#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl5 n SER 2 N 0.00 0.75 0.03 1.61 7.64 -1.26 -4.87 113.62 117.52 2dl5 n SER 2 Ca 0.00 1.15 -0.01 0.00 1.01 0.00 0.00 58.87 61.02 2dl5 n SER 2 Cb 0.00 -1.00 -0.00 0.00 -1.01 0.00 0.00 64.21 62.20 2dl5 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dl5 n SER 3 N 2.39 1.15 0.00 6.43 2.88 -1.26 -5.16 113.62 120.06 2dl5 n SER 3 Ca 0.22 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.91 2dl5 n SER 3 Cb 0.09 -0.37 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 2dl5 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dl5 n GLY 4 N 3.23 2.30 3.68 0.46 0.00 -1.26 -5.10 105.19 108.50 2dl5 n GLY 4 Ca -0.02 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.38 2dl5 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dl5 s SER 5 N 0.00 6.51 0.61 1.61 0.01 -1.26 -4.99 113.70 116.19 2dl5 s SER 5 Ca 0.00 2.61 0.06 0.00 1.31 0.00 0.00 55.95 59.93 2dl5 s SER 5 Cb 0.00 -2.56 0.09 0.00 0.21 0.00 0.00 66.02 63.76 2dl5 s SER 5 CO 0.00 -0.96 0.84 -0.44 0.41 0.00 0.00 173.24 173.09 2dl5 s SER 6 N 2.89 4.90 0.00 2.44 0.01 -1.26 -5.02 113.70 117.65 2dl5 s SER 6 Ca 0.79 -0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.43 2dl5 s SER 6 Cb -0.42 0.08 0.00 0.00 0.21 0.00 0.00 66.02 65.88 2dl5 s SER 6 CO 0.35 -1.46 0.00 0.61 0.41 0.00 0.00 173.24 173.15 2dl5 n GLY 7 N -2.41 1.53 0.00 3.44 0.00 -1.26 -4.92 105.19 101.57 2dl5 n GLY 7 Ca 0.15 -1.22 0.09 0.00 0.00 0.00 0.00 46.02 45.04 2dl5 n GLY 7 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dl5 n THR 8 N -1.11 0.00 -3.88 2.61 -2.24 -1.26 -4.70 114.28 103.70 2dl5 n THR 8 Ca 0.00 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 2dl5 n THR 8 Cb 0.00 -0.70 -0.06 0.00 -2.10 0.00 0.00 70.33 67.46 2dl5 n THR 8 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2dl5 s LEU 9 N -1.98 4.36 0.75 3.22 1.43 -1.26 -5.06 118.68 120.13 2dl5 s LEU 9 Ca 0.27 0.44 -0.17 0.00 -1.03 0.00 0.00 54.13 53.65 2dl5 s LEU 9 Cb 0.12 -2.06 -0.12 0.00 0.03 0.00 0.00 46.19 44.16 2dl5 s LEU 9 CO 0.21 0.39 -0.22 0.54 0.23 0.00 0.00 176.35 177.50 2dl5 n ARG 10 N 2.09 0.05 -3.87 1.70 1.74 -1.26 -4.94 116.66 112.17 2dl5 n ARG 10 Ca -0.20 0.03 -0.29 0.00 -0.77 0.00 0.00 57.85 56.62 2dl5 n ARG 10 Cb 0.55 -1.21 -0.13 0.00 -1.02 0.00 0.00 32.46 30.65 2dl5 n ARG 10 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2dl5 s ASN 11 N -1.14 4.40 0.65 0.55 2.47 -1.26 -5.02 114.94 115.59 2dl5 s ASN 11 Ca 0.52 -3.48 -0.16 0.00 0.42 0.00 0.00 52.86 50.16 2dl5 s ASN 11 Cb -0.34 -1.53 -0.00 0.00 -1.45 0.00 