#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 0.00 -1.05 3.17 0.00 -1.26 -4.86 120.51 116.51 1ny4 n ALA 2 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.97 1ny4 n ALA 2 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1ny4 n ALA 2 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ny4 n GLU 3 N -0.19 0.00 -0.28 0.00 0.00 -1.26 -4.72 120.64 114.19 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 -1.14 0.00 0.00 0.00 0.00 0.00 31.44 30.30 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 5.05 0.05 -0.24 -1.84 9.92 -1.26 -4.79 116.55 123.43 1ny4 n ASP 4 Ca 0.37 -1.60 0.03 0.00 -0.53 0.00 0.00 54.79 53.06 1ny4 n ASP 4 Cb -0.03 -0.12 0.09 0.00 -0.64 0.00 0.00 41.12 40.42 1ny4 n ASP 4 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1ny4 n GLU 5 N -0.02 1.30 0.00 -1.24 4.71 -1.26 -4.92 120.64 119.21 1ny4 n GLU 5 Ca 0.00 -0.47 0.00 0.00 -0.01 0.00 0.00 57.16 56.68 1ny4 n GLU 5 Cb 0.61 -1.12 0.00 0.00 -1.01 0.00 0.00 31.44 29.92 1ny4 n GLU 5 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ny4 n GLY 6 N 0.72 3.94 3.62 0.62 0.00 -1.26 -5.04 105.19 107.79 1ny4 n GLY 6 Ca 0.05 -1.42 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.32 2.91 1.03 1.61 2.02 -1.12 -4.86 117.35 117.62 1ny4 s TYR 7 Ca 0.00 0.96 -0.16 0.00 -0.37 0.00 0.00 57.07 57.49 1ny4 s TYR 7 Cb 0.00 -3.99 0.21 0.00 -0.40 0.00 0.00 41.96 37.78 1ny4 s TYR 7 CO 0.00 -1.19 1.20 -1.25 -1.57 0.00 0.00 175.55 172.74 1ny4 s PRO 8 N 4.07 0.11 -0.26 -1.71 0.04 -1.26 0.44 135.00 136.43 1ny4 s PRO 8 Ca 0.49 -0.10 -0.26 0.00 0.04 0.00 0.00 61.00 61.18 1ny4 s PRO 8 Cb -0.12 -1.75 0.10 0.00 0.04 0.00 0.00 34.50 32.77 1ny4 s PRO 8 CO 0.23 -2.82 0.92 0.00 0.04 0.00 0.00 177.00 175.37 1ny4 s ALA 9 N -3.41 -1.90 -0.14 8.56 0.00 0.17 -3.78 121.76 121.27 1ny4 s ALA 9 Ca 0.70 1.87 0.01 0.00 0.00 0.00 0.00 51.96 54.54 1ny4 s ALA 9 Cb -0.09 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.80 1ny4 s ALA 9 CO 0.54 -0.28 -0.16 -2.00 0.00 0.00 0.00 175.76 173.86 1ny4 s GLU 10 N 0.08 3.24 0.21 0.00 -6.30 0.97 -1.35 118.70 115.55 1ny4 s GLU 10 Ca 0.01 -0.75 -0.32 0.00 -2.50 0.00 0.00 54.97 51.41 1ny4 s GLU 10 Cb -0.04 -2.57 -0.11 0.00 0.00 0.00 0.00 34.13 31.40 1ny4 s GLU 10 CO -0.03 0.11 1.66 0.08 0.02 0.00 0.00 175.26 177.10 1ny4 s VAL 11 N 0.59 2.20 -0.12 3.70 1.01 -0.48 -0.15 120.40 127.14 1ny4 s VAL 11 Ca -0.09 0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.09 1ny4 s VAL 11 Cb -0.16 -3.09 -0.11 0.00 0.00 0.00 0.00 36.38 33.01 1ny4 s VAL 11 CO 0.03 0.01 -0.04 2.30 0.00 0.00 0.00 175.10 177.40 1ny4 