#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 5.42 0.56 6.15 -4.77 -1.26 -4.90 116.67 117.87 1wkp s ASP 7 Ca 0.00 -0.51 0.30 0.00 -3.30 0.00 0.00 52.55 49.04 1wkp s ASP 7 Cb 0.00 -0.78 1.64 0.00 -1.09 0.00 0.00 42.92 42.69 1wkp s ASP 7 CO 0.00 -0.59 2.15 1.55 0.70 0.00 0.00 175.17 178.98 1wkp h PRO 8 N 0.94 0.00 -0.01 2.11 0.13 -1.98 -0.28 132.00 132.92 1wkp h PRO 8 Ca -0.42 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.57 1wkp h PRO 8 Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1wkp h PRO 8 CO 0.53 0.07 -0.64 -0.07 -0.23 0.00 0.00 178.00 177.66 1wkp h LEU 9 N 0.00 0.03 0.11 1.56 3.38 -1.97 -1.89 115.31 116.54 1wkp h LEU 9 Ca -0.00 -0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 1wkp h LEU 9 Cb 0.22 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1wkp h LEU 9 CO 0.01 0.66 -1.01 0.40 0.09 0.00 0.00 178.44 178.59 1wkp h ILE 10 N 0.02 1.32 -0.87 1.22 2.04 -1.46 0.06 117.51 119.84 1wkp h ILE 10 Ca -0.01 -2.45 -0.01 0.00 1.00 0.00 0.00 64.86 63.39 1wkp h ILE 10 Cb 1.13 2.98 -0.04 0.00 -0.74 0.00 0.00 36.82 40.15 1wkp h ILE 10 CO 0.08 0.68 0.51 0.58 0.00 0.00 0.00 178.15 180.01 1wkp h VAL 11 N -0.42 1.24 -0.00 1.67 2.07 -1.16 -0.82 116.25 118.83 1wkp h VAL 11 Ca -0.21 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1wkp h VAL 11 Cb 1.63 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1wkp h VAL 11 CO 0.09 0.26 -0.07 -1.54 0.02 0.00 0.00 177.57 176.32 1wkp n SER 12 N -4.36 0.24 -1.56 0.57 3.41 -0.71 -4.92 113.62 106.29 1wkp n SER 12 Ca 0.09 -0.33 -0.16 0.00 -0.26 0.00 0.00 58.87 58.21 1wkp n SER 12 Cb 0.07 -0.17 -0.04 0.00 -0.26 0.00 0.00 64.21 63.81 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 -1.14 -1.23 -0.01 4.33 1.74 -0.31 -4.90 116.66 115.13 1wkp n ARG 13 Ca 0.14 0.94 -0.12 0.00 -0.77 0.00 0.00 57.85 58.04 1wkp n ARG 13 Cb 0.27 -5.25 -0.08 0.00 -1.02 0.00 0.00 32.46 26.38 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 1.24 -3.26 1.55 2.07 -1.29 -0.66 116.25 115.90 1wkp h VAL 14 Ca -0.36 -0.74 -0.56 0.00 0.82 0.00 0.00 66.70 65.86 1wkp h VAL 14 Cb 1.18 1.64 -0.06 0.00 -1.52 0.00 0.00 31.29 32.53 1wkp h VAL 14 CO 0.48 0.20 1.04 -0.69 0.02 0.00 0.00 177.57 178.62 1wkp s VAL 15 N -5.01 3.95 0.00 2.57 1.01 -0.41 -1.01 120.40 121.50 1wkp s VAL 15 Ca -0.15 0.92 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1wkp s VAL 15 Cb 0.04 -4.41 0.00 0.00 0.00 0.00 0.00 36.38 32.01 1wkp s VAL 15 CO 0.68 -0.98 0.00 0.61 0.00 0.00 0.00 175.10 175.42 1wkp n GLY 16 N 5.08 1.76 0.27 4.51 0.00 0.17 -4.60 105.19 112.37 1wkp n GLY 16 Ca 0.14 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 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 1.00 0.00 1.61 3.32 -1.16 -3.41 116.42 117.79 1wkp h ASP 17 Ca 0.00 -0.42 -0.14 0.00 0.02 0.00 0.00 57.03 56.49 1wkp h ASP 17 Cb 0.00 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.25 1wkp h ASP 17 CO 0.00 1.22 -1.32 0.52 -1.72 0.00 0.00 179.24 177.94 1wkp n VAL 18 N -4.08 0.74 -4.32 -1.35 0.31 -0.52 -5.07 118.33 104.05 1wkp n VAL 18 Ca -0.01 -0.05 -0.25 0.00 -0.01 0.00 0.00 64.34 64.03 1wkp n VAL 18 Cb 0.51 -1.69 -0.08 0.00 -0.91 0.00 0.00 33.84 31.66 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 -6.74 3.02 0.52 7.52 1.43 -0.18 -4.28 118.68 119.97 1wkp s LEU 19 Ca -0.14 -0.68 -0.05 0.00 -1.03 0.00 0.00 54.13 52.23 1wkp s LEU 19 Cb 0.05 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.64 1wkp s LEU 19 CO 0.18 0.05 0.83 -1.81 0.23 0.00 0.00 176.35 175.82 1wkp s ASP 20 N -3.32 6.05 0.34 2.29 1.01 -1.26 -0.66 116.67 121.12 1wkp s ASP 20 Ca 0.29 0.86 -0.27 0.00 0.71 0.00 0.00 52.55 54.14 1wkp s ASP 20 Cb -0.07 -2.07 -0.12 0.00 1.01 0.00 0.00 42.92 41.66 1wkp s ASP 20 CO 0.17 -0.74 1.14 -0.81 0.21 0.00 0.00 175.17 175.14 1wkp n PRO 21 N -2.37 1.70 -3.67 8.23 -0.04 -1.26 -4.89 135.00 132.69 1wkp n PRO 21 Ca 0.02 0.60 -0.10 0.00 -0.04 0.00 0.00 63.50 63.98 1wkp n PRO 21 Cb 0.56 -2.10 -0.03 0.00 -0.04 0.00 0.00 33.50 31.89 1wkp n PRO 21 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1wkp s PHE 22 N -1.12 -0.27 -0.28 0.54 -0.71 -1.26 -4.99 117.98 109.89 1wkp s PHE 22 Ca 0.58 -0.06 -0.10 0.00 -1.04 0.00 0.00 56.93 56.31 1wkp s PHE 22 Cb -0.61 0.54 -0.04 0.00 -1.21 0.00 0.00 43.02 41.70 1wkp s PHE 22 CO 0.60 -0.99 0.15 1.21 -1.34 0.00 0.00 175.22 174.86 1wkp s ASN 23 N -2.85 5.71 0.21 1.98 2.47 -1.26 -5.05 114.94 116.15 1wkp s ASN 23 Ca 0.07 -0.13 -0.32 0.00 0.42 0.00 0.00 52.86 52.90 1wkp s ASN 23 Cb -0.02 -2.05 -0.13 0.00 -1.45 0.00 0.00 41.25 37.60 1wkp s ASN 23 CO -0.03 -0.06 1.60 0.54 -3.72 0.00 0.00 177.10 175.43 1wkp n ARG 24 N 5.01 2.44 0.00 0.43 1.74 -1.26 -4.77 116.66 120.26 1wkp n ARG 24 Ca -0.15 0.88 0.00 0.00 -0.77 0.00 0.00 57.85 57.81 1wkp n ARG 24 Cb 0.51 -2.66 0.00 0.00 -1.02 0.00 0.00 32.46 29.30 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 3.18 1.55 -4.28 0.55 3.41 0.75 -5.02 113.62 113.77 1wkp n SER 25 Ca 0.14 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.44 1wkp n SER 25 Cb 0.33 0.18 -0.16 0.00 -0.26 0.00 0.00 64.21 64.29 1wkp n SER 25 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1wkp s ILE 26 N -1.21 2.00 0.21 -1.33 1.01 -1.05 -4.96 121.20 115.87 1wkp s ILE 26 Ca 0.00 -1.06 -0.31 0.00 0.00 0.00 0.00 60.65 59.28 1wkp s ILE 26 Cb 0.00 -1.68 -0.15 0.00 0.01 0.00 0.00 42.46 40.64 1wkp s ILE 26 CO 0.00 0.56 1.07 0.41 0.00 0.00 0.00 