#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ny4 h ALA 2 N 0.00 0.02 -0.56 3.04 0.00 -2.10 -3.45 119.26 116.21 1ny4 h ALA 2 Ca 0.00 -0.34 -0.71 0.00 0.00 0.00 0.00 54.91 53.86 1ny4 h ALA 2 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ny4 h ALA 2 CO 0.00 0.11 0.75 -0.85 0.00 0.00 0.00 179.25 179.26 1ny4 n GLU 3 N -4.67 0.00 -0.28 0.00 0.28 -1.26 -4.75 120.64 109.95 1ny4 n GLU 3 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.93 1ny4 n GLU 3 Cb 0.26 -1.26 0.00 0.00 1.43 0.00 0.00 31.44 31.87 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 4.32 0.00 -0.10 -1.84 8.00 -1.26 -4.96 116.55 120.71 1ny4 n ASP 4 Ca 0.33 -1.57 -0.01 0.00 0.71 0.00 0.00 54.79 54.25 1ny4 n ASP 4 Cb -0.04 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.12 40.94 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 -0.00 -1.20 -2.51 -1.24 1.02 -1.26 -4.89 120.64 110.55 1ny4 n GLU 5 Ca 0.00 0.37 -0.41 0.00 -0.02 0.00 0.00 57.16 57.10 1ny4 n GLU 5 Cb 0.61 -4.31 -0.01 0.00 -0.02 0.00 0.00 31.44 27.71 1ny4 n GLU 5 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1ny4 s GLY 6 N -2.09 1.41 -0.31 0.62 0.00 -1.26 -4.66 107.32 101.03 1ny4 s GLY 6 Ca 0.00 -2.74 -0.29 0.00 0.00 0.00 0.00 44.72 41.70 1ny4 s GLY 6 CO 0.00 2.82 1.52 -0.19 0.00 0.00 0.00 173.10 177.25 1ny4 s TYR 7 N 5.14 2.27 0.36 1.90 2.02 -1.25 -4.86 117.35 122.92 1ny4 s TYR 7 Ca 0.55 0.67 -0.26 0.00 -0.37 0.00 0.00 57.07 57.66 1ny4 s TYR 7 Cb 0.03 -4.08 -0.09 0.00 -0.40 0.00 0.00 41.96 37.42 1ny4 s TYR 7 CO 0.06 -2.39 1.06 -1.25 -1.57 0.00 0.00 175.55 171.46 1ny4 s PRO 8 N 4.79 4.33 -0.03 -1.71 0.04 -1.26 -1.47 135.00 139.68 1ny4 s PRO 8 Ca 0.66 1.61 0.03 0.00 0.04 0.00 0.00 61.00 63.34 1ny4 s PRO 8 Cb -0.19 -2.77 0.00 0.00 0.04 0.00 0.00 34.50 31.58 1ny4 s PRO 8 CO 0.29 -0.02 -0.11 0.00 0.04 0.00 0.00 177.00 177.21 1ny4 s ALA 9 N -1.49 1.06 -0.17 8.56 0.00 0.14 -2.27 121.76 127.60 1ny4 s ALA 9 Ca 0.53 -0.44 -0.01 0.00 0.00 0.00 0.00 51.96 52.04 1ny4 s ALA 9 Cb -0.25 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 1ny4 s ALA 9 CO 0.32 0.18 -0.11 -2.00 0.00 0.00 0.00 175.76 174.15 1ny4 s GLU 10 N 0.15 3.31 0.19 0.00 2.12 0.95 -0.34 118.70 125.08 1ny4 s GLU 10 Ca -0.03 -0.69 -0.33 0.00 0.36 0.00 0.00 54.97 54.28 1ny4 s GLU 10 Cb -0.09 -2.74 -0.15 0.00 0.26 0.00 0.00 34.13 31.40 1ny4 s GLU 10 CO 0.01 0.00 1.30 0.28 -0.54 0.00 0.00 175.26 176.31 1ny4 n VAL 11 N 4.13 0.77 -0.03 3.70 0.31 -0.28 -0.74 118.33 126.19 1ny4 n VAL 11 Ca -0.19 -0.19 -0.04 0.00 -0.01 0.00 0.00 64.34 63.91 1ny4 n VAL 11 Cb 0.52 -1.12 -0.04 0.00 -0.91 