n ILE 12 N 3.72 0.78 -3.60 2.22 -5.35 -0.43 -2.73 119.36 113.98 1ny4 n ILE 12 Ca 0.14 -0.39 -0.14 0.00 -0.27 0.00 0.00 62.75 62.10 1ny4 n ILE 12 Cb 0.36 -0.85 -0.06 0.00 -1.74 0.00 0.00 39.64 37.35 1ny4 n ILE 12 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1ny4 s GLU 13 N -2.27 0.80 -0.29 6.28 2.12 -1.21 -4.92 118.70 119.21 1ny4 s GLU 13 Ca -0.12 0.60 -0.16 0.00 0.36 0.00 0.00 54.97 55.66 1ny4 s GLU 13 Cb 0.04 0.38 -0.03 0.00 0.26 0.00 0.00 34.13 34.79 1ny4 s GLU 13 CO 0.39 -0.16 0.40 0.42 -0.54 0.00 0.00 175.26 175.77 1ny4 s ILE 14 N -0.27 5.14 0.04 -3.70 1.09 -1.26 -0.57 121.20 121.67 1ny4 s ILE 14 Ca -0.03 0.49 -0.32 0.00 -1.10 0.00 0.00 60.65 59.69 1ny4 s ILE 14 Cb -0.03 -3.76 -0.18 0.00 -1.06 0.00 0.00 42.46 37.43 1ny4 s ILE 14 CO 0.02 0.07 1.34 0.40 -0.10 0.00 0.00 174.94 176.66 1ny4 h ILE 15 N 5.44 0.00 0.00 2.92 2.04 -1.87 -3.48 117.51 122.56 1ny4 h ILE 15 Ca -0.31 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.42 1ny4 h ILE 15 Cb 1.15 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 1ny4 h ILE 15 CO 0.67 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.43 1ny4 n GLY 16 N -1.18 -2.61 3.77 5.37 0.00 -1.08 -5.07 105.19 104.39 1ny4 n GLY 16 Ca -0.14 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.98 4.11 -0.35 1.61 1.81 -1.26 -2.44 118.95 120.45 1ny4 s ARG 17 Ca 0.00 1.79 0.15 0.00 -1.72 0.00 0.00 55.73 55.95 1ny4 s ARG 17 Cb 0.00 -2.69 0.42 0.00 -0.45 0.00 0.00 34.95 32.23 1ny4 s ARG 17 CO 0.00 -0.26 0.88 2.41 -0.68 0.00 0.00 175.30 177.65 1ny4 n THR 18 N 0.12 0.66 -1.43 0.02 -1.04 0.23 -4.82 114.28 108.02 1ny4 n THR 18 Ca 0.04 -3.68 -0.35 0.00 -2.04 0.00 0.00 64.05 58.01 1ny4 n THR 18 Cb 0.47 0.26 0.07 0.00 -1.82 0.00 0.00 70.33 69.31 1ny4 n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ny4 n GLY 19 N 0.04 5.84 0.34 3.41 0.00 -1.17 -3.55 105.19 110.11 1ny4 n GLY 19 Ca 0.16 -2.34 0.15 0.00 0.00 0.00 0.00 46.02 43.98 1ny4 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ny4 h THR 20 N 1.17 0.04 0.00 2.61 1.03 -1.91 -2.48 112.91 113.37 1ny4 h THR 20 Ca 0.60 -0.01 -0.12 0.00 -0.01 0.00 0.00 66.41 66.87 1ny4 h THR 20 Cb 0.72 0.02 -0.02 0.00 -1.07 0.00 0.00 68.15 67.80 1ny4 h THR 20 CO 1.56 0.00 -1.52 0.41 -0.01 0.00 0.00 175.52 175.96 1ny4 n THR 21 N -5.47 0.44 0.00 0.00 -1.04 -1.26 -5.05 114.28 101.90 1ny4 n THR 21 Ca 0.23 -0.31 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1ny4 n THR 21 Cb 0.76 -0.57 0.00 0.00 -1.82 0.00 0.00 70.33 68.70 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 2.41 3.17 2.71 3.41 0.00 -0.93 -5.07 