174.94 176.99 1wkp n THR 27 N 2.73 1.28 -3.66 2.92 -1.04 -1.26 -4.55 114.28 110.70 1wkp n THR 27 Ca -0.17 -0.32 -0.24 0.00 -2.04 0.00 0.00 64.05 61.28 1wkp n THR 27 Cb 0.52 -0.82 -0.17 0.00 -1.82 0.00 0.00 70.33 68.03 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 0.74 0.38 -0.17 -4.42 2.96 -1.26 -1.29 118.68 115.62 1wkp s LEU 28 Ca 0.68 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 1wkp s LEU 28 Cb -0.82 -0.26 0.03 0.00 0.50 0.00 0.00 46.19 45.64 1wkp s LEU 28 CO 0.55 -0.30 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.59 1wkp s LYS 29 N 2.11 2.50 -0.18 1.98 -0.14 -0.42 -5.01 119.74 120.58 1wkp s LYS 29 Ca 0.03 -0.73 -0.02 0.00 -1.36 0.00 0.00 55.97 53.89 1wkp s LYS 29 Cb -0.14 -2.35 -0.01 0.00 -1.68 0.00 0.00 37.83 33.65 1wkp s LYS 29 CO -0.06 -0.27 -0.08 0.08 -0.76 0.00 0.00 175.35 174.25 1wkp s VAL 30 N 1.39 3.25 -0.06 3.17 1.01 -1.26 -1.47 120.40 126.43 1wkp s VAL 30 Ca 0.03 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.47 1wkp s VAL 30 Cb -0.14 -2.43 0.02 0.00 0.00 0.00 0.00 36.38 33.83 1wkp s VAL 30 CO -0.11 0.47 -0.10 -0.89 0.00 0.00 0.00 175.10 174.47 1wkp s THR 31 N 0.96 0.95 -0.35 3.92 2.01 -0.01 -0.23 115.64 122.89 1wkp s THR 31 Ca -0.01 -0.38 -0.07 0.00 0.31 0.00 0.00 61.69 61.55 1wkp s THR 31 Cb -0.15 -0.89 0.04 0.00 0.01 0.00 0.00 72.50 71.52 1wkp s THR 31 CO -0.00 0.31 0.12 -0.31 -0.69 0.00 0.00 174.62 174.06 1wkp s TYR 32 N 0.70 3.27 0.00 4.92 2.02 -0.42 0.32 117.35 128.17 1wkp s TYR 32 Ca -0.13 -1.44 0.00 0.00 -0.37 0.00 0.00 57.07 55.12 1wkp s TYR 32 Cb -0.15 -2.37 0.00 0.00 -0.40 0.00 0.00 41.96 39.04 1wkp s TYR 32 CO 0.03 -0.74 0.00 0.41 -1.57 0.00 0.00 175.55 173.67 1wkp n GLY 33 N 4.82 2.69 0.78 0.71 0.00 -1.26 -1.15 105.19 111.78 1wkp n GLY 33 Ca -0.12 0.23 0.09 0.00 0.00 0.00 0.00 46.02 46.22 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 6.49 1.72 -3.46 1.61 6.02 -1.26 -4.93 117.38 123.57 1wkp n GLN 34 Ca 0.00 -1.71 -0.41 0.00 -0.01 0.00 0.00 57.00 54.87 1wkp n GLN 34 Cb 0.00 -1.36 -0.10 0.00 1.02 0.00 0.00 30.24 29.80 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 -1.43 3.40 0.06 -1.09 0.52 -0.30 -5.06 118.95 115.05 1wkp s ARG 35 Ca 0.24 -0.65 -0.31 0.00 -0.52 0.00 0.00 55.73 54.50 1wkp s ARG 35 Cb 0.16 -3.85 -0.06 0.00 0.52 0.00 0.00 34.95 31.72 1wkp s ARG 35 CO 0.23 -0.55 1.22 -2.00 0.02 0.00 0.00 175.30 174.23 1wkp s GLU 36 N 1.84 4.41 -0.23 3.54 2.12 -1.26 -1.30 118.70 127.81 1wkp s GLU 36 Ca 0.08 1.80 -0.29 0.00 0.36 0.00 0.00 54.97 56.92 1wkp s GLU 36 Cb -0.17 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 30.84 1wkp s GLU 36 CO 0.11 -0.30 1.55 0.08 -0.54 0.00 0.00 175.26 176.16 1wkp s VAL 37 N 1.17 3.79 0.17 3.70 1.01 0.67 -4.98 120.40 125.93 1wkp s VAL 37 Ca 0.59 0.89 0.09 0.00 0.00 0.00 0.00 61.98 63.56 1wkp s VAL 37 Cb -0.30 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1wkp s VAL 37 CO 0.29 -0.32 -0.14 0.42 0.00 0.00 0.00 175.10 175.35 1wkp s THR 38 N 4.98 2.99 -0.04 3.92 -4.23 -1.26 -4.66 115.64 117.33 1wkp s THR 38 Ca 0.68 -1.69 -0.33 0.00 -1.18 0.00 0.00 61.69 59.17 1wkp s THR 38 Cb -0.24 -2.45 -0.11 0.00 1.34 0.00 0.00 72.50 71.05 1wkp s THR 38 CO 0.28 -0.07 1.92 0.59 -0.54 0.00 0.00 174.62 176.79 1wkp n ASN 39 N 0.22 3.72 0.00 3.99 5.03 -1.25 -1.71 115.26 125.27 1wkp n ASN 39 Ca -0.12 0.95 0.00 0.00 0.87 0.00 0.00 54.58 56.28 1wkp n ASN 39 Cb 0.55 -1.43 0.00 0.00 -1.02 0.00 0.00 39.78 37.88 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 4.47 0.76 3.78 7.41 0.00 -0.27 -5.01 105.19 116.33 1wkp n GLY 40 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 4.33 -0.30 0.99 2.96 -0.69 -4.49 118.68 121.48 1wkp s LEU 41 Ca 0.00 3.02 -0.22 0.00 -0.22 0.00 0.00 54.13 56.71 1wkp s LEU 41 Cb 0.00 -3.66 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1wkp s LEU 41 CO 0.00 -0.86 0.71 0.20 -1.32 0.00 0.00 176.35 175.08 1wkp s ASN 42 N -0.10 6.59 -0.05 3.68 0.01 -1.26 -0.37 114.94 123.44 1wkp s ASN 42 Ca 0.54 0.59 0.06 0.00 -0.71 0.00 0.00 52.86 53.34 1wkp s ASN 42 Cb -0.46 -2.37 -0.02 0.00 0.41 0.00 0.00 41.25 38.81 1wkp s ASN 42 CO 0.61 -0.52 -0.23 -0.76 -1.51 0.00 0.00 177.10 174.68 1wkp s LEU 43 N 2.75 2.18 0.34 0.60 1.43 -0.05 -4.97 118.68 120.97 1wkp s LEU 43 Ca 0.29 -0.45 -0.26 0.00 -1.03 0.00 0.00 54.13 52.68 1wkp s LEU 43 Cb -0.15 -1.40 -0.10 0.00 0.03 0.00 0.00 46.19 44.58 1wkp s LEU 43 CO 0.11 0.28 0.99 -0.13 0.23 0.00 0.00 176.35 177.83 1wkp s ARG 44 N -0.35 4.48 0.47 1.70 0.52 -1.26 -4.25 118.95 120.26 1wkp s ARG 44 Ca 0.02 1.44 0.29 0.00 -0.52 0.00 0.00 55.73 56.96 1wkp s ARG 44 Cb -0.12 -2.79 1.35 0.00 0.52 0.00 0.00 34.95 33.91 1wkp s ARG 44 CO 0.02 0.16 1.77 -1.35 0.02 0.00 0.00 175.30 175.91 1wkp h PRO 45 N 3.09 0.17 0.00 3.54 0.11 -1.83 0.46 132.00 137.54 1wkp h PRO 45 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1wkp h PRO 45 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1wkp h PRO 45 CO 0.65 0.11 0.00 0.66 -0.21 0.00 0.00 178.00 179.21 1wkp h SER 46 N 0.18 0.00 0.84 -2.05 4.64 -1.92 -2.96 113.55 112.27 1wkp h SER 46 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 1wkp h SER 46 Cb 2.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.10 1wkp h SER 46 CO -0.17 0.00 -0.77 1.56 -0.87 0.00 0.00 176.83 176.58 1wkp h GLN 47 N 0.00 0.00 -0.23 4.77 4.20 -1.28 -3.36 115.11 119.21 1wkp h GLN 47 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1wkp h GLN 47 Cb 0.