0.00 41.25 37.93 2dl5 s ASN 11 CO 0.71 -0.14 1.15 -0.31 -3.72 0.00 0.00 177.10 174.78 2dl5 s TYR 12 N -0.90 2.45 0.88 0.43 2.02 -1.26 -4.42 117.35 116.55 2dl5 s TYR 12 Ca 0.22 1.56 -0.11 0.00 -0.37 0.00 0.00 57.07 58.37 2dl5 s TYR 12 Cb -0.12 -3.30 0.12 0.00 -0.40 0.00 0.00 41.96 38.26 2dl5 s TYR 12 CO -0.11 -1.97 1.09 -1.25 -1.57 0.00 0.00 175.55 171.75 2dl5 s PRO 13 N -3.82 1.35 -0.15 -1.71 0.04 -1.26 -5.10 135.00 124.35 2dl5 s PRO 13 Ca 0.71 0.85 -0.04 0.00 0.04 0.00 0.00 61.00 62.56 2dl5 s PRO 13 Cb -0.24 -1.82 0.07 0.00 0.04 0.00 0.00 34.50 32.55 2dl5 s PRO 13 CO 0.39 -2.18 0.19 -0.51 0.04 0.00 0.00 177.00 174.92 2dl5 s LEU 14 N -6.19 -0.06 -0.11 -3.56 1.43 0.82 -4.96 118.68 106.06 2dl5 s LEU 14 Ca 0.63 -0.00 -0.30 0.00 -1.03 0.00 0.00 54.13 53.43 2dl5 s LEU 14 Cb -0.18 0.30 -0.03 0.00 0.03 0.00 0.00 46.19 46.31 2dl5 s LEU 14 CO 0.57 -0.29 1.41 -0.89 0.23 0.00 0.00 176.35 177.37 2dl5 s THR 15 N 2.30 3.98 0.37 5.49 2.01 -1.26 -0.01 115.64 128.52 2dl5 s THR 15 Ca 0.05 1.21 0.08 0.00 0.31 0.00 0.00 61.69 63.33 2dl5 s THR 15 Cb -0.14 -3.78 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 2dl5 s THR 15 CO -0.09 -0.09 0.26 0.00 -0.69 0.00 0.00 174.62 174.01 2dl5 s LYS 17 N -3.98 1.39 -0.12 0.00 2.47 -0.72 -1.65 119.74 117.13 2dl5 s LYS 17 Ca 0.42 -1.02 -0.29 0.00 -1.56 0.00 0.00 55.97 53.51 2dl5 s LYS 17 Cb -0.03 -2.52 -0.06 0.00 -1.46 0.00 0.00 37.83 33.76 2dl5 s LYS 17 CO 0.25 -0.68 1.96 0.08 0.16 0.00 0.00 175.35 177.12 2dl5 s VAL 18 N 1.43 3.20 -0.14 4.02 1.01 -0.28 -1.70 120.40 127.94 2dl5 s VAL 18 Ca -0.02 0.22 0.15 0.00 0.00 0.00 0.00 61.98 62.34 2dl5 s VAL 18 Cb -0.18 -3.20 -0.21 0.00 0.00 0.00 0.00 36.38 32.78 2dl5 s VAL 18 CO -0.09 -0.08 0.11 1.33 0.00 0.00 0.00 175.10 176.37 2dl5 n VAL 19 N 6.55 0.93 -4.01 2.92 0.24 -1.20 -0.67 118.33 123.09 2dl5 n VAL 19 Ca 0.23 -0.64 -0.33 0.00 -2.04 0.00 0.00 64.34 61.55 2dl5 n VAL 19 Cb 0.44 -0.45 -0.15 0.00 -1.47 0.00 0.00 33.84 32.21 2dl5 n VAL 19 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2dl5 s TYR 20 N -2.54 3.17 0.67 6.34 1.51 -1.24 -4.71 117.35 120.56 2dl5 s TYR 20 Ca -0.08 -1.97 -0.17 0.00 -1.01 0.00 0.00 57.07 53.84 2dl5 s TYR 20 Cb 0.06 -2.00 -0.02 0.00 -0.11 0.00 0.00 41.96 39.88 2dl5 s TYR 20 CO 0.68 -0.82 0.92 -1.13 -1.11 0.00 0.00 175.55 174.09 2dl5 n SER 21 N 4.55 0.43 -3.57 2.29 3.41 -1.26 -4.65 113.62 114.82 2dl5 n SER 21 Ca -0.15 0.72 -0.08 0.00 -0.26 0.00 0.00 58.87 59.10 2dl5 n SER 21 Cb 0.44 -1.38 -0.08 0.00 -0.26 0.00 0.00 64.21 62.93 2dl5 n SER 21 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2dl5 