#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 2.44 -1.36 3.04 0.00 -1.26 -5.04 120.51 118.34 1ny4 n ALA 2 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 53.44 52.89 1ny4 n ALA 2 Cb 0.00 0.42 -0.08 0.00 0.00 0.00 0.00 19.45 19.79 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 -2.60 0.00 -0.52 0.00 0.28 -1.26 -4.75 120.64 111.79 1ny4 n GLU 3 Ca 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1ny4 n GLU 3 Cb 0.42 -1.23 -0.00 0.00 1.43 0.00 0.00 31.44 32.06 1ny4 n GLU 3 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1ny4 n ASP 4 N 3.78 -0.00 -1.32 -1.84 8.00 -1.26 -4.85 116.55 119.06 1ny4 n ASP 4 Ca 0.29 -1.47 0.12 0.00 0.71 0.00 0.00 54.79 54.43 1ny4 n ASP 4 Cb -0.05 -0.09 0.31 0.00 -0.02 0.00 0.00 41.12 41.28 1ny4 n ASP 4 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ny4 n GLU 5 N 0.01 2.66 0.00 -1.24 1.02 -1.26 -4.88 120.64 116.94 1ny4 n GLU 5 Ca -0.00 -2.57 0.00 0.00 -0.02 0.00 0.00 57.16 54.56 1ny4 n GLU 5 Cb 0.60 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1ny4 n GLU 5 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ny4 n GLY 6 N 1.64 -2.36 3.11 0.62 0.00 -1.26 -4.89 105.19 102.04 1ny4 n GLY 6 Ca 0.24 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 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 3.47 0.12 1.61 2.02 -1.26 -4.93 117.35 118.38 1ny4 s TYR 7 Ca 0.00 -2.59 -0.30 0.00 -0.37 0.00 0.00 57.07 53.81 1ny4 s TYR 7 Cb 0.00 -3.22 -0.07 0.00 -0.40 0.00 0.00 41.96 38.28 1ny4 s TYR 7 CO 0.00 -0.89 1.14 -1.25 -1.57 0.00 0.00 175.55 172.98 1ny4 s PRO 8 N 0.38 4.52 -0.09 -1.71 0.04 -1.26 -4.12 135.00 132.76 1ny4 s PRO 8 Ca 0.14 1.73 0.01 0.00 0.04 0.00 0.00 61.00 62.92 1ny4 s PRO 8 Cb -0.21 -3.31 0.02 0.00 0.04 0.00 0.00 34.50 31.03 1ny4 s PRO 8 CO -0.04 -0.07 -0.12 0.00 0.04 0.00 0.00 177.00 176.81 1ny4 s ALA 9 N 0.35 1.44 -0.04 8.56 0.00 0.14 -1.79 121.76 130.43 1ny4 s ALA 9 Ca 0.53 -0.57 -0.11 0.00 0.00 0.00 0.00 51.96 51.82 1ny4 s ALA 9 Cb -0.29 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.03 1ny4 s ALA 9 CO 0.32 -0.08 0.29 -2.00 0.00 0.00 0.00 175.76 174.30 1ny4 s GLU 10 N 1.02 3.69 0.09 0.00 2.12 0.32 -1.16 118.70 124.78 1ny4 s GLU 10 Ca -0.07 0.13 -0.31 0.00 0.36 0.00 0.00 54.97 55.09 1ny4 s GLU 10 Cb -0.15 -3.18 -0.08 0.00 0.26 0.00 0.00 34.13 30.98 1ny4 s GLU 10 CO -0.01 0.71 1.57 0.08 -0.54 0.00 0.00 175.26 177.07 1ny4 s VAL 11 N -1.11 3.05 -0.14 3.70 1.01 -0.15 0.20 120.40 126.97 1ny4 s VAL 11 Ca 0.21 0.60 0.09 0.00 0.00 0.00 0.00 61.98 62.89 1ny4 s VAL 11 Cb -0.14 -3.39 -0.15 0.00 0.00 0.00 0.00 36.38 