#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ny4 n ALA 2 N 0.00 0.11 -2.45 -5.12 0.00 -1.26 -5.19 120.51 106.60 1ny4 n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ny4 n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1ny4 n ALA 2 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ny4 n GLU 3 N 0.00 0.00 -0.54 0.00 0.00 -1.26 -5.04 120.64 113.79 1ny4 n GLU 3 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 57.16 57.16 1ny4 n GLU 3 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 31.44 31.44 1ny4 n GLU 3 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1ny4 n ASP 4 N 0.00 -0.01 -4.13 4.31 9.92 -1.26 -5.05 116.55 120.32 1ny4 n ASP 4 Ca 0.00 -1.42 -0.37 0.00 -0.53 0.00 0.00 54.79 52.47 1ny4 n ASP 4 Cb 0.00 -0.07 -0.11 0.00 -0.64 0.00 0.00 41.12 40.30 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 2.10 0.00 -1.24 2.02 -1.26 -4.98 118.70 115.34 1ny4 s GLU 5 Ca 0.01 -1.84 0.00 0.00 0.02 0.00 0.00 54.97 53.16 1ny4 s GLU 5 Cb 0.01 -3.65 0.00 0.00 0.10 0.00 0.00 34.13 30.59 1ny4 s GLU 5 CO -0.00 -1.10 0.00 0.41 0.02 0.00 0.00 175.26 174.59 1ny4 n GLY 6 N 4.61 1.02 2.76 -1.39 0.00 -1.26 -4.91 105.19 106.01 1ny4 n GLY 6 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 2.15 0.41 1.61 1.51 -1.26 -4.90 117.35 116.88 1ny4 s TYR 7 Ca 0.00 -2.40 -0.23 0.00 -1.01 0.00 0.00 57.07 53.42 1ny4 s TYR 7 Cb 0.00 -2.01 -0.09 0.00 -0.11 0.00 0.00 41.96 39.76 1ny4 s TYR 7 CO 0.00 -0.81 1.05 -1.25 -1.11 0.00 0.00 175.55 173.43 1ny4 s PRO 8 N 0.57 4.10 -0.08 -1.71 0.04 -1.26 -1.41 135.00 135.25 1ny4 s PRO 8 Ca 0.16 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.69 1ny4 s PRO 8 Cb -0.23 -2.47 0.02 0.00 0.04 0.00 0.00 34.50 31.86 1ny4 s PRO 8 CO -0.05 -0.20 -0.05 0.00 0.04 0.00 0.00 177.00 176.74 1ny4 s ALA 9 N -1.71 0.96 -0.22 8.56 0.00 0.11 -2.09 121.76 127.37 1ny4 s ALA 9 Ca 0.59 -0.28 -0.10 0.00 0.00 0.00 0.00 51.96 52.17 1ny4 s ALA 9 Cb -0.21 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.18 1ny4 s ALA 9 CO 0.27 -0.24 0.16 -2.00 0.00 0.00 0.00 175.76 173.94 1ny4 s GLU 10 N 1.41 4.12 0.16 0.00 2.12 0.65 -0.31 118.70 126.85 1ny4 s GLU 10 Ca -0.02 -0.24 -0.34 0.00 0.36 0.00 0.00 54.97 54.73 1ny4 s GLU 10 Cb -0.13 -3.49 -0.15 0.00 0.26 0.00 0.00 34.13 30.61 1ny4 s GLU 10 CO -0.03 0.15 1.44 0.28 -0.54 0.00 0.00 175.26 176.56 1ny4 n VAL 11 N 4.00 0.26 -0.04 3.70 0.31 -0.32 -0.20 118.33 126.03 1ny4 n VAL 11 Ca -0.15 -0.06 -0.05 0.00 -0.01 0.00 0.00 64.34 64.06 1ny4 n VAL 11 Cb 0.52 -1.27 -0.05 0.00 -0.91 0.00 0.00 33.84 32.14 1ny4 n VAL 11 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1ny4 