s TYR 22 N -1.69 -0.88 -0.49 7.33 5.04 -1.10 -4.92 117.35 120.64 2dl5 s TYR 22 Ca 0.74 1.44 -0.24 0.00 -2.44 0.00 0.00 57.07 56.57 2dl5 s TYR 22 Cb -0.38 0.29 0.03 0.00 0.35 0.00 0.00 41.96 42.26 2dl5 s TYR 22 CO 0.49 -0.56 0.88 0.21 -1.34 0.00 0.00 175.55 175.23 2dl5 s LYS 23 N 2.63 3.42 0.35 4.97 2.20 -1.26 -2.42 119.74 129.62 2dl5 s LYS 23 Ca 0.02 -0.09 -0.28 0.00 -0.36 0.00 0.00 55.97 55.26 2dl5 s LYS 23 Cb -0.13 -3.98 -0.12 0.00 -1.51 0.00 0.00 37.83 32.10 2dl5 s LYS 23 CO -0.14 -1.28 1.41 0.00 -0.36 0.00 0.00 175.35 174.98 2dl5 n ALA 24 N 7.10 1.89 -0.01 3.13 0.00 -1.26 -4.92 120.51 126.45 2dl5 n ALA 24 Ca 0.03 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.83 2dl5 n ALA 24 Cb 0.48 -2.35 -0.04 0.00 0.00 0.00 0.00 19.45 17.54 2dl5 n ALA 24 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dl5 n SER 25 N 0.82 3.93 -4.91 0.00 7.64 -1.26 -4.95 113.62 114.88 2dl5 n SER 25 Ca 0.04 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.61 2dl5 n SER 25 Cb 0.37 0.93 -0.04 0.00 -1.01 0.00 0.00 64.21 64.46 2dl5 n SER 25 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2dl5 s GLN 26 N -2.22 3.49 0.00 1.43 -0.21 -1.26 -4.98 119.66 115.90 2dl5 s GLN 26 Ca -0.02 -0.34 0.15 0.00 0.02 0.00 0.00 55.36 55.17 2dl5 s GLN 26 Cb 0.02 -2.99 0.75 0.00 1.00 0.00 0.00 33.01 31.80 2dl5 s GLN 26 CO 0.19 0.57 1.41 -0.35 -2.12 0.00 0.00 175.29 174.99 2dl5 n PRO 27 N 0.24 0.22 -0.17 2.91 -0.04 -1.26 -1.87 135.00 135.02 2dl5 n PRO 27 Ca -0.04 0.14 0.05 0.00 -0.04 0.00 0.00 63.50 63.61 2dl5 n PRO 27 Cb 0.51 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.62 2dl5 n PRO 27 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dl5 n ASP 28 N -1.28 2.88 -4.95 3.54 9.92 -1.26 -5.01 116.55 120.39 2dl5 n ASP 28 Ca 0.07 -2.04 -0.19 0.00 -0.53 0.00 0.00 54.79 52.11 2dl5 n ASP 28 Cb 0.12 -0.22 -0.01 0.00 -0.64 0.00 0.00 41.12 40.37 2dl5 n ASP 28 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2dl5 s GLU 29 N -1.07 2.76 -0.26 -1.24 2.02 -0.78 -2.57 118.70 117.56 2dl5 s GLU 29 Ca 0.22 -1.32 0.02 0.00 0.02 0.00 0.00 54.97 53.91 2dl5 s GLU 29 Cb 0.12 -2.62 0.05 0.00 0.10 0.00 0.00 34.13 31.78 2dl5 s GLU 29 CO 0.14 -0.18 -0.09 -1.17 0.02 0.00 0.00 175.26 173.98 2dl5 s LEU 30 N -4.24 3.47 -0.29 1.80 1.98 -1.15 -4.50 118.68 115.75 2dl5 s LEU 30 Ca 0.51 -1.32 -0.28 0.00 -2.89 0.00 0.00 54.13 50.14 2dl5 s LEU 30 Cb -0.07 -1.58 -0.03 0.00 0.66 0.00 0.00 46.19 45.17 2dl5 s LEU 30 CO 0.31 -0.19 1.89 -0.89 -1.89 0.00 0.00 176.35 175.58 2dl5 s THR 31 N 1.15 3.37 0.39 3.68 2.01 -1.26 -4.68 115.64 120.30 2dl5 s THR 31 Ca -0.07 0.38 0.08 0.00 0.31 0.00 0.00 61.69 62.38 2dl5 s THR 31 Cb -0.20 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 2dl5 s THR 31 CO -0.05 -0.30 0.27 0.27 -0.69 0.00 0.00 174.62 174.12 2dl5 s ILE 32 N 7.11 2.70 -0.11 1.82 -4.36 -1.02 -4.95 121.20 122.40 2dl5 s ILE 32 Ca 0.85 -1.51 -0.13 0.00 -0.26 0.00 0.00 60.65 59.60 2dl5 s ILE 32 Cb -0.25 -3.01 0.03 0.00 1.25 0.00 0.00 42.46 40.48 2dl5 s ILE 32 CO 0.34 -0.05 0.36 -1.61 0.24 0.00 0.00 174.94 174.22 2dl5 s GLU 33 N -4.00 0.49 0.46 0.37 2.02 -1.26 -2.72 118.70 114.05 2dl5 s GLU 33 Ca 0.44 0.36 -0.21 0.00 0.02 0.00 0.00 54.97 55.58 2dl5 s GLU 33 Cb -0.01 0.23 -0.12 0.00 0.10 0.00 0.00 34.13 34.33 2dl5 s GLU 33 CO 0.25 -0.08 0.41 -1.91 0.02 0.00 0.00 175.26 173.95 2dl5 n GLU 34 N 2.52 0.43 -2.47 1.61 2.13 -1.26 -2.23 120.64 121.36 2dl5 n GLU 34 Ca -0.15 0.16 -0.12 0.00 0.66 0.00 0.00 57.16 57.71 2dl5 n GLU 34 Cb 0.57 -1.44 0.01 0.00 0.27 0.00 0.00 31.44 30.85 2dl5 n GLU 34 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2dl5 n HIS 35 N -1.15 -0.86 -4.11 4.31 8.25 0.16 -4.98 115.22 116.84 2dl5 n HIS 35 Ca 0.11 0.16 -0.33 0.00 -0.26 0.00 0.00 57.72 57.40 2dl5 n HIS 35 Cb 0.42 -2.84 -0.16 0.00 1.12 0.00 0.00 29.99 28.53 2dl5 n HIS 35 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2dl5 s GLU 36 N -4.91 2.82 -0.31 -0.41 2.56 -0.95 -4.98 118.70 112.52 2dl5 s GLU 36 Ca 0.09 -0.95 -0.23 0.00 0.00 0.00 0.00 54.97 53.88 2dl5 s GLU 36 Cb -0.04 -2.64 0.00 0.00 2.00 0.00 0.00 34.13 33.45 2dl5 s GLU 36 CO 0.11 -0.29 0.78 0.08 -0.56 0.00 0.00 175.26 175.39 2dl5 s VAL 37 N 1.25 4.79 0.45 3.70 1.01 -1.26 -1.12 120.40 129.21 2dl5 s VAL 37 Ca 0.02 1.14 0.06 0.00 0.00 0.00 0.00 61.98 63.19 2dl5 s VAL 37 Cb -0.15 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 2dl5 s VAL 37 CO -0.11 -0.27 0.16 -0.76 0.00 0.00 0.00 175.10 174.12 2dl5 s LEU 38 N 2.97 2.86 -0.22 3.92 1.43 -0.66 -4.71 118.68 124.27 2dl5 s LEU 38 Ca 0.32 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.17 2dl5 s LEU 38 Cb -0.14 -1.19 0.06 0.00 0.03 0.00 0.00 46.19 44.95 2dl5 s LEU 38 CO 0.13 -0.68 -0.05 -0.70 0.23 0.00 0.00 176.35 175.28 2dl5 s GLU 39 N -3.93 1.54 -0.29 1.70 2.56 -1.22 -0.65 118.70 118.42 2dl5 s GLU 39 Ca 0.32 -0.89 -0.29 0.00 0.00 0.00 0.00 54.97 54.11 2dl5 s GLU 39 Cb 0.03 -2.49 0.01 0.00 2.00 0.00 0.00 34.13 33.68 2dl5 s GLU 39 CO 0.18 -0.58 1.13 0.08 -0.56 0.00 0.00 175.26 175.51 2dl5 s VAL 40 N 1.46 4.44 -0.18 3.70 1.01 0.99 -2.32 120.40 129.49 2dl5 s VAL 40 Ca -0.05 1.67 0.03 0.00 0.00 0.00 