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.31 1wkp h GLN 47 CO 0.00 0.00 0.00 1.33 -0.67 0.00 0.00 178.83 179.49 1wkp n VAL 48 N -2.22 1.53 -0.33 -0.54 0.24 -1.13 -4.69 118.33 111.19 1wkp n VAL 48 Ca 0.02 -1.42 0.18 0.00 -2.04 0.00 0.00 64.34 61.08 1wkp n VAL 48 Cb 0.46 0.17 0.43 0.00 -1.47 0.00 0.00 33.84 33.43 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 1.46 0.53 -6.18 7.34 4.20 -1.69 -3.42 115.11 117.35 1wkp h GLN 49 Ca 0.00 -0.03 -0.54 0.00 0.06 0.00 0.00 58.65 58.14 1wkp h GLN 49 Cb 0.97 -0.12 -0.08 0.00 0.30 0.00 0.00 27.48 28.55 1wkp h GLN 49 CO 0.08 0.35 -0.59 -0.80 -0.67 0.00 0.00 178.83 177.19 1wkp s ASN 50 N -5.35 4.81 0.37 1.46 -0.87 -1.26 -4.56 114.94 109.55 1wkp s ASN 50 Ca -0.10 -0.57 -0.28 0.00 -1.57 0.00 0.00 52.86 50.34 1wkp s ASN 50 Cb 0.25 -0.96 -0.10 0.00 -0.02 0.00 0.00 41.25 40.43 1wkp s ASN 50 CO 0.80 -0.07 1.35 -1.59 -2.57 0.00 0.00 177.10 175.02 1wkp s LYS 51 N -3.75 4.14 0.77 -0.60 -2.85 -1.26 -5.00 119.74 111.19 1wkp s LYS 51 Ca 0.33 2.29 -0.12 0.00 -1.00 0.00 0.00 55.97 57.47 1wkp s LYS 51 Cb -0.06 -2.93 0.05 0.00 -2.06 0.00 0.00 37.83 32.83 1wkp s LYS 51 CO 0.22 -0.39 1.13 -1.25 0.10 0.00 0.00 175.35 175.15 1wkp s PRO 52 N -2.03 2.35 0.15 1.78 0.04 -1.26 -4.97 135.00 131.04 1wkp s PRO 52 Ca 0.53 0.36 -0.30 0.00 0.04 0.00 0.00 61.00 61.63 1wkp s PRO 52 Cb -0.41 -1.97 -0.07 0.00 0.04 0.00 0.00 34.50 32.09 1wkp s PRO 52 CO 0.54 -1.38 0.96 1.03 0.04 0.00 0.00 177.00 178.19 1wkp s ARG 53 N -5.39 4.74 -0.15 4.56 1.81 0.15 -4.87 118.95 119.80 1wkp s ARG 53 Ca 0.60 1.46 -0.00 0.00 -1.72 0.00 0.00 55.73 56.07 1wkp s ARG 53 Cb -0.12 -3.35 0.04 0.00 -0.45 0.00 0.00 34.95 31.07 1wkp s ARG 53 CO 0.51 0.30 -0.06 0.08 -0.68 0.00 0.00 175.30 175.45 1wkp s VAL 54 N -0.33 1.10 -0.07 3.52 1.01 -1.26 -0.83 120.40 123.55 1wkp s VAL 54 Ca 0.45 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 1wkp s VAL 54 Cb -0.24 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1wkp s VAL 54 CO 0.30 0.20 0.14 -1.61 0.00 0.00 0.00 175.10 174.13 1wkp s GLU 55 N 1.65 3.36 0.15 2.72 2.02 -0.54 -2.64 118.70 125.42 1wkp s GLU 55 Ca 0.02 -0.26 0.06 0.00 0.02 0.00 0.00 54.97 54.81 1wkp s GLU 55 Cb -0.14 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 30.96 1wkp s GLU 55 CO -0.08 0.72 -0.13 0.96 0.02 0.00 0.00 175.26 176.75 1wkp s ILE 56 N -1.14 1.39 0.00 -1.63 -4.36 -0.54 -1.30 121.20 113.63 1wkp s ILE 56 Ca 0.20 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.63 1wkp s ILE 56 Cb -0.12 -1.77 0.00 0.00 1.25 0.00 0.00 42.46 41.82 1wkp s ILE 56 CO 0.10 -0.57 0.00 0.61 0.24 0.00 0.00 174.94 175.32 1wkp n GLY 57 N 0.05 2.21 0.00 6.27 0.00 -0.41 -3.52 105.19 109.79 1wkp n GLY 57 Ca -0.12 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.97 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 3.48 0.78 -0.02 0.00 -1.26 -0.87 105.19 112.31 1wkp n GLY 58 Ca 0.00 -1.53 -0.01 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.82 0.05 -2.30 1.61 2.13 -1.26 -4.78 120.64 114.27 1wkp n GLU 59 Ca 0.00 0.02 -0.43 0.00 0.66 0.00 0.00 57.16 57.41 1wkp n GLU 59 Cb 0.00 -0.34 -0.02 0.00 0.27 0.00 0.00 31.44 31.34 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 -5.21 6.87 0.29 4.31 -1.08 -1.26 -4.93 116.67 115.66 1wkp s ASP 60 Ca -0.03 1.88 0.25 0.00 -0.52 0.00 0.00 52.55 54.14 1wkp s ASP 60 Cb 0.00 -2.54 1.00 0.00 -1.46 0.00 0.00 42.92 39.92 1wkp s ASP 60 CO 0.04 -0.78 1.75 -0.07 0.52 0.00 0.00 175.17 176.62 1wkp h LEU 61 N 9.58 0.00 -0.08 -1.34 3.38 -1.93 -3.07 115.31 121.84 1wkp h LEU 61 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1wkp h LEU 61 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1wkp h LEU 61 CO 0.95 0.00 -0.16 0.54 0.09 0.00 0.00 178.44 179.86 1wkp n ARG 62 N -2.34 0.25 -2.12 1.13 1.74 -1.26 -4.39 116.66 109.67 1wkp n ARG 62 Ca 0.02 -0.08 -0.32 0.00 -0.77 0.00 0.00 57.85 56.71 1wkp n ARG 62 Cb 0.26 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.19 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 -2.81 6.26 0.10 0.55 0.02 -1.16 -4.97 114.94 112.92 1wkp s ASN 63 Ca 0.19 1.58 0.07 0.00 -1.02 0.00 0.00 52.86 53.67 1wkp s ASN 63 Cb 0.19 -2.50 -0.03 0.00 0.02 0.00 0.00 41.25 38.93 1wkp s ASN 63 CO 0.55 -0.84 -0.17 -0.36 0.02 0.00 0.00 177.10 176.30 1wkp s PHE 64 N -2.78 1.51 0.08 2.20 0.08 -1.26 -2.10 117.98 115.71 1wkp s PHE 64 Ca 0.59 -0.46 0.06 0.00 0.12 0.00 0.00 56.93 57.24 1wkp s PHE 64 Cb -0.12 -0.82 -0.03 0.00 -0.57 0.00 0.00 43.02 41.48 1wkp s PHE 64 CO 0.40 0.14 -0.15 0.71 -0.10 0.00 0.00 175.22 176.22 1wkp s TYR 65 N -1.39 1.33 -0.10 0.36 1.51 0.13 -1.12 117.35 118.06 1wkp s TYR 65 Ca 0.04 -0.45 0.03 0.00 -1.01 0.00 0.00 57.07 55.67 1wkp s TYR 65 Cb -0.09 -0.74 -0.01 0.00 -0.11 0.00 0.00 41.96 41.01 1wkp s TYR 65 CO 0.03 0.09 -0.20 0.99 -1.11 0.00 0.00 175.55 175.35 1wkp s THR 66 N -1.28 2.47 -0.20 -0.71 2.01 0.73 -0.71 115.64 117.96 1wkp s THR 66 Ca -0.00 -0.88 -0.05 0.00 0.31 0.00 0.00 61.69 61.07 1wkp s THR 66 Cb -0.10 -1.97 -0.02 0.00 0.01 0.00 0.00 72.50 70.42 1wkp s THR 66 CO 0.03 0.55 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.27 1wkp s LEU 67 N 0.16 3.18 -0.13 4.42 2.96 0.94 -0.35 118.68 129.86 1wkp s LEU 67 Ca -0.11 -0.23 -0.03 0.00 -0.22 0.00 0.00 54.13 53.54 1wkp s LEU 67 Cb -0.16 -1.80 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 1wkp s LEU 67 CO 0.06 