0.00 0.00 33.84 32.29 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 1.87 0.41 -3.60 2.52 -5.35 -0.52 -3.56 119.36 111.13 1ny4 n ILE 12 Ca 0.14 -0.20 -0.13 0.00 -0.27 0.00 0.00 62.75 62.29 1ny4 n ILE 12 Cb 0.27 -0.80 -0.07 0.00 -1.74 0.00 0.00 39.64 37.30 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 -2.14 0.78 -0.07 6.28 2.56 -1.21 -5.02 118.70 119.89 1ny4 s GLU 13 Ca -0.07 0.65 -0.10 0.00 0.00 0.00 0.00 54.97 55.45 1ny4 s GLU 13 Cb 0.02 0.38 -0.05 0.00 2.00 0.00 0.00 34.13 36.48 1ny4 s GLU 13 CO 0.20 -0.15 0.25 0.42 -0.56 0.00 0.00 175.26 175.42 1ny4 s ILE 14 N -0.17 5.30 0.00 -3.70 1.01 -1.26 -0.33 121.20 122.06 1ny4 s ILE 14 Ca -0.02 0.47 0.00 0.00 0.00 0.00 0.00 60.65 61.10 1ny4 s ILE 14 Cb -0.03 -3.53 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1ny4 s ILE 14 CO 0.01 0.60 0.00 -0.38 0.00 0.00 0.00 174.94 175.17 1ny4 n ILE 15 N 1.89 0.00 -3.91 2.92 5.41 -0.96 -4.92 119.36 119.80 1ny4 n ILE 15 Ca -0.17 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.58 1ny4 n ILE 15 Cb 0.54 -0.68 0.00 0.00 -0.71 0.00 0.00 39.64 38.79 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 2.57 0.46 3.98 7.39 0.00 -1.04 -5.01 105.19 113.54 1ny4 n GLY 16 Ca 0.00 -0.80 -0.18 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.84 2.79 -0.31 1.61 0.52 -1.26 0.19 118.95 120.66 1ny4 s ARG 17 Ca 0.00 -1.29 0.07 0.00 -0.52 0.00 0.00 55.73 54.00 1ny4 s ARG 17 Cb 0.00 -2.68 0.27 0.00 0.52 0.00 0.00 34.95 33.07 1ny4 s ARG 17 CO 0.00 -0.22 1.24 -2.37 0.02 0.00 0.00 175.30 173.97 1ny4 n THR 18 N -1.76 0.00 -2.63 0.02 5.66 -0.95 -4.84 114.28 109.77 1ny4 n THR 18 Ca 0.06 -0.96 -0.26 0.00 -3.05 0.00 0.00 64.05 59.84 1ny4 n THR 18 Cb 0.60 0.84 -0.01 0.00 -1.55 0.00 0.00 70.33 70.21 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 -0.80 5.68 5.35 1.09 0.00 -1.26 -4.57 105.19 110.68 1ny4 n GLY 19 Ca -0.12 -2.70 0.00 0.00 0.00 0.00 0.00 46.02 43.20 1ny4 n GLY 19 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ny4 n THR 20 N -0.38 0.00 0.04 2.61 -1.04 -1.26 -1.84 114.28 112.41 1ny4 n THR 20 Ca 0.35 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.39 1ny4 n THR 20 Cb 0.59 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 69.02 1ny4 n THR 20 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1ny4 n THR 21 N 0.00 0.99 0.00 12.58 -1.04 -1.26 -4.92 114.28 120.63 1ny4 n THR 21 Ca 0.00 -0.66 0.00 0.00 -2.04 0.00 0.00 64.05 61.35 1ny4 n THR 21 Cb 0.00 -0.