105.19 110.88 1ny4 n GLY 22 Ca -0.11 -0.35 -0.07 0.00 0.00 0.00 0.00 46.02 45.50 1ny4 n GLY 22 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ny4 n ASP 23 N 0.00 1.52 -4.81 1.61 2.03 -1.26 -4.24 116.55 111.39 1ny4 n ASP 23 Ca 0.00 -2.52 -0.32 0.00 0.52 0.00 0.00 54.79 52.47 1ny4 n ASP 23 Cb 0.00 -0.51 0.03 0.00 -0.72 0.00 0.00 41.12 39.91 1ny4 n ASP 23 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1ny4 s VAL 24 N -3.34 3.94 -0.23 5.18 1.01 -1.23 -3.94 120.40 121.78 1ny4 s VAL 24 Ca 0.27 0.79 -0.01 0.00 0.00 0.00 0.00 61.98 63.04 1ny4 s VAL 24 Cb 0.42 -3.41 0.07 0.00 0.00 0.00 0.00 36.38 33.46 1ny4 s VAL 24 CO 0.02 -0.66 0.01 -0.89 0.00 0.00 0.00 175.10 173.57 1ny4 s THR 25 N -2.71 1.01 -0.06 3.92 2.01 0.17 -0.60 115.64 119.38 1ny4 s THR 25 Ca 0.61 -0.96 -0.23 0.00 0.31 0.00 0.00 61.69 61.41 1ny4 s THR 25 Cb -0.15 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.87 1ny4 s THR 25 CO 0.44 -0.23 0.70 -1.58 -0.69 0.00 0.00 174.62 173.26 1ny4 s GLN 26 N 1.62 4.44 0.03 4.92 0.74 -1.02 -1.07 119.66 129.32 1ny4 s GLN 26 Ca -0.02 0.87 -0.04 0.00 0.05 0.00 0.00 55.36 56.22 1ny4 s GLN 26 Cb -0.18 -3.44 -0.01 0.00 1.10 0.00 0.00 33.01 30.47 1ny4 s GLN 26 CO -0.09 0.07 0.07 0.14 -0.55 0.00 0.00 175.29 174.93 1ny4 s VAL 27 N 0.77 0.13 -0.12 1.34 -7.23 -0.16 -2.64 120.40 112.49 1ny4 s VAL 27 Ca 0.37 -1.08 -0.16 0.00 -1.81 0.00 0.00 61.98 59.31 1ny4 s VAL 27 Cb -0.18 -0.79 -0.05 0.00 0.56 0.00 0.00 36.38 35.92 1ny4 s VAL 27 CO 0.18 -0.59 0.40 -0.54 -0.31 0.00 0.00 175.10 174.23 1ny4 s LYS 28 N -2.40 4.23 -0.02 4.82 1.02 0.27 -0.44 119.74 127.23 1ny4 s LYS 28 Ca -0.07 0.31 0.03 0.00 0.02 0.00 0.00 55.97 56.27 1ny4 s LYS 28 Cb -0.03 -3.40 -0.01 0.00 -0.52 0.00 0.00 37.83 33.88 1ny4 s LYS 28 CO -0.04 0.28 -0.12 0.14 -0.92 0.00 0.00 175.35 174.69 1ny4 s VAL 29 N 0.28 0.96 0.03 3.17 -7.23 0.13 -1.31 120.40 116.43 1ny4 s VAL 29 Ca 0.22 -0.50 -0.00 0.00 -1.81 0.00 0.00 61.98 59.89 1ny4 s VAL 29 Cb -0.15 -0.82 -0.04 0.00 0.56 0.00 0.00 36.38 35.94 1ny4 s VAL 29 CO 0.08 0.28 0.17 -0.60 -0.31 0.00 0.00 175.10 174.72 1ny4 s ARG 30 N -0.13 3.32 -0.04 4.82 3.52 0.78 -0.63 118.95 130.59 1ny4 s ARG 30 Ca 0.02 -0.44 -0.30 0.00 -0.13 0.00 0.00 55.73 54.88 1ny4 s ARG 30 Cb -0.06 -2.99 -0.05 0.00 -1.56 0.00 0.00 34.95 30.28 1ny4 s ARG 30 CO 0.00 0.63 1.44 0.42 -0.81 0.00 0.00 175.30 176.98 1ny4 s ILE 31 N -1.40 3.76 0.16 4.11 1.01 0.09 -0.02 121.20 128.91 1ny4 s ILE 31 Ca 0.30 1.07 -0.00 0.00 0.00 0.00 0.00 60.65 62.02 1ny4 s ILE 31 Cb -0.13 -3.69 -0.15 0.00 0.01 0.00 0.00 42.46 38.50 1ny4 s ILE 