32.70 1ny4 s VAL 11 CO 0.10 0.02 -0.00 2.30 0.00 0.00 0.00 175.10 177.52 1ny4 n ILE 12 N 4.45 0.95 -3.60 2.22 -6.64 -0.36 -3.60 119.36 112.78 1ny4 n ILE 12 Ca 0.15 -0.53 -0.13 0.00 -1.77 0.00 0.00 62.75 60.46 1ny4 n ILE 12 Cb 0.41 -0.76 -0.07 0.00 -1.44 0.00 0.00 39.64 37.78 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 -2.33 0.79 -0.23 6.28 2.12 -1.19 -5.05 118.70 119.08 1ny4 s GLU 13 Ca -0.11 0.67 -0.12 0.00 0.36 0.00 0.00 54.97 55.77 1ny4 s GLU 13 Cb 0.05 0.38 -0.05 0.00 0.26 0.00 0.00 34.13 34.77 1ny4 s GLU 13 CO 0.52 -0.15 0.23 0.42 -0.54 0.00 0.00 175.26 175.74 1ny4 s ILE 14 N -0.12 5.30 -0.04 -3.70 1.01 -1.26 -0.26 121.20 122.13 1ny4 s ILE 14 Ca -0.02 0.34 -0.02 0.00 0.00 0.00 0.00 60.65 60.95 1ny4 s ILE 14 Cb -0.04 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.85 1ny4 s ILE 14 CO 0.01 0.30 0.13 0.40 0.00 0.00 0.00 174.94 175.79 1ny4 h ILE 15 N 5.07 0.00 0.00 2.92 2.04 -1.88 -3.48 117.51 122.18 1ny4 h ILE 15 Ca -0.37 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.06 1ny4 h ILE 15 Cb 1.17 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1ny4 h ILE 15 CO 0.66 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.42 1ny4 n GLY 16 N 1.56 -0.58 3.23 5.37 0.00 -0.92 -5.06 105.19 108.79 1ny4 n GLY 16 Ca -0.01 -0.28 -0.19 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.31 0.98 -0.38 1.61 0.52 -1.26 -1.23 118.95 117.88 1ny4 s ARG 17 Ca 0.00 -1.13 0.12 0.00 -0.52 0.00 0.00 55.73 54.20 1ny4 s ARG 17 Cb 0.00 -0.97 0.38 0.00 0.52 0.00 0.00 34.95 34.88 1ny4 s ARG 17 CO 0.00 0.20 0.93 -2.37 0.02 0.00 0.00 175.30 174.08 1ny4 n THR 18 N 0.87 0.18 -4.43 0.02 5.66 -1.19 -4.90 114.28 110.49 1ny4 n THR 18 Ca -0.18 -3.29 -0.25 0.00 -3.05 0.00 0.00 64.05 57.29 1ny4 n THR 18 Cb 0.55 0.44 -0.11 0.00 -1.55 0.00 0.00 70.33 69.67 1ny4 n THR 18 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1ny4 s GLY 19 N -2.27 1.75 0.20 1.09 0.00 -1.26 -4.73 107.32 102.11 1ny4 s GLY 19 Ca 0.31 -1.74 -0.19 0.00 0.00 0.00 0.00 44.72 43.10 1ny4 s GLY 19 CO -0.04 -1.80 1.58 -0.84 0.00 0.00 0.00 173.10 171.99 1ny4 h THR 20 N 2.73 0.13 0.00 0.90 2.02 -1.99 -2.81 112.91 113.88 1ny4 h THR 20 Ca -0.42 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.76 1ny4 h THR 20 Cb 1.23 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1ny4 h THR 20 CO 0.55 0.00 -1.34 0.41 0.37 0.00 0.00 175.52 175.51 1ny4 n THR 21 N -5.45 0.00 0.00 3.16 -1.04 -1.26 -5.00 114.28 104.69 1ny4 n THR 21 Ca 0.07 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 1ny4 n THR 21 Cb 0.37 0.38 0.00 0.00 -1.82 0.00 0.00 