0.06 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.44 1wkp s VAL 68 N 1.00 3.99 -0.25 1.68 1.01 0.93 -1.84 120.40 126.91 1wkp s VAL 68 Ca 0.01 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.68 1wkp s VAL 68 Cb -0.14 -2.71 0.05 0.00 0.00 0.00 0.00 36.38 33.58 1wkp s VAL 68 CO 0.01 0.53 -0.12 -0.32 0.00 0.00 0.00 175.10 175.21 1wkp s MET 69 N -0.10 2.30 0.22 2.72 1.75 -0.60 -0.05 119.30 125.54 1wkp s MET 69 Ca 0.03 -1.25 0.09 0.00 -1.25 0.00 0.00 55.69 53.30 1wkp s MET 69 Cb -0.13 -2.82 -0.05 0.00 2.84 0.00 0.00 34.83 34.67 1wkp s MET 69 CO 0.02 -0.52 -0.17 0.14 -0.65 0.00 0.00 175.02 173.84 1wkp s VAL 70 N 1.14 1.99 -0.30 10.11 -7.23 -0.15 0.02 120.40 125.98 1wkp s VAL 70 Ca -0.07 -2.23 0.03 0.00 -1.81 0.00 0.00 61.98 57.91 1wkp s VAL 70 Cb -0.19 -2.09 0.08 0.00 0.56 0.00 0.00 36.38 34.74 1wkp s VAL 70 CO -0.06 -0.49 -0.02 -0.62 -0.31 0.00 0.00 175.10 173.60 1wkp s ASP 71 N -3.27 4.64 0.00 4.85 -1.08 -0.13 -0.97 116.67 120.72 1wkp s ASP 71 Ca 0.24 -1.78 0.18 0.00 -0.52 0.00 0.00 52.55 50.67 1wkp s ASP 71 Cb -0.03 -1.60 0.85 0.00 -1.46 0.00 0.00 42.92 40.68 1wkp s ASP 71 CO 0.09 -0.29 1.57 -0.81 0.52 0.00 0.00 175.17 176.25 1wkp n PRO 72 N 4.35 0.13 -1.66 4.34 -0.04 -1.25 -0.94 135.00 139.93 1wkp n PRO 72 Ca -0.05 0.15 -0.29 0.00 -0.04 0.00 0.00 63.50 63.27 1wkp n PRO 72 Cb 0.42 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.43 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 -1.40 6.29 -4.65 3.54 8.00 -1.26 -4.58 116.55 122.50 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 0.18 -0.67 -0.10 0.00 -0.02 0.00 0.00 41.12 40.52 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 -4.70 4.58 -0.70 2.53 1.01 -1.26 -1.55 120.40 120.32 1wkp s VAL 74 Ca 0.58 -0.12 0.26 0.00 0.00 0.00 0.00 61.98 62.69 1wkp s VAL 74 Cb 0.46 -3.01 0.29 0.00 0.00 0.00 0.00 36.38 34.12 1wkp s VAL 74 CO 0.01 0.52 1.76 1.55 0.00 0.00 0.00 175.10 178.95 1wkp h PRO 75 N 6.11 0.00 -2.66 2.72 0.13 -1.89 -1.25 132.00 135.17 1wkp h PRO 75 Ca -0.41 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.61 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 -0.14 -1.54 -0.23 0.00 0.00 178.00 176.73 1wkp s SER 76 N -4.69 -0.40 0.42 1.44 1.04 -0.59 -4.42 113.70 106.50 1wkp s SER 76 Ca 0.10 0.57 0.15 0.00 0.48 0.00 0.00 55.95 57.25 1wkp s SER 76 Cb 0.12 0.63 1.04 0.00 0.10 0.00 0.00 66.02 67.90 1wkp s SER 76 CO 0.60 -0.36 1.91 -0.65 0.98 0.00 0.00 173.24 175.72 1wkp h PRO 77 N 4.36 0.42 0.00 4.02 0.11 -1.80 -1.31 132.00 137.80 1wkp h PRO 77 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1wkp h PRO 77 Cb 1.17 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1wkp h PRO 77 CO 0.32 0.28 -0.00 0.66 -0.21 0.00 0.00 178.00 179.04 1wkp h SER 78 N 0.43 0.00 -2.08 -2.05 4.64 -1.96 -3.35 113.55 109.18 1wkp h SER 78 Ca 0.38 -0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.14 1wkp h SER 78 Cb 0.87 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.57 1wkp h SER 78 CO -0.13 0.00 -1.06 -3.20 -0.87 0.00 0.00 176.83 171.57 1wkp n ASN 79 N -2.81 0.25 -3.58 4.97 4.05 -0.57 -5.05 115.26 112.51 1wkp n ASN 79 Ca 0.05 -2.68 -0.41 0.00 0.45 0.00 0.00 54.58 51.99 1wkp n ASN 79 Cb 0.50 -0.63 -0.00 0.00 1.23 0.00 0.00 39.78 40.88 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 1.63 4.27 0.16 1.20 -0.04 -0.73 -3.74 135.00 137.74 1wkp n PRO 80 Ca 0.23 -3.42 0.13 0.00 -0.04 0.00 0.00 63.50 60.40 1wkp n PRO 80 Cb 0.51 -2.73 0.44 0.00 -0.04 0.00 0.00 33.50 31.69 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 4.96 0.00 -0.30 0.54 2.07 -1.83 -2.92 115.15 117.68 1wkp h HIS 81 Ca 0.62 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.14 1wkp h HIS 81 Cb 0.40 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.38 1wkp h HIS 81 CO 1.52 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 177.66 1wkp n LEU 82 N -2.52 2.65 -4.63 6.12 4.77 -0.48 -4.88 117.00 118.02 1wkp n LEU 82 Ca 0.03 -1.14 -0.48 0.00 -0.03 0.00 0.00 56.01 54.39 1wkp n LEU 82 Cb 0.36 -0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1wkp n LEU 82 CO 0.27 0.57 1.03 -1.14 -1.33 0.00 0.00 177.39 176.79 1wkp n ARG 83 N 0.97 1.69 -3.67 3.23 0.63 -1.10 -0.81 116.66 117.60 1wkp n ARG 83 Ca 0.18 0.61 -0.28 0.00 -0.92 0.00 0.00 57.85 57.44 1wkp n ARG 83 Cb 0.48 -2.30 -0.03 0.00 0.45 0.00 0.00 32.46 31.06 1wkp n ARG 83 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1wkp s GLU 84 N 0.52 3.53 -0.28 -0.14 2.02 0.06 -3.83 118.70 120.59 1wkp s GLU 84 Ca 0.79 -0.30 -0.14 0.00 0.02 0.00 0.00 54.97 55.34 1wkp s GLU 84 Cb -0.79 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 30.58 1wkp s GLU 84 CO 0.43 0.39 0.35 -0.47 0.02 0.00 0.00 175.26 175.98 1wkp s TYR 85 N -1.88 3.24 -0.35 1.61 5.04 -0.12 -0.63 117.35 124.27 1wkp s TYR 85 Ca 0.39 0.34 -0.29 0.00 -2.44 0.00 0.00 57.07 55.07 1wkp s TYR 85 Cb -0.11 -2.56 0.02 0.00 0.35 0.00 0.00 41.96 39.66 1wkp s TYR 85 CO 0.29 -0.24 1.13 -1.17 -1.34 0.00 0.00 175.55 174.22 1wkp s LEU 86 N 2.03 3.86 0.01 6.97 2.96 -0.10 -0.95 118.68 133.45 1wkp s LEU 86 Ca 0.14 0.96 0.19 0.00 -0.22 0.00 0.00 54.13 55.19 1wkp s LEU 86 Cb -0.16 -3.54 -0.19 0.00 0.50 0.00 0.00 46.19 42.80 1wkp s LEU 86 CO 0.10 -1.00 0.63 1.41 -1.32 0.00 0.00 176.35 176.18 1wkp n HIS 87 N 7.22 0.59 -3.63 5.38 8.25 0.10 -4.85 115.22 128.29 1wkp n HIS 87 Ca 0.13 0.19 -0.11 0.00 -0.26 0.00 0.00 57.72 57.67 1wkp n HIS 87 