#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wkp s ASP 7 N 0.00 2.66 0.60 2.89 -4.77 -1.26 -4.96 116.67 111.83 1wkp s ASP 7 Ca 0.00 -1.37 0.29 0.00 -3.30 0.00 0.00 52.55 48.17 1wkp s ASP 7 Cb 0.00 -0.14 1.65 0.00 -1.09 0.00 0.00 42.92 43.33 1wkp s ASP 7 CO 0.00 -0.57 2.05 -0.65 0.70 0.00 0.00 175.17 176.70 1wkp h PRO 8 N 2.05 0.00 0.00 2.11 0.11 -1.99 -0.80 132.00 133.49 1wkp h PRO 8 Ca -0.41 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.66 1wkp h PRO 8 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1wkp h PRO 8 CO 0.72 0.00 -0.52 -0.07 -0.21 0.00 0.00 178.00 177.92 1wkp h LEU 9 N 0.00 0.00 0.05 2.35 3.38 -1.97 -3.01 115.31 116.11 1wkp h LEU 9 Ca 0.10 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.88 1wkp h LEU 9 Cb 0.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1wkp h LEU 9 CO -0.00 0.17 -1.00 0.40 0.09 0.00 0.00 178.44 178.10 1wkp h ILE 10 N 0.00 1.20 -0.81 1.22 2.04 -1.42 0.46 117.51 120.19 1wkp h ILE 10 Ca -0.02 -2.32 -0.00 0.00 1.00 0.00 0.00 64.86 63.52 1wkp h ILE 10 Cb 1.15 2.74 -0.04 0.00 -0.74 0.00 0.00 36.82 39.92 1wkp h ILE 10 CO 0.02 0.55 0.49 0.58 0.00 0.00 0.00 178.15 179.79 1wkp h VAL 11 N -0.70 1.22 -0.00 1.67 2.07 -1.44 -0.25 116.25 118.82 1wkp h VAL 11 Ca -0.24 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1wkp h VAL 11 Cb 1.42 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1wkp h VAL 11 CO -0.04 0.24 -0.07 -1.54 0.02 0.00 0.00 177.57 176.18 1wkp n SER 12 N -4.38 0.37 -1.50 0.57 3.41 -1.14 -4.92 113.62 106.04 1wkp n SER 12 Ca 0.09 -0.60 -0.16 0.00 -0.26 0.00 0.00 58.87 57.93 1wkp n SER 12 Cb 0.06 -0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 63.87 1wkp n SER 12 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1wkp n ARG 13 N -0.96 -1.21 0.01 4.33 1.74 -0.11 -4.90 116.66 115.56 1wkp n ARG 13 Ca 0.16 0.96 -0.13 0.00 -0.77 0.00 0.00 57.85 58.08 1wkp n ARG 13 Cb 0.25 -5.25 -0.09 0.00 -1.02 0.00 0.00 32.46 26.35 1wkp n ARG 13 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1wkp h VAL 14 N 0.00 1.27 -3.15 1.55 2.07 -0.99 -0.91 116.25 116.09 1wkp h VAL 14 Ca -0.36 -0.87 -0.56 0.00 0.82 0.00 0.00 66.70 65.73 1wkp h VAL 14 Cb 1.16 1.86 -0.06 0.00 -1.52 0.00 0.00 31.29 32.73 1wkp h VAL 14 CO 0.48 0.22 1.06 -0.69 0.02 0.00 0.00 177.57 178.67 1wkp s VAL 15 N -4.69 3.90 0.00 2.57 1.01 0.13 -1.11 120.40 122.21 1wkp s VAL 15 Ca -0.15 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.68 1wkp s VAL 15 Cb 0.03 -4.37 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1wkp s VAL 15 CO 0.67 -0.98 0.00 0.61 0.00 0.00 0.00 175.10 175.40 1wkp n GLY 16 N 5.13 1.12 0.22 4.51 0.00 0.52 -4.56 105.19 112.13 1wkp n GLY 16 Ca 0.14 -0.23 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 1wkp n GLY 16 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1wkp h ASP 17 N 0.00 0.70 0.00 1.61 3.32 -1.23 -3.39 116.42 117.43 1wkp h ASP 17 Ca 0.00 -0.25 -0.34 0.00 0.02 0.00 0.00 57.03 56.46 1wkp h ASP 17 Cb 0.00 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.31 1wkp h ASP 17 CO 0.00 0.77 -2.16 0.52 -1.72 0.00 0.00 179.24 176.65 1wkp n VAL 18 N -4.49 1.14 -4.40 -1.35 0.31 -0.67 -5.07 118.33 103.80 1wkp n VAL 18 Ca 0.00 -0.32 -0.26 0.00 -0.01 0.00 0.00 64.34 63.75 1wkp n VAL 18 Cb 0.23 -1.68 -0.12 0.00 -0.91 0.00 0.00 33.84 31.37 1wkp n VAL 18 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1wkp s LEU 19 N -6.95 2.41 0.67 7.52 1.43 -0.27 -4.32 118.68 119.17 1wkp s LEU 19 Ca -0.29 -0.84 -0.11 0.00 -1.03 0.00 0.00 54.13 51.87 1wkp s LEU 19 Cb 0.10 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 45.21 1wkp s LEU 19 CO 0.38 0.11 1.06 -1.81 0.23 0.00 0.00 176.35 176.31 1wkp s ASP 20 N -2.55 5.66 0.21 2.29 1.01 -1.26 -0.36 116.67 121.68 1wkp s ASP 20 Ca 0.18 1.15 -0.32 0.00 0.71 0.00 0.00 52.55 54.28 1wkp s ASP 20 Cb -0.08 -2.04 -0.14 0.00 1.01 0.00 0.00 42.92 41.67 1wkp s ASP 20 CO 0.09 -1.19 1.38 -2.65 0.21 0.00 0.00 175.17 173.00 1wkp n PRO 21 N -2.89 1.85 -3.82 8.23 -0.02 -1.26 -4.86 135.00 132.23 1wkp n PRO 21 Ca 0.06 0.66 -0.10 0.00 -2.02 0.00 0.00 63.50 62.11 1wkp n PRO 21 Cb 0.56 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.69 1wkp n PRO 21 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1wkp s PHE 22 N 0.03 0.10 -0.32 6.00 -0.71 -1.26 -5.00 117.98 116.83 1wkp s PHE 22 Ca 0.71 -0.46 -0.10 0.00 -1.04 0.00 0.00 56.93 56.04 1wkp s PHE 22 Cb -0.70 0.13 -0.00 0.00 -1.21 0.00 0.00 43.02 41.24 1wkp s PHE 22 CO 0.49 -0.75 0.15 1.21 -1.34 0.00 0.00 175.22 174.98 1wkp s ASN 23 N -2.90 5.55 0.20 1.98 2.47 -1.26 -5.06 114.94 115.93 1wkp s ASN 23 Ca 0.10 -0.58 -0.32 0.00 0.42 0.00 0.00 52.86 52.48 1wkp s ASN 23 Cb 0.02 -2.00 -0.14 0.00 -1.45 0.00 0.00 41.25 37.69 1wkp s ASN 23 CO -0.05 -0.21 1.46 0.54 -3.72 0.00 0.00 177.10 175.12 1wkp n ARG 24 N 4.98 2.01 0.00 0.43 1.74 -1.26 -4.79 116.66 119.77 1wkp n ARG 24 Ca -0.14 0.72 0.00 0.00 -0.77 0.00 0.00 57.85 57.66 1wkp n ARG 24 Cb 0.49 -2.41 0.00 0.00 -1.02 0.00 0.00 32.46 29.52 1wkp n ARG 24 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1wkp n SER 25 N 2.59 1.79 -4.27 0.55 3.41 0.85 -5.01 113.62 113.53 1wkp n SER 25 Ca 0.14 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.54 1wkp n SER 25 Cb 0.30 0.20 -0.12 0.00 -0.26 0.00 0.00 64.21 64.33 1wkp n SER 25 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1wkp s ILE 26 N -1.29 1.55 0.25 -1.33 -4.36 -1.12 -4.98 121.20 109.92 1wkp s ILE 26 Ca 0.00 -1.62 -0.31 0.00 -0.26 0.00 0.00 60.65 58.47 1wkp s ILE 26 Cb 0.00 -1.53 -0.13 0.00 1.25 0.00 0.00 42.46 42.05 1wkp s ILE 26 CO 0.00 -0.22 