70.33 69.26 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 1.73 0.95 0.11 3.41 0.00 -1.06 -5.05 105.19 105.27 1ny4 n GLY 22 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 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 0.95 -4.82 1.61 9.92 -1.26 -4.91 116.55 118.05 1ny4 n ASP 23 Ca 0.00 -0.01 -0.34 0.00 -0.53 0.00 0.00 54.79 53.91 1ny4 n ASP 23 Cb 0.00 0.26 -0.07 0.00 -0.64 0.00 0.00 41.12 40.68 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 -2.51 4.45 -0.19 2.53 1.01 -1.26 -3.35 120.40 121.07 1ny4 s VAL 24 Ca -0.20 1.40 -0.03 0.00 0.00 0.00 0.00 61.98 63.15 1ny4 s VAL 24 Cb 0.07 -3.73 0.06 0.00 0.00 0.00 0.00 36.38 32.79 1ny4 s VAL 24 CO 0.74 -0.11 0.06 -0.89 0.00 0.00 0.00 175.10 174.89 1ny4 s THR 25 N -1.92 0.34 -0.04 3.92 2.01 0.12 -3.17 115.64 116.90 1ny4 s THR 25 Ca 0.55 -0.47 -0.16 0.00 0.31 0.00 0.00 61.69 61.92 1ny4 s THR 25 Cb -0.12 -0.91 -0.05 0.00 0.01 0.00 0.00 72.50 71.42 1ny4 s THR 25 CO 0.17 -0.26 0.43 -1.58 -0.69 0.00 0.00 174.62 172.70 1ny4 s GLN 26 N 1.94 4.08 0.05 4.92 0.74 -0.37 -1.19 119.66 129.84 1ny4 s GLN 26 Ca 0.00 0.43 -0.13 0.00 0.05 0.00 0.00 55.36 55.71 1ny4 s GLN 26 Cb -0.17 -3.30 0.02 0.00 1.10 0.00 0.00 33.01 30.66 1ny4 s GLN 26 CO -0.09 0.51 0.28 0.08 -0.55 0.00 0.00 175.29 175.51 1ny4 s VAL 27 N -0.49 0.09 -0.09 1.34 1.01 -0.15 -2.17 120.40 119.94 1ny4 s VAL 27 Ca 0.24 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.34 1ny4 s VAL 27 Cb -0.16 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 1ny4 s VAL 27 CO 0.12 -0.42 0.30 -0.54 0.00 0.00 0.00 175.10 174.56 1ny4 s LYS 28 N -2.76 3.94 -0.02 2.72 1.02 0.64 -0.35 119.74 124.93 1ny4 s LYS 28 Ca -0.04 0.15 0.01 0.00 0.02 0.00 0.00 55.97 56.12 1ny4 s LYS 28 Cb -0.00 -3.30 0.01 0.00 -0.52 0.00 0.00 37.83 34.02 1ny4 s LYS 28 CO -0.05 0.53 -0.03 0.14 -0.92 0.00 0.00 175.35 175.02 1ny4 s VAL 29 N -0.43 0.36 0.08 3.17 -7.23 0.10 -1.22 120.40 115.22 1ny4 s VAL 29 Ca 0.19 -0.11 -0.01 0.00 -1.81 0.00 0.00 61.98 60.23 1ny4 s VAL 29 Cb -0.14 -0.36 -0.04 0.00 0.56 0.00 0.00 36.38 36.39 1ny4 s VAL 29 CO 0.07 0.14 0.25 -0.60 -0.31 0.00 0.00 175.10 174.66 1ny4 s ARG 30 N 0.41 3.49 -0.39 4.82 3.52 0.13 -0.63 118.95 130.30 1ny4 s ARG 30 Ca -0.04 -0.34 -0.29 0.00 -0.13 0.00 0.00 55.73 54.93 1ny4 s ARG 30 Cb -0.08 -2.99 0.01 0.00 -1.56 0.00 0.00 34.95 30.32 1ny4 s ARG 30 CO -0.00 0.58 1.39 0.42 -0.81 0.00 0.00 175.30 176.88 1ny4 s ILE 31 N -1.54 3.95 0.15 4.11 -1.09 0.06 -0.52 121.20 126.31 1ny4 s ILE 31 Ca 0.36 0.99 -0.14 0.00 -2.23 0.00 0.00 60.65 59.63 1ny4 s ILE 31 Cb -0.13 -4.19 0.02 0.00 -1.58 0.00 0.00 42.46 36.59 1ny4 s ILE 31 CO 0.27 -0.69 1.66 -0.07 -1.23 0.00 0.00 174.94 174.87 1ny4 h LEU 32 N 11.92 0.71 -7.88 2.97 3.38 -1.71 0.76 115.31 125.47 1ny4 h LEU 32 Ca -0.27 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.49 1ny4 h LEU 32 Cb 1.10 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.59 1ny4 h LEU 32 CO 1.07 0.75 0.12 -0.70 0.09 0.00 0.00 178.44 179.77 1ny4 s GLU 33 N -5.34 1.60 0.00 1.13 2.56 -1.26 -4.55 118.70 112.85 1ny4 s GLU 33 Ca -0.13 -0.97 0.00 0.00 0.00 0.00 0.00 54.97 53.88 1ny4 s GLU 33 Cb 0.11 0.56 0.00 0.00 2.00 0.00 0.00 34.13 36.80 1ny4 s GLU 33 CO 0.79 -0.71 0.00 0.41 -0.56 0.00 0.00 175.26 175.19 1ny4 n GLY 34 N -0.41 0.63 0.13 -1.50 0.00 -1.26 -4.49 105.19 98.29 1ny4 n GLY 34 Ca -0.06 -0.87 -0.20 0.00 0.00 0.00 0.00 46.02 44.89 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 0.70 -0.02 1.61 1.74 -1.26 -4.52 116.66 114.92 1ny4 n ARG 35 Ca 0.00 0.22 -0.20 0.00 -0.77 0.00 0.00 57.85 57.10 1ny4 n ARG 35 Cb 0.00 -1.62 -0.14 0.00 -1.02 0.00 0.00 32.46 29.68 1ny4 n ARG 35 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ny4 n ASP 36 N -3.43 2.05 -2.91 0.55 2.03 -1.26 -5.03 116.55 108.55 1ny4 n ASP 36 Ca -0.39 0.16 -0.05 0.00 0.52 0.00 0.00 54.79 55.03 1ny4 n ASP 36 Cb 1.01 -0.75 0.01 0.00 -0.72 0.00 0.00 41.12 40.66 1ny4 n ASP 36 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1ny4 n LYS 37 N -3.43 -0.44 0.00 -0.67 0.00 -1.26 -4.54 118.16 107.82 1ny4 n LYS 37 Ca -0.34 0.75 0.00 0.00 0.00 0.00 0.00 58.31 58.73 1ny4 n LYS 37 Cb 1.04 -0.98 0.00 0.00 0.00 0.00 0.00 35.03 35.09 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 0.99 1.29 3.17 3.14 0.00 0.26 -4.91 105.19 109.14 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 -0.06 2.95 0.18 1.61 3.52 -1.25 -4.84 118.95 121.05 1ny4 s ARG 39 Ca 0.00 -0.88 -0.30 0.00 -0.13 0.00 0.00 55.73 54.42 1ny4 s ARG 39 Cb 0.00 -2.79 -0.07 0.00 -1.56 0.00 0.00 34.95 30.53 1ny4 s ARG 39 CO 0.00 -0.29 1.00 0.54 -0.81 0.00 0.00 175.30 175.74 1ny4 s VAL 40 N 1.32 4.14 0.31 7.11 0.11 -1.26 -0.76 120.40 131.36 1ny4 s VAL 40 Ca 0.03 1.92 0.06 0.00 -2.93 0.00 0.00 61.98 61.05 1ny4 s VAL 40 Cb -0.15 -4.22 -0.03 0.00 -1.53 0.00 0.00 36.38 30.45 1ny4 s VAL 40 CO -0.08 0.36 0.25 0.27 -3.33 0.00 0.00 175.10 172.57 1ny4 s ILE 41 N -0.47 0.00 -0.28 7.04 -4.36 0.20 -4.95 121.20 118.37 1ny4 s ILE 41 Ca 0.46 -1.99 0.00 0.00 -0.26 0.00 0.00 60.65 58.86 1ny4 s ILE 41 Cb -0.26 -2.50 0.08 0.00 1.25 0.00 0.00 42.46 41.03 1ny4 s ILE 41 CO 0.33 0.00 0.04 -0.60 0.24 0.00 0.00 174.94 174.95 1ny4 s ARG 42 N -3.58 