Cb 0.47 -0.94 -0.07 0.00 1.12 0.00 0.00 29.99 30.58 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 -3.01 -0.55 -0.12 4.41 -0.00 -1.17 -0.90 118.94 117.60 1wkp s TRP 88 Ca -0.05 1.31 -0.05 0.00 -0.00 0.00 0.00 56.10 57.31 1wkp s TRP 88 Cb 0.09 0.35 0.06 0.00 -0.00 0.00 0.00 33.47 33.97 1wkp s TRP 88 CO 0.83 -0.29 0.24 -1.17 -0.00 0.00 0.00 176.95 176.57 1wkp s LEU 89 N 0.10 -0.20 -0.08 5.86 0.20 -0.36 -1.56 118.68 122.64 1wkp s LEU 89 Ca 0.01 0.54 0.01 0.00 0.69 0.00 0.00 54.13 55.39 1wkp s LEU 89 Cb -0.04 0.63 0.02 0.00 -0.43 0.00 0.00 46.19 46.36 1wkp s LEU 89 CO -0.03 -0.23 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.01 1wkp s VAL 90 N 2.29 1.04 0.34 1.68 1.01 -0.77 -0.78 120.40 125.22 1wkp s VAL 90 Ca 0.01 -0.37 0.08 0.00 0.00 0.00 0.00 61.98 61.69 1wkp s VAL 90 Cb -0.12 -1.00 -0.07 0.00 0.00 0.00 0.00 36.38 35.19 1wkp s VAL 90 CO -0.08 0.35 -0.06 0.28 0.00 0.00 0.00 175.10 175.59 1wkp s THR 91 N 1.10 2.02 -1.41 3.92 -1.32 -0.64 -0.04 115.64 119.26 1wkp s THR 91 Ca -0.06 -2.14 -0.06 0.00 -1.21 0.00 0.00 61.69 58.21 1wkp s THR 91 Cb -0.14 -2.67 0.04 0.00 -1.51 0.00 0.00 72.50 68.21 1wkp s THR 91 CO -0.01 -0.18 0.79 0.47 -2.21 0.00 0.00 174.62 173.47 1wkp n ASP 92 N -0.77 -2.54 -4.64 8.08 8.00 -1.11 -0.38 116.55 123.19 1wkp n ASP 92 Ca -0.05 -0.82 -0.42 0.00 0.71 0.00 0.00 54.79 54.20 1wkp n ASP 92 Cb 0.64 -3.87 -0.03 0.00 -0.02 0.00 0.00 41.12 37.84 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 -3.55 4.71 0.39 0.53 1.01 0.11 -4.26 121.20 120.14 1wkp s ILE 93 Ca 0.27 1.73 -0.27 0.00 0.00 0.00 0.00 60.65 62.38 1wkp s ILE 93 Cb -0.14 -4.25 -0.10 0.00 0.01 0.00 0.00 42.46 37.98 1wkp s ILE 93 CO 0.83 -0.21 1.42 -2.84 0.00 0.00 0.00 174.94 174.13 1wkp s PRO 94 N 3.15 4.05 0.22 2.79 0.02 -1.26 0.17 135.00 144.13 1wkp s PRO 94 Ca 0.40 2.42 -0.30 0.00 0.02 0.00 0.00 61.00 63.53 1wkp s PRO 94 Cb -0.14 -2.89 -0.15 0.00 0.02 0.00 0.00 34.50 31.33 1wkp s PRO 94 CO 0.09 -0.52 0.99 0.00 -0.33 0.00 0.00 177.00 177.23 1wkp n ALA 95 N 0.34 -1.03 -1.34 -1.55 0.00 -0.89 -2.09 120.51 113.95 1wkp n ALA 95 Ca 0.02 0.44 -0.12 0.00 0.00 0.00 0.00 53.44 53.78 1wkp n ALA 95 Cb 0.41 -1.94 -0.05 0.00 0.00 0.00 0.00 19.45 17.86 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 0.75 0.00 0.00 0.00 -2.24 -0.05 -4.93 114.28 107.80 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 -1.38 0.00 0.00 -2.10 0.00 0.00 70.33 67.12 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 -2.52 0.00 -3.91 4.28 -2.24 -0.89 -4.79 114.28 104.22 1wkp n THR 97 Ca -0.12 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.70 1wkp n THR 97 Cb 0.46 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.69 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 -0.27 0.50 3.38 0.00 -1.26 -1.47 107.32 108.20 1wkp s GLY 98 Ca 0.00 0.34 0.15 0.00 0.00 0.00 0.00 44.72 45.21 1wkp s GLY 98 CO 0.00 5.02 2.12 -0.91 0.00 0.00 0.00 173.10 179.33 1wkp h THR 99 N 2.00 1.03 -0.15 0.90 1.35 -1.90 -1.32 112.91 114.82 1wkp h THR 99 Ca -0.23 -0.11 0.04 0.00 -0.55 0.00 0.00 66.41 65.56 1wkp h THR 99 Cb 1.18 1.02 -0.01 0.00 -1.73 0.00 0.00 68.15 68.61 1wkp h THR 99 CO 0.30 0.03 0.24 0.74 -0.25 0.00 0.00 175.52 176.58 1wkp h THR 100 N 0.03 0.29 -0.01 6.82 2.02 -1.96 -2.27 112.91 117.83 1wkp h THR 100 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.19 1wkp h THR 100 Cb 0.05 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1wkp h THR 100 CO 0.00 0.00 -0.69 0.49 0.37 0.00 0.00 175.52 175.69 1wkp n PHE 101 N -3.49 0.00 -1.87 3.16 3.01 -0.50 -4.97 117.46 112.80 1wkp n PHE 101 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1wkp n PHE 101 Cb 0.34 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 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 1.42 1.34 3.13 1.37 0.00 -0.85 -4.62 105.19 106.98 1wkp n GLY 102 Ca 0.06 -1.98 -0.34 0.00 0.00 0.00 0.00 46.02 43.77 1wkp n GLY 102 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wkp s ASN 103 N -1.00 4.71 -0.67 1.61 2.47 0.49 -4.95 114.94 117.60 1wkp s ASN 103 Ca 0.00 -1.35 -0.26 0.00 0.42 0.00 0.00 52.86 51.67 1wkp s ASN 103 Cb 0.00 -1.65 -0.02 0.00 -1.45 0.00 0.00 41.25 38.13 1wkp s ASN 103 CO 0.00 -0.24 1.81 -0.70 -3.72 0.00 0.00 177.10 174.26 1wkp s GLU 104 N 1.18 2.68 0.05 0.43 2.12 -1.26 -1.63 118.70 122.28 1wkp s GLU 104 Ca -0.06 0.37 0.22 0.00 0.36 0.00 0.00 54.97 55.85 1wkp s GLU 104 Cb -0.20 -4.48 -0.20 0.00 0.26 0.00 0.00 34.13 29.50 1wkp s GLU 104 CO -0.03 -2.76 0.67 0.44 -0.54 0.00 0.00 175.26 173.04 1wkp n ILE 105 N 7.22 0.37 -3.89 -3.70 -5.35 0.04 -4.67 119.36 109.39 1wkp n ILE 105 Ca 0.22 -0.55 -0.28 0.00 -0.27 0.00 0.00 62.75 61.86 1wkp n ILE 105 Cb 0.51 -0.19 -0.16 0.00 -1.74 0.00 0.00 39.64 38.05 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 -3.37 1.13 0.71 7.28 1.01 -0.76 -4.90 120.40 121.49 1wkp s VAL 106 Ca -0.05 -0.66 -0.15 0.00 0.00 0.00 0.00 61.98 61.11 1wkp s VAL 106 Cb 0.12 -1.31 0.03 0.00 0.00 0.00 0.00 36.38 35.21 1wkp s VAL 106 CO 0.86 0.11 1.19 -0.94 0.00 0.00 0.00 175.10 176.32 1wkp s SER 107 N 1.62 4.45 -0.01 3.32 1.04 -1.26 -1.23 113.70 121.63 1wkp s SER 107 Ca 0.00 2.29 -0.30 0.00 0.48 0.00 0.00 55.95 58.42 1wkp s SER 107 Cb -0.15 -2.58 -0.06 0.00 0.10 0.00 0.00 66.02 63.32 1wkp s SER 107 CO -0.08 -2.09 1.61 -0.47 0.98 0.00 0.00 173.24 173.20 1wkp s TYR 108 N -2.02 2.25 -0.21 5.02 6.14 -1.25 -4.32 117.35 