#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wi7 s SER 2 N 0.00 1.88 -0.20 1.61 0.01 -1.26 -4.96 113.70 110.77 1wi7 s SER 2 Ca 0.00 -2.80 -0.17 0.00 1.31 0.00 0.00 55.95 54.29 1wi7 s SER 2 Cb 0.00 -0.42 -0.08 0.00 0.21 0.00 0.00 66.02 65.73 1wi7 s SER 2 CO 0.00 -0.21 -0.34 -0.24 0.41 0.00 0.00 173.24 172.86 1wi7 n SER 3 N 3.20 1.94 -0.95 2.44 2.88 -1.26 -5.08 113.62 116.79 1wi7 n SER 3 Ca 0.24 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 58.13 1wi7 n SER 3 Cb 0.45 -0.77 0.00 0.00 -0.75 0.00 0.00 64.21 63.14 1wi7 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wi7 n GLY 4 N 1.41 0.61 3.23 0.46 0.00 -1.26 -5.12 105.19 104.52 1wi7 n GLY 4 Ca -0.24 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 1wi7 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wi7 s SER 5 N -2.39 0.00 0.06 1.61 0.01 -1.26 -5.08 113.70 106.65 1wi7 s SER 5 Ca 0.00 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 56.80 1wi7 s SER 5 Cb 0.00 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.59 1wi7 s SER 5 CO 0.00 -0.70 0.00 -0.24 0.41 0.00 0.00 173.24 172.71 1wi7 n SER 6 N 0.16 -7.69 0.00 2.44 2.88 -1.26 -5.07 113.62 105.08 1wi7 n SER 6 Ca -0.16 1.33 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 1wi7 n SER 6 Cb 0.61 -4.20 0.00 0.00 -0.75 0.00 0.00 64.21 59.87 1wi7 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wi7 n GLY 7 N 1.42 2.83 3.88 0.46 0.00 -1.26 -5.11 105.19 107.41 1wi7 n GLY 7 Ca 0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 1wi7 n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wi7 s ARG 8 N -2.70 3.76 0.03 1.61 3.00 -0.14 -4.89 118.95 119.62 1wi7 s ARG 8 Ca 0.00 0.29 0.09 0.00 0.00 0.00 0.00 55.73 56.10 1wi7 s ARG 8 Cb 0.00 -2.55 -0.03 0.00 0.00 0.00 0.00 34.95 32.37 1wi7 s ARG 8 CO 0.00 0.16 -0.25 1.03 0.00 0.00 0.00 175.30 176.24 1wi7 s ARG 9 N -3.37 1.91 -0.04 3.54 0.52 -1.26 0.19 118.95 120.44 1wi7 s ARG 9 Ca 0.48 -1.05 -0.13 0.00 -0.52 0.00 0.00 55.73 54.52 1wi7 s ARG 9 Cb -0.11 -2.03 0.02 0.00 0.52 0.00 0.00 34.95 33.36 1wi7 s ARG 9 CO 0.26 0.53 0.29 0.00 0.02 0.00 0.00 175.30 176.40 1wi7 s GLN 11 N -0.88 3.45 -0.30 0.00 0.74 -0.74 -2.12 119.66 119.81 1wi7 s GLN 11 Ca -0.10 -0.16 -0.28 0.00 0.05 0.00 0.00 55.36 54.87 1wi7 s GLN 11 Cb -0.05 -3.17 0.01 0.00 1.10 0.00 0.00 33.01 30.91 1wi7 s GLN 11 CO 0.03 0.76 1.03 0.08 -0.55 0.00 0.00 175.29 176.64 1wi7 s VAL 12 N -1.09 4.57 -0.24 1.34 1.01 -0.37 -0.46 120.40 125.16 1wi7 s VAL 12 Ca 0.17 1.70 