26 -1.13 121.20 127.18 1ny4 s ILE 54 Ca 0.82 -0.73 -0.00 0.00 -2.23 0.00 0.00 60.65 58.51 1ny4 s ILE 54 Cb -0.70 -2.19 0.02 0.00 -1.58 0.00 0.00 42.46 38.01 1ny4 s ILE 54 CO 0.41 0.53 -0.03 -0.22 -1.23 0.00 0.00 174.94 174.40 1ny4 s LEU 55 N 0.30 1.01 0.20 2.97 0.20 -0.52 -4.94 118.68 117.90 1ny4 s LEU 55 Ca -0.11 -0.13 -0.30 0.00 0.69 0.00 0.00 54.13 54.28 1ny4 s LEU 55 Cb -0.16 -0.49 -0.08 0.00 -0.43 0.00 0.00 46.19 45.03 1ny4 s LEU 55 CO 0.06 -0.12 1.15 -0.63 -0.29 0.00 0.00 176.35 176.52 1ny4 s ILE 56 N 1.43 3.64 0.19 6.68 -1.09 -1.26 -0.28 121.20 130.50 1ny4 s ILE 56 Ca -0.03 1.44 0.09 0.00 -2.23 0.00 0.00 60.65 59.93 1ny4 s ILE 56 Cb -0.13 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.78 1ny4 s ILE 56 CO -0.03 0.26 -0.11 -0.22 -1.23 0.00 0.00 174.94 173.61 1ny4 s LEU 57 N -0.55 2.90 0.35 2.97 0.20 -0.86 -4.86 118.68 118.83 1ny4 s LEU 57 Ca 0.50 -0.64 0.19 0.00 0.69 0.00 0.00 54.13 54.87 1ny4 s LEU 57 Cb -0.31 -1.57 0.28 0.00 -0.43 0.00 0.00 46.19 44.15 1ny4 s LEU 57 CO 0.37 0.10 1.55 0.03 -0.29 0.00 0.00 176.35 178.11 1ny4 h ARG 58 N 2.88 0.00 0.00 1.98 3.08 -1.96 -2.73 114.38 117.62 1ny4 h ARG 58 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1ny4 h ARG 58 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1ny4 h ARG 58 CO 0.54 0.32 0.00 0.39 -1.07 0.00 0.00 179.97 180.14 1ny4 n GLU 59 N -3.21 0.00 -3.56 0.04 1.02 -1.26 -4.84 120.64 108.83 1ny4 n GLU 59 Ca 0.02 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.90 1ny4 n GLU 59 Cb 0.63 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 32.06 1ny4 n GLU 59 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1ny4 n THR 60 N 0.00 -1.36 -0.36 2.62 5.66 -1.26 -4.82 114.28 114.76 1ny4 n THR 60 Ca 0.00 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.98 1ny4 n THR 60 Cb 0.00 -2.24 0.02 0.00 -1.55 0.00 0.00 70.33 66.56 1ny4 n THR 60 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1ny4 n GLU 61 N -4.08 -0.24 0.00 1.09 -0.00 -1.26 -4.75 120.64 111.40 1ny4 n GLU 61 Ca 0.00 1.41 0.00 0.00 -0.00 0.00 0.00 57.16 58.57 1ny4 n GLU 61 Cb 0.54 -2.09 0.00 0.00 -0.00 0.00 0.00 31.44 29.89 1ny4 n GLU 61 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1ny4 n ARG 62 N -5.33 0.00 -1.44 3.44 0.63 -1.26 -4.90 116.66 107.80 1ny4 n ARG 62 Ca 0.08 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.72 1ny4 n ARG 62 Cb 0.35 0.00 0.20 0.00 0.45 0.00 0.00 32.46 33.46 1ny4 n ARG 62 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 1ny4 s GLU 63 N 0.00 -0.18 -0.27 -0.14 -1.05 -1.26 -4.87 118.70 110.93 1ny4 s GLU 63 Ca 0.00 -0.11 -0.42 0.00 -0.15 0.00 0.00 54.97 54.29 1ny4 s GLU 63 Cb 0.00 -1.72 -0.18 0.00 -0.44 0.00 0.00 34.13 31.79 1ny4 s GLU 63 CO 0.00 -3.01 1.55 0.00 0.95 0.00 0.00 175.26 174.75 1ny4 n ALA 64 N -4.25 -1.16 -0.28 -0.84 0.00 -1.26 -4.78 120.51 107.94 1ny4 n ALA 64 Ca 0.13 0.47 0.09 0.00 0.00 0.00 0.00 53.44 54.13 1ny4 n ALA 64 Cb 0.59 -2.04 0.24 0.00 0.00 0.00 0.00 19.45 18.25 1ny4 n ALA 64 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1ny4 h ARG 65 N 5.54 0.32 0.00 0.00 2.43 -1.97 -3.42 114.38 117.28 1ny4 h ARG 65 Ca -0.46 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1ny4 h ARG 65 Cb 1.35 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1ny4 h ARG 65 CO 0.90 0.21 0.00 -1.91 -1.51 0.00 0.00 179.97 177.67 1ny4 n GLU 66 N -5.11 0.00 -1.10 0.20 2.13 -1.26 -5.14 120.64 110.36 1ny4 n GLU 66 Ca 0.18 0.00 0.13 0.00 0.66 0.00 0.00 57.16 58.13 1ny4 n GLU 66 Cb 0.55 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.22 1ny4 n GLU 66 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1ny4 n ILE 67 N -3.24 0.00 -2.67 6.31 0.13 -1.26 -4.92 119.36 113.71 1ny4 n ILE 67 Ca 0.00 0.23 -0.05 0.00 -1.10 0.00 0.00 62.75 61.83 1ny4 n ILE 67 Cb 0.00 -0.56 0.04 0.00 -0.84 0.00 0.00 39.64 38.27 1ny4 n ILE 67 CO 0.00 0.00 0.00 2.29 2.80 0.00 0.00 176.55 181.64 1ny4 n LYS 68 N -3.41 0.57 -2.10 9.51 2.85 -1.26 -5.06 118.16 119.25 1ny4 n LYS 68 Ca -0.02 -1.09 -0.33 0.00 -1.05 0.00 0.00 58.31 55.82 1ny4 n LYS 68 Cb 0.62 -0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.95 1ny4 n LYS 68 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1ny4 n SER 69 N -0.56 3.50 -4.65 -5.58 2.88 -1.26 -4.90 113.62 103.04 1ny4 n SER 69 Ca -0.18 -2.75 -0.34 0.00 -1.33 0.00 0.00 58.87 54.27 1ny4 n SER 69 Cb 0.72 -1.69 -0.10 0.00 -0.75 0.00 0.00 64.21 62.39 1ny4 n SER 69 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1ny4 s ARG 70 N 5.72 2.85 0.00 -1.46 3.52 -1.26 -5.34 118.95 122.98 1ny4 s ARG 70 Ca 0.63 -0.51 0.25 0.00 -0.13 0.00 0.00 55.73 55.97 1ny4 s ARG 70 Cb 0.02 -2.69 0.31 0.00 -1.56 0.00 0.00 34.95 31.03 1ny4 s ARG 70 CO 0.12 0.67 1.33 2.89 -0.81 0.00 0.00 175.30 179.49