122.96 1wkp s TYR 108 Ca 0.73 0.33 -0.03 0.00 0.64 0.00 0.00 57.07 58.74 1wkp s TYR 108 Cb -0.28 -3.89 -0.01 0.00 0.42 0.00 0.00 41.96 38.20 1wkp s TYR 108 CO 0.44 -3.64 -0.06 -2.00 0.64 0.00 0.00 175.55 170.92 1wkp s GLU 109 N 3.34 3.35 0.23 4.97 2.12 -0.07 -4.94 118.70 127.70 1wkp s GLU 109 Ca 0.72 -0.64 -0.30 0.00 0.36 0.00 0.00 54.97 55.11 1wkp s GLU 109 Cb -0.35 -2.94 -0.09 0.00 0.26 0.00 0.00 34.13 31.01 1wkp s GLU 109 CO 0.30 -0.15 1.25 0.54 -0.54 0.00 0.00 175.26 176.66 1wkp s ASN 110 N 1.34 6.97 0.10 -1.70 4.22 -1.26 -4.86 114.94 119.76 1wkp s ASN 110 Ca 0.04 2.40 -0.31 0.00 -2.14 0.00 0.00 52.86 52.85 1wkp s ASN 110 Cb -0.14 -2.62 -0.08 0.00 1.28 0.00 0.00 41.25 39.69 1wkp s ASN 110 CO -0.03 -0.44 1.41 -2.84 -2.04 0.00 0.00 177.10 173.16 1wkp s PRO 111 N -0.67 4.31 -0.42 3.55 0.02 -1.26 -5.00 135.00 135.53 1wkp s PRO 111 Ca 0.52 2.08 0.02 0.00 0.02 0.00 0.00 61.00 63.65 1wkp s PRO 111 Cb -0.36 -3.29 0.16 0.00 0.02 0.00 0.00 34.50 31.03 1wkp s PRO 111 CO 0.41 -0.47 0.30 -1.54 -0.33 0.00 0.00 177.00 175.37 1wkp s SER 112 N 1.23 2.46 0.30 2.53 1.04 -1.26 -4.67 113.70 115.33 1wkp s SER 112 Ca 0.65 -2.78 -0.30 0.00 0.48 0.00 0.00 55.95 54.01 1wkp s SER 112 Cb -0.37 -0.58 -0.12 0.00 0.10 0.00 0.00 66.02 65.05 1wkp s SER 112 CO 0.30 -0.22 1.51 -2.65 0.98 0.00 0.00 173.24 173.16 1wkp n PRO 113 N 3.27 2.51 -0.00 4.02 -0.02 -1.26 -4.93 135.00 138.59 1wkp n PRO 113 Ca 0.20 0.89 0.08 0.00 -2.02 0.00 0.00 63.50 62.66 1wkp n PRO 113 Cb 0.42 -2.62 -0.12 0.00 -0.02 0.00 0.00 33.50 31.16 1wkp n PRO 113 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1wkp n THR 114 N 1.62 0.00 -3.72 3.45 -2.24 -1.26 -3.31 114.28 108.82 1wkp n THR 114 Ca 0.07 -0.27 -0.11 0.00 -2.27 0.00 0.00 64.05 61.47 1wkp n THR 114 Cb 0.36 0.50 -0.11 0.00 -2.10 0.00 0.00 70.33 68.98 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 -2.94 -0.89 0.18 6.98 0.00 -1.26 -4.89 121.76 118.94 1wkp s ALA 115 Ca -0.01 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.23 1wkp s ALA 115 Cb 0.12 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.46 1wkp s ALA 115 CO 0.71 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.66 1wkp n GLY 116 N 3.95 -1.91 3.66 0.00 0.00 -1.26 -4.60 105.19 105.03 1wkp n GLY 116 Ca -0.22 -1.27 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.48 5.07 -0.12 -0.61 1.01 -1.26 -4.51 121.20 119.29 1wkp s ILE 117 Ca 0.00 1.07 -0.05 0.00 0.00 0.00 0.00 60.65 61.67 1wkp s ILE 117 Cb 0.00 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 1wkp s ILE 117 CO 0.00 0.15 0.06 -1.00 0.00 0.00 0.00 174.94 174.15 1wkp s HIS 118 N 1.73 3.32 -0.10 3.97 3.76 0.51 -4.66 115.29 123.83 1wkp s HIS 118 Ca 0.26 0.27 -0.23 0.00 -0.15 0.00 0.00 55.06 55.21 1wkp s HIS 118 Cb -0.16 -1.91 -0.03 0.00 1.11 0.00 0.00 32.58 31.59 1wkp s HIS 118 CO 0.10 0.47 0.69 1.03 -0.85 0.00 0.00 174.74 176.18 1wkp s ARG 119 N -0.59 4.39 -0.22 1.40 0.52 -1.26 -0.81 118.95 122.37 1wkp s ARG 119 Ca 0.11 0.83 -0.03 0.00 -0.52 0.00 0.00 55.73 56.13 1wkp s ARG 119 Cb -0.12 -3.47 0.00 0.00 0.52 0.00 0.00 34.95 31.88 1wkp s ARG 119 CO 0.02 -0.01 -0.07 0.08 0.02 0.00 0.00 175.30 175.35 1wkp s VAL 120 N 1.06 3.06 -0.16 3.52 1.01 0.19 -3.96 120.40 125.11 1wkp s VAL 120 Ca 0.36 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.65 1wkp s VAL 120 Cb -0.17 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.79 1wkp s VAL 120 CO 0.16 0.38 -0.17 -0.69 0.00 0.00 0.00 175.10 174.78 1wkp s VAL 121 N 1.41 2.50 -0.21 2.92 1.01 -0.14 -0.85 120.40 127.04 1wkp s VAL 121 Ca 0.04 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.10 1wkp s VAL 121 Cb -0.15 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 1wkp s VAL 121 CO -0.05 0.52 0.13 -0.36 0.00 0.00 0.00 175.10 175.34 1wkp s PHE 122 N 0.91 3.35 -0.06 5.22 0.40 0.82 -0.98 117.98 127.64 1wkp s PHE 122 Ca -0.04 0.24 0.02 0.00 -0.60 0.00 0.00 56.93 56.55 1wkp s PHE 122 Cb -0.15 -2.19 0.01 0.00 0.51 0.00 0.00 43.02 41.21 1wkp s PHE 122 CO -0.02 0.18 -0.11 0.42 0.70 0.00 0.00 175.22 176.38 1wkp s ILE 123 N 0.62 1.06 -0.11 0.64 1.09 0.93 -1.10 121.20 124.33 1wkp s ILE 123 Ca 0.07 -0.45 -0.02 0.00 -1.10 0.00 0.00 60.65 59.16 1wkp s ILE 123 Cb -0.12 -0.97 -0.03 0.00 -1.06 0.00 0.00 42.46 40.28 1wkp s ILE 123 CO 0.01 0.34 -0.03 -0.22 -0.10 0.00 0.00 174.94 174.93 1wkp s LEU 124 N 0.61 3.33 0.06 2.97 2.96 -0.38 -0.05 118.68 128.19 1wkp s LEU 124 Ca -0.13 -0.01 0.05 0.00 -0.22 0.00 0.00 54.13 53.82 1wkp s LEU 124 Cb -0.15 -1.77 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1wkp s LEU 124 CO 0.03 0.29 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.84 1wkp s PHE 125 N -0.36 1.25 0.04 5.38 0.40 0.52 -1.12 117.98 124.10 1wkp s PHE 125 Ca 0.06 -0.43 -0.23 0.00 -0.60 0.00 0.00 56.93 55.73 1wkp s PHE 125 Cb -0.12 -0.71 -0.06 0.00 0.51 0.00 0.00 43.02 42.64 1wkp s PHE 125 CO 0.02 0.06 0.68 0.50 0.70 0.00 0.00 175.22 177.18 1wkp s ARG 126 N -1.60 4.40 0.39 0.44 3.52 -1.26 -0.19 118.95 124.65 1wkp s ARG 126 Ca -0.01 0.91 -0.04 0.00 -0.13 0.00 0.00 55.73 56.46 1wkp s ARG 126 Cb -0.09 -3.33 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 1wkp s ARG 126 CO 0.02 0.40 0.67 -0.65 -0.81 0.00 0.00 175.30 174.93 1wkp s GLN 127 N -0.37 3.58 0.30 5.12 -0.21 -0.28 -4.56 119.66 123.24 1wkp s GLN 127 Ca 0.34 0.05 0.09 0.00 0.02 0.00 0.00 55.36 55.86 1wkp s GLN 127 Cb -0.20 -2.51 0.47 0.00 1.00 0.00 