1.35 0.41 0.24 0.00 0.00 174.94 176.73 1wkp n THR 27 N 0.84 1.16 -3.62 8.37 -1.04 -1.26 -4.59 114.28 114.13 1wkp n THR 27 Ca -0.18 -0.29 -0.27 0.00 -2.04 0.00 0.00 64.05 61.28 1wkp n THR 27 Cb 0.55 -1.43 -0.17 0.00 -1.82 0.00 0.00 70.33 67.47 1wkp n THR 27 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1wkp s LEU 28 N -0.03 0.54 -0.21 -4.42 2.96 -1.26 -1.39 118.68 114.87 1wkp s LEU 28 Ca 0.66 -0.76 -0.00 0.00 -0.22 0.00 0.00 54.13 53.80 1wkp s LEU 28 Cb -0.65 -0.32 0.02 0.00 0.50 0.00 0.00 46.19 45.73 1wkp s LEU 28 CO 0.52 -0.36 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.52 1wkp s LYS 29 N 2.08 3.00 -0.18 1.98 -0.14 -0.53 -4.99 119.74 120.96 1wkp s LYS 29 Ca 0.03 -0.84 -0.01 0.00 -1.36 0.00 0.00 55.97 53.78 1wkp s LYS 29 Cb -0.16 -2.77 -0.00 0.00 -1.68 0.00 0.00 37.83 33.22 1wkp s LYS 29 CO -0.13 -0.26 -0.12 0.08 -0.76 0.00 0.00 175.35 174.15 1wkp s VAL 30 N 1.33 2.87 -0.08 3.17 1.01 -1.26 -1.47 120.40 125.96 1wkp s VAL 30 Ca 0.03 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.34 1wkp s VAL 30 Cb -0.14 -2.24 0.02 0.00 0.00 0.00 0.00 36.38 34.01 1wkp s VAL 30 CO -0.09 0.49 -0.09 -0.89 0.00 0.00 0.00 175.10 174.53 1wkp s THR 31 N 1.04 0.97 -0.35 3.92 2.01 -0.14 0.01 115.64 123.10 1wkp s THR 31 Ca -0.01 -0.32 -0.09 0.00 0.31 0.00 0.00 61.69 61.59 1wkp s THR 31 Cb -0.15 -0.95 0.02 0.00 0.01 0.00 0.00 72.50 71.44 1wkp s THR 31 CO -0.03 0.34 0.16 -0.31 -0.69 0.00 0.00 174.62 174.09 1wkp s TYR 32 N 1.22 3.22 0.00 4.92 2.02 -0.49 -0.04 117.35 128.21 1wkp s TYR 32 Ca -0.05 -1.00 0.00 0.00 -0.37 0.00 0.00 57.07 55.65 1wkp s TYR 32 Cb -0.14 -2.37 0.00 0.00 -0.40 0.00 0.00 41.96 39.05 1wkp s TYR 32 CO -0.02 -0.63 0.00 0.41 -1.57 0.00 0.00 175.55 173.74 1wkp n GLY 33 N 4.94 2.53 0.86 0.71 0.00 -1.26 -1.12 105.19 111.85 1wkp n GLY 33 Ca -0.13 0.32 0.10 0.00 0.00 0.00 0.00 46.02 46.32 1wkp n GLY 33 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wkp n GLN 34 N 5.74 1.96 -3.51 1.61 6.02 -1.26 -4.94 117.38 123.00 1wkp n GLN 34 Ca 0.00 -1.80 -0.41 0.00 -0.01 0.00 0.00 57.00 54.78 1wkp n GLN 34 Cb 0.00 -1.41 -0.10 0.00 1.02 0.00 0.00 30.24 29.75 1wkp n GLN 34 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1wkp s ARG 35 N -1.68 3.46 0.02 -1.09 0.52 -0.27 -5.06 118.95 114.84 1wkp s ARG 35 Ca 0.26 -0.65 -0.30 0.00 -0.52 0.00 0.00 55.73 54.51 1wkp s ARG 35 Cb 0.18 -3.82 -0.05 0.00 0.52 0.00 0.00 34.95 31.78 1wkp s ARG 35 CO 0.26 -0.48 1.23 -2.00 0.02 0.00 0.00 175.30 174.34 1wkp s GLU 36 N 1.75 4.38 -0.20 3.54 2.12 -1.26 -1.39 118.70 127.64 1wkp s GLU 36 Ca 0.07 1.78 -0.29 0.00 0.36 0.00 0.00 54.97 56.88 1wkp s GLU 36 Cb -0.17 -3.44 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 1wkp s GLU 36 CO 0.11 -0.37 1.68 0.08 -0.54 0.00 0.00 175.26 176.22 1wkp s VAL 37 N 1.62 3.60 0.15 3.70 1.01 0.10 -4.99 120.40 125.60 1wkp s VAL 37 Ca 0.59 0.68 0.09 0.00 0.00 0.00 0.00 61.98 63.34 1wkp s VAL 37 Cb -0.28 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1wkp s VAL 37 CO 0.27 -0.25 -0.16 0.42 0.00 0.00 0.00 175.10 175.38 1wkp s THR 38 N 5.34 2.89 -0.13 3.92 -4.23 -1.26 -4.65 115.64 117.52 1wkp s THR 38 Ca 0.74 -1.66 -0.35 0.00 -1.18 0.00 0.00 61.69 59.25 1wkp s THR 38 Cb -0.27 -2.38 -0.12 0.00 1.34 0.00 0.00 72.50 71.07 1wkp s THR 38 CO 0.30 -0.02 1.89 0.59 -0.54 0.00 0.00 174.62 176.84 1wkp n ASN 39 N 0.41 3.28 0.00 3.99 5.03 -1.25 -1.83 115.26 124.89 1wkp n ASN 39 Ca -0.13 0.95 0.00 0.00 0.87 0.00 0.00 54.58 56.27 1wkp n ASN 39 Cb 0.54 -1.34 0.00 0.00 -1.02 0.00 0.00 39.78 37.96 1wkp n ASN 39 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1wkp n GLY 40 N 4.50 0.75 3.76 7.41 0.00 -0.22 -5.00 105.19 116.39 1wkp n GLY 40 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1wkp n GLY 40 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wkp s LEU 41 N 0.00 4.37 -0.25 0.99 2.96 -0.76 -4.54 118.68 121.44 1wkp s LEU 41 Ca 0.00 2.81 -0.24 0.00 -0.22 0.00 0.00 54.13 56.48 1wkp s LEU 41 Cb 0.00 -3.64 -0.01 0.00 0.50 0.00 0.00 46.19 43.04 1wkp s LEU 41 CO 0.00 -0.75 0.79 0.20 -1.32 0.00 0.00 176.35 175.27 1wkp s ASN 42 N 0.13 6.77 -0.06 3.68 0.01 -1.26 -0.73 114.94 123.47 1wkp s ASN 42 Ca 0.57 0.93 0.05 0.00 -0.71 0.00 0.00 52.86 53.70 1wkp s ASN 42 Cb -0.44 -2.42 -0.01 0.00 0.41 0.00 0.00 41.25 38.79 1wkp s ASN 42 CO 0.50 -0.51 -0.23 -0.76 -1.51 0.00 0.00 177.10 174.59 1wkp s LEU 43 N 2.81 2.19 0.39 0.60 1.43 0.03 -4.96 118.68 121.18 1wkp s LEU 43 Ca 0.33 -0.46 -0.24 0.00 -1.03 0.00 0.00 54.13 52.73 1wkp s LEU 43 Cb -0.15 -1.41 -0.09 0.00 0.03 0.00 0.00 46.19 44.57 1wkp s LEU 43 CO 0.08 0.25 1.06 -0.13 0.23 0.00 0.00 176.35 177.85 1wkp s ARG 44 N -0.20 4.17 0.50 1.70 0.52 -1.26 -4.30 118.95 120.08 1wkp s ARG 44 Ca -0.02 1.55 0.29 0.00 -0.52 0.00 0.00 55.73 57.02 1wkp s ARG 44 Cb -0.13 -2.58 1.38 0.00 0.52 0.00 0.00 34.95 34.14 1wkp s ARG 44 CO 0.03 -0.14 1.85 -1.35 0.02 0.00 0.00 175.30 175.72 1wkp h PRO 45 N 2.56 0.11 0.00 3.54 0.11 -1.85 -1.04 132.00 135.44 1wkp h PRO 45 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1wkp h PRO 45 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1wkp h PRO 45 CO 0.62 0.07 0.00 -1.13 -0.21 0.00 0.00 178.00 177.36 1wkp n SER 46 N -4.34 0.68 0.06 -2.05 3.41 -1.26 -2.65 113.62 107.46 1wkp n SER 46 Ca 0.21 0.63 0.11 0.00 -0.26 0.00 0.00 58.87 59.57 1wkp n SER 46 Cb 0.96 -0.79 0.03 0.00 -0.26 0.00 0.00 64.21 64.15 1wkp n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wkp n GLN 47 N -2.21 0.42 -0.28 4.33 6.02 -0.40 -4.19 117.38 121.07 1wkp n GLN 47 Ca 0.03 0.04 0.08 0.00 -0.01 0.00 0.00 57.00 57.14 1wkp n GLN 47 