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.92 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 1.36 0.23 0.12 3.41 0.00 -0.76 -5.04 105.19 104.50 1ny4 n GLY 22 Ca -0.08 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.04 1ny4 n GLY 22 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ny4 h ASP 23 N 0.00 0.00 -3.19 1.61 5.19 -1.80 -3.46 116.42 114.77 1ny4 h ASP 23 Ca 0.00 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.77 1ny4 h ASP 23 Cb 0.00 0.00 -0.10 0.00 0.18 0.00 0.00 39.33 39.41 1ny4 h ASP 23 CO 0.00 0.07 -0.60 -0.69 -3.12 0.00 0.00 179.24 174.90 1ny4 s VAL 24 N -3.30 4.50 -0.31 -1.35 1.01 -1.26 -3.74 120.40 115.95 1ny4 s VAL 24 Ca -0.00 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 1ny4 s VAL 24 Cb 0.09 -3.14 0.12 0.00 0.00 0.00 0.00 36.38 33.45 1ny4 s VAL 24 CO 0.79 0.18 0.20 -0.89 0.00 0.00 0.00 175.10 175.37 1ny4 s THR 25 N -1.33 -0.11 0.24 3.92 2.01 0.13 -2.25 115.64 118.25 1ny4 s THR 25 Ca 0.27 -0.92 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 1ny4 s THR 25 Cb -0.12 -0.99 -0.09 0.00 0.01 0.00 0.00 72.50 71.31 1ny4 s THR 25 CO 0.20 -0.73 0.99 -1.58 -0.69 0.00 0.00 174.62 172.82 1ny4 s GLN 26 N 1.89 4.78 -0.03 4.92 0.74 0.50 -1.50 119.66 130.95 1ny4 s GLN 26 Ca 0.12 1.59 -0.20 0.00 0.05 0.00 0.00 55.36 56.91 1ny4 s GLN 26 Cb -0.17 -3.26 0.04 0.00 1.10 0.00 0.00 33.01 30.72 1ny4 s GLN 26 CO -0.26 0.40 0.44 0.54 -0.55 0.00 0.00 175.29 175.85 1ny4 s VAL 27 N -1.08 0.04 -0.12 1.34 0.11 -0.32 -2.26 120.40 118.11 1ny4 s VAL 27 Ca 0.43 -0.30 -0.15 0.00 -2.93 0.00 0.00 61.98 59.03 1ny4 s VAL 27 Cb -0.28 -0.74 -0.05 0.00 -1.53 0.00 0.00 36.38 33.78 1ny4 s VAL 27 CO 0.35 -0.17 0.36 -0.54 -3.33 0.00 0.00 175.10 171.77 1ny4 s LYS 28 N -1.23 4.18 -0.01 1.54 1.02 0.55 -0.23 119.74 125.57 1ny4 s LYS 28 Ca -0.12 0.25 0.07 0.00 0.02 0.00 0.00 55.97 56.19 1ny4 s LYS 28 Cb -0.03 -3.38 -0.02 0.00 -0.52 0.00 0.00 37.83 33.88 1ny4 s LYS 28 CO 0.06 0.33 -0.23 0.14 -0.92 0.00 0.00 175.35 174.73 1ny4 s VAL 29 N 0.15 1.82 0.03 3.17 -7.23 -0.15 -1.43 120.40 116.77 1ny4 s VAL 29 Ca 0.20 -1.03 0.02 0.00 -1.81 0.00 0.00 61.98 59.37 1ny4 s VAL 29 Cb -0.14 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.24 1ny4 s VAL 29 CO 0.07 0.48 0.03 -0.60 -0.31 0.00 0.00 175.10 174.78 1ny4 s ARG 30 N -0.64 2.81 -0.67 4.82 3.52 0.08 -0.92 118.95 127.95 1ny4 s ARG 30 Ca 0.09 -0.65 -0.27 0.00 -0.13 0.00 0.00 55.73 54.77 1ny4 s ARG 30 Cb -0.09 -2.69 0.01 0.00 -1.56 0.00 0.00 34.95 30.61 1ny4 s ARG 30 CO -0.00 0.60 1.55 0.42 -0.81 0.00 0.00 175.30 177.06 1ny4 s ILE 31 N -1.22 3.55 0.29 4.11 -1.09 0.14 -0.03 121.20 126.96 1ny4 s ILE 31 Ca 0.23 0.32 0.03 0.00 -2.23 0.00 0.00 60.65 59.01 1ny4 s ILE 31 