0.00 61.98 63.64 2dl5 s VAL 40 Cb -0.18 -4.31 -0.13 0.00 0.00 0.00 0.00 36.38 31.75 2dl5 s VAL 40 CO -0.07 -0.40 -0.13 2.30 0.00 0.00 0.00 175.10 176.80 2dl5 n ILE 41 N 5.81 1.08 -4.41 2.22 -5.35 -0.93 -0.12 119.36 117.65 2dl5 n ILE 41 Ca 0.13 -0.45 -0.20 0.00 -0.27 0.00 0.00 62.75 61.95 2dl5 n ILE 41 Cb 0.47 -1.08 -0.10 0.00 -1.74 0.00 0.00 39.64 37.18 2dl5 n ILE 41 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2dl5 s GLU 42 N -2.38 1.60 -0.11 6.28 0.41 -1.17 -4.77 118.70 118.55 2dl5 s GLU 42 Ca -0.23 -1.89 0.19 0.00 -0.41 0.00 0.00 54.97 52.63 2dl5 s GLU 42 Cb 0.06 -0.63 0.73 0.00 -1.78 0.00 0.00 34.13 32.51 2dl5 s GLU 42 CO 0.47 -0.26 1.64 -0.40 -0.49 0.00 0.00 175.26 176.22 2dl5 n ASP 43 N -0.68 4.82 -1.40 -0.19 5.68 -1.26 -1.14 116.55 122.38 2dl5 n ASP 43 Ca -0.02 -2.45 0.18 0.00 -0.50 0.00 0.00 54.79 52.00 2dl5 n ASP 43 Cb 0.66 -0.59 -0.06 0.00 -1.14 0.00 0.00 41.12 40.00 2dl5 n ASP 43 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dl5 n GLY 44 N 1.16 -2.25 0.22 6.12 0.00 -1.26 -4.00 105.19 105.17 2dl5 n GLY 44 Ca 0.26 -1.03 0.07 0.00 0.00 0.00 0.00 46.02 45.32 2dl5 n GLY 44 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dl5 h ASP 45 N -1.35 0.00 -2.80 1.61 3.32 -1.94 -3.43 116.42 111.83 2dl5 h ASP 45 Ca -0.05 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.46 2dl5 h ASP 45 Cb 1.35 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.88 2dl5 h ASP 45 CO 0.03 0.24 -0.36 -0.32 -1.72 0.00 0.00 179.24 177.11 2dl5 s MET 46 N -4.28 3.51 -0.07 3.56 1.75 -1.26 -5.03 119.30 117.47 2dl5 s MET 46 Ca -0.03 -0.38 -0.23 0.00 -1.25 0.00 0.00 55.69 53.80 2dl5 s MET 46 Cb 0.14 -2.86 -0.30 0.00 2.84 0.00 0.00 34.83 34.64 2dl5 s MET 46 CO 0.67 0.43 0.86 0.93 -0.65 0.00 0.00 175.02 177.26 2dl5 h GLU 47 N 2.07 0.23 -0.27 4.11 5.08 -1.84 -3.32 114.58 120.64 2dl5 h GLU 47 Ca -0.48 -0.39 -0.04 0.00 -1.00 0.00 0.00 59.36 57.45 2dl5 h GLU 47 Cb 1.19 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.57 2dl5 h GLU 47 CO 0.68 1.19 -0.00 -0.44 -1.00 0.00 0.00 179.01 179.44 2dl5 h ASP 48 N -0.52 0.38 -1.36 1.42 5.19 -1.96 -3.44 116.42 116.14 2dl5 h ASP 48 Ca -0.11 -0.06 -0.47 0.00 -0.62 0.00 0.00 57.03 55.77 2dl5 h ASP 48 Cb 1.50 -0.10 0.04 0.00 0.18 0.00 0.00 39.33 40.95 2dl5 h ASP 48 CO 0.12 0.45 -0.05 0.26 -3.12 0.00 0.00 179.24 176.89 2dl5 s TRP 49 N -4.97 1.70 0.31 4.55 0.52 -1.25 -2.22 118.94 117.58 2dl5 s TRP 49 Ca -0.07 -0.52 -0.10 0.00 0.02 0.00 0.00 56.10 55.44 2dl5 s TRP 49 Cb 0.16 -2.49 0.01 0.00 -1.15 0.00 0.00 33.47 30.00 2dl5 s TRP 49 CO 0.75 -1.22 