Cb 0.28 -1.68 0.20 0.00 1.02 0.00 0.00 30.24 30.06 1wkp n GLN 47 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1wkp n VAL 48 N -2.25 1.96 -0.34 5.09 0.24 -1.09 -4.68 118.33 117.27 1wkp n VAL 48 Ca 0.01 -1.84 0.08 0.00 -2.04 0.00 0.00 64.34 60.55 1wkp n VAL 48 Cb 0.49 -0.12 0.28 0.00 -1.47 0.00 0.00 33.84 33.01 1wkp n VAL 48 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1wkp h GLN 49 N 1.21 0.89 -6.18 7.34 4.20 -1.70 -3.42 115.11 117.45 1wkp h GLN 49 Ca 0.00 -0.05 -0.52 0.00 0.06 0.00 0.00 58.65 58.14 1wkp h GLN 49 Cb 1.19 -0.20 -0.06 0.00 0.30 0.00 0.00 27.48 28.70 1wkp h GLN 49 CO 0.12 0.59 -0.54 -0.80 -0.67 0.00 0.00 178.83 177.54 1wkp s ASN 50 N -5.72 5.16 0.35 1.46 -0.87 -1.26 -4.56 114.94 109.50 1wkp s ASN 50 Ca -0.11 -0.45 -0.28 0.00 -1.57 0.00 0.00 52.86 50.44 1wkp s ASN 50 Cb 0.22 -1.11 -0.10 0.00 -0.02 0.00 0.00 41.25 40.24 1wkp s ASN 50 CO 0.80 -0.13 1.37 -1.59 -2.57 0.00 0.00 177.10 174.98 1wkp s LYS 51 N -3.84 4.23 0.82 -0.60 -2.85 -1.26 -5.00 119.74 111.24 1wkp s LYS 51 Ca 0.35 2.34 -0.12 0.00 -1.00 0.00 0.00 55.97 57.54 1wkp s LYS 51 Cb -0.06 -3.01 0.09 0.00 -2.06 0.00 0.00 37.83 32.78 1wkp s LYS 51 CO 0.24 -0.34 1.15 -1.25 0.10 0.00 0.00 175.35 175.25 1wkp s PRO 52 N -1.94 1.88 0.16 1.78 0.04 -1.26 -4.96 135.00 130.70 1wkp s PRO 52 Ca 0.51 0.27 -0.28 0.00 0.04 0.00 0.00 61.00 61.54 1wkp s PRO 52 Cb -0.42 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.12 1wkp s PRO 52 CO 0.56 -1.68 0.89 1.03 0.04 0.00 0.00 177.00 177.84 1wkp s ARG 53 N -5.41 4.70 -0.14 4.56 1.81 0.95 -4.88 118.95 120.54 1wkp s ARG 53 Ca 0.62 1.36 -0.00 0.00 -1.72 0.00 0.00 55.73 55.98 1wkp s ARG 53 Cb -0.12 -3.32 0.03 0.00 -0.45 0.00 0.00 34.95 31.09 1wkp s ARG 53 CO 0.51 0.41 -0.07 0.08 -0.68 0.00 0.00 175.30 175.55 1wkp s VAL 54 N -0.67 1.12 -0.07 3.52 1.01 -1.26 -0.97 120.40 123.09 1wkp s VAL 54 Ca 0.41 -0.48 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 1wkp s VAL 54 Cb -0.24 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 1wkp s VAL 54 CO 0.29 0.27 0.10 -1.61 0.00 0.00 0.00 175.10 174.15 1wkp s GLU 55 N 1.65 3.24 0.20 2.72 2.02 -0.54 -2.80 118.70 125.19 1wkp s GLU 55 Ca 0.03 -0.30 0.08 0.00 0.02 0.00 0.00 54.97 54.80 1wkp s GLU 55 Cb -0.14 -3.00 -0.05 0.00 0.10 0.00 0.00 34.13 31.04 1wkp s GLU 55 CO -0.08 0.72 -0.15 0.96 0.02 0.00 0.00 175.26 176.72 1wkp s ILE 56 N -1.06 1.80 0.00 -1.63 -4.36 -0.34 -1.45 121.20 114.15 1wkp s ILE 56 Ca 0.18 -2.18 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 1wkp s ILE 56 Cb -0.12 -2.02 0.00 0.00 1.25 0.00 0.00 42.46 41.57 1wkp s ILE 56 CO 0.08 -0.54 0.00 0.61 0.24 0.00 0.00 174.94 175.32 1wkp n GLY 57 N -0.29 1.81 0.00 6.27 0.00 -0.49 -3.59 105.19 108.90 1wkp n GLY 57 Ca -0.09 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1wkp n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wkp n GLY 58 N 5.00 3.28 0.90 -0.02 0.00 -1.26 -0.03 105.19 113.05 1wkp n GLY 58 Ca 0.00 -1.51 -0.00 0.00 0.00 0.00 0.00 46.02 44.51 1wkp n GLY 58 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1wkp n GLU 59 N -1.76 0.03 -2.35 1.61 2.13 -1.26 -4.77 120.64 114.27 1wkp n GLU 59 Ca 0.00 0.01 -0.42 0.00 0.66 0.00 0.00 57.16 57.41 1wkp n GLU 59 Cb 0.00 -0.31 -0.03 0.00 0.27 0.00 0.00 31.44 31.38 1wkp n GLU 59 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1wkp s ASP 60 N -5.37 6.93 0.44 4.31 -1.08 -1.26 -4.92 116.67 115.72 1wkp s ASP 60 Ca -0.02 1.87 0.30 0.00 -0.52 0.00 0.00 52.55 54.19 1wkp s ASP 60 Cb 0.00 -2.55 1.26 0.00 -1.46 0.00 0.00 42.92 40.17 1wkp s ASP 60 CO 0.02 -0.71 1.89 -0.07 0.52 0.00 0.00 175.17 176.82 1wkp h LEU 61 N 8.96 0.00 -0.08 -1.34 3.38 -1.94 -2.92 115.31 121.37 1wkp h LEU 61 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1wkp h LEU 61 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1wkp h LEU 61 CO 0.92 0.00 -0.10 0.54 0.09 0.00 0.00 178.44 179.89 1wkp n ARG 62 N -2.74 0.36 -2.87 1.13 1.74 -1.26 -4.33 116.66 108.69 1wkp n ARG 62 Ca 0.01 -0.08 -0.33 0.00 -0.77 0.00 0.00 57.85 56.68 1wkp n ARG 62 Cb 0.26 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.13 1wkp n ARG 62 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1wkp s ASN 63 N -2.70 6.92 0.16 0.55 -0.87 -1.10 -4.95 114.94 112.95 1wkp s ASN 63 Ca 0.23 1.63 0.11 0.00 -1.57 0.00 0.00 52.86 53.25 1wkp s ASN 63 Cb 0.20 -2.51 -0.04 0.00 -0.02 0.00 0.00 41.25 38.87 1wkp s ASN 63 CO 0.51 -0.33 -0.24 -0.36 -2.57 0.00 0.00 177.10 174.11 1wkp s PHE 64 N -2.14 2.36 0.13 2.20 0.08 -1.26 -1.19 117.98 118.15 1wkp s PHE 64 Ca 0.61 -0.35 0.06 0.00 0.12 0.00 0.00 56.93 57.37 1wkp s PHE 64 Cb -0.09 -1.22 -0.04 0.00 -0.57 0.00 0.00 43.02 41.10 1wkp s PHE 64 CO 0.14 0.42 -0.14 0.71 -0.10 0.00 0.00 175.22 176.25 1wkp s TYR 65 N -1.35 1.43 -0.08 0.36 1.51 0.14 -1.75 117.35 117.60 1wkp s TYR 65 Ca 0.18 -0.56 0.04 0.00 -1.01 0.00 0.00 57.07 55.72 1wkp s TYR 65 Cb -0.09 -0.74 -0.00 0.00 -0.11 0.00 0.00 41.96 41.01 1wkp s TYR 65 CO 0.09 0.16 -0.23 0.99 -1.11 0.00 0.00 175.55 175.45 1wkp s THR 66 N -2.21 1.95 -0.13 -0.71 2.01 -0.69 -0.64 115.64 115.22 1wkp s THR 66 Ca 0.10 -0.97 -0.02 0.00 0.31 0.00 0.00 61.69 61.11 1wkp s THR 66 Cb -0.04 -1.68 -0.03 0.00 0.01 0.00 0.00 72.50 70.76 1wkp s THR 66 CO 0.03 0.54 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.22 1wkp s LEU 67 N 0.24 3.16 -0.06 4.42 2.96 0.57 -1.29 118.68 128.67 1wkp s LEU 67 Ca -0.14 -0.13 0.06 0.00 -0.22 0.00 0.00 54.13 53.69 1wkp s LEU 67 Cb -0.17 -1.74 -0.01 0.00 0.50 0.00 0.00 46.19 44.78 1wkp s LEU 67 CO 0.07 0.21 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.38 