Cb -0.12 -4.45 0.29 0.00 -1.58 0.00 0.00 42.46 36.60 1ny4 s ILE 31 CO 0.15 -1.40 1.82 0.25 -1.23 0.00 0.00 174.94 174.53 1ny4 h LEU 32 N 14.60 0.89 -7.58 2.97 6.46 -1.78 0.13 115.31 131.00 1ny4 h LEU 32 Ca -0.27 0.06 0.23 0.00 -0.12 0.00 0.00 57.88 57.78 1ny4 h LEU 32 Cb 1.10 -0.11 -0.09 0.00 -0.73 0.00 0.00 40.66 40.84 1ny4 h LEU 32 CO 1.25 0.42 0.63 -0.70 -0.62 0.00 0.00 178.44 179.42 1ny4 s GLU 33 N -5.92 0.93 0.00 1.25 2.12 -1.26 -4.68 118.70 111.13 1ny4 s GLU 33 Ca -0.12 -0.53 0.00 0.00 0.36 0.00 0.00 54.97 54.68 1ny4 s GLU 33 Cb 0.23 0.30 0.00 0.00 0.26 0.00 0.00 34.13 34.93 1ny4 s GLU 33 CO 0.81 -0.43 0.00 0.41 -0.54 0.00 0.00 175.26 175.51 1ny4 n GLY 34 N -0.53 1.00 3.72 -1.50 0.00 -1.26 -4.40 105.19 102.23 1ny4 n GLY 34 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.78 1.61 0.00 -1.26 -4.60 116.66 111.63 1ny4 n ARG 35 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.70 1ny4 n ARG 35 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 32.46 32.57 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 2.54 3.64 -4.50 6.15 8.00 -1.26 -4.89 116.55 126.22 1ny4 n ASP 36 Ca 0.00 -3.02 -0.16 0.00 0.71 0.00 0.00 54.79 52.32 1ny4 n ASP 36 Cb 0.00 -0.73 -0.13 0.00 -0.02 0.00 0.00 41.12 40.24 1ny4 n ASP 36 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1ny4 n LYS 37 N -0.51 0.28 0.00 -1.24 2.85 -1.26 0.11 118.16 118.39 1ny4 n LYS 37 Ca 0.38 -0.55 0.00 0.00 -1.05 0.00 0.00 58.31 57.09 1ny4 n LYS 37 Cb 1.21 -2.54 0.00 0.00 -0.65 0.00 0.00 35.03 33.04 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 6.13 1.95 3.70 2.58 0.00 0.44 -4.93 105.19 115.05 1ny4 n GLY 38 Ca 0.51 -0.14 -0.55 0.00 0.00 0.00 0.00 46.02 45.84 1ny4 n GLY 38 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ny4 n ARG 39 N 0.00 1.42 -4.10 1.61 0.63 0.30 -4.35 116.66 112.17 1ny4 n ARG 39 Ca 0.00 0.52 -0.31 0.00 -0.92 0.00 0.00 57.85 57.14 1ny4 n ARG 39 Cb 0.00 -2.25 -0.07 0.00 0.45 0.00 0.00 32.46 30.59 1ny4 n ARG 39 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1ny4 s VAL 40 N 3.75 4.44 0.28 5.15 0.11 -1.26 0.29 120.40 133.15 1ny4 s VAL 40 Ca 0.97 -0.71 -0.05 0.00 -2.93 0.00 0.00 61.98 59.27 1ny4 s VAL 40 Cb -0.97 -3.10 -0.01 0.00 -1.53 0.00 0.00 36.38 30.77 1ny4 s VAL 40 CO 0.62 0.20 0.38 0.27 -3.33 0.00 0.00 175.10 173.25 1ny4 s ILE 41 N -1.30 0.00 -0.44 7.04 -4.36 -0.10 -5.00 121.20 117.04 1ny4 s ILE 41 Ca 0.26 -1.65 -0.07 0.00 -0.26 0.00 0.00 60.65 58.93 1ny4 s ILE 41 Cb -0.12 -2.45 0.11 0.00 1.25 0.00 0.00 42.46 41.25 1ny4 s ILE 41 CO 0.18 0.00 0.28 -0.13 0.24 0.00 0.00 174.94 175.52 