0.54 0.14 0.02 0.00 0.00 176.95 177.17 2dl5 s VAL 50 N -2.78 0.00 -0.18 4.03 -7.23 0.57 -4.47 120.40 110.34 2dl5 s VAL 50 Ca 0.62 -1.40 -0.02 0.00 -1.81 0.00 0.00 61.98 59.37 2dl5 s VAL 50 Cb -0.06 -2.47 -0.01 0.00 0.56 0.00 0.00 36.38 34.40 2dl5 s VAL 50 CO 0.40 0.00 -0.09 -0.75 -0.31 0.00 0.00 175.10 174.35 2dl5 s LYS 51 N -3.38 3.34 0.07 4.82 2.20 -0.29 -1.66 119.74 124.84 2dl5 s LYS 51 Ca 0.24 -0.67 0.03 0.00 -0.36 0.00 0.00 55.97 55.21 2dl5 s LYS 51 Cb -0.01 -2.83 -0.03 0.00 -1.51 0.00 0.00 37.83 33.45 2dl5 s LYS 51 CO 0.13 -0.05 -0.09 0.00 -0.36 0.00 0.00 175.35 174.99 2dl5 s ALA 52 N 1.05 0.83 -0.20 3.13 0.00 -1.25 -2.19 121.76 123.14 2dl5 s ALA 52 Ca -0.00 -0.98 -0.00 0.00 0.00 0.00 0.00 51.96 50.97 2dl5 s ALA 52 Cb -0.15 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.03 2dl5 s ALA 52 CO -0.01 -0.04 -0.15 0.50 0.00 0.00 0.00 175.76 176.05 2dl5 s ARG 53 N -2.25 3.04 1.00 0.00 3.52 -0.98 -3.47 118.95 119.81 2dl5 s ARG 53 Ca -0.02 -0.81 -0.17 0.00 -0.13 0.00 0.00 55.73 54.60 2dl5 s ARG 53 Cb -0.06 -2.70 0.22 0.00 -1.56 0.00 0.00 34.95 30.85 2dl5 s ARG 53 CO -0.00 -0.23 1.31 0.54 -0.81 0.00 0.00 175.30 176.11 2dl5 s ASN 54 N 1.33 2.81 0.17 -2.12 2.20 -1.12 -3.40 114.94 114.81 2dl5 s ASN 54 Ca 0.04 0.26 -0.16 0.00 -0.94 0.00 0.00 52.86 52.06 2dl5 s ASN 54 Cb -0.14 -0.29 0.11 0.00 -2.00 0.00 0.00 41.25 38.93 2dl5 s ASN 54 CO -0.10 -2.92 1.67 0.07 -2.94 0.00 0.00 177.10 172.88 2dl5 h LYS 55 N -1.77 0.02 -0.19 3.55 2.10 -1.93 0.19 116.57 118.55 2dl5 h LYS 55 Ca -0.44 -0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.26 2dl5 h LYS 55 Cb 1.23 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.55 2dl5 h LYS 55 CO 0.36 0.01 0.22 -0.39 -2.00 0.00 0.00 179.45 177.65 2dl5 h VAL 56 N 0.02 0.43 0.00 0.07 -1.51 -2.01 -3.45 116.25 109.80 2dl5 h VAL 56 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.67 2dl5 h VAL 56 Cb 0.30 0.82 0.00 0.00 -2.13 0.00 0.00 31.29 30.28 2dl5 h VAL 56 CO -0.41 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.54 2dl5 n GLY 57 N -1.39 0.39 3.67 5.19 0.00 0.67 -5.05 105.19 108.68 2dl5 n GLY 57 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2dl5 n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dl5 s GLN 58 N -0.82 4.14 -0.23 1.61 -0.21 -1.26 -4.65 119.66 118.24 2dl5 s GLN 58 Ca 0.00 2.62 -0.03 0.00 0.02 0.00 0.00 55.36 57.98 2dl5 s GLN 58 Cb 0.00 -3.93 0.01 0.00 1.00 0.00 0.00 33.01 30.09 2dl5 s GLN 58 CO 0.00 -0.92 -0.06 0.08 -2.12 0.00 0.00 175.29 172.27 2dl5 s VAL 59 N 3.75 3.08 0.00 1.09 1.01 -1.26 -2.78 120.40 125.29 