0.23 0.00 0.00 0.00 0.00 61.98 64.08 1wi7 s VAL 12 Cb -0.12 -4.36 -0.05 0.00 0.00 0.00 0.00 36.38 31.84 1wi7 s VAL 12 CO 0.07 -0.41 0.97 0.00 0.00 0.00 0.00 175.10 175.74 1wi7 n ALA 13 N 6.70 2.63 -3.69 5.51 0.00 -1.15 -1.82 120.51 128.69 1wi7 n ALA 13 Ca 0.11 -0.28 -0.17 0.00 0.00 0.00 0.00 53.44 53.10 1wi7 n ALA 13 Cb 0.47 -1.05 -0.16 0.00 0.00 0.00 0.00 19.45 18.71 1wi7 n ALA 13 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1wi7 s PHE 14 N -3.37 -0.10 0.48 0.00 0.40 -1.14 -4.83 117.98 109.43 1wi7 s PHE 14 Ca -0.01 0.45 -0.24 0.00 -0.60 0.00 0.00 56.93 56.54 1wi7 s PHE 14 Cb 0.11 -0.28 -0.07 0.00 0.51 0.00 0.00 43.02 43.29 1wi7 s PHE 14 CO 0.80 -0.21 1.33 -1.54 0.70 0.00 0.00 175.22 176.30 1wi7 s SER 15 N 1.94 5.77 -0.08 1.36 1.04 -1.26 -4.62 113.70 117.85 1wi7 s SER 15 Ca 0.00 2.69 -0.02 0.00 0.48 0.00 0.00 55.95 59.10 1wi7 s SER 15 Cb -0.12 -2.63 0.04 0.00 0.10 0.00 0.00 66.02 63.40 1wi7 s SER 15 CO -0.05 -1.23 0.04 -0.47 0.98 0.00 0.00 173.24 172.51 1wi7 s TYR 16 N -1.32 0.42 -0.10 5.02 6.14 0.59 -4.88 117.35 123.22 1wi7 s TYR 16 Ca 0.65 -0.09 -0.24 0.00 0.64 0.00 0.00 57.07 58.03 1wi7 s TYR 16 Cb -0.39 -0.69 -0.03 0.00 0.42 0.00 0.00 41.96 41.28 1wi7 s TYR 16 CO 0.47 -0.32 0.74 -0.51 0.64 0.00 0.00 175.55 176.57 1wi7 s LEU 17 N 2.06 4.26 -0.27 6.97 2.01 -1.26 -0.80 118.68 131.65 1wi7 s LEU 17 Ca 0.04 1.16 -0.29 0.00 0.01 0.00 0.00 54.13 55.05 1wi7 s LEU 17 Cb -0.13 -3.12 -0.00 0.00 0.01 0.00 0.00 46.19 42.95 1wi7 s LEU 17 CO -0.05 -0.21 1.33 -2.16 1.01 0.00 0.00 176.35 176.27 1wi7 s PRO 18 N 1.29 3.94 0.00 1.29 0.04 -1.26 -4.87 135.00 135.43 1wi7 s PRO 18 Ca 0.37 1.35 0.13 0.00 0.04 0.00 0.00 61.00 62.89 1wi7 s PRO 18 Cb -0.17 -3.88 0.80 0.00 0.04 0.00 0.00 34.50 31.28 1wi7 s PRO 18 CO 0.16 -1.09 1.50 1.04 0.04 0.00 0.00 177.00 178.65 1wi7 n GLN 19 N 7.27 0.98 -4.26 4.56 1.13 -1.26 -4.80 117.38 120.99 1wi7 n GLN 19 Ca 0.15 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 55.00 1wi7 n GLN 19 Cb 0.46 -1.21 -0.07 0.00 0.11 0.00 0.00 30.24 29.52 1wi7 n GLN 19 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1wi7 n ASN 20 N -0.71 0.02 -1.75 1.08 4.13 -1.26 -5.04 115.26 111.72 1wi7 n ASN 20 Ca 0.10 -3.16 -0.16 0.00 1.68 0.00 0.00 54.58 53.05 1wi7 n ASN 20 Cb 0.05 1.41 0.18 0.00 -1.54 0.00 0.00 39.78 39.88 1wi7 n ASN 20 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1wi7 n ASP 21 N -1.64 3.32 -0.49 6.41 2.03 -1.26 -4.15 116.55 120.76 1wi7 n ASP 21 Ca 0.03 -3.71 0.00 