n ILE 12 N 2.72 0.50 -3.60 2.52 -6.64 -0.08 -3.59 119.36 111.18 1ny4 n ILE 12 Ca 0.16 -0.24 -0.14 0.00 -1.77 0.00 0.00 62.75 60.76 1ny4 n ILE 12 Cb 0.26 -0.82 -0.07 0.00 -1.44 0.00 0.00 39.64 37.58 1ny4 n ILE 12 CO 0.00 0.00 0.00 -0.70 -1.77 0.00 0.00 176.55 174.08 1ny4 s GLU 13 N -2.17 0.79 0.18 6.28 2.12 -1.14 -5.04 118.70 119.72 1ny4 s GLU 13 Ca -0.08 0.66 -0.10 0.00 0.36 0.00 0.00 54.97 55.81 1ny4 s GLU 13 Cb 0.03 0.38 -0.07 0.00 0.26 0.00 0.00 34.13 34.73 1ny4 s GLU 13 CO 0.25 -0.15 0.50 0.42 -0.54 0.00 0.00 175.26 175.74 1ny4 s ILE 14 N -0.16 4.97 0.00 -3.70 -1.09 -1.26 -0.76 121.20 119.20 1ny4 s ILE 14 Ca -0.02 0.47 0.00 0.00 -2.23 0.00 0.00 60.65 58.87 1ny4 s ILE 14 Cb -0.03 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.20 1ny4 s ILE 14 CO 0.02 0.05 0.00 -0.38 -1.23 0.00 0.00 174.94 173.40 1ny4 n ILE 15 N 0.21 0.00 -3.42 2.92 -0.00 -1.14 -4.88 119.36 113.05 1ny4 n ILE 15 Ca -0.02 0.47 0.00 0.00 -0.00 0.00 0.00 62.75 63.19 1ny4 n ILE 15 Cb 0.52 -1.44 0.00 0.00 -0.00 0.00 0.00 39.64 38.72 1ny4 n ILE 15 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1ny4 n GLY 16 N 1.72 -0.83 3.41 7.39 0.00 -1.20 -5.07 105.19 110.60 1ny4 n GLY 16 Ca 0.00 -0.88 -0.28 0.00 0.00 0.00 0.00 46.02 44.86 1ny4 n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ny4 s ARG 17 N -0.85 1.47 -0.03 1.61 0.52 -1.26 -2.60 118.95 117.81 1ny4 s ARG 17 Ca 0.00 -1.45 -0.06 0.00 -0.52 0.00 0.00 55.73 53.70 1ny4 s ARG 17 Cb 0.00 -1.86 0.01 0.00 0.52 0.00 0.00 34.95 33.61 1ny4 s ARG 17 CO 0.00 0.42 0.14 -0.08 0.02 0.00 0.00 175.30 175.80 1ny4 s THR 18 N -1.42 0.04 -0.42 0.02 -1.32 -0.67 -5.01 115.64 106.85 1ny4 s THR 18 Ca 0.18 -0.35 0.07 0.00 -1.21 0.00 0.00 61.69 60.38 1ny4 s THR 18 Cb -0.09 -0.32 0.43 0.00 -1.51 0.00 0.00 72.50 71.01 1ny4 s THR 18 CO 0.08 -0.19 1.09 0.61 -2.21 0.00 0.00 174.62 174.00 1ny4 n GLY 19 N 2.25 5.39 0.01 6.08 0.00 -1.26 0.45 105.19 118.10 1ny4 n GLY 19 Ca -0.18 -2.57 0.09 0.00 0.00 0.00 0.00 46.02 43.37 1ny4 n GLY 19 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ny4 n THR 20 N -0.42 0.00 0.00 2.61 5.66 -1.26 -4.66 114.28 116.21 1ny4 n THR 20 Ca 0.35 -0.34 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1ny4 n THR 20 Cb 0.68 0.29 0.00 0.00 -1.55 0.00 0.00 70.33 69.75 1ny4 n THR 20 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1ny4 n THR 21 N -1.97 0.00 0.00 1.09 -1.04 -1.26 -5.03 114.28 106.07 1ny4 n THR 21 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1ny4 n THR 21 Cb 0.43 -0.60 0.00 0.00 -1.82 0.00 0.00 70.33 68.34 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 