2dl5 s VAL 59 Ca 0.86 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.10 2dl5 s VAL 59 Cb -0.44 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2dl5 s VAL 59 CO 0.40 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.45 2dl5 n GLY 60 N 4.74 5.46 3.14 4.51 0.00 -1.23 -4.94 105.19 116.87 2dl5 n GLY 60 Ca -0.18 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 2dl5 n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dl5 s TYR 61 N 1.14 2.14 0.03 1.61 2.02 -1.06 -3.80 117.35 119.44 2dl5 s TYR 61 Ca 0.00 -0.87 0.01 0.00 -0.37 0.00 0.00 57.07 55.84 2dl5 s TYR 61 Cb 0.00 -1.47 -0.02 0.00 -0.40 0.00 0.00 41.96 40.06 2dl5 s TYR 61 CO 0.00 -0.38 -0.05 0.14 -1.57 0.00 0.00 175.55 173.70 2dl5 s VAL 62 N 0.50 0.29 -0.28 0.71 -7.23 -0.67 -2.93 120.40 110.80 2dl5 s VAL 62 Ca -0.17 -1.10 -0.29 0.00 -1.81 0.00 0.00 61.98 58.62 2dl5 s VAL 62 Cb -0.17 -0.56 -0.02 0.00 0.56 0.00 0.00 36.38 36.19 2dl5 s VAL 62 CO 0.06 -0.53 1.65 -2.16 -0.31 0.00 0.00 175.10 173.81 2dl5 s PRO 63 N -1.84 3.63 0.58 4.82 0.04 -1.26 -0.32 135.00 140.65 2dl5 s PRO 63 Ca -0.11 1.51 0.31 0.00 0.04 0.00 0.00 61.00 62.75 2dl5 s PRO 63 Cb -0.08 -4.08 1.41 0.00 0.04 0.00 0.00 34.50 31.79 2dl5 s PRO 63 CO -0.02 -1.50 1.77 1.49 0.04 0.00 0.00 177.00 178.79 2dl5 h GLU 64 N 11.38 0.00 -0.97 4.56 4.22 -1.72 0.33 114.58 132.37 2dl5 h GLU 64 Ca -0.33 0.00 0.01 0.00 0.08 0.00 0.00 59.36 59.12 2dl5 h GLU 64 Cb 1.15 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.35 2dl5 h GLU 64 CO 1.02 0.00 0.63 0.87 -2.18 0.00 0.00 179.01 179.35 2dl5 h LYS 65 N 0.00 1.29 0.00 1.92 1.57 -1.89 -1.48 116.57 117.97 2dl5 h LYS 65 Ca 0.37 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 59.02 2dl5 h LYS 65 Cb 1.81 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 33.82 2dl5 h LYS 65 CO -0.00 0.86 -0.22 1.88 -0.57 0.00 0.00 179.45 181.40 2dl5 h TYR 66 N 1.32 0.00 -3.83 -1.35 -1.99 -0.70 -3.45 116.97 106.98 2dl5 h TYR 66 Ca 0.35 0.00 -0.48 0.00 2.00 0.00 0.00 58.73 60.61 2dl5 h TYR 66 Cb -0.13 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.57 2dl5 h TYR 66 CO 0.00 0.22 0.22 -0.51 -0.00 0.00 0.00 178.16 178.08 2dl5 s LEU 67 N -6.54 4.12 -0.77 3.88 1.43 -0.56 -3.22 118.68 117.02 2dl5 s LEU 67 Ca 0.02 1.53 -0.03 0.00 -1.03 0.00 0.00 54.13 54.62 2dl5 s LEU 67 Cb 0.09 -4.12 0.19 0.00 0.03 0.00 0.00 46.19 42.38 2dl5 s LEU 67 CO 0.65 -0.19 0.63 -1.58 0.23 0.00 0.00 176.35 176.10 2dl5 s GLN 68 N -2.70 3.00 0.75 1.70 0.74 -0.69 -4.91 119.66 117.55 2dl5 s GLN 68 Ca 0.54 -2.89 -0.15 0.00 0.05 0.00 0.00 55.36 52.91 2dl5 