31 CO 0.22 -0.04 1.37 -0.07 0.00 0.00 0.00 174.94 176.43 1ny4 h LEU 32 N 8.96 0.39 -7.90 2.97 3.38 -1.91 -2.06 115.31 119.14 1ny4 h LEU 32 Ca -0.36 -0.30 0.18 0.00 0.09 0.00 0.00 57.88 57.49 1ny4 h LEU 32 Cb 1.17 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1ny4 h LEU 32 CO 0.92 1.08 0.60 -0.70 0.09 0.00 0.00 178.44 180.44 1ny4 s GLU 33 N -3.31 1.21 0.00 1.13 2.12 -1.26 -4.77 118.70 113.82 1ny4 s GLU 33 Ca -0.04 -0.77 0.00 0.00 0.36 0.00 0.00 54.97 54.52 1ny4 s GLU 33 Cb 0.10 0.35 0.00 0.00 0.26 0.00 0.00 34.13 34.84 1ny4 s GLU 33 CO 0.84 -0.57 0.00 0.41 -0.54 0.00 0.00 175.26 175.40 1ny4 n GLY 34 N -0.68 0.83 0.00 -1.50 0.00 -1.26 -4.49 105.19 98.08 1ny4 n GLY 34 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1ny4 n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ny4 n ARG 35 N 0.00 2.32 -0.09 1.61 3.00 -1.26 -4.77 116.66 117.47 1ny4 n ARG 35 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 57.75 1ny4 n ARG 35 Cb 0.00 -0.98 -0.13 0.00 0.00 0.00 0.00 32.46 31.35 1ny4 n ARG 35 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1ny4 n ASP 36 N -2.14 0.95 -2.29 0.55 9.92 -1.26 -5.05 116.55 117.23 1ny4 n ASP 36 Ca 0.00 -0.02 -0.03 0.00 -0.53 0.00 0.00 54.79 54.21 1ny4 n ASP 36 Cb 0.48 0.75 0.00 0.00 -0.64 0.00 0.00 41.12 41.72 1ny4 n ASP 36 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 1ny4 n LYS 37 N -2.71 -0.31 0.00 -1.24 2.85 -1.26 -4.65 118.16 110.85 1ny4 n LYS 37 Ca -0.30 0.55 0.00 0.00 -1.05 0.00 0.00 58.31 57.51 1ny4 n LYS 37 Cb 1.04 -0.72 0.00 0.00 -0.65 0.00 0.00 35.03 34.71 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 0.86 0.55 3.17 2.58 0.00 -0.78 -4.92 105.19 106.67 1ny4 n GLY 38 Ca -0.01 0.00 -0.34 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 2.99 -0.22 1.61 3.52 -1.26 -4.86 118.95 120.72 1ny4 s ARG 39 Ca 0.00 -0.85 -0.22 0.00 -0.13 0.00 0.00 55.73 54.53 1ny4 s ARG 39 Cb 0.00 -2.77 -0.02 0.00 -1.56 0.00 0.00 34.95 30.60 1ny4 s ARG 39 CO 0.00 -0.27 0.71 0.54 -0.81 0.00 0.00 175.30 175.47 1ny4 s VAL 40 N 1.32 4.94 0.46 7.11 0.11 -1.26 -0.73 120.40 132.36 1ny4 s VAL 40 Ca 0.03 1.33 0.03 0.00 -2.93 0.00 0.00 61.98 60.44 1ny4 s VAL 40 Cb -0.15 -4.01 -0.01 0.00 -1.53 0.00 0.00 36.38 30.68 1ny4 s VAL 40 CO -0.09 0.02 0.10 2.30 -3.33 0.00 0.00 175.10 174.11 1ny4 n ILE 41 N 5.00 0.00 -3.92 7.04 -5.35 0.19 -4.96 119.36 117.37 1ny4 n ILE 41 Ca 0.01 -2.50 -0.30 0.00 -0.27 0.00 0.00 62.75 59.69 1ny4 n ILE 41 Cb 0.49 0.76 -0.15 0.00 -1.74 0.00 0.00 39.64 39.00 1ny4 n ILE 41 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ny4 s