1ny4 s ARG 42 N -3.66 2.33 -0.21 0.37 3.00 -1.26 -0.97 118.95 118.54 1ny4 s ARG 42 Ca 0.30 -1.75 -0.11 0.00 0.00 0.00 0.00 55.73 54.17 1ny4 s ARG 42 Cb 0.01 -3.79 -0.05 0.00 0.00 0.00 0.00 34.95 31.13 1ny4 s ARG 42 CO 0.15 -1.12 0.19 1.03 0.00 0.00 0.00 175.30 175.55 1ny4 s ARG 43 N 1.29 4.15 -0.22 3.54 1.81 0.69 -4.92 118.95 125.28 1ny4 s ARG 43 Ca 0.06 -0.15 -0.10 0.00 -1.72 0.00 0.00 55.73 53.82 1ny4 s ARG 43 Cb -0.25 -3.48 -0.05 0.00 -0.45 0.00 0.00 34.95 30.72 1ny4 s ARG 43 CO -0.02 0.16 0.14 0.54 -0.68 0.00 0.00 175.30 175.44 1ny4 s ASN 44 N 0.74 6.08 0.07 0.23 2.20 -1.26 -1.18 114.94 121.82 1ny4 s ASN 44 Ca 0.10 0.14 0.02 0.00 -0.94 0.00 0.00 52.86 52.18 1ny4 s ASN 44 Cb -0.13 -2.08 -0.03 0.00 -2.00 0.00 0.00 41.25 37.01 1ny4 s ASN 44 CO 0.02 0.11 -0.07 -0.69 -2.94 0.00 0.00 177.10 173.53 1ny4 s VAL 45 N 0.80 0.64 -0.09 3.54 1.01 -0.56 -4.97 120.40 120.77 1ny4 s VAL 45 Ca 0.07 -1.49 -0.21 0.00 0.00 0.00 0.00 61.98 60.35 1ny4 s VAL 45 Cb -0.13 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1ny4 s VAL 45 CO 0.02 -0.61 0.59 -0.13 0.00 0.00 0.00 175.10 174.97 1ny4 s ARG 46 N -2.65 4.39 0.00 2.72 0.52 -1.26 0.22 118.95 122.89 1ny4 s ARG 46 Ca 0.01 0.66 0.00 0.00 -0.52 0.00 0.00 55.73 55.88 1ny4 s ARG 46 Cb -0.03 -3.44 0.00 0.00 0.52 0.00 0.00 34.95 32.00 1ny4 s ARG 46 CO -0.02 0.12 0.00 0.41 0.02 0.00 0.00 175.30 175.83 1ny4 n GLY 47 N 3.16 -2.10 0.48 -3.53 0.00 -1.24 -4.91 105.19 97.04 1ny4 n GLY 47 Ca -0.04 -2.19 -0.04 0.00 0.00 0.00 0.00 46.02 43.75 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 -0.31 -0.72 -3.79 1.61 -0.04 -1.26 -4.41 135.00 126.08 1ny4 n PRO 48 Ca 0.00 -0.25 -0.02 0.00 -0.04 0.00 0.00 63.50 63.19 1ny4 n PRO 48 Cb 0.00 -0.19 0.00 0.00 -0.04 0.00 0.00 33.50 33.27 1ny4 n PRO 48 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ny4 s VAL 49 N -1.32 0.00 -0.21 0.52 0.11 -1.26 -5.07 120.40 113.18 1ny4 s VAL 49 Ca 0.10 -0.54 -0.16 0.00 -2.93 0.00 0.00 61.98 58.45 1ny4 s VAL 49 Cb -0.01 -2.36 0.06 0.00 -1.53 0.00 0.00 36.38 32.54 1ny4 s VAL 49 CO 0.07 0.00 0.54 -0.13 -3.33 0.00 0.00 175.10 172.25 1ny4 s ARG 50 N -2.67 0.59 0.14 1.54 0.52 -1.26 -5.11 118.95 112.69 1ny4 s ARG 50 Ca 0.17 0.84 -0.34 0.00 -0.52 0.00 0.00 55.73 55.88 1ny4 s ARG 50 Cb -0.01 0.21 -0.16 0.00 0.52 0.00 0.00 34.95 35.51 1ny4 s ARG 50 CO 0.02 -0.11 1.26 1.55 0.02 0.00 0.00 175.30 178.04 1ny4 n VAL 51 N 3.37 0.51 0.00 3.52 3.14 -1.26 -1.34 118.33 126.26 1ny4 n VAL 51 Ca -0.17 -0.13 0.00 0.00 -2.96 0.00 0.00 64.34 61.09 1ny4 n VAL 51 Cb 0.56 -0.88 0.00 0.00 -1.06 0.00 0.00 33.84 32.47 