s GLN 68 Cb -0.12 -3.90 0.05 0.00 1.10 0.00 0.00 33.01 30.13 2dl5 s GLN 68 CO 0.18 -1.23 1.21 -0.06 -0.55 0.00 0.00 175.29 174.84 2dl5 s PHE 69 N -0.67 1.98 -0.19 1.67 0.40 -1.26 -1.76 117.98 118.16 2dl5 s PHE 69 Ca 0.22 1.61 -0.29 0.00 -0.60 0.00 0.00 56.93 57.87 2dl5 s PHE 69 Cb -0.13 -3.49 -0.03 0.00 0.51 0.00 0.00 43.02 39.88 2dl5 s PHE 69 CO -0.08 -2.70 1.59 -1.25 0.70 0.00 0.00 175.22 173.47 2dl5 s PRO 70 N -3.95 3.90 0.07 0.24 0.04 -1.26 -4.92 135.00 129.13 2dl5 s PRO 70 Ca 0.74 1.75 -0.22 0.00 0.04 0.00 0.00 61.00 63.31 2dl5 s PRO 70 Cb -0.30 -4.00 -0.06 0.00 0.04 0.00 0.00 34.50 30.18 2dl5 s PRO 70 CO 0.47 -1.16 0.66 0.95 0.04 0.00 0.00 177.00 177.96 2dl5 s THR 71 N 4.83 4.69 -0.21 1.26 -4.23 -1.26 -5.00 115.64 115.72 2dl5 s THR 71 Ca 0.70 1.42 -0.19 0.00 -1.18 0.00 0.00 61.69 62.45 2dl5 s THR 71 Cb -0.26 -4.01 -0.15 0.00 1.34 0.00 0.00 72.50 69.42 2dl5 s THR 71 CO 0.28 0.48 0.05 -1.20 -0.54 0.00 0.00 174.62 173.68 2dl5 n SER 72 N 2.14 1.87 -4.77 3.99 7.64 -1.26 -4.95 113.62 118.29 2dl5 n SER 72 Ca -0.07 0.43 -0.35 0.00 1.01 0.00 0.00 58.87 59.90 2dl5 n SER 72 Cb 0.50 -0.92 0.02 0.00 -1.01 0.00 0.00 64.21 62.80 2dl5 n SER 72 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dl5 s SER 73 N -6.80 5.47 0.00 6.43 0.15 -1.26 -4.97 113.70 112.73 2dl5 s SER 73 Ca -0.29 2.20 0.00 0.00 0.70 0.00 0.00 55.95 58.57 2dl5 s SER 73 Cb 0.07 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2dl5 s SER 73 CO 0.52 -1.39 0.00 0.61 1.20 0.00 0.00 173.24 174.18 2dl5 n GLY 74 N 0.15 0.15 3.56 9.45 0.00 -1.26 -5.05 105.19 112.18 2dl5 n GLY 74 Ca 0.12 0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.97 2dl5 n GLY 74 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dl5 s PRO 75 N 0.26 2.59 -0.34 1.61 0.04 -1.26 -4.95 135.00 132.94 2dl5 s PRO 75 Ca 0.00 0.15 -0.17 0.00 0.04 0.00 0.00 61.00 61.02 2dl5 s PRO 75 Cb 0.00 -4.74 -0.01 0.00 0.04 0.00 0.00 34.50 29.79 2dl5 s PRO 75 CO 0.00 -3.07 0.43 -1.54 0.04 0.00 0.00 177.00 172.86 2dl5 s SER 76 N 8.09 6.24 0.02 6.66 1.04 -1.26 -5.06 113.70 129.43 2dl5 s SER 76 Ca 0.69 -0.13 -0.22 0.00 0.48 0.00 0.00 55.95 56.77 2dl5 s SER 76 Cb -0.10 -2.23 -0.06 0.00 0.10 0.00 0.00 66.02 63.74 2dl5 s SER 76 CO 0.10 -0.40 0.65 -0.94 0.98 0.00 0.00 173.24 173.62 2dl5 s SER 77 N 1.74 7.06 0.00 7.02 1.04 -1.26 -5.32 113.70 123.98 2dl5 s SER 77 Ca 0.15 1.26 0.00 0.00 0.48 0.00 0.00 55.95 57.84 2dl5 s SER 77 Cb -0.16 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.56 2dl5 s SER 77 CO 0.12 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.04