ARG 42 N -3.73 1.37 -0.05 6.28 3.03 -1.26 -0.70 118.95 123.89 1ny4 s ARG 42 Ca 0.14 -1.34 -0.05 0.00 2.03 0.00 0.00 55.73 56.51 1ny4 s ARG 42 Cb 0.01 -2.67 -0.04 0.00 -1.03 0.00 0.00 34.95 31.22 1ny4 s ARG 42 CO 0.10 -0.82 0.18 0.50 -1.13 0.00 0.00 175.30 174.13 1ny4 s ARG 43 N 1.26 3.47 -0.30 3.89 6.06 0.42 -4.91 118.95 128.84 1ny4 s ARG 43 Ca 0.04 -0.19 -0.08 0.00 -2.50 0.00 0.00 55.73 53.00 1ny4 s ARG 43 Cb -0.19 -3.14 0.00 0.00 0.06 0.00 0.00 34.95 31.69 1ny4 s ARG 43 CO -0.12 0.72 0.11 -0.80 -2.50 0.00 0.00 175.30 172.71 1ny4 s ASN 44 N -1.51 5.29 0.04 -2.12 -0.87 -1.26 -0.99 114.94 113.52 1ny4 s ASN 44 Ca 0.22 -0.60 0.03 0.00 -1.57 0.00 0.00 52.86 50.94 1ny4 s ASN 44 Cb -0.13 -1.93 -0.02 0.00 -0.02 0.00 0.00 41.25 39.15 1ny4 s ASN 44 CO 0.12 -0.18 -0.10 -0.69 -2.57 0.00 0.00 177.10 173.68 1ny4 s VAL 45 N 1.55 0.71 0.34 1.60 1.01 -0.23 -4.92 120.40 120.46 1ny4 s VAL 45 Ca 0.04 -0.95 -0.25 0.00 0.00 0.00 0.00 61.98 60.82 1ny4 s VAL 45 Cb -0.17 -0.71 -0.10 0.00 0.00 0.00 0.00 36.38 35.40 1ny4 s VAL 45 CO 0.04 -0.20 0.94 -0.60 0.00 0.00 0.00 175.10 175.28 1ny4 s ARG 46 N -1.27 4.50 0.00 2.72 3.52 -1.26 0.45 118.95 127.60 1ny4 s ARG 46 Ca -0.05 1.27 0.00 0.00 -0.13 0.00 0.00 55.73 56.82 1ny4 s ARG 46 Cb -0.08 -2.68 0.00 0.00 -1.56 0.00 0.00 34.95 30.63 1ny4 s ARG 46 CO 0.01 0.22 0.00 0.41 -0.81 0.00 0.00 175.30 175.13 1ny4 n GLY 47 N 0.32 0.75 3.80 8.12 0.00 -1.25 -4.84 105.19 112.09 1ny4 n GLY 47 Ca 0.03 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.90 3.78 0.27 1.61 0.04 -1.26 -4.45 135.00 133.09 1ny4 s PRO 48 Ca 0.00 1.35 0.06 0.00 0.04 0.00 0.00 61.00 62.45 1ny4 s PRO 48 Cb 0.00 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 1ny4 s PRO 48 CO 0.00 -0.45 -0.05 0.08 0.04 0.00 0.00 177.00 176.63 1ny4 s VAL 49 N -2.01 1.51 -0.20 -0.36 1.01 -1.26 -5.14 120.40 113.95 1ny4 s VAL 49 Ca 0.67 -2.10 -0.20 0.00 0.00 0.00 0.00 61.98 60.35 1ny4 s VAL 49 Cb -0.16 -2.43 0.06 0.00 0.00 0.00 0.00 36.38 33.84 1ny4 s VAL 49 CO 0.21 -0.30 0.57 -0.60 0.00 0.00 0.00 175.10 174.98 1ny4 s ARG 50 N -3.76 0.68 0.13 2.72 3.52 -1.26 -5.04 118.95 115.95 1ny4 s ARG 50 Ca 0.29 0.75 -0.34 0.00 -0.13 0.00 0.00 55.73 56.31 1ny4 s ARG 50 Cb 0.04 0.33 -0.17 0.00 -1.56 0.00 0.00 34.95 33.59 1ny4 s ARG 50 CO 0.11 -0.09 1.04 0.28 -0.81 0.00 0.00 175.30 175.83 1ny4 n VAL 51 N 2.67 0.84 0.00 7.11 0.31 -1.26 -1.14 118.33 126.86 1ny4 n VAL 51 Ca -0.14 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1ny4 n VAL 51 Cb 0.56 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.99 