0.00 0.52 0.00 0.00 54.79 51.63 1wi7 n ASP 21 Cb 0.60 -0.75 0.00 0.00 -0.72 0.00 0.00 41.12 40.25 1wi7 n ASP 21 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1wi7 n ASP 22 N -1.13 0.00 -4.64 1.67 -0.08 -1.26 -5.11 116.55 106.00 1wi7 n ASP 22 Ca 0.48 -1.59 -0.24 0.00 -1.51 0.00 0.00 54.79 51.93 1wi7 n ASP 22 Cb 1.34 -0.12 -0.08 0.00 2.34 0.00 0.00 41.12 44.60 1wi7 n ASP 22 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1wi7 s GLU 23 N 0.00 2.16 -0.03 -0.67 2.02 -1.26 -4.08 118.70 116.85 1wi7 s GLU 23 Ca 0.00 -1.63 -0.09 0.00 0.02 0.00 0.00 54.97 53.27 1wi7 s GLU 23 Cb 0.00 -2.03 -0.05 0.00 0.10 0.00 0.00 34.13 32.16 1wi7 s GLU 23 CO 0.00 0.20 0.27 -0.51 0.02 0.00 0.00 175.26 175.24 1wi7 s LEU 24 N -3.72 4.40 -0.55 1.80 1.43 -1.26 -4.85 118.68 115.94 1wi7 s LEU 24 Ca 0.34 0.65 -0.17 0.00 -1.03 0.00 0.00 54.13 53.92 1wi7 s LEU 24 Cb -0.02 -2.47 0.12 0.00 0.03 0.00 0.00 46.19 43.84 1wi7 s LEU 24 CO 0.20 0.32 0.56 -0.70 0.23 0.00 0.00 176.35 176.96 1wi7 s GLU 25 N -1.35 3.01 0.29 1.70 2.12 -1.26 -4.30 118.70 118.91 1wi7 s GLU 25 Ca 0.23 -1.54 -0.29 0.00 0.36 0.00 0.00 54.97 53.72 1wi7 s GLU 25 Cb -0.14 -4.27 -0.10 0.00 0.26 0.00 0.00 34.13 29.88 1wi7 s GLU 25 CO 0.12 -1.37 1.15 -0.51 -0.54 0.00 0.00 175.26 174.11 1wi7 s LEU 26 N 1.96 4.52 -0.10 2.70 1.43 0.02 -4.81 118.68 124.40 1wi7 s LEU 26 Ca 0.06 2.37 -0.03 0.00 -1.03 0.00 0.00 54.13 55.50 1wi7 s LEU 26 Cb -0.28 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.36 1wi7 s LEU 26 CO 0.04 -0.25 0.10 -0.54 0.23 0.00 0.00 176.35 175.94 1wi7 s LYS 27 N -1.47 0.01 -0.59 1.70 1.02 -1.26 -0.30 119.74 118.85 1wi7 s LYS 27 Ca 0.46 0.26 -0.32 0.00 0.02 0.00 0.00 55.97 56.39 1wi7 s LYS 27 Cb -0.34 -0.93 -0.17 0.00 -0.52 0.00 0.00 37.83 35.87 1wi7 s LYS 27 CO 0.44 -0.46 1.98 0.28 -0.92 0.00 0.00 175.35 176.66 1wi7 n VAL 28 N 5.30 0.00 0.00 3.17 0.31 -1.26 0.23 118.33 126.08 1wi7 n VAL 28 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1wi7 n VAL 28 Cb 0.50 -0.42 0.00 0.00 -0.91 0.00 0.00 33.84 33.01 1wi7 n VAL 28 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wi7 n GLY 29 N 5.87 2.44 3.58 2.92 0.00 -0.75 -5.00 105.19 114.24 1wi7 n GLY 29 Ca 0.50 -0.85 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 1wi7 n GLY 29 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wi7 n ASP 30 N 0.00 0.56 -4.07 1.61 9.92 0.61 -4.58 116.55 120.60 1wi7 n ASP 30 Ca 0.00 0.88 -0.32 0.00 -0.53 0.00 0.00 54.79 54.83 1wi7 n ASP 30 Cb 0.00 -1.33 -0.16 0.00 -0.64 0.00 0.00 41.12 38.99 1wi7 n ASP 30 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1wi7 s ILE 31 N -1.46 1.83 -0.23 0.53 1.01 -1.26 -1.24 121.20 120.38 1wi7 s ILE 31 Ca 0.69 -0.82 -0.09 0.00 0.00 0.00 0.00 60.65 60.44 1wi7 s ILE 31 Cb -0.48 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 1wi7 s ILE 31 CO 0.52 0.48 0.10 -0.63 0.00 0.00 0.00 174.94 175.42 1wi7 s ILE 32 N 1.38 4.83 -1.24 2.92 1.01 -0.90 -4.61 121.20 124.59 1wi7 s ILE 32 Ca 0.05 -0.00 -0.20 0.00 0.00 0.00 0.00 60.65 60.50 1wi7 s ILE 32 Cb -0.13 -3.24 0.04 0.00 0.01 0.00 0.00 42.46 39.14 1wi7 s ILE 32 CO -0.12 0.37 1.74 -1.61 0.00 0.00 0.00 174.94 175.33 1wi7 s GLU 33 N 1.10 3.66 -0.49 2.79 2.02 -1.05 -2.78 118.70 123.95 1wi7 s GLU 33 Ca 0.05 -1.72 -0.46 0.00 0.02 0.00 0.00 54.97 52.86 1wi7 s GLU 33 Cb -0.14 -5.46 -0.20 0.00 0.10 0.00 0.00 34.13 28.44 1wi7 s GLU 33 CO 0.04 -2.57 1.69 0.28 0.02 0.00 0.00 175.26 174.72 1wi7 n VAL 34 N 6.73 0.02 -0.10 2.63 0.31 0.51 -3.41 118.33 125.01 1wi7 n VAL 34 Ca 0.46 -0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.60 1wi7 n VAL 34 Cb 0.47 -0.55 -0.08 0.00 -0.91 0.00 0.00 33.84 32.77 1wi7 n VAL 34 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 1wi7 n VAL 35 N 4.40 1.10 -3.74 2.52 3.14 0.28 -0.97 118.33 125.06 1wi7 n VAL 35 Ca 0.34 -0.33 -0.06 0.00 -2.96 0.00 0.00 64.34 61.33 1wi7 n VAL 35 Cb -0.05 -1.54 -0.01 0.00 -1.06 0.00 0.00 33.84 31.19 1wi7 n VAL 35 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wi7 n GLY 36 N 2.07 2.67 3.12 7.55 0.00 0.23 -4.94 105.19 115.89 1wi7 n GLY 36 Ca -0.37 -1.46 -0.27 0.00 0.00 0.00 0.00 46.02 43.92 1wi7 n GLY 36 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wi7 s GLU 37 N -2.31 2.00 -0.01 1.61 -6.30 -1.26 0.19 118.70 112.62 1wi7 s GLU 37 Ca 0.11 -0.60 -0.00 0.00 -2.50 0.00 0.00 54.97 51.98 1wi7 s GLU 37 Cb -0.00 -1.65 -0.00 0.00 0.00 0.00 0.00 34.13 32.47 1wi7 s GLU 37 CO 0.08 0.17 -0.00 0.28 0.02 0.00 0.00 175.26 175.81 1wi7 h VAL 38 N 5.56 0.00 -3.80 3.70 2.07 -1.60 -3.44 116.25 118.75 1wi7 h VAL 38 Ca -0.30 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.03 1wi7 h VAL 38 Cb 1.19 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.86 1wi7 h VAL 38 CO 0.48 0.00 -0.19 -1.83 0.02 0.00 0.00 177.57 176.05 1wi7 s GLU 39 N -1.07 1.51 -0.33 1.57 -1.05 0.07 -5.00 118.70 114.41 1wi7 s GLU 39 Ca -0.00 -1.32 -0.36 0.00 -0.15 0.00 0.00 54.97 53.14 1wi7 s GLU 39 Cb 0.00 0.44 -0.12 0.00 -0.44 0.00 0.00 34.13 