1wkp s VAL 68 N 0.09 2.01 -0.21 1.68 1.01 0.23 -1.65 120.40 123.57 1wkp s VAL 68 Ca -0.02 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 60.95 1wkp s VAL 68 Cb -0.14 -1.71 0.03 0.00 0.00 0.00 0.00 36.38 34.57 1wkp s VAL 68 CO 0.03 0.56 -0.16 -0.32 0.00 0.00 0.00 175.10 175.21 1wkp s MET 69 N -0.07 2.66 0.20 2.72 1.75 -0.61 0.03 119.30 125.99 1wkp s MET 69 Ca -0.06 -1.00 0.08 0.00 -1.25 0.00 0.00 55.69 53.46 1wkp s MET 69 Cb -0.14 -2.65 -0.05 0.00 2.84 0.00 0.00 34.83 34.83 1wkp s MET 69 CO 0.04 -0.34 -0.15 0.14 -0.65 0.00 0.00 175.02 174.06 1wkp s VAL 70 N 1.24 1.77 -0.33 10.11 -7.23 -0.26 -0.02 120.40 125.68 1wkp s VAL 70 Ca -0.00 -2.18 0.00 0.00 -1.81 0.00 0.00 61.98 58.00 1wkp s VAL 70 Cb -0.16 -2.02 0.08 0.00 0.56 0.00 0.00 36.38 34.84 1wkp s VAL 70 CO -0.10 -0.55 0.04 -0.62 -0.31 0.00 0.00 175.10 173.56 1wkp s ASP 71 N -3.24 4.87 0.00 4.85 -1.08 0.23 -1.01 116.67 121.29 1wkp s ASP 71 Ca 0.22 -1.74 0.18 0.00 -0.52 0.00 0.00 52.55 50.70 1wkp s ASP 71 Cb -0.02 -1.69 0.88 0.00 -1.46 0.00 0.00 42.92 40.64 1wkp s ASP 71 CO 0.07 -0.35 1.57 -0.81 0.52 0.00 0.00 175.17 176.17 1wkp n PRO 72 N 4.47 0.17 -1.61 4.34 -0.04 -1.25 -1.11 135.00 139.97 1wkp n PRO 72 Ca -0.06 0.14 -0.25 0.00 -0.04 0.00 0.00 63.50 63.29 1wkp n PRO 72 Cb 0.42 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.45 1wkp n PRO 72 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wkp n ASP 73 N -1.36 5.56 -4.69 3.54 8.00 -1.26 -4.61 116.55 121.73 1wkp n ASP 73 Ca 0.07 -3.77 -0.35 0.00 0.71 0.00 0.00 54.79 51.45 1wkp n ASP 73 Cb 0.17 -0.61 -0.09 0.00 -0.02 0.00 0.00 41.12 40.57 1wkp n ASP 73 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1wkp s VAL 74 N -4.49 4.78 -0.46 2.53 1.01 -1.26 -1.45 120.40 121.06 1wkp s VAL 74 Ca 0.55 -0.05 0.26 0.00 0.00 0.00 0.00 61.98 62.74 1wkp s VAL 74 Cb 0.45 -3.11 0.32 0.00 0.00 0.00 0.00 36.38 34.04 1wkp s VAL 74 CO 0.02 0.53 1.73 1.55 0.00 0.00 0.00 175.10 178.93 1wkp h PRO 75 N 6.02 0.00 -2.78 2.72 0.13 -1.90 -1.78 132.00 134.40 1wkp h PRO 75 Ca -0.43 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 1wkp h PRO 75 Cb 1.18 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.10 1wkp h PRO 75 CO 0.64 0.00 -0.19 -1.54 -0.23 0.00 0.00 178.00 176.69 1wkp s SER 76 N -5.33 -0.33 0.47 1.44 1.04 -0.53 -4.33 113.70 106.13 1wkp s SER 76 Ca 0.07 0.40 0.18 0.00 0.48 0.00 0.00 55.95 57.08 1wkp s SER 76 Cb 0.09 0.50 1.17 0.00 0.10 0.00 0.00 66.02 67.88 1wkp s SER 76 CO 0.59 -0.39 1.99 -0.65 0.98 0.00 0.00 173.24 175.76 1wkp h PRO 77 N 4.18 0.24 0.00 4.02 0.11 -1.76 -1.68 132.00 137.11 1wkp h PRO 77 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1wkp h PRO 77 Cb 1.17 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1wkp h PRO 77 CO 0.35 0.16 0.00 0.66 -0.21 0.00 0.00 178.00 178.96 1wkp h SER 78 N 0.24 0.00 -1.83 -2.05 4.64 -1.95 -3.36 113.55 109.24 1wkp h SER 78 Ca 0.27 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 61.10 1wkp h SER 78 Cb 0.72 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.47 1wkp h SER 78 CO -0.05 0.00 -0.92 -3.20 -0.87 0.00 0.00 176.83 171.79 1wkp n ASN 79 N -2.85 -0.85 -3.69 4.97 4.05 -0.69 -5.06 115.26 111.15 1wkp n ASN 79 Ca 0.04 -2.65 -0.42 0.00 0.45 0.00 0.00 54.58 52.01 1wkp n ASN 79 Cb 0.49 -0.07 -0.00 0.00 1.23 0.00 0.00 39.78 41.43 1wkp n ASN 79 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1wkp n PRO 80 N 2.21 3.49 0.15 1.20 -0.04 -0.88 -4.14 135.00 136.99 1wkp n PRO 80 Ca 0.23 -3.01 0.13 0.00 -0.04 0.00 0.00 63.50 60.81 1wkp n PRO 80 Cb 0.52 -3.00 0.37 0.00 -0.04 0.00 0.00 33.50 31.36 1wkp n PRO 80 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1wkp h HIS 81 N 5.58 0.00 -0.09 0.54 2.07 -1.82 -3.12 115.15 118.30 1wkp h HIS 81 Ca 0.56 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.08 1wkp h HIS 81 Cb 0.54 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.52 1wkp h HIS 81 CO 1.46 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 177.60 1wkp n LEU 82 N -2.52 2.50 -4.77 6.12 4.77 -0.68 -4.88 117.00 117.53 1wkp n LEU 82 Ca 0.04 -0.90 -0.39 0.00 -0.03 0.00 0.00 56.01 54.73 1wkp n LEU 82 Cb 0.42 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 1wkp n LEU 82 CO 0.30 0.45 0.93 0.00 -1.33 0.00 0.00 177.39 177.74 1wkp s ARG 83 N -1.90 4.04 0.26 3.23 1.70 -1.18 0.46 118.95 125.55 1wkp s ARG 83 Ca 0.33 2.09 -0.02 0.00 -0.47 0.00 0.00 55.73 57.66 1wkp s ARG 83 Cb 0.20 -2.78 -0.04 0.00 -0.57 0.00 0.00 34.95 31.76 1wkp s ARG 83 CO 0.31 -0.41 0.48 -1.21 -1.08 0.00 0.00 175.30 173.39 1wkp s GLU 84 N -2.18 3.56 -0.28 3.89 2.02 0.34 -3.90 118.70 122.15 1wkp s GLU 84 Ca 0.56 -0.20 -0.14 0.00 0.02 0.00 0.00 54.97 55.21 1wkp s GLU 84 Cb -0.37 -2.74 -0.04 0.00 0.10 0.00 0.00 34.13 31.09 1wkp s GLU 84 CO 0.47 0.29 0.31 -0.47 0.02 0.00 0.00 175.26 175.88 1wkp s TYR 85 N -2.02 3.24 -0.34 1.61 5.04 -0.27 -0.20 117.35 124.41 1wkp s TYR 85 Ca 0.41 0.30 -0.27 0.00 -2.44 0.00 0.00 57.07 55.07 1wkp s TYR 85 Cb -0.11 -2.51 0.01 0.00 0.35 0.00 0.00 41.96 39.70 1wkp s TYR 85 CO 0.30 -0.22 0.96 -1.17 -1.34 0.00 0.00 175.55 174.09 1wkp s LEU 86 N 1.97 3.98 0.04 6.97 2.96 -0.05 -0.60 118.68 133.94 1wkp s LEU 86 Ca 0.12 0.77 0.20 0.00 -0.22 0.00 0.00 54.13 55.00 1wkp s LEU 86 Cb -0.16 -3.34 -0.18 0.00 0.50 0.00 0.00 46.19 43.01 1wkp s LEU 86 CO 0.10 -0.83 0.68 1.41 -1.32 0.00 0.00 176.35 176.39 1wkp n HIS 87 N 6.73 0.55 -3.64 5.38 8.25 0.98 -4.84 115.22 128.62 1wkp n HIS 87 Ca 0.08 0.17 -0.06 0.00 -0.26 0.00 0.00 57.72 57.65 1wkp n HIS 87 Cb 0.48 -0.86 -0.07 0.00 1.12 0.00 0.00 29.99 30.66 1wkp n HIS 87 