1.09 -0.13 0.37 3.52 -1.26 -0.72 118.95 118.24 1ny4 s ARG 42 Ca 0.40 -1.12 -0.08 0.00 -0.13 0.00 0.00 55.73 54.81 1ny4 s ARG 42 Cb 0.03 -2.38 -0.04 0.00 -1.56 0.00 0.00 34.95 31.00 1ny4 s ARG 42 CO 0.25 -0.83 0.15 0.50 -0.81 0.00 0.00 175.30 174.55 1ny4 s ARG 43 N 1.46 3.54 -0.21 5.12 3.00 0.53 -4.92 118.95 127.46 1ny4 s ARG 43 Ca 0.04 -0.13 -0.03 0.00 -1.00 0.00 0.00 55.73 54.62 1ny4 s ARG 43 Cb -0.18 -3.22 -0.01 0.00 0.00 0.00 0.00 34.95 31.55 1ny4 s ARG 43 CO -0.15 0.72 -0.06 0.54 0.00 0.00 0.00 175.30 176.35 1ny4 s ASN 44 N -0.87 4.15 0.01 -2.12 2.20 -1.26 -0.98 114.94 116.08 1ny4 s ASN 44 Ca 0.14 -0.42 -0.08 0.00 -0.94 0.00 0.00 52.86 51.57 1ny4 s ASN 44 Cb -0.12 -1.71 0.00 0.00 -2.00 0.00 0.00 41.25 37.42 1ny4 s ASN 44 CO 0.04 -0.01 0.14 -0.69 -2.94 0.00 0.00 177.10 173.64 1ny4 s VAL 45 N 1.43 0.10 -0.10 3.54 1.01 -0.33 -4.94 120.40 121.10 1ny4 s VAL 45 Ca 0.05 -0.79 -0.26 0.00 0.00 0.00 0.00 61.98 60.98 1ny4 s VAL 45 Cb -0.14 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 1ny4 s VAL 45 CO -0.04 -0.43 0.84 -0.13 0.00 0.00 0.00 175.10 175.33 1ny4 s ARG 46 N -1.79 4.40 0.00 2.72 0.52 -1.26 0.12 118.95 123.67 1ny4 s ARG 46 Ca -0.12 1.09 0.00 0.00 -0.52 0.00 0.00 55.73 56.19 1ny4 s ARG 46 Cb -0.05 -3.51 0.00 0.00 0.52 0.00 0.00 34.95 31.91 1ny4 s ARG 46 CO -0.00 -0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.57 1ny4 n GLY 47 N 3.21 3.41 3.76 -3.53 0.00 -1.21 -4.90 105.19 105.92 1ny4 n GLY 47 Ca 0.03 -1.91 -0.30 0.00 0.00 0.00 0.00 46.02 43.85 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 -2.93 -0.36 0.21 1.61 0.04 -1.26 -4.58 135.00 127.73 1ny4 s PRO 48 Ca 0.00 -0.27 -0.21 0.00 0.04 0.00 0.00 61.00 60.56 1ny4 s PRO 48 Cb 0.00 -1.72 0.08 0.00 0.04 0.00 0.00 34.50 32.90 1ny4 s PRO 48 CO 0.00 -3.10 1.02 0.54 0.04 0.00 0.00 177.00 175.50 1ny4 s VAL 49 N -3.47 0.00 -0.15 -0.36 0.11 -1.26 -5.13 120.40 110.14 1ny4 s VAL 49 Ca 0.73 -0.62 -0.23 0.00 -2.93 0.00 0.00 61.98 58.94 1ny4 s VAL 49 Cb -0.06 -2.99 0.06 0.00 -1.53 0.00 0.00 36.38 31.86 1ny4 s VAL 49 CO 0.55 0.00 0.58 -0.13 -3.33 0.00 0.00 175.10 172.76 1ny4 s ARG 50 N -2.07 0.79 0.06 1.54 1.81 -1.26 -5.11 118.95 114.71 1ny4 s ARG 50 Ca 0.22 0.53 -0.37 0.00 -1.72 0.00 0.00 55.73 54.39 1ny4 s ARG 50 Cb -0.03 0.38 -0.17 0.00 -0.45 0.00 0.00 34.95 34.67 1ny4 s ARG 50 CO 0.06 -0.16 1.33 1.55 -0.68 0.00 0.00 175.30 177.40 1ny4 n VAL 51 N 2.06 0.02 0.00 3.52 3.14 -1.26 -1.39 118.33 124.41 1ny4 n VAL 51 Ca -0.16 -0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.22 1ny4 n VAL 51 Cb 0.56 -0.75 0.00 0.00 -1.06 0.00 