34.02 1wi7 s GLU 39 CO 0.00 -0.61 2.14 -1.91 0.95 0.00 0.00 175.26 175.83 1wi7 n GLU 40 N -0.37 1.14 0.00 -4.83 2.13 -1.26 0.20 120.64 117.65 1wi7 n GLU 40 Ca -0.01 0.33 0.00 0.00 0.66 0.00 0.00 57.16 58.14 1wi7 n GLU 40 Cb 0.62 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.90 1wi7 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wi7 n GLY 41 N 6.25 2.26 3.19 8.31 0.00 -1.26 -5.03 105.19 118.92 1wi7 n GLY 41 Ca 0.39 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.09 1wi7 n GLY 41 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1wi7 s TRP 42 N -2.59 2.53 0.37 1.61 0.52 0.53 0.03 118.94 121.93 1wi7 s TRP 42 Ca 0.00 -1.10 0.09 0.00 0.02 0.00 0.00 56.10 55.10 1wi7 s TRP 42 Cb 0.00 -1.70 -0.07 0.00 -1.15 0.00 0.00 33.47 30.55 1wi7 s TRP 42 CO 0.00 -0.47 -0.05 -1.58 0.02 0.00 0.00 176.95 174.87 1wi7 s TRP 43 N 0.49 2.45 -0.12 -1.98 0.51 0.10 -0.75 118.94 119.65 1wi7 s TRP 43 Ca -0.15 -0.57 0.03 0.00 -2.12 0.00 0.00 56.10 53.29 1wi7 s TRP 43 Cb -0.17 -1.54 0.01 0.00 -0.81 0.00 0.00 33.47 30.95 1wi7 s TRP 43 CO 0.06 0.53 -0.21 -2.00 -0.51 0.00 0.00 176.95 174.82 1wi7 s GLU 44 N -3.65 2.80 0.00 4.98 2.12 0.50 -1.56 118.70 123.88 1wi7 s GLU 44 Ca 0.34 -0.78 0.00 0.00 0.36 0.00 0.00 54.97 54.89 1wi7 s GLU 44 Cb 0.05 -2.25 0.00 0.00 0.26 0.00 0.00 34.13 32.20 1wi7 s GLU 44 CO 0.17 0.02 0.00 0.41 -0.54 0.00 0.00 175.26 175.32 1wi7 n GLY 45 N 3.97 3.11 3.47 -1.50 0.00 -1.19 0.76 105.19 113.81 1wi7 n GLY 45 Ca -0.20 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.44 1wi7 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wi7 s VAL 46 N -2.54 2.70 -0.35 1.61 1.01 -1.22 -2.92 120.40 118.69 1wi7 s VAL 46 Ca 0.00 -1.71 -0.00 0.00 0.00 0.00 0.00 61.98 60.26 1wi7 s VAL 46 Cb 0.00 -2.27 0.12 0.00 0.00 0.00 0.00 36.38 34.23 1wi7 s VAL 46 CO 0.00 -0.00 0.18 -0.22 0.00 0.00 0.00 175.10 175.05 1wi7 s LEU 47 N -2.41 1.64 -1.33 3.92 2.96 0.45 -2.52 118.68 121.39 1wi7 s LEU 47 Ca 0.20 -2.02 -0.03 0.00 -0.22 0.00 0.00 54.13 52.06 1wi7 s LEU 47 Cb -0.09 -0.66 0.00 0.00 0.50 0.00 0.00 46.19 45.94 1wi7 s LEU 47 CO 0.10 -0.35 0.36 0.59 -1.32 0.00 0.00 176.35 175.73 1wi7 n ASN 48 N 4.31 -5.23 0.00 3.68 3.02 -1.26 -2.03 115.26 117.76 1wi7 n ASN 48 Ca 0.05 -0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 1wi7 n ASN 48 Cb 0.38 -4.14 0.00 0.00 -0.61 0.00 0.00 39.78 35.41 1wi7 n ASN 48 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wi7 n GLY 49 N -1.28 3.06 3.73 7.41 0.00 -1.26 -5.05 