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 1wkp s TRP 88 N -3.17 -0.49 -0.06 4.41 -0.00 -1.18 -0.87 118.94 117.57 1wkp s TRP 88 Ca -0.05 1.11 -0.02 0.00 -0.00 0.00 0.00 56.10 57.13 1wkp s TRP 88 Cb 0.10 0.37 0.04 0.00 -0.00 0.00 0.00 33.47 33.97 1wkp s TRP 88 CO 0.84 -0.24 0.08 -1.17 -0.00 0.00 0.00 176.95 176.46 1wkp s LEU 89 N 0.65 0.12 -0.11 5.86 0.20 -0.56 -1.57 118.68 123.27 1wkp s LEU 89 Ca -0.01 0.07 0.00 0.00 0.69 0.00 0.00 54.13 54.88 1wkp s LEU 89 Cb -0.04 -0.07 0.02 0.00 -0.43 0.00 0.00 46.19 45.66 1wkp s LEU 89 CO -0.10 -0.26 -0.09 -0.69 -0.29 0.00 0.00 176.35 174.92 1wkp s VAL 90 N 2.19 1.09 0.51 1.68 1.01 -0.66 -1.42 120.40 124.80 1wkp s VAL 90 Ca 0.05 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 61.73 1wkp s VAL 90 Cb -0.12 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1wkp s VAL 90 CO -0.04 0.37 0.29 0.42 0.00 0.00 0.00 175.10 176.15 1wkp s THR 91 N 1.52 1.72 -1.59 3.92 -4.23 0.03 -0.32 115.64 116.70 1wkp s THR 91 Ca 0.02 -1.61 -0.15 0.00 -1.18 0.00 0.00 61.69 58.77 1wkp s THR 91 Cb -0.13 -2.33 0.11 0.00 1.34 0.00 0.00 72.50 71.49 1wkp s THR 91 CO -0.07 0.00 0.89 0.47 -0.54 0.00 0.00 174.62 175.37 1wkp n ASP 92 N -1.58 -4.02 -4.65 3.99 8.00 -1.01 0.21 116.55 117.49 1wkp n ASP 92 Ca -0.04 -0.87 -0.43 0.00 0.71 0.00 0.00 54.79 54.15 1wkp n ASP 92 Cb 0.65 -3.44 -0.02 0.00 -0.02 0.00 0.00 41.12 38.28 1wkp n ASP 92 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1wkp s ILE 93 N -3.33 4.61 0.39 0.53 1.01 0.19 -4.37 121.20 120.23 1wkp s ILE 93 Ca 0.65 1.91 -0.27 0.00 0.00 0.00 0.00 60.65 62.95 1wkp s ILE 93 Cb -0.34 -4.34 -0.10 0.00 0.01 0.00 0.00 42.46 37.69 1wkp s ILE 93 CO 0.87 -0.28 1.46 -2.84 0.00 0.00 0.00 174.94 174.14 1wkp s PRO 94 N 3.37 4.00 0.21 2.79 0.02 -1.26 0.27 135.00 144.40 1wkp s PRO 94 Ca 0.45 2.50 -0.31 0.00 0.02 0.00 0.00 61.00 63.66 1wkp s PRO 94 Cb -0.14 -2.88 -0.15 0.00 0.02 0.00 0.00 34.50 31.34 1wkp s PRO 94 CO 0.10 -0.59 1.00 0.00 -0.33 0.00 0.00 177.00 177.18 1wkp n ALA 95 N 0.29 -1.03 -1.18 -1.55 0.00 -0.33 -2.02 120.51 114.69 1wkp n ALA 95 Ca 0.02 0.44 -0.06 0.00 0.00 0.00 0.00 53.44 53.84 1wkp n ALA 95 Cb 0.40 -1.95 -0.03 0.00 0.00 0.00 0.00 19.45 17.88 1wkp n ALA 95 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1wkp n THR 96 N 0.80 0.00 0.00 0.00 -2.24 0.95 -4.92 114.28 108.87 1wkp n THR 96 Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1wkp n THR 96 Cb 0.27 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 67.47 1wkp n THR 96 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1wkp n THR 97 N -2.46 0.00 -4.00 4.28 -2.24 -0.85 -4.78 114.28 104.23 1wkp n THR 97 Ca -0.06 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.76 1wkp n THR 97 Cb 0.39 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.63 1wkp n THR 97 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1wkp s GLY 98 N 0.00 -0.19 0.53 3.38 0.00 -1.26 -1.20 107.32 108.58 1wkp s GLY 98 Ca 0.00 0.14 0.19 0.00 0.00 0.00 0.00 44.72 45.06 1wkp s GLY 98 CO 0.00 6.18 2.15 -0.91 0.00 0.00 0.00 173.10 180.52 1wkp h THR 99 N 2.00 0.90 -0.10 0.90 1.35 -1.91 -1.23 112.91 114.81 1wkp h THR 99 Ca -0.21 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 65.68 1wkp h THR 99 Cb 1.18 0.98 -0.00 0.00 -1.73 0.00 0.00 68.15 68.57 1wkp h THR 99 CO 0.30 0.00 0.17 0.74 -0.25 0.00 0.00 175.52 176.48 1wkp h THR 100 N 0.00 0.31 -0.02 6.82 2.02 -1.96 -2.40 112.91 117.67 1wkp h THR 100 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1wkp h THR 100 Cb 0.08 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 1wkp h THR 100 CO -0.00 0.00 -0.34 0.49 0.37 0.00 0.00 175.52 176.04 1wkp n PHE 101 N -3.52 0.00 -2.67 3.16 3.01 -0.47 -5.00 117.46 111.98 1wkp n PHE 101 Ca -0.00 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.38 1wkp n PHE 101 Cb 0.26 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.77 1wkp n PHE 101 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1wkp n GLY 102 N 1.29 1.28 3.53 1.37 0.00 -0.91 -4.61 105.19 107.15 1wkp n GLY 102 Ca 0.09 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 43.63 1wkp n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wkp s ASN 103 N -2.44 6.17 -0.52 1.61 0.01 0.13 -4.95 114.94 114.96 1wkp s ASN 103 Ca 0.24 -0.32 -0.26 0.00 -0.71 0.00 0.00 52.86 51.81 1wkp s ASN 103 Cb -0.02 -2.20 0.03 0.00 0.41 0.00 0.00 41.25 39.48 1wkp s ASN 103 CO 0.15 -0.37 1.00 -0.70 -1.51 0.00 0.00 177.10 175.67 1wkp s GLU 104 N 2.01 3.47 -0.05 -0.60 2.12 -1.26 -0.79 118.70 123.60 1wkp s GLU 104 Ca 0.11 0.05 0.20 0.00 0.36 0.00 0.00 54.97 55.70 1wkp s GLU 104 Cb -0.17 -3.99 -0.25 0.00 0.26 0.00 0.00 34.13 29.99 1wkp s GLU 104 CO 0.12 -1.42 0.46 0.44 -0.54 0.00 0.00 175.26 174.32 1wkp n ILE 105 N 6.42 0.71 -3.91 -3.70 -5.35 -0.51 -4.76 119.36 108.27 1wkp n ILE 105 Ca 0.05 -0.65 -0.27 0.00 -0.27 0.00 0.00 62.75 61.62 1wkp n ILE 105 Cb 0.48 -0.31 -0.17 0.00 -1.74 0.00 0.00 39.64 37.90 1wkp n ILE 105 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1wkp s VAL 106 N -3.07 0.99 0.73 7.28 1.01 -0.89 -4.91 120.40 121.55 1wkp s VAL 106 Ca -0.07 -0.27 -0.13 0.00 0.00 0.00 0.00 61.98 61.51 1wkp s VAL 106 Cb 0.10 -1.02 0.04 0.00 0.00 0.00 0.00 36.38 35.50 1wkp s VAL 106 CO 0.86 0.36 1.11 -0.94 0.00 0.00 0.00 175.10 176.49 1wkp s SER 107 N 1.71 4.62 -0.04 3.32 1.04 -1.26 -1.50 113.70 121.59 1wkp s SER 107 Ca 0.05 1.96 -0.30 0.00 0.48 0.00 0.00 55.95 58.14 1wkp s SER 107 Cb -0.13 -2.54 -0.05 0.00 0.10 0.00 0.00 66.02 63.41 1wkp s SER 107 CO -0.08 -1.96 1.41 -0.47 0.98 0.00 0.00 173.24 173.12 1wkp s TYR 108 N -2.58 2.72 -0.17 5.02 