3.40 -1.79 3.72 3.41 0.00 -1.26 -4.98 105.19 107.70 1ny4 n GLY 22 Ca 0.00 0.66 -0.30 0.00 0.00 0.00 0.00 46.02 46.38 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 -4.31 -4.81 1.61 8.00 -1.18 -4.92 116.55 110.94 1ny4 n ASP 23 Ca 0.00 -1.01 -0.34 0.00 0.71 0.00 0.00 54.79 54.16 1ny4 n ASP 23 Cb 0.00 -3.36 -0.05 0.00 -0.02 0.00 0.00 41.12 37.68 1ny4 n ASP 23 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ny4 s VAL 24 N -3.55 4.10 -0.27 2.53 1.01 0.17 -4.46 120.40 119.92 1ny4 s VAL 24 Ca 0.38 1.32 0.02 0.00 0.00 0.00 0.00 61.98 63.70 1ny4 s VAL 24 Cb -0.13 -3.54 0.07 0.00 0.00 0.00 0.00 36.38 32.78 1ny4 s VAL 24 CO 0.86 -0.27 -0.04 -0.89 0.00 0.00 0.00 175.10 174.76 1ny4 s THR 25 N -2.07 1.87 -0.05 3.92 2.01 0.14 -1.68 115.64 119.78 1ny4 s THR 25 Ca 0.64 -1.63 -0.20 0.00 0.31 0.00 0.00 61.69 60.82 1ny4 s THR 25 Cb -0.13 -2.15 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 1ny4 s THR 25 CO 0.17 -0.23 0.56 -1.10 -0.69 0.00 0.00 174.62 173.32 1ny4 s GLN 26 N 1.20 4.32 0.01 4.92 -0.21 -1.07 -1.01 119.66 127.82 1ny4 s GLN 26 Ca -0.02 0.63 -0.02 0.00 0.02 0.00 0.00 55.36 55.97 1ny4 s GLN 26 Cb -0.19 -3.38 -0.01 0.00 1.00 0.00 0.00 33.01 30.42 1ny4 s GLN 26 CO -0.08 0.27 0.02 0.14 -2.12 0.00 0.00 175.29 173.52 1ny4 s VAL 27 N 0.18 0.09 -0.20 1.09 -7.23 0.25 -2.89 120.40 111.69 1ny4 s VAL 27 Ca 0.30 -0.78 -0.08 0.00 -1.81 0.00 0.00 61.98 59.61 1ny4 s VAL 27 Cb -0.17 -0.28 -0.04 0.00 0.56 0.00 0.00 36.38 36.45 1ny4 s VAL 27 CO 0.15 -0.43 0.09 -0.54 -0.31 0.00 0.00 175.10 174.06 1ny4 s LYS 28 N -1.31 4.00 0.04 4.82 1.02 0.06 -0.82 119.74 127.55 1ny4 s LYS 28 Ca -0.14 -0.32 0.06 0.00 0.02 0.00 0.00 55.97 55.59 1ny4 s LYS 28 Cb -0.09 -3.32 -0.02 0.00 -0.52 0.00 0.00 37.83 33.88 1ny4 s LYS 28 CO -0.00 0.19 -0.18 0.14 -0.92 0.00 0.00 175.35 174.58 1ny4 s VAL 29 N 0.62 1.41 0.04 3.17 -7.23 0.04 -0.91 120.40 117.54 1ny4 s VAL 29 Ca 0.05 -1.11 0.02 0.00 -1.81 0.00 0.00 61.98 59.12 1ny4 s VAL 29 Cb -0.13 -1.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.53 1ny4 s VAL 29 CO 0.01 0.11 0.06 -0.60 -0.31 0.00 0.00 175.10 174.37 1ny4 s ARG 30 N -1.17 2.92 0.04 4.82 3.52 0.72 -0.26 118.95 129.54 1ny4 s ARG 30 Ca 0.05 -0.61 -0.30 0.00 -0.13 0.00 0.00 55.73 54.74 1ny4 s ARG 30 Cb -0.08 -2.76 -0.06 0.00 -1.56 0.00 0.00 34.95 30.49 1ny4 s ARG 30 CO 0.02 0.60 1.27 0.42 -0.81 0.00 0.00 175.30 176.80 1ny4 s ILE 31 N -1.27 3.90 0.08 4.11 1.01 0.18 -0.25 121.20 128.96 1ny4 s ILE 31 Ca 0.25 1.33 -0.03 0.00 0.00 0.00 0.00 60.65 62.21 1ny4 s ILE 31 Cb -0.12 -3.85 -0.27 0.00 0.01 0.00 0.00 42.46 38.22 1ny4 s ILE 31 