105.19 111.80 1wi7 n GLY 49 Ca -0.13 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.72 1wi7 n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wi7 s LYS 50 N 0.00 2.03 0.02 1.61 -2.85 -0.86 -4.96 119.74 114.73 1wi7 s LYS 50 Ca 0.00 1.44 0.03 0.00 -1.00 0.00 0.00 55.97 56.45 1wi7 s LYS 50 Cb 0.00 -1.85 -0.01 0.00 -2.06 0.00 0.00 37.83 33.90 1wi7 s LYS 50 CO 0.00 -1.85 -0.10 0.99 0.10 0.00 0.00 175.35 174.48 1wi7 s THR 51 N -2.52 0.80 0.01 3.79 2.01 -1.26 0.17 115.64 118.64 1wi7 s THR 51 Ca 0.67 -0.71 -0.10 0.00 0.31 0.00 0.00 61.69 61.86 1wi7 s THR 51 Cb -0.22 -0.73 0.03 0.00 0.01 0.00 0.00 72.50 71.60 1wi7 s THR 51 CO 0.51 0.03 0.46 0.61 -0.69 0.00 0.00 174.62 175.53 1wi7 n GLY 52 N 2.28 0.59 3.46 4.40 0.00 -1.15 -4.81 105.19 109.97 1wi7 n GLY 52 Ca -0.17 -0.93 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 1wi7 n GLY 52 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1wi7 s MET 53 N -2.01 3.65 0.16 1.61 0.23 -1.26 -3.18 119.30 118.50 1wi7 s MET 53 Ca 0.11 -0.50 0.06 0.00 -1.03 0.00 0.00 55.69 54.33 1wi7 s MET 53 Cb -0.00 -3.11 -0.04 0.00 -1.53 0.00 0.00 34.83 30.14 1wi7 s MET 53 CO 0.00 0.02 -0.14 -0.59 -2.03 0.00 0.00 175.02 172.29 1wi7 s PHE 54 N 0.99 1.49 0.03 3.16 -0.71 -0.60 -4.05 117.98 118.29 1wi7 s PHE 54 Ca 0.02 -0.60 -0.30 0.00 -1.04 0.00 0.00 56.93 55.00 1wi7 s PHE 54 Cb -0.14 -0.74 -0.05 0.00 -1.21 0.00 0.00 43.02 40.88 1wi7 s PHE 54 CO 0.02 0.21 1.18 -1.25 -1.34 0.00 0.00 175.22 174.03 1wi7 s PRO 55 N -3.22 4.43 -0.03 1.99 0.04 -1.26 0.01 135.00 136.96 1wi7 s PRO 55 Ca 0.15 1.71 0.07 0.00 0.04 0.00 0.00 61.00 62.98 1wi7 s PRO 55 Cb -0.02 -3.41 0.27 0.00 0.04 0.00 0.00 34.50 31.38 1wi7 s PRO 55 CO 0.04 -0.28 1.12 -1.13 0.04 0.00 0.00 177.00 176.80 1wi7 n SER 56 N 4.20 1.93 -1.14 6.66 3.41 0.10 -3.34 113.62 125.45 1wi7 n SER 56 Ca 0.09 -2.12 0.08 0.00 -0.26 0.00 0.00 58.87 56.66 1wi7 n SER 56 Cb 0.47 -0.32 0.27 0.00 -0.26 0.00 0.00 64.21 64.38 1wi7 n SER 56 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1wi7 n ASN 57 N 0.29 4.00 -2.19 4.04 2.85 -1.26 -4.34 115.26 118.65 1wi7 n ASN 57 Ca 0.10 -2.44 0.02 0.00 -0.11 0.00 0.00 54.58 52.15 1wi7 n ASN 57 Cb 0.36 -0.47 0.04 0.00 1.24 0.00 0.00 39.78 40.95 1wi7 n ASN 57 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1wi7 n PHE 58 N 0.57 0.64 -4.04 1.20 3.72 -1.21 -5.08 117.46 113.26 1wi7 n PHE 58 Ca 0.21 -1.35 -0.06 0.00 -0.05 0.00 0.00 57.45 56.20 1wi7 n PHE 58 Cb 0.75 -0.18 -0.02 0.00 -0.94 0.00 0.00 