6.14 -1.25 -4.35 117.35 122.88 1wkp s TYR 108 Ca 0.65 0.77 -0.02 0.00 0.64 0.00 0.00 57.07 59.11 1wkp s TYR 108 Cb -0.20 -3.66 -0.01 0.00 0.42 0.00 0.00 41.96 38.51 1wkp s TYR 108 CO 0.49 -2.48 -0.10 -2.00 0.64 0.00 0.00 175.55 172.10 1wkp s GLU 109 N 2.87 3.37 0.07 4.97 2.12 -0.05 -4.93 118.70 127.12 1wkp s GLU 109 Ca 0.63 -0.66 -0.31 0.00 0.36 0.00 0.00 54.97 54.99 1wkp s GLU 109 Cb -0.29 -2.79 -0.08 0.00 0.26 0.00 0.00 34.13 31.23 1wkp s GLU 109 CO 0.25 0.02 1.56 0.54 -0.54 0.00 0.00 175.26 177.08 1wkp s ASN 110 N 0.87 6.68 0.09 -1.70 4.22 -1.26 -4.86 114.94 118.98 1wkp s ASN 110 Ca -0.03 2.41 -0.31 0.00 -2.14 0.00 0.00 52.86 52.79 1wkp s ASN 110 Cb -0.15 -2.57 -0.06 0.00 1.28 0.00 0.00 41.25 39.75 1wkp s ASN 110 CO 0.00 -0.82 1.22 -2.16 -2.04 0.00 0.00 177.10 173.30 1wkp s PRO 111 N 2.19 4.43 -0.41 3.55 0.04 -1.26 -4.99 135.00 138.56 1wkp s PRO 111 Ca 0.70 1.81 0.05 0.00 0.04 0.00 0.00 61.00 63.60 1wkp s PRO 111 Cb -0.38 -3.32 0.19 0.00 0.04 0.00 0.00 34.50 31.03 1wkp s PRO 111 CO 0.31 -0.24 0.40 0.45 0.04 0.00 0.00 177.00 177.95 1wkp n SER 112 N 3.70 -0.48 -4.76 6.66 2.88 -1.26 -4.72 113.62 115.64 1wkp n SER 112 Ca 0.08 -2.47 -0.38 0.00 -1.33 0.00 0.00 58.87 54.77 1wkp n SER 112 Cb 0.46 -0.46 0.02 0.00 -0.75 0.00 0.00 64.21 63.48 1wkp n SER 112 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1wkp s PRO 113 N -0.19 3.32 -0.01 -1.46 0.04 -1.26 -4.95 135.00 130.49 1wkp s PRO 113 Ca 0.33 2.04 0.01 0.00 0.04 0.00 0.00 61.00 63.42 1wkp s PRO 113 Cb 0.07 -2.27 0.02 0.00 0.04 0.00 0.00 34.50 32.36 1wkp s PRO 113 CO -0.17 -0.99 0.86 0.25 0.04 0.00 0.00 177.00 176.99 1wkp n THR 114 N -0.91 0.72 -3.61 1.26 -2.24 -1.26 -3.84 114.28 104.40 1wkp n THR 114 Ca 0.10 -0.74 -0.01 0.00 -2.27 0.00 0.00 64.05 61.13 1wkp n THR 114 Cb 0.46 0.61 -0.04 0.00 -2.10 0.00 0.00 70.33 69.27 1wkp n THR 114 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wkp s ALA 115 N -0.77 -2.03 0.00 6.98 0.00 -1.26 -4.98 121.76 119.69 1wkp s ALA 115 Ca 0.02 2.28 0.00 0.00 0.00 0.00 0.00 51.96 54.25 1wkp s ALA 115 Cb 0.02 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.34 1wkp s ALA 115 CO 0.00 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.21 1wkp n GLY 116 N 5.45 -0.97 3.54 0.00 0.00 -1.26 -4.50 105.19 107.45 1wkp n GLY 116 Ca -0.11 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 1wkp n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wkp s ILE 117 N 0.00 5.14 -0.11 -0.61 1.01 -1.26 -4.50 121.20 120.86 1wkp s ILE 117 Ca 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 60.65 60.62 1wkp s ILE 117 Cb 0.00 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 1wkp s ILE 117 CO 0.00 -0.13 0.24 -1.00 0.00 0.00 0.00 174.94 174.05 1wkp s HIS 118 N 2.09 3.57 -0.01 3.97 3.76 0.44 -4.69 115.29 124.42 1wkp s HIS 118 Ca 0.13 0.63 -0.28 0.00 -0.15 0.00 0.00 55.06 55.39 1wkp s HIS 118 Cb -0.16 -2.16 -0.03 0.00 1.11 0.00 0.00 32.58 31.33 1wkp s HIS 118 CO 0.12 0.52 0.89 1.03 -0.85 0.00 0.00 174.74 176.45 1wkp s ARG 119 N -0.43 4.53 -0.21 1.40 0.52 -1.26 -1.02 118.95 122.47 1wkp s ARG 119 Ca 0.16 1.26 -0.03 0.00 -0.52 0.00 0.00 55.73 56.60 1wkp s ARG 119 Cb -0.13 -3.45 -0.00 0.00 0.52 0.00 0.00 34.95 31.89 1wkp s ARG 119 CO 0.05 0.02 -0.07 0.08 0.02 0.00 0.00 175.30 175.40 1wkp s VAL 120 N 0.83 3.18 -0.11 3.52 1.01 0.14 -3.93 120.40 125.05 1wkp s VAL 120 Ca 0.47 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.92 1wkp s VAL 120 Cb -0.20 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1wkp s VAL 120 CO 0.25 0.44 -0.20 -0.69 0.00 0.00 0.00 175.10 174.91 1wkp s VAL 121 N 1.45 2.46 -0.21 2.92 1.01 -0.18 -0.97 120.40 126.88 1wkp s VAL 121 Ca 0.06 -0.88 -0.08 0.00 0.00 0.00 0.00 61.98 61.08 1wkp s VAL 121 Cb -0.14 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1wkp s VAL 121 CO -0.05 0.55 0.07 -0.36 0.00 0.00 0.00 175.10 175.31 1wkp s PHE 122 N 0.34 3.19 -0.06 5.22 0.40 0.87 -1.10 117.98 126.84 1wkp s PHE 122 Ca -0.16 -0.08 0.03 0.00 -0.60 0.00 0.00 56.93 56.13 1wkp s PHE 122 Cb -0.17 -2.15 0.00 0.00 0.51 0.00 0.00 43.02 41.21 1wkp s PHE 122 CO 0.08 -0.03 -0.16 0.42 0.70 0.00 0.00 175.22 176.23 1wkp s ILE 123 N 0.86 1.36 -0.09 0.64 1.09 0.11 -1.65 121.20 123.52 1wkp s ILE 123 Ca 0.04 -0.64 0.03 0.00 -1.10 0.00 0.00 60.65 58.98 1wkp s ILE 123 Cb -0.14 -1.19 -0.02 0.00 -1.06 0.00 0.00 42.46 40.05 1wkp s ILE 123 CO 0.02 0.40 -0.17 -0.22 -0.10 0.00 0.00 174.94 174.87 1wkp s LEU 124 N 0.34 2.53 0.16 2.97 2.96 -0.10 -0.60 118.68 126.94 1wkp s LEU 124 Ca -0.10 -0.34 0.10 0.00 -0.22 0.00 0.00 54.13 53.57 1wkp s LEU 124 Cb -0.14 -1.52 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 1wkp s LEU 124 CO 0.04 0.24 -0.23 -0.36 -1.32 0.00 0.00 176.35 174.72 1wkp s PHE 125 N -0.12 2.10 -0.23 5.38 0.08 -0.41 0.24 117.98 125.02 1wkp s PHE 125 Ca -0.03 -0.40 -0.12 0.00 0.12 0.00 0.00 56.93 56.51 1wkp s PHE 125 Cb -0.14 -1.07 -0.05 0.00 -0.57 0.00 0.00 43.02 41.19 1wkp s PHE 125 CO 0.04 0.39 0.21 0.50 -0.10 0.00 0.00 175.22 176.26 1wkp s ARG 126 N -2.49 4.11 0.61 0.44 3.52 -1.26 -1.71 118.95 122.18 1wkp s ARG 126 Ca 0.16 -0.15 -0.11 0.00 -0.13 0.00 0.00 55.73 55.49 1wkp s ARG 126 Cb -0.08 -3.53 -0.04 0.00 -1.56 0.00 0.00 34.95 29.74 1wkp s ARG 126 CO 0.08 0.06 1.03 -0.65 -0.81 0.00 0.00 175.30 175.00 1wkp s GLN 127 N 1.05 3.62 0.37 5.12 -0.21 -0.72 -4.68 119.66 124.20 1wkp s GLN 127 Ca 0.10 0.77 0.20 0.00 0.02 0.00 0.00 55.36 56.45 1wkp s GLN 127 Cb -0.14 -2.08 0.41 0.00 1.00 0.00 0.00 33.01 32.20 1wkp s GLN 127 CO 0.05 -0.56 1.61 -0.07 -2.12 0.00 0.00 175.29 174.20 1wkp h LEU 128 N -0.24 0.00 0.00 2.90 3.38 -1.89 -3.43 115.31 116.04 1wkp h LEU 128 Ca -0.44 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.54 1wkp h LEU 128 Cb 1.