0.00 33.01 31.76 1wkp s GLN 127 CO 0.21 0.00 1.69 -0.07 -2.12 0.00 0.00 175.29 175.00 1wkp h LEU 128 N 0.82 0.09 -7.82 2.90 3.38 -1.83 -3.43 115.31 109.42 1wkp h LEU 128 Ca -0.48 -0.04 0.17 0.00 0.09 0.00 0.00 57.88 57.61 1wkp h LEU 128 Cb 1.20 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 1wkp h LEU 128 CO 0.63 0.58 0.54 -0.83 0.09 0.00 0.00 178.44 179.45 1wkp s GLY 129 N -4.35 -0.02 0.34 0.83 0.00 -1.26 -5.07 107.32 97.79 1wkp s GLY 129 Ca -0.03 -0.15 -0.29 0.00 0.00 0.00 0.00 44.72 44.25 1wkp s GLY 129 CO 0.76 1.34 1.36 -1.60 0.00 0.00 0.00 173.10 174.96 1wkp s ARG 130 N -2.58 4.29 -0.96 2.90 3.52 -1.26 -4.11 118.95 120.74 1wkp s ARG 130 Ca 0.18 2.31 -0.02 0.00 -0.13 0.00 0.00 55.73 58.07 1wkp s ARG 130 Cb -0.02 -3.05 -0.02 0.00 -1.56 0.00 0.00 34.95 30.31 1wkp s ARG 130 CO 0.04 -0.28 0.81 1.04 -0.81 0.00 0.00 175.30 176.10 1wkp n GLN 131 N 0.75 -4.39 0.00 5.12 6.02 -1.26 -4.95 117.38 118.68 1wkp n GLN 131 Ca 0.00 0.71 0.00 0.00 -0.01 0.00 0.00 57.00 57.70 1wkp n GLN 131 Cb 0.41 -5.23 0.00 0.00 1.02 0.00 0.00 30.24 26.44 1wkp n GLN 131 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1wkp n THR 132 N -3.39 0.00 -4.18 5.09 -2.24 -1.26 -5.01 114.28 103.29 1wkp n THR 132 Ca -0.18 -0.49 -0.34 0.00 -2.27 0.00 0.00 64.05 60.76 1wkp n THR 132 Cb 0.63 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.75 1wkp n THR 132 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1wkp s VAL 133 N -0.80 4.39 0.29 2.28 1.01 -1.26 -4.89 120.40 121.42 1wkp s VAL 133 Ca 0.00 -0.18 0.09 0.00 0.00 0.00 0.00 61.98 61.89 1wkp s VAL 133 Cb 0.00 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1wkp s VAL 133 CO 0.00 0.48 0.05 -0.31 0.00 0.00 0.00 175.10 175.31 1wkp s TYR 134 N 0.37 2.71 0.47 5.22 1.51 -1.26 -5.05 117.35 121.32 1wkp s TYR 134 Ca -0.00 -0.28 -0.21 0.00 -1.01 0.00 0.00 57.07 55.57 1wkp s TYR 134 Cb -0.13 -1.35 -0.09 0.00 -0.11 0.00 0.00 41.96 40.28 1wkp s TYR 134 CO 0.01 0.53 1.04 0.00 -1.11 0.00 0.00 175.55 176.02 1wkp s ALA 135 N -2.36 2.91 1.05 3.71 0.00 -1.26 -5.05 121.76 120.77 1wkp s ALA 135 Ca 0.34 0.63 -0.16 0.00 0.00 0.00 0.00 51.96 52.76 1wkp s ALA 135 Cb -0.05 -3.26 0.22 0.00 0.00 0.00 0.00 23.12 20.04 1wkp s ALA 135 CO 0.21 -0.29 1.19 -1.25 0.00 0.00 0.00 175.76 175.61 1wkp s PRO 136 N -3.09 -0.05 0.35 0.00 0.04 -1.26 -4.99 135.00 126.00 1wkp s PRO 136 Ca 0.65 -0.10 0.23 0.00 0.04 0.00 0.00 61.00 61.83 1wkp s PRO 136 Cb -0.17 -1.74 0.22 0.00 0.04 0.00 0.00 34.50 32.85 1wkp s PRO 136 CO 0.21 -2.93 1.40 0.78 0.04 0.00 0.00 177.00 176.51 1wkp h GLY 137 N -2.02 0.00 -1.59 0.56 0.00 -1.98 -3.47 103.07 94.57 1wkp h GLY 137 Ca -0.46 0.00 0.04 0.00 0.00 0.00 0.00 47.33 46.91 1wkp h GLY 137 CO 0.42 0.00 0.27 0.66 0.00 0.00 0.00 176.54 177.89 1wkp s TRP 138 N -3.26 -0.04 -0.10 5.60 -2.14 -1.26 -5.10 118.94 112.64 1wkp s TRP 138 Ca 0.04 -0.52 0.02 0.00 2.66 0.00 0.00 56.10 58.30 1wkp s TRP 138 Cb 0.07 0.77 -0.25 0.00 -3.10 0.00 0.00 33.47 30.96 1wkp s TRP 138 CO 0.71 -1.37 0.45 0.54 -2.66 0.00 0.00 176.95 174.62 1wkp n ARG 139 N -0.50 0.70 -1.42 3.25 1.74 -1.26 -4.87 116.66 114.30 1wkp n ARG 139 Ca -0.06 0.26 -0.32 0.00 -0.77 0.00 0.00 57.85 56.97 1wkp n ARG 139 Cb 0.59 -1.73 0.08 0.00 -1.02 0.00 0.00 32.46 30.38 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 -2.57 2.45 -1.24 5.56 0.00 -1.26 -0.93 119.66 121.67 1wkp s GLN 140 Ca -0.16 1.22 -0.07 0.00 -0.00 0.00 0.00 55.36 56.36 1wkp s GLN 140 Cb 0.07 -1.92 0.05 0.00 0.00 0.00 0.00 33.01 31.21 1wkp s GLN 140 CO 0.79 -1.50 0.39 0.09 0.00 0.00 0.00 175.29 175.05 1wkp n ASN 141 N -3.19 -3.95 -4.77 12.60 5.03 0.01 -4.87 115.26 116.12 1wkp n ASN 141 Ca 0.09 -0.24 -0.39 0.00 0.87 0.00 0.00 54.58 54.92 1wkp n ASN 141 Cb 0.53 -3.28 -0.03 0.00 -1.02 0.00 0.00 39.78 35.98 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 -2.87 3.17 -0.29 3.10 5.36 0.20 -4.57 117.98 122.08 1wkp s PHE 142 Ca 0.30 1.57 0.02 0.00 -0.96 0.00 0.00 56.93 57.85 1wkp s PHE 142 Cb -0.15 -3.39 0.08 0.00 -0.34 0.00 0.00 43.02 39.22 1wkp s PHE 142 CO 0.37 -1.20 0.01 1.21 -1.46 0.00 0.00 175.22 174.15 1wkp s ASN 143 N -1.04 4.29 0.24 6.13 3.84 -1.26 -0.76 114.94 126.38 1wkp s ASN 143 Ca 0.54 -1.66 -0.05 0.00 0.21 0.00 0.00 52.86 51.90 1wkp s ASN 143 Cb -0.31 -1.31 0.34 0.00 -0.55 0.00 0.00 41.25 39.42 1wkp s ASN 143 CO 0.40 -0.32 1.85 0.74 -2.79 0.00 0.00 177.10 176.98 1wkp h THR 144 N 6.62 1.05 0.30 -5.21 2.02 -1.96 0.24 112.91 115.96 1wkp h THR 144 Ca -0.12 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 1wkp h THR 144 Cb 1.04 -0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1wkp h THR 144 CO 0.47 0.18 -0.17 0.03 0.37 0.00 0.00 175.52 176.40 1wkp h ARG 145 N 0.99 -0.43 -0.90 6.66 3.08 -1.96 -0.12 114.38 121.70 1wkp h ARG 145 Ca 0.38 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.47 1wkp h ARG 145 Cb 0.17 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.28 1wkp h ARG 145 CO -0.17 -0.29 0.59 0.93 -1.07 0.00 0.00 179.97 179.96 1wkp h GLU 146 N -0.45 1.19 -0.09 0.04 5.08 -1.89 -1.71 114.58 116.77 1wkp h GLU 146 Ca -0.03 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1wkp h GLU 146 Cb 0.37 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1wkp h GLU 146 CO 0.04 0.80 0.03 0.35 -1.00 0.00 0.00 179.01 179.22 1wkp h PHE 147 N 1.23 0.05 -0.98 4.33 3.57 -0.37 -1.37 116.94 123.40 1wkp h PHE 147 Ca 0.33 