0.00 33.84 32.59 1ny4 n VAL 51 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ny4 n GLY 52 N 2.50 1.68 3.63 7.55 0.00 -1.24 -5.01 105.19 114.31 1ny4 n GLY 52 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 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 1.18 -4.06 1.61 -0.08 -0.49 -4.63 116.55 110.08 1ny4 n ASP 53 Ca 0.00 0.90 -0.21 0.00 -1.51 0.00 0.00 54.79 53.97 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 -1.41 0.93 -0.01 5.18 1.01 -1.26 -0.97 121.20 124.67 1ny4 s ILE 54 Ca 0.71 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.88 1ny4 s ILE 54 Cb -0.46 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.22 1ny4 s ILE 54 CO 0.51 0.27 -0.03 -0.76 0.00 0.00 0.00 174.94 174.93 1ny4 s LEU 55 N -0.13 1.80 0.00 2.97 1.02 -0.31 -4.89 118.68 119.14 1ny4 s LEU 55 Ca 0.02 -0.07 0.00 0.00 0.02 0.00 0.00 54.13 54.10 1ny4 s LEU 55 Cb -0.06 -0.23 0.00 0.00 0.02 0.00 0.00 46.19 45.92 1ny4 s LEU 55 CO -0.00 0.02 0.00 -0.38 0.02 0.00 0.00 176.35 176.00 1ny4 n ILE 56 N 3.27 0.00 0.00 -0.59 5.41 -1.26 0.27 119.36 126.47 1ny4 n ILE 56 Ca -0.16 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.59 1ny4 n ILE 56 Cb 0.56 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.49 1ny4 n ILE 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ny4 n LEU 57 N 0.00 -0.56 -0.05 1.39 -0.00 -1.26 -4.78 117.00 111.73 1ny4 n LEU 57 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 56.01 55.81 1ny4 n LEU 57 Cb 0.00 0.60 -0.13 0.00 -0.00 0.00 0.00 43.42 43.89 1ny4 n LEU 57 CO 0.00 0.00 -1.01 0.54 -0.00 0.00 0.00 177.39 176.92 1ny4 n ARG 58 N 0.18 0.71 -0.60 1.47 1.74 -1.26 -3.99 116.66 114.91 1ny4 n ARG 58 Ca 0.00 0.23 0.46 0.00 -0.77 0.00 0.00 57.85 57.78 1ny4 n ARG 58 Cb 0.00 -1.64 0.71 0.00 -1.02 0.00 0.00 32.46 30.52 1ny4 n ARG 58 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1ny4 n GLU 59 N -3.45 0.00 -0.99 5.56 0.00 -1.26 -0.34 120.64 120.16 1ny4 n GLU 59 Ca -0.38 1.00 -0.12 0.00 0.00 0.00 0.00 57.16 57.66 1ny4 n GLU 59 Cb 1.01 -2.34 -0.14 0.00 0.00 0.00 0.00 31.44 29.97 1ny4 n GLU 59 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1ny4 n THR 60 N -3.69 2.93 0.01 6.31 5.66 -1.26 -4.07 114.28 120.18 1ny4 n THR 60 Ca 0.39 -1.52 -0.02 0.00 -3.05 0.00 0.00 64.05 59.84 1ny4 n THR 60 Cb 1.82 -1.92 -0.10 0.00 -1.55 0.00 0.00 70.33 68.58 1ny4 n THR 60 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1ny4 n GLU 61 N 2.27 0.63 -1.99 1.09 1.02 0.54 -5.07 120.64 119.13 1ny4 n GLU 61 Ca 0.39 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 1ny4 n GLU 61 Cb 0.85 