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 1wkp h LEU 128 CO 0.62 0.30 0.04 0.61 0.09 0.00 0.00 178.44 180.10 1wkp n GLY 129 N 0.85 0.91 3.70 0.83 0.00 -1.26 -5.03 105.19 105.18 1wkp n GLY 129 Ca 0.02 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 1wkp n GLY 129 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wkp s ARG 130 N -2.00 4.27 0.05 1.61 3.52 -1.26 -4.85 118.95 120.29 1wkp s ARG 130 Ca 0.01 2.11 -0.02 0.00 -0.13 0.00 0.00 55.73 57.70 1wkp s ARG 130 Cb -0.00 -3.43 -0.03 0.00 -1.56 0.00 0.00 34.95 29.93 1wkp s ARG 130 CO 0.00 -0.56 0.02 1.14 -0.81 0.00 0.00 175.30 175.08 1wkp s GLN 131 N 1.90 0.59 -0.24 5.12 -2.07 -1.26 -5.13 119.66 118.56 1wkp s GLN 131 Ca 0.67 -1.02 -0.18 0.00 -1.82 0.00 0.00 55.36 53.01 1wkp s GLN 131 Cb -0.36 0.21 -0.03 0.00 -1.09 0.00 0.00 33.01 31.74 1wkp s GLN 131 CO 0.29 -0.12 0.50 0.95 -1.32 0.00 0.00 175.29 175.59 1wkp s THR 132 N -3.33 5.09 -0.14 3.63 -4.23 -1.26 -4.92 115.64 110.49 1wkp s THR 132 Ca 0.01 0.87 -0.02 0.00 -1.18 0.00 0.00 61.69 61.37 1wkp s THR 132 Cb 0.03 -3.82 -0.03 0.00 1.34 0.00 0.00 72.50 70.03 1wkp s THR 132 CO -0.08 0.13 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.38 1wkp s VAL 133 N 2.05 3.71 0.49 2.29 1.01 -1.26 -5.12 120.40 123.58 1wkp s VAL 133 Ca 0.21 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.66 1wkp s VAL 133 Cb -0.15 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 1wkp s VAL 133 CO 0.09 0.52 0.86 -0.31 0.00 0.00 0.00 175.10 176.26 1wkp s TYR 134 N 0.17 3.53 0.20 5.22 1.51 -1.26 -5.06 117.35 121.66 1wkp s TYR 134 Ca -0.03 1.10 -0.19 0.00 -1.01 0.00 0.00 57.07 56.94 1wkp s TYR 134 Cb -0.14 -2.51 -0.08 0.00 -0.11 0.00 0.00 41.96 39.12 1wkp s TYR 134 CO 0.03 -0.31 0.69 0.00 -1.11 0.00 0.00 175.55 174.85 1wkp s ALA 135 N -2.68 3.46 0.56 3.71 0.00 -1.26 -5.06 121.76 120.49 1wkp s ALA 135 Ca 0.52 0.12 -0.19 0.00 0.00 0.00 0.00 51.96 52.41 1wkp s ALA 135 Cb -0.10 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.20 1wkp s ALA 135 CO 0.40 0.35 1.15 -1.25 0.00 0.00 0.00 175.76 176.41 1wkp s PRO 136 N -1.87 3.22 0.00 0.00 0.04 -1.26 -4.93 135.00 130.20 1wkp s PRO 136 Ca 0.41 1.65 0.14 0.00 0.04 0.00 0.00 61.00 63.23 1wkp s PRO 136 Cb -0.17 -1.98 0.63 0.00 0.04 0.00 0.00 34.50 33.02 1wkp s PRO 136 CO 0.21 -0.96 1.40 0.41 0.04 0.00 0.00 177.00 178.10 1wkp n GLY 137 N 0.20 -0.86 3.67 0.56 0.00 -1.26 -4.80 105.19 102.71 1wkp n GLY 137 Ca 0.12 -0.06 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1wkp n GLY 137 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1wkp s TRP 138 N -2.80 -0.23 -0.13 1.61 -2.14 -1.26 -5.10 118.94 108.89 1wkp s TRP 138 Ca 0.10 -0.04 0.18 0.00 2.66 0.00 0.00 56.10 59.00 1wkp s TRP 138 Cb 0.09 0.62 -0.17 0.00 -3.10 0.00 0.00 33.47 30.91 1wkp s TRP 138 CO 0.23 -0.82 0.68 0.54 -2.66 0.00 0.00 176.95 174.92 1wkp n ARG 139 N -0.40 0.63 -2.44 3.25 1.74 -1.26 -4.91 116.66 113.27 1wkp n ARG 139 Ca -0.08 0.12 -0.31 0.00 -0.77 0.00 0.00 57.85 56.82 1wkp n ARG 139 Cb 0.61 -1.73 -0.02 0.00 -1.02 0.00 0.00 32.46 30.31 1wkp n ARG 139 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1wkp s GLN 140 N -2.98 3.77 -1.60 5.56 0.00 -1.26 -0.87 119.66 122.26 1wkp s GLN 140 Ca -0.04 0.67 0.00 0.00 -0.00 0.00 0.00 55.36 55.98 1wkp s GLN 140 Cb 0.09 -2.23 0.00 0.00 0.00 0.00 0.00 33.01 30.87 1wkp s GLN 140 CO 0.83 -0.26 0.00 0.09 0.00 0.00 0.00 175.29 175.94 1wkp n ASN 141 N -1.86 -5.42 -4.77 12.60 5.03 0.17 -4.90 115.26 116.12 1wkp n ASN 141 Ca 0.04 -0.02 -0.39 0.00 0.87 0.00 0.00 54.58 55.09 1wkp n ASN 141 Cb 0.54 -4.47 -0.03 0.00 -1.02 0.00 0.00 39.78 34.80 1wkp n ASN 141 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1wkp s PHE 142 N -2.93 3.19 -0.25 3.10 5.36 0.73 -4.56 117.98 122.61 1wkp s PHE 142 Ca 0.00 1.57 0.02 0.00 -0.96 0.00 0.00 56.93 57.56 1wkp s PHE 142 Cb 0.00 -3.41 0.06 0.00 -0.34 0.00 0.00 43.02 39.34 1wkp s PHE 142 CO 0.00 -1.20 -0.08 1.21 -1.46 0.00 0.00 175.22 173.69 1wkp s ASN 143 N -0.98 4.19 0.21 6.13 3.84 -1.26 -0.50 114.94 126.57 1wkp s ASN 143 Ca 0.53 -1.32 -0.09 0.00 0.21 0.00 0.00 52.86 52.18 1wkp s ASN 143 Cb -0.32 -1.38 0.17 0.00 -0.55 0.00 0.00 41.25 39.17 1wkp s ASN 143 CO 0.41 -0.22 1.86 0.74 -2.79 0.00 0.00 177.10 177.11 1wkp h THR 144 N 6.72 1.22 -0.25 -5.21 2.02 -1.96 0.68 112.91 116.13 1wkp h THR 144 Ca -0.18 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 1wkp h THR 144 Cb 1.05 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1wkp h THR 144 CO 0.44 0.23 0.11 0.03 0.37 0.00 0.00 175.52 176.70 1wkp h ARG 145 N 1.09 0.37 -0.46 6.66 3.08 -1.96 0.41 114.38 123.58 1wkp h ARG 145 Ca 0.29 -0.06 -0.12 0.00 0.07 0.00 0.00 59.98 60.16 1wkp h ARG 145 Cb -0.05 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1wkp h ARG 145 CO -0.06 0.38 -0.17 0.93 -1.07 0.00 0.00 179.97 179.99 1wkp h GLU 146 N 0.27 0.92 -0.20 0.04 5.08 -1.89 -2.08 114.58 116.71 1wkp h GLU 146 Ca 0.09 -0.38 0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1wkp h GLU 146 Cb 0.14 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1wkp h GLU 146 CO -0.01 1.03 -0.04 0.35 -1.00 0.00 0.00 179.01 179.34 1wkp h PHE 147 N 0.76 -0.09 -0.88 4.33 3.57 -0.71 -1.37 116.94 122.55 1wkp h PHE 147 Ca 0.11 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.70 1wkp h PHE 147 Cb 0.73 0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.48 1wkp h PHE 147 CO 0.05 -0.08 0.57 0.00 -2.23 0.00 0.00 178.31 176.63 1wkp h