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 2.27 2.58 3.59 7.55 0.00 -1.23 -5.00 105.19 114.94 1ny4 n GLY 52 Ca 0.16 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.63 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 1.30 -4.25 1.61 2.03 -0.45 -4.54 116.55 112.25 1ny4 n ASP 53 Ca 0.00 1.13 -0.36 0.00 0.52 0.00 0.00 54.79 56.08 1ny4 n ASP 53 Cb 0.00 -1.10 -0.13 0.00 -0.72 0.00 0.00 41.12 39.17 1ny4 n ASP 53 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ny4 s ILE 54 N 0.84 3.43 -0.02 5.18 -1.09 -1.26 -1.12 121.20 127.16 1ny4 s ILE 54 Ca 0.89 -1.07 0.03 0.00 -2.23 0.00 0.00 60.65 58.27 1ny4 s ILE 54 Cb -1.07 -2.87 -0.00 0.00 -1.58 0.00 0.00 42.46 36.94 1ny4 s ILE 54 CO 0.53 -0.02 -0.10 -0.22 -1.23 0.00 0.00 174.94 173.90 1ny4 s LEU 55 N 1.37 1.87 0.07 2.97 0.20 0.54 -4.91 118.68 120.79 1ny4 s LEU 55 Ca -0.01 -0.20 -0.08 0.00 0.69 0.00 0.00 54.13 54.52 1ny4 s LEU 55 Cb -0.18 -0.59 -0.05 0.00 -0.43 0.00 0.00 46.19 44.94 1ny4 s LEU 55 CO 0.00 0.09 0.36 -0.63 -0.29 0.00 0.00 176.35 175.89 1ny4 s ILE 56 N 0.04 5.16 -0.03 6.68 1.01 -1.26 0.26 121.20 133.05 1ny4 s ILE 56 Ca -0.01 0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.96 1ny4 s ILE 56 Cb -0.07 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.81 1ny4 s ILE 56 CO 0.00 0.28 0.06 -1.48 0.00 0.00 0.00 174.94 173.80 1ny4 s LEU 57 N -1.96 1.00 -0.21 2.97 0.05 -0.54 -4.95 118.68 115.04 1ny4 s LEU 57 Ca 0.33 0.10 -0.12 0.00 0.05 0.00 0.00 54.13 54.48 1ny4 s LEU 57 Cb -0.14 0.03 -0.19 0.00 -2.05 0.00 0.00 46.19 43.84 1ny4 s LEU 57 CO 0.18 -0.13 0.07 -1.14 -0.55 0.00 0.00 176.35 174.78 1ny4 n ARG 58 N 4.18 0.64 -2.94 1.48 0.00 -1.26 -3.91 116.66 114.85 1ny4 n ARG 58 Ca -0.28 0.36 -0.23 0.00 -0.00 0.00 0.00 57.85 57.71 1ny4 n ARG 58 Cb 0.50 -1.65 0.01 0.00 0.00 0.00 0.00 32.46 31.33 1ny4 n ARG 58 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 1ny4 s GLU 59 N -2.47 3.01 0.00 -0.14 2.12 -1.26 -4.27 118.70 115.69 1ny4 s GLU 59 Ca -0.30 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 54.51 1ny4 s GLU 59 Cb 0.09 -2.55 0.00 0.00 0.26 0.00 0.00 34.13 31.93 1ny4 s GLU 59 CO 0.62 -0.32 0.00 -2.37 -0.54 0.00 0.00 175.26 172.65 1ny4 n THR 60 N -2.11 0.00 -0.04 -1.70 5.66 -1.26 -4.89 114.28 109.95 1ny4 n THR 60 Ca 0.02 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.86 1ny4 n THR 60 Cb 0.58 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.22 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 -2.71 0.70 -3.59 1.09 0.28 -1.26 -4.90 120.64 110.24 1ny4 n GLU 61 Ca 0.00 0.22 -0.37 0.00 -0.16 0.00 0.00 