CO 0.17 0.07 1.16 -0.07 0.00 0.00 0.00 174.94 176.27 1ny4 h LEU 32 N 7.33 0.37 -7.88 2.97 -0.00 -1.78 -1.92 115.31 114.40 1ny4 h LEU 32 Ca -0.40 -0.39 0.11 0.00 -0.00 0.00 0.00 57.88 57.20 1ny4 h LEU 32 Cb 1.20 -0.12 -0.04 0.00 -0.00 0.00 0.00 40.66 41.70 1ny4 h LEU 32 CO 0.85 1.31 0.44 -1.83 -0.00 0.00 0.00 178.44 179.20 1ny4 s GLU 33 N -2.68 1.55 0.00 1.13 -1.05 -1.26 -4.75 118.70 111.64 1ny4 s GLU 33 Ca -0.03 -0.94 0.00 0.00 -0.15 0.00 0.00 54.97 53.84 1ny4 s GLU 33 Cb 0.07 0.47 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 1ny4 s GLU 33 CO 0.88 -0.72 0.00 0.41 0.95 0.00 0.00 175.26 176.77 1ny4 n GLY 34 N -0.56 0.68 5.14 -3.83 0.00 -1.26 -4.40 105.19 100.95 1ny4 n GLY 34 Ca -0.05 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 3.00 -1.26 -3.71 116.66 116.32 1ny4 n ARG 35 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.72 1ny4 n ARG 35 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.39 1ny4 n ARG 35 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1ny4 h ASP 36 N 0.00 -1.36 -6.31 6.15 3.32 -1.99 -3.47 116.42 112.76 1ny4 h ASP 36 Ca 0.00 0.17 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 1ny4 h ASP 36 Cb 0.00 0.54 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1ny4 h ASP 36 CO 0.00 -0.45 -1.00 1.17 -1.72 0.00 0.00 179.24 177.24 1ny4 n LYS 37 N -5.45 -0.36 0.00 3.56 0.00 -1.24 -4.67 118.16 110.00 1ny4 n LYS 37 Ca -0.05 0.79 0.00 0.00 0.00 0.00 0.00 58.31 59.05 1ny4 n LYS 37 Cb 0.37 -1.02 0.00 0.00 0.00 0.00 0.00 35.03 34.38 1ny4 n LYS 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ny4 n GLY 38 N 1.18 0.92 3.23 3.14 0.00 -0.72 -4.94 105.19 108.01 1ny4 n GLY 38 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 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 3.09 -0.33 1.61 3.52 -1.26 -4.85 118.95 120.73 1ny4 s ARG 39 Ca 0.00 -0.80 -0.20 0.00 -0.13 0.00 0.00 55.73 54.60 1ny4 s ARG 39 Cb 0.00 -2.91 -0.00 0.00 -1.56 0.00 0.00 34.95 30.47 1ny4 s ARG 39 CO 0.00 -0.28 0.63 0.08 -0.81 0.00 0.00 175.30 174.92 1ny4 s VAL 40 N 1.38 4.91 0.33 7.11 1.01 -1.26 -0.65 120.40 133.24 1ny4 s VAL 40 Ca 0.04 0.70 0.09 0.00 0.00 0.00 0.00 61.98 62.81 1ny4 s VAL 40 Cb -0.15 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.14 1ny4 s VAL 40 CO -0.06 -0.23 -0.01 0.27 0.00 0.00 0.00 175.10 175.07 1ny4 s ILE 41 N 2.66 2.61 -0.32 2.22 -4.36 0.64 -4.94 121.20 119.70 1ny4 s ILE 41 Ca 0.25 -2.01 0.03 0.00 -0.26 0.00 0.00 60.65 58.65 1ny4 s ILE 41 Cb -0.15 -2.76 0.09 0.00 1.25 0.00 0.00 42.46 40.89 1ny4 s ILE 41 CO 0.13 -0.21 0.01 -0.60 0.24 0.00 0.00 174.94 174.51 1ny4 s ARG 42 N -3.69 1.75 0.02 0.37 3.00 -1.26 -0.78 118.95 118.35 1ny4 s ARG 42 Ca 0.34 -1.71 -0.03 0.00 -1.00 0.00 0.00 55.73 53.33 1ny4 s ARG 42 Cb -0.00 -3.14 -0.04 0.00 0.00 0.00 0.00 34.95 31.77 1ny4 s ARG 42 CO 0.19 -0.83 0.22 0.50 0.00 0.00 0.00 175.30 175.37 1ny4 s ARG 43 N 0.98 3.48 -0.34 5.12 3.52 -0.00 -4.92 118.95 126.78 1ny4 s ARG 43 Ca 0.05 -0.28 -0.00 0.00 -0.13 0.00 0.00 55.73 55.36 1ny4 s ARG 43 Cb -0.19 -3.06 0.08 0.00 -1.56 0.00 0.00 34.95 30.21 1ny4 s ARG 43 CO -0.07 0.64 0.07 0.54 -0.81 0.00 0.00 175.30 175.68 1ny4 s ASN 44 N -2.04 4.96 0.31 -2.12 4.22 -1.26 -0.58 114.94 118.42 1ny4 s ASN 44 Ca 0.30 -1.75 0.08 0.00 -2.14 0.00 0.00 52.86 49.35 1ny4 s ASN 44 Cb -0.13 -1.72 -0.06 0.00 1.28 0.00 0.00 41.25 40.62 1ny4 s ASN 44 CO 0.21 -0.38 -0.09 -0.69 -2.04 0.00 0.00 177.10 174.11 1ny4 s VAL 45 N 1.12 1.98 -0.05 3.54 1.01 -0.18 -4.88 120.40 122.95 1ny4 s VAL 45 Ca 0.03 -2.18 -0.16 0.00 0.00 0.00 0.00 61.98 59.66 1ny4 s VAL 45 Cb -0.21 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 1ny4 s VAL 45 CO -0.04 -0.26 0.44 -0.13 0.00 0.00 0.00 175.10 175.11 1ny4 s ARG 46 N -3.66 4.13 0.00 2.72 1.81 -1.26 0.28 118.95 122.97 1ny4 s ARG 46 Ca 0.31 0.44 0.00 0.00 -1.72 0.00 0.00 55.73 54.76 1ny4 s ARG 46 Cb 0.03 -3.32 0.00 0.00 -0.45 0.00 0.00 34.95 31.21 1ny4 s ARG 46 CO 0.14 0.46 0.00 0.41 -0.68 0.00 0.00 175.30 175.63 1ny4 n GLY 47 N 2.45 2.36 1.12 -3.53 0.00 -1.26 -4.93 105.19 101.41 1ny4 n GLY 47 Ca -0.11 -1.85 -0.09 0.00 0.00 0.00 0.00 46.02 43.97 1ny4 n GLY 47 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ny4 n PRO 48 N 1.60 -1.03 -0.96 1.61 -0.04 -1.26 -4.67 135.00 130.25 1ny4 n PRO 48 Ca 0.00 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 62.88 1ny4 n PRO 48 Cb 0.00 -0.46 0.00 0.00 -0.04 0.00 0.00 33.50 33.00 1ny4 n PRO 48 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1ny4 n VAL 49 N -2.89 0.00 -3.67 0.52 3.14 -1.26 -5.15 118.33 109.02 1ny4 n VAL 49 Ca 0.05 0.00 -0.12 0.00 -2.96 0.00 0.00 64.34 61.31 1ny4 n VAL 49 Cb 0.18 0.00 -0.09 0.00 -1.06 0.00 0.00 33.84 32.87 1ny4 n VAL 49 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1ny4 s ARG 50 N -1.09 0.63 0.31 1.45 0.52 -1.26 -5.11 118.95 114.39 1ny4 s ARG 50 Ca 0.00 0.88 -0.25 0.00 -0.52 0.00 0.00 55.73 55.85 1ny4 s ARG 50 Cb 0.00 0.23 -0.16 0.00 0.52 0.00 0.00 34.95 35.54 1ny4 s ARG 50 CO 0.00 -0.11 0.40 0.28 0.02 0.00 0.00 175.30 175.89 1ny4 n VAL 51 N 3.33 1.48 0.00 3.52 0.31 -1.26 -1.27 118.33 124.44 1ny4 n VAL 51 Ca -0.17 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 1ny4 n VAL 51 Cb 0.56 -0.13 