ALA 148 N 1.19 1.57 -0.20 2.41 0.00 -0.72 -2.30 119.26 121.22 1wkp h ALA 148 Ca 0.09 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 1wkp h ALA 148 Cb 0.14 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1wkp h ALA 148 CO -0.20 0.28 -0.40 1.49 0.00 0.00 0.00 179.25 180.42 1wkp h GLU 149 N 0.95 0.62 -0.64 0.00 4.81 -0.89 -0.23 114.58 119.19 1wkp h GLU 149 Ca 0.39 -0.40 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1wkp h GLU 149 Cb 0.27 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 1wkp h GLU 149 CO -0.15 1.02 0.20 0.82 -0.73 0.00 0.00 179.01 180.16 1wkp h ILE 150 N 0.30 1.24 -0.61 2.32 2.04 -1.08 -3.11 117.51 118.61 1wkp h ILE 150 Ca 0.01 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1wkp h ILE 150 Cb 1.00 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1wkp h ILE 150 CO 0.09 0.32 0.00 -1.22 0.00 0.00 0.00 178.15 177.34 1wkp n TYR 151 N -4.27 1.59 -4.01 1.37 4.01 -0.88 -4.96 117.16 110.01 1wkp n TYR 151 Ca 0.05 -0.65 -0.29 0.00 -0.16 0.00 0.00 57.90 56.85 1wkp n TYR 151 Cb 0.22 -0.31 -0.01 0.00 -0.31 0.00 0.00 39.34 38.93 1wkp n TYR 151 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1wkp n ASN 152 N 0.93 -1.87 -0.28 7.72 3.02 -0.88 -4.84 115.26 119.06 1wkp n ASN 152 Ca 0.26 -0.96 0.13 0.00 -0.03 0.00 0.00 54.58 53.98 1wkp n ASN 152 Cb 0.96 -3.16 0.45 0.00 -0.61 0.00 0.00 39.78 37.41 1wkp n ASN 152 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1wkp n LEU 153 N -4.43 1.05 0.00 3.41 4.77 -0.15 -4.34 117.00 117.31 1wkp n LEU 153 Ca -0.15 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 1wkp n LEU 153 Cb 0.61 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1wkp n LEU 153 CO 0.78 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 1wkp n GLY 154 N 1.29 2.54 3.88 -0.72 0.00 -1.26 -4.22 105.19 106.70 1wkp n GLY 154 Ca 0.14 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 1wkp n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wkp s LEU 155 N 0.00 4.10 0.69 0.99 1.43 -1.26 -4.86 118.68 119.77 1wkp s LEU 155 Ca 0.00 0.93 -0.17 0.00 -1.03 0.00 0.00 54.13 53.86 1wkp s LEU 155 Cb 0.00 -3.72 0.00 0.00 0.03 0.00 0.00 46.19 42.51 1wkp s LEU 155 CO 0.00 -0.15 1.12 -2.65 0.23 0.00 0.00 176.35 174.90 1wkp n PRO 156 N -0.46 0.72 -0.00 1.29 -0.02 -1.26 -4.58 135.00 130.69 1wkp n PRO 156 Ca 0.00 0.30 0.07 0.00 -2.02 0.00 0.00 63.50 61.86 1wkp n PRO 156 Cb 0.53 -2.36 -0.10 0.00 -0.02 0.00 0.00 33.50 31.56 1wkp n PRO 156 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1wkp n VAL 157 N -2.32 0.00 -3.53 -1.45 0.24 0.14 -4.65 118.33 106.76 1wkp n VAL 157 Ca 0.14 -0.21 -0.15 0.00 -2.04 0.00 0.00 64.34 62.08 1wkp n VAL 157 Cb 0.49 0.72 -0.05 0.00 -1.47 0.00 0.00 33.84 33.53 1wkp n VAL 157 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1wkp s ALA 158 N -2.62 -1.80 -0.10 2.33 0.00 -1.14 -0.11 121.76 118.33 1wkp s ALA 158 Ca 0.02 1.31 -0.30 0.00 0.00 0.00 0.00 51.96 52.99 1wkp s ALA 158 Cb 0.11 -0.10 0.08 0.00 0.00 0.00 0.00 23.12 23.21 1wkp s ALA 158 CO 0.62 -0.40 0.73 0.00 0.00 0.00 0.00 175.76 176.71 1wkp s ALA 159 N -1.47 -1.80 0.04 0.00 0.00 -1.26 -0.93 121.76 116.35 1wkp s ALA 159 Ca -0.07 1.45 -0.18 0.00 0.00 0.00 0.00 51.96 53.16 1wkp s ALA 159 Cb -0.00 -0.27 0.04 0.00 0.00 0.00 0.00 23.12 22.89 1wkp s ALA 159 CO 0.05 -0.36 0.41 0.54 0.00 0.00 0.00 175.76 176.40 1wkp s VAL 160 N -0.96 0.05 -0.01 0.00 0.11 -0.66 -5.00 120.40 113.94 1wkp s VAL 160 Ca -0.08 -0.45 -0.16 0.00 -2.93 0.00 0.00 61.98 58.35 1wkp s VAL 160 Cb -0.01 -0.93 0.03 0.00 -1.53 0.00 0.00 36.38 33.94 1wkp s VAL 160 CO 0.07 -0.25 0.35 0.72 -3.33 0.00 0.00 175.10 172.67 1wkp s PHE 161 N -2.34 -0.22 0.43 1.54 -0.71 -1.26 -0.09 117.98 115.33 1wkp s PHE 161 Ca -0.06 0.31 0.04 0.00 -1.04 0.00 0.00 56.93 56.18 1wkp s PHE 161 Cb -0.01 0.13 -0.05 0.00 -1.21 0.00 0.00 43.02 41.89 1wkp s PHE 161 CO -0.01 -0.44 0.03 1.52 -1.34 0.00 0.00 175.22 174.98 1wkp s TYR 162 N -1.54 2.12 -0.09 3.49 1.13 -0.14 -1.06 117.35 121.25 1wkp s TYR 162 Ca -0.12 -0.89 0.00 0.00 -1.41 0.00 0.00 57.07 54.65 1wkp s TYR 162 Cb -0.04 -1.57 -0.03 0.00 -1.10 0.00 0.00 41.96 39.23 1wkp s TYR 162 CO 0.03 0.21 -0.08 -0.80 -2.51 0.00 0.00 175.55 172.41 1wkp s ASN 163 N -3.72 4.55 0.05 -0.18 0.02 0.09 0.28 114.94 116.03 1wkp s ASN 163 Ca 0.24 -0.09 0.04 0.00 -1.02 0.00 0.00 52.86 52.02 1wkp s ASN 163 Cb 0.06 -1.31 -0.03 0.00 0.02 0.00 0.00 41.25 39.99 1wkp s ASN 163 CO 0.12 0.30 -0.11 -0.55 0.02 0.00 0.00 177.10 176.88 1wkp s SER 164 N -0.44 1.25 -0.02 -1.22 0.15 -0.19 -0.79 113.70 112.43 1wkp s SER 164 Ca 0.06 -0.57 -0.29 0.00 0.70 0.00 0.00 55.95 55.85 1wkp s SER 164 Cb -0.12 -0.01 0.08 0.00 -1.71 0.00 0.00 66.02 64.26 1wkp s SER 164 CO 0.02 -0.14 0.72 0.00 1.20 0.00 0.00 173.24 175.04 1wkp s GLN 165 N -1.63 1.03 0.26 5.44 -2.07 -1.26 -0.42 119.66 121.01 1wkp s GLN 165 Ca -0.06 0.07 -0.30 0.00 -1.82 0.00 0.00 55.36 53.24 1wkp s GLN 165 Cb -0.10 0.48 -0.14 0.00 -1.09 0.00 0.00 33.01 32.17 1wkp s GLN 165 CO 0.01 -0.36 1.32 2.89 -1.32 0.00 0.00 175.29 177.83 1wkp n ARG 166 N 0.57 1.88 0.12 9.60 1.85 -1.25 -4.54 116.66 124.89 1wkp n ARG 166 Ca -0.17 0.67 -0.02 0.00 -1.00 0.00 0.00 57.85 57.33 1wkp n ARG 166 Cb 0.59 -2.26 0.10 0.00 -1.05 0.00 0.00 32.46 29.84 1wkp n ARG 166 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1wkp h GLU 167 N 3.58 0.00 -0.01 2.89 5.08 -1.99 -3.51 114.58 120.62 1wkp h GLU 167 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1wkp h GLU 167 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1wkp h GLU 167 CO 0.71 0.69 0.00 0.43 -1.00 0.00 0.00 179.01 179.84