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.90 1wkp h PHE 147 Cb -0.13 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.54 1wkp h PHE 147 CO -0.01 0.03 0.64 0.00 -2.23 0.00 0.00 178.31 176.74 1wkp h ALA 148 N 1.05 1.43 -0.10 2.41 0.00 -0.67 -2.44 119.26 120.94 1wkp h ALA 148 Ca 0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1wkp h ALA 148 Cb 0.02 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1wkp h ALA 148 CO -0.04 0.42 0.00 1.49 0.00 0.00 0.00 179.25 181.12 1wkp h GLU 149 N 1.14 0.18 -0.96 0.00 4.81 -1.01 -0.73 114.58 118.01 1wkp h GLU 149 Ca 0.43 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.62 1wkp h GLU 149 Cb 0.19 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.50 1wkp h GLU 149 CO -0.17 0.42 0.64 0.82 -0.73 0.00 0.00 179.01 179.99 1wkp h ILE 150 N -0.09 1.21 -0.58 2.32 2.04 -0.97 -2.88 117.51 118.56 1wkp h ILE 150 Ca 0.03 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.45 1wkp h ILE 150 Cb 0.34 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 1wkp h ILE 150 CO 0.00 0.23 0.00 -1.22 0.00 0.00 0.00 178.15 177.17 1wkp n TYR 151 N -4.44 1.83 -4.05 1.37 4.01 -0.94 -4.97 117.16 109.97 1wkp n TYR 151 Ca 0.12 -0.70 -0.31 0.00 -0.16 0.00 0.00 57.90 56.85 1wkp n TYR 151 Cb 0.05 -0.42 -0.01 0.00 -0.31 0.00 0.00 39.34 38.65 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 0.71 -2.61 -0.20 7.72 3.02 -0.86 -4.65 115.26 118.40 1wkp n ASN 152 Ca 0.27 -0.95 0.13 0.00 -0.03 0.00 0.00 54.58 54.00 1wkp n ASN 152 Cb 1.09 -3.16 0.41 0.00 -0.61 0.00 0.00 39.78 37.50 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 -4.45 0.87 0.00 3.41 4.77 -0.34 -4.23 117.00 117.03 1wkp n LEU 153 Ca -0.07 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1wkp n LEU 153 Cb 0.57 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1wkp n LEU 153 CO 0.79 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.63 1wkp n GLY 154 N 1.35 2.02 3.87 -0.72 0.00 -1.26 -4.34 105.19 106.12 1wkp n GLY 154 Ca 0.12 -0.46 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 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 3.88 0.64 0.99 1.43 -1.26 -4.86 118.68 119.51 1wkp s LEU 155 Ca 0.00 1.12 -0.18 0.00 -1.03 0.00 0.00 54.13 54.04 1wkp s LEU 155 Cb 0.00 -3.99 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 1wkp s LEU 155 CO 0.00 -0.35 1.18 -2.65 0.23 0.00 0.00 176.35 174.75 1wkp n PRO 156 N -1.13 1.01 -0.00 1.29 -0.02 -1.26 -4.68 135.00 130.21 1wkp n PRO 156 Ca 0.02 0.40 0.08 0.00 -2.02 0.00 0.00 63.50 61.98 1wkp n PRO 156 Cb 0.54 -2.41 -0.10 0.00 -0.02 0.00 0.00 33.50 31.51 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 -1.91 0.00 -3.53 -1.45 0.24 -0.28 -4.67 118.33 106.73 1wkp n VAL 157 Ca 0.15 -0.19 -0.15 0.00 -2.04 0.00 0.00 64.34 62.12 1wkp n VAL 157 Cb 0.48 0.79 -0.05 0.00 -1.47 0.00 0.00 33.84 33.58 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 -2.66 -1.81 -0.09 2.33 0.00 -1.22 -0.18 121.76 118.14 1wkp s ALA 158 Ca 0.03 1.34 -0.27 0.00 0.00 0.00 0.00 51.96 53.05 1wkp s ALA 158 Cb 0.12 -0.14 0.06 0.00 0.00 0.00 0.00 23.12 23.16 1wkp s ALA 158 CO 0.66 -0.39 0.63 0.00 0.00 0.00 0.00 175.76 176.67 1wkp s ALA 159 N -1.40 -1.63 0.06 0.00 0.00 -1.26 -1.24 121.76 116.29 1wkp s ALA 159 Ca -0.07 1.32 -0.14 0.00 0.00 0.00 0.00 51.96 53.07 1wkp s ALA 159 Cb -0.00 -0.22 0.02 0.00 0.00 0.00 0.00 23.12 22.92 1wkp s ALA 159 CO 0.05 -0.35 0.33 0.54 0.00 0.00 0.00 175.76 176.34 1wkp s VAL 160 N -0.88 0.08 -0.04 0.00 0.11 -0.26 -5.00 120.40 114.42 1wkp s VAL 160 Ca -0.09 -0.67 -0.22 0.00 -2.93 0.00 0.00 61.98 58.07 1wkp s VAL 160 Cb -0.02 -1.02 0.05 0.00 -1.53 0.00 0.00 36.38 33.86 1wkp s VAL 160 CO 0.07 -0.37 0.49 0.72 -3.33 0.00 0.00 175.10 172.69 1wkp s PHE 161 N -2.88 -0.42 0.39 1.54 -0.71 -1.26 -0.13 117.98 114.51 1wkp s PHE 161 Ca -0.03 0.73 0.04 0.00 -1.04 0.00 0.00 56.93 56.64 1wkp s PHE 161 Cb 0.00 0.24 -0.06 0.00 -1.21 0.00 0.00 43.02 42.00 1wkp s PHE 161 CO -0.05 -0.48 0.04 1.52 -1.34 0.00 0.00 175.22 174.91 1wkp s TYR 162 N -1.15 2.11 -0.08 3.49 1.13 -0.03 -1.11 117.35 121.72 1wkp s TYR 162 Ca -0.11 -0.90 -0.00 0.00 -1.41 0.00 0.00 57.07 54.64 1wkp s TYR 162 Cb -0.03 -1.48 -0.03 0.00 -1.10 0.00 0.00 41.96 39.32 1wkp s TYR 162 CO 0.07 0.15 -0.03 -0.80 -2.51 0.00 0.00 175.55 172.42 1wkp s ASN 163 N -3.63 4.93 0.06 -0.18 0.02 0.50 0.53 114.94 117.16 1wkp s ASN 163 Ca 0.30 0.06 0.03 0.00 -1.02 0.00 0.00 52.86 52.22 1wkp s ASN 163 Cb 0.07 -1.31 -0.03 0.00 0.02 0.00 0.00 41.25 40.00 1wkp s ASN 163 CO 0.14 0.37 -0.09 -0.55 0.02 0.00 0.00 177.10 177.00 1wkp s SER 164 N -0.85 1.04 -0.02 -1.22 0.15 0.01 -0.87 113.70 111.93 1wkp s SER 164 Ca 0.13 -0.64 -0.23 0.00 0.70 0.00 0.00 55.95 55.90 1wkp s SER 164 Cb -0.11 0.03 0.05 0.00 -1.71 0.00 0.00 66.02 64.28 1wkp s SER 164 CO 0.02 -0.23 0.51 0.00 1.20 0.00 0.00 173.24 174.74 1wkp s GLN 165 N -2.01 0.91 0.06 5.44 -2.07 -1.26 -0.37 119.66 120.36 1wkp s GLN 165 Ca -0.05 0.00 -0.38 0.00 -1.82 0.00 0.00 55.36 53.12 1wkp s GLN 165 Cb -0.07 0.42 -0.18 0.00 -1.09 0.00 0.00 33.01 32.09 1wkp s GLN 165 CO -0.00 -0.28 1.24 -2.13 -1.32 0.00 0.00 175.29 172.80 1wkp n ARG 166 N 0.95 0.77 0.00 9.60 0.00 -1.21 -4.49 116.66 122.28 1wkp n ARG 166 Ca -0.20 0.28 0.10 0.00 -0.00 0.00 0.00 57.85 58.03 1wkp n ARG 166 Cb 0.57 -1.87 0.61 0.00 0.00 0.00 0.00 32.46 31.78 1wkp n ARG 166 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02