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 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 2.05 3.27 3.55 2.92 0.00 -1.24 -5.00 105.19 110.74 1ny4 n GLY 52 Ca 0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.72 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 0.04 0.71 -4.28 1.61 -0.08 -0.39 -4.54 116.55 109.60 1ny4 n ASP 53 Ca 0.00 1.14 -0.33 0.00 -1.51 0.00 0.00 54.79 54.09 1ny4 n ASP 53 Cb 0.00 -1.23 -0.15 0.00 2.34 0.00 0.00 41.12 42.08 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 -1.10 2.75 -0.07 5.18 -1.09 -1.26 -1.18 121.20 124.44 1ny4 s ILE 54 Ca 0.60 -0.75 -0.01 0.00 -2.23 0.00 0.00 60.65 58.27 1ny4 s ILE 54 Cb -0.72 -2.16 0.03 0.00 -1.58 0.00 0.00 42.46 38.03 1ny4 s ILE 54 CO 0.59 0.51 -0.02 -0.22 -1.23 0.00 0.00 174.94 174.58 1ny4 s LEU 55 N 0.74 0.85 0.12 2.97 1.98 0.57 -4.90 118.68 121.02 1ny4 s LEU 55 Ca -0.06 -0.11 -0.10 0.00 -2.89 0.00 0.00 54.13 50.96 1ny4 s LEU 55 Cb -0.15 -0.47 -0.06 0.00 0.66 0.00 0.00 46.19 46.17 1ny4 s LEU 55 CO 0.01 -0.15 0.45 -0.63 -1.89 0.00 0.00 176.35 174.15 1ny4 s ILE 56 N 1.64 5.02 -0.02 6.68 1.01 -1.26 0.08 121.20 134.36 1ny4 s ILE 56 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.16 1ny4 s ILE 56 Cb -0.13 -3.66 0.03 0.00 0.01 0.00 0.00 42.46 38.71 1ny4 s ILE 56 CO -0.04 0.21 0.03 -1.48 0.00 0.00 0.00 174.94 173.66 1ny4 s LEU 57 N -2.10 1.18 0.03 2.97 -0.00 -0.50 -4.96 118.68 115.30 1ny4 s LEU 57 Ca 0.37 0.03 -0.21 0.00 -0.00 0.00 0.00 54.13 54.32 1ny4 s LEU 57 Cb -0.14 -0.06 -0.12 0.00 -0.00 0.00 0.00 46.19 45.87 1ny4 s LEU 57 CO 0.19 -0.11 1.23 0.03 -0.00 0.00 0.00 176.35 177.69 1ny4 h ARG 58 N 7.17 -0.73 0.00 1.48 3.08 -1.99 -3.35 114.38 120.05 1ny4 h ARG 58 Ca -0.43 0.05 -0.33 0.00 0.07 0.00 0.00 59.98 59.34 1ny4 h ARG 58 Cb 1.13 0.17 -0.08 0.00 0.08 0.00 0.00 29.97 31.27 1ny4 h ARG 58 CO 0.48 -0.49 -0.29 0.39 -1.07 0.00 0.00 179.97 179.00 1ny4 n GLU 59 N -4.16 0.58 0.15 0.04 4.71 -1.26 -4.87 120.64 115.83 1ny4 n GLU 59 Ca -0.09 -2.11 -0.00 0.00 -0.01 0.00 0.00 57.16 54.94 1ny4 n GLU 59 Cb 0.30 1.31 0.22 0.00 -1.01 0.00 0.00 31.44 32.26 1ny4 n GLU 59 CO 0.00 0.00 0.00 1.15 0.09 0.00 0.00 177.13 178.37 1ny4 h THR 60 N 1.49 1.39 0.00 2.62 2.02 -2.05 -3.46 112.91 114.92 1ny4 h THR 60 Ca -0.18 -1.88 0.00 0.00 0.77 0.00 0.00 66.41 65.12 1ny4 h THR 60 Cb 0.75 2.01 0.00 0.00 -1.74 0.00 0.00 68.15 69.17 1ny4 h THR 60 CO 0.28 0.54 0.00 -0.62 0.37 0.00 0.00 175.52 176.09 1ny4 n GLU 61 N -3.89 0.00 -1.05 6.66 1.02 -1.26 -4.76 120.64 117.37 1ny4 n GLU 61 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1ny4 n GLU 61 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.98 