57.16 56.85 1ny4 n GLU 61 Cb 0.00 -1.68 -0.06 0.00 1.43 0.00 0.00 31.44 31.13 1ny4 n GLU 61 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1ny4 s ARG 62 N -2.56 3.79 0.09 3.44 3.52 -1.26 -5.09 118.95 120.88 1ny4 s ARG 62 Ca -0.18 0.26 0.02 0.00 -0.13 0.00 0.00 55.73 55.70 1ny4 s ARG 62 Cb 0.07 -3.18 -0.04 0.00 -1.56 0.00 0.00 34.95 30.25 1ny4 s ARG 62 CO 0.77 0.69 -0.08 -2.00 -0.81 0.00 0.00 175.30 173.87 1ny4 s GLU 63 N -1.21 0.78 0.06 5.12 2.56 -1.26 -5.02 118.70 119.73 1ny4 s GLU 63 Ca 0.23 -1.18 0.00 0.00 0.00 0.00 0.00 54.97 54.03 1ny4 s GLU 63 Cb -0.15 -0.32 0.00 0.00 2.00 0.00 0.00 34.13 35.66 1ny4 s GLU 63 CO 0.12 0.02 0.00 0.00 -0.56 0.00 0.00 175.26 174.85 1ny4 n ALA 64 N 0.40 0.00 0.00 6.30 0.00 -1.26 -5.05 120.51 120.90 1ny4 n ALA 64 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1ny4 n ALA 64 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1ny4 n ALA 64 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1ny4 n ARG 65 N -2.46 0.00 -2.61 0.00 0.00 -1.26 -4.64 116.66 105.69 1ny4 n ARG 65 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1ny4 n ARG 65 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1ny4 n ARG 65 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1ny4 n GLU 66 N 0.00 -0.95 -0.16 -0.14 2.13 -1.26 -4.94 120.64 115.33 1ny4 n GLU 66 Ca 0.00 1.21 -0.11 0.00 0.66 0.00 0.00 57.16 58.92 1ny4 n GLU 66 Cb 0.00 -4.55 -0.00 0.00 0.27 0.00 0.00 31.44 27.16 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 0.32 1.27 -6.82 6.31 3.07 -2.07 -3.47 117.51 116.12 1ny4 h ILE 67 Ca -0.00 -1.28 -0.57 0.00 1.55 0.00 0.00 64.86 64.56 1ny4 h ILE 67 Cb 1.00 1.12 -0.01 0.00 -0.27 0.00 0.00 36.82 38.66 1ny4 h ILE 67 CO 0.21 0.44 -1.00 1.17 -1.05 0.00 0.00 178.15 177.93 1ny4 n LYS 68 N -4.21 -0.49 -2.85 0.16 4.81 -1.26 -4.88 118.16 109.43 1ny4 n LYS 68 Ca -0.00 0.14 -0.38 0.00 -0.87 0.00 0.00 58.31 57.20 1ny4 n LYS 68 Cb 0.41 -2.88 -0.06 0.00 0.02 0.00 0.00 35.03 32.52 1ny4 n LYS 68 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1ny4 s SER 69 N -3.58 7.35 0.09 3.14 0.01 -1.26 -5.05 113.70 114.40 1ny4 s SER 69 Ca 0.46 1.76 -0.26 0.00 1.31 0.00 0.00 55.95 59.22 1ny4 s SER 69 Cb -0.24 -2.55 0.08 0.00 0.21 0.00 0.00 66.02 63.53 1ny4 s SER 69 CO 0.96 0.02 0.85 -0.60 0.41 0.00 0.00 173.24 174.88 1ny4 s ARG 70 N -1.77 1.07 0.00 12.44 3.52 -1.26 -5.30 118.95 127.65 1ny4 s ARG 70 Ca 0.46 -0.48 0.00 0.00 -0.13 0.00 0.00 55.73 55.58 1ny4 s ARG 70 Cb -0.20 0.44 0.00 0.00 -1.56 0.00 0.00 34.95 33.63 1ny4 s ARG 70 CO 0.25 -0.48 0.03 -2.13 -0.81 0.00 0.00 175.30 172.17