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 1ny4 n GLU 61 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1ny4 n ARG 62 N -2.90 -4.53 -2.73 3.49 1.74 -1.26 -5.04 116.66 105.42 1ny4 n ARG 62 Ca -0.12 3.33 -0.08 0.00 -0.77 0.00 0.00 57.85 60.21 1ny4 n ARG 62 Cb 0.89 -3.84 0.06 0.00 -1.02 0.00 0.00 32.46 28.56 1ny4 n ARG 62 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1ny4 n GLU 63 N 1.57 0.73 -1.62 5.56 0.00 -1.26 -5.13 120.64 120.48 1ny4 n GLU 63 Ca 0.00 -1.61 -0.46 0.00 0.00 0.00 0.00 57.16 55.09 1ny4 n GLU 63 Cb 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 31.44 30.23 1ny4 n GLU 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ny4 n ALA 64 N 1.33 0.19 -0.23 4.31 0.00 -1.26 -4.85 120.51 120.00 1ny4 n ALA 64 Ca 0.07 0.42 -0.01 0.00 0.00 0.00 0.00 53.44 53.93 1ny4 n ALA 64 Cb 0.66 -2.14 0.21 0.00 0.00 0.00 0.00 19.45 18.18 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 3.43 1.03 -3.35 0.00 2.43 -2.07 -3.47 114.38 112.37 1ny4 h ARG 65 Ca -0.43 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1ny4 h ARG 65 Cb 1.31 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1ny4 h ARG 65 CO 0.70 0.72 -0.00 -1.91 -1.51 0.00 0.00 179.97 177.96 1ny4 n GLU 66 N -4.39 -0.21 -2.99 0.20 2.13 -1.26 -5.08 120.64 109.04 1ny4 n GLU 66 Ca 0.08 0.66 -0.20 0.00 0.66 0.00 0.00 57.16 58.36 1ny4 n GLU 66 Cb 0.06 -2.14 0.06 0.00 0.27 0.00 0.00 31.44 29.69 1ny4 n GLU 66 CO 0.00 0.00 0.00 0.96 -0.41 0.00 0.00 177.13 177.68 1ny4 s ILE 67 N -2.89 2.27 -0.37 6.31 -5.25 -1.26 -5.07 121.20 114.93 1ny4 s ILE 67 Ca 0.00 -0.96 0.05 0.00 -0.99 0.00 0.00 60.65 58.75 1ny4 s ILE 67 Cb -0.00 -2.31 0.32 0.00 2.95 0.00 0.00 42.46 43.42 1ny4 s ILE 67 CO 0.11 0.00 1.30 1.17 -1.79 0.00 0.00 174.94 175.73 1ny4 n LYS 68 N -2.24 0.46 -3.56 0.37 3.00 -1.26 -5.13 118.16 109.80 1ny4 n LYS 68 Ca 0.14 -1.14 -0.39 0.00 -0.00 0.00 0.00 58.31 56.93 1ny4 n LYS 68 Cb 0.61 -0.47 -0.11 0.00 0.00 0.00 0.00 35.03 35.06 1ny4 n LYS 68 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1ny4 s SER 69 N -0.58 6.04 -0.14 3.14 0.01 -1.26 -5.05 113.70 115.86 1ny4 s SER 69 Ca 0.21 -0.12 -0.09 0.00 1.31 0.00 0.00 55.95 57.26 1ny4 s SER 69 Cb 0.29 -2.13 0.05 0.00 0.21 0.00 0.00 66.02 64.44 1ny4 s SER 69 CO -0.15 -0.11 0.35 -0.60 0.41 0.00 0.00 173.24 173.14 1ny4 s ARG 70 N 1.76 0.35 0.00 12.44 3.52 -1.26 -5.33 118.95 130.42 1ny4 s ARG 70 Ca 0.07 0.62 0.26 0.00 -0.13 0.00 0.00 55.73 56.55 1ny4 s ARG 70 Cb -0.16 0.02 0.60 0.00 -1.56 0.00 0.00 34.95 33.85 1ny4 s ARG 70 CO 0.11 -0.13 1.49 -2.13 -0.81 0.00 0.00 175.30 173.84