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 1.90 2.05 3.49 2.92 0.00 -1.10 -5.00 105.19 109.45 1ny4 n GLY 52 Ca 0.17 -0.05 -0.57 0.00 0.00 0.00 0.00 46.02 45.57 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 0.03 -0.13 -4.34 1.61 4.64 -0.29 -4.54 116.55 113.53 1ny4 n ASP 53 Ca 0.00 1.16 -0.33 0.00 -1.38 0.00 0.00 54.79 54.24 1ny4 n ASP 53 Cb 0.00 -0.93 -0.15 0.00 -1.04 0.00 0.00 41.12 39.00 1ny4 n ASP 53 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1ny4 s ILE 54 N -0.12 2.90 0.34 5.18 -1.09 -1.26 -1.38 121.20 125.77 1ny4 s ILE 54 Ca 0.87 -0.71 0.03 0.00 -2.23 0.00 0.00 60.65 58.61 1ny4 s ILE 54 Cb -1.22 -2.21 -0.01 0.00 -1.58 0.00 0.00 42.46 37.44 1ny4 s ILE 54 CO 0.57 0.52 0.38 0.18 -1.23 0.00 0.00 174.94 175.36 1ny4 n LEU 55 N 3.63 0.00 -3.89 2.97 4.32 -0.46 -4.98 117.00 118.59 1ny4 n LEU 55 Ca -0.18 -3.00 -0.11 0.00 -0.02 0.00 0.00 56.01 52.69 1ny4 n LEU 55 Cb 0.53 2.07 -0.12 0.00 -1.62 0.00 0.00 43.42 44.28 1ny4 n LEU 55 CO 0.30 -0.58 -0.29 -0.63 -1.22 0.00 0.00 177.39 174.97 1ny4 s ILE 56 N -3.09 0.05 -0.04 -0.08 1.01 -1.26 0.46 121.20 118.24 1ny4 s ILE 56 Ca 0.35 -0.41 0.05 0.00 0.00 0.00 0.00 60.65 60.64 1ny4 s ILE 56 Cb 0.01 -0.21 -0.02 0.00 0.01 0.00 0.00 42.46 42.24 1ny4 s ILE 56 CO 0.25 -0.23 -0.19 -0.22 0.00 0.00 0.00 174.94 174.55 1ny4 s LEU 57 N -0.70 2.42 0.00 2.97 2.96 0.17 -4.94 118.68 121.56 1ny4 s LEU 57 Ca -0.08 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 53.50 1ny4 s LEU 57 Cb -0.05 -1.46 0.00 0.00 0.50 0.00 0.00 46.19 45.18 1ny4 s LEU 57 CO 0.00 0.32 0.34 0.54 -1.32 0.00 0.00 176.35 176.23 1ny4 n ARG 58 N 2.47 0.00 -4.31 1.98 3.00 -1.26 -2.79 116.66 115.74 1ny4 n ARG 58 Ca -0.17 0.39 -0.17 0.00 -0.01 0.00 0.00 57.85 57.89 1ny4 n ARG 58 Cb 0.52 -1.08 -0.10 0.00 0.00 0.00 0.00 32.46 31.80 1ny4 n ARG 58 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1ny4 s GLU 59 N -1.46 1.26 0.53 5.56 2.02 -1.26 -4.74 118.70 120.61 1ny4 s GLU 59 Ca 0.00 -1.60 0.35 0.00 0.02 0.00 0.00 54.97 53.75 1ny4 s GLU 59 Cb 0.00 -0.75 1.84 0.00 0.10 0.00 0.00 34.13 35.33 1ny4 s GLU 59 CO 0.00 0.02 2.08 1.79 0.02 0.00 0.00 175.26 179.17 1ny4 h THR 60 N 2.57 0.00 -1.15 3.63 1.35 -2.04 -2.66 112.91 114.61 1ny4 h THR 60 Ca -0.38 -0.08 0.37 0.00 -0.55 0.00 0.00 66.41 65.77 1ny4 h THR 60 Cb 1.21 0.92 -0.13 0.00 -1.73 0.00 0.00 68.15 68.42 1ny4 h THR 60 CO 0.64 0.00 0.71 1.05 -0.25 0.00 0.00 175.52 177.68 1ny4 h GLU 61 N 0.00 0.20 -2.88 4.72 4.11 -2.02 -3.46 114.58 115.24 1ny4 h GLU 61 Ca 0.00 -0.01 0.34 0.00 0.07 0.00 0.00 59.36 59.75 1ny4 h GLU 61 Cb 0.09 -0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.19 1ny4 h GLU 61 CO 0.00 0.13 -0.61 0.54 0.07 0.00 0.00 179.01 179.14 1ny4 n ARG 62 N -4.83 -2.64 -3.54 1.06 1.74 -1.00 -4.89 116.66 102.56 1ny4 n ARG 62 Ca 0.34 1.85 -0.28 0.00 -0.77 0.00 0.00 57.85 58.99 1ny4 n ARG 62 Cb 1.19 -3.19 0.01 0.00 -1.02 0.00 0.00 32.46 29.46 1ny4 n ARG 62 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1ny4 n GLU 63 N -3.96 -1.54 -3.94 5.56 0.28 -1.26 -4.97 120.64 110.82 1ny4 n GLU 63 Ca -0.01 0.91 -0.08 0.00 -0.16 0.00 0.00 57.16 57.81 1ny4 n GLU 63 Cb 0.58 -1.93 -0.09 0.00 1.43 0.00 0.00 31.44 31.44 1ny4 n GLU 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ny4 s ALA 64 N -2.30 0.03 0.00 -1.84 0.00 -1.26 -4.82 121.76 111.57 1ny4 s ALA 64 Ca 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1ny4 s ALA 64 Cb -0.01 0.36 0.00 0.00 0.00 0.00 0.00 23.12 23.47 1ny4 s ALA 64 CO 0.81 -0.42 0.00 -2.13 0.00 0.00 0.00 175.76 174.02 1ny4 n ARG 65 N 0.20 0.00 -1.12 0.00 0.63 -1.26 -4.83 116.66 110.28 1ny4 n ARG 65 Ca -0.16 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.67 1ny4 n ARG 65 Cb 0.61 -2.74 0.15 0.00 0.45 0.00 0.00 32.46 30.92 1ny4 n ARG 65 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1ny4 n GLU 66 N -2.00 2.30 -0.43 -0.14 2.13 -1.26 -4.77 120.64 116.47 1ny4 n GLU 66 Ca 0.00 -3.48 0.38 0.00 0.66 0.00 0.00 57.16 54.72 1ny4 n GLU 66 Cb 0.00 -1.93 0.66 0.00 0.27 0.00 0.00 31.44 30.43 1ny4 n GLU 66 CO 0.00 0.00 0.00 -0.84 -0.41 0.00 0.00 177.13 175.88 1ny4 h ILE 67 N 1.30 0.01 0.00 6.31 -2.65 -1.94 -3.40 117.51 117.15 1ny4 h ILE 67 Ca 0.25 -0.00 0.00 0.00 1.03 0.00 0.00 64.86 66.13 1ny4 h ILE 67 Cb 1.42 0.00 0.00 0.00 -2.05 0.00 0.00 36.82 36.20 1ny4 h ILE 67 CO 0.50 0.00 0.00 2.29 0.03 0.00 0.00 178.15 180.98 1ny4 n LYS 68 N -4.87 0.00 0.00 0.16 2.85 -1.26 -5.04 118.16 110.01 1ny4 n LYS 68 Ca 0.40 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.66 1ny4 n LYS 68 Cb 1.50 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.88 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 0.00 0.00 0.15 -5.58 2.88 -1.26 -3.63 113.62 106.17 1ny4 n SER 69 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ny4 n SER 69 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1ny4 n SER 69 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1ny4 n ARG 70 N 0.00 0.00 0.00 -1.46 0.63 -1.26 -5.20 116.66 109.37 1ny4 n ARG 70 Ca 0.00 0.00 0.01 0.00 -0.92 0.00 0.00 57.85 56.94 1ny4 n ARG 70 Cb 0.00 0.00 0.01 0.00 0.45 0.00 0.00 32.46 32.92 1ny4 n ARG 70 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66