1ny4 n GLU 61 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1ny4 n ARG 62 N 0.00 0.00 -1.49 3.49 0.63 -1.26 -5.07 116.66 112.96 1ny4 n ARG 62 Ca 0.00 0.44 -0.29 0.00 -0.92 0.00 0.00 57.85 57.08 1ny4 n ARG 62 Cb 0.00 -0.61 0.22 0.00 0.45 0.00 0.00 32.46 32.53 1ny4 n ARG 62 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1ny4 n GLU 63 N 0.27 -2.11 -2.43 -0.14 2.13 -1.26 -4.93 120.64 112.16 1ny4 n GLU 63 Ca 0.00 -1.89 -0.41 0.00 0.66 0.00 0.00 57.16 55.52 1ny4 n GLU 63 Cb 0.00 -1.47 -0.03 0.00 0.27 0.00 0.00 31.44 30.21 1ny4 n GLU 63 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ny4 s ALA 64 N -3.54 2.77 0.11 4.31 0.00 -1.26 -4.88 121.76 119.27 1ny4 s ALA 64 Ca 0.72 -0.86 -0.26 0.00 0.00 0.00 0.00 51.96 51.57 1ny4 s ALA 64 Cb -0.04 -4.15 -0.09 0.00 0.00 0.00 0.00 23.12 18.84 1ny4 s ALA 64 CO 0.53 -3.06 1.66 -0.09 0.00 0.00 0.00 175.76 174.80 1ny4 h ARG 65 N 10.91 -0.35 -4.55 0.00 2.43 -2.04 -3.45 114.38 117.34 1ny4 h ARG 65 Ca -0.27 0.02 -0.17 0.00 -0.81 0.00 0.00 59.98 58.76 1ny4 h ARG 65 Cb 1.08 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.69 1ny4 h ARG 65 CO 1.21 -0.23 -0.22 -0.85 -1.51 0.00 0.00 179.97 178.36 1ny4 n GLU 66 N -5.32 -2.61 0.00 0.20 0.28 -1.26 -4.59 120.64 107.33 1ny4 n GLU 66 Ca -0.06 0.33 0.00 0.00 -0.16 0.00 0.00 57.16 57.26 1ny4 n GLU 66 Cb 0.24 -4.90 0.00 0.00 1.43 0.00 0.00 31.44 28.21 1ny4 n GLU 66 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 1ny4 n ILE 67 N -3.09 0.00 -2.64 3.84 -0.00 -1.26 -4.79 119.36 111.41 1ny4 n ILE 67 Ca -0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 62.75 62.65 1ny4 n ILE 67 Cb 0.55 0.00 0.02 0.00 -0.00 0.00 0.00 39.64 40.22 1ny4 n ILE 67 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1ny4 n LYS 68 N -0.04 0.45 -0.00 6.28 4.81 -1.26 -5.05 118.16 123.34 1ny4 n LYS 68 Ca 0.00 -0.86 -0.00 0.00 -0.87 0.00 0.00 58.31 56.58 1ny4 n LYS 68 Cb 0.00 0.02 -0.00 0.00 0.02 0.00 0.00 35.03 35.07 1ny4 n LYS 68 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1ny4 h SER 69 N 1.14 -0.00 -4.01 3.14 0.87 -1.99 -3.50 113.55 109.19 1ny4 h SER 69 Ca -0.43 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 1ny4 h SER 69 Cb 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1ny4 h SER 69 CO -0.15 0.05 -0.67 -1.14 -0.53 0.00 0.00 176.83 174.38 1ny4 n ARG 70 N -2.31 -3.25 0.00 2.24 0.63 -1.26 -5.34 116.66 107.37 1ny4 n ARG 70 Ca -0.00 2.44 0.00 0.00 -0.92 0.00 0.00 57.85 59.37 1ny4 n ARG 70 Cb 0.00 -2.83 0.00 0.00 0.45 0.00 0.00 32.46 30.08 1ny4 n ARG 70 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99