39.48 39.09 1wi7 n PHE 58 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1wi7 n ILE 59 N -0.08 0.00 -3.39 4.37 -6.64 -1.26 -2.86 119.36 109.50 1wi7 n ILE 59 Ca 0.06 -0.72 -0.13 0.00 -1.77 0.00 0.00 62.75 60.18 1wi7 n ILE 59 Cb 0.97 0.37 -0.09 0.00 -1.44 0.00 0.00 39.64 39.45 1wi7 n ILE 59 CO 0.00 0.00 0.00 -1.59 -1.77 0.00 0.00 176.55 173.19 1wi7 s LYS 60 N -2.39 0.32 1.05 6.28 -2.85 0.39 -4.72 119.74 117.82 1wi7 s LYS 60 Ca 0.12 0.20 -0.16 0.00 -1.00 0.00 0.00 55.97 55.14 1wi7 s LYS 60 Cb 0.00 -0.65 0.09 0.00 -2.06 0.00 0.00 37.83 35.21 1wi7 s LYS 60 CO 0.08 -0.82 0.27 0.39 0.10 0.00 0.00 175.35 175.37 1wi7 n GLU 61 N 5.34 -1.10 -4.00 1.78 4.71 -1.26 -1.80 120.64 124.31 1wi7 n GLU 61 Ca -0.03 -0.29 -0.09 0.00 -0.01 0.00 0.00 57.16 56.74 1wi7 n GLU 61 Cb 0.49 -1.82 -0.08 0.00 -1.01 0.00 0.00 31.44 29.02 1wi7 n GLU 61 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1wi7 s LEU 62 N -1.79 1.54 -0.38 -4.62 1.43 -1.18 -4.76 118.68 108.91 1wi7 s LEU 62 Ca 0.58 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 1wi7 s LEU 62 Cb -0.17 0.77 0.14 0.00 0.03 0.00 0.00 46.19 46.96 1wi7 s LEU 62 CO 0.66 -0.76 0.23 -0.44 0.23 0.00 0.00 176.35 176.28 1wi7 s SER 63 N -2.95 3.06 0.00 2.29 0.01 -1.26 -4.79 113.70 110.06 1wi7 s SER 63 Ca 0.14 -2.39 0.00 0.00 1.31 0.00 0.00 55.95 55.00 1wi7 s SER 63 Cb 0.06 -0.59 0.00 0.00 0.21 0.00 0.00 66.02 65.69 1wi7 s SER 63 CO -0.04 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 173.93 1wi7 n GLY 64 N 3.79 -1.23 3.57 3.44 0.00 -1.26 -4.81 105.19 108.70 1wi7 n GLY 64 Ca 0.13 -2.11 -0.35 0.00 0.00 0.00 0.00 46.02 43.68 1wi7 n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wi7 s PRO 65 N 0.00 3.19 -0.09 1.61 0.04 -1.26 -4.94 135.00 133.55 1wi7 s PRO 65 Ca 0.00 -1.23 -0.27 0.00 0.04 0.00 0.00 61.00 59.54 1wi7 s PRO 65 Cb 0.00 -5.32 -0.02 0.00 0.04 0.00 0.00 34.50 29.20 1wi7 s PRO 65 CO 0.00 -2.96 0.90 -1.12 0.04 0.00 0.00 177.00 173.86 1wi7 s SER 66 N 5.80 7.16 -0.30 6.66 0.01 -1.26 -4.36 113.70 127.39 1wi7 s SER 66 Ca 0.59 1.41 -0.25 0.00 1.31 0.00 0.00 55.95 59.02 1wi7 s SER 66 Cb -0.00 -2.51 0.04 0.00 0.21 0.00 0.00 66.02 63.76 1wi7 s SER 66 CO 0.04 -0.33 0.43 -1.20 0.41 0.00 0.00 173.24 172.59 1wi7 n SER 67 N 4.57 -6.04 0.00 2.44 7.64 -1.26 -5.15 113.62 115.82 1wi7 n SER 67 Ca 0.05 0.10 0.00 0.00 1.01 0.00 0.00 58.87 60.04 1wi7 n SER 67 Cb 0.50 -1.94 0.00 0.00 -1.01 0.00 0.00 64.21 61.76 1wi7 n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64