#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wob n ALA 9 N 0.00 0.00 1.53 2.12 0.00 -1.26 -4.41 120.51 118.49 2wob n ALA 9 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 2wob n ALA 9 Cb 0.00 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.12 2wob n ALA 9 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wob n ASN 10 N 0.02 0.52 -4.77 0.00 5.03 -1.26 -4.92 115.26 109.87 2wob n ASN 10 Ca 0.00 -0.78 -0.36 0.00 0.87 0.00 0.00 54.58 54.31 2wob n ASN 10 Cb 0.00 -0.05 -0.07 0.00 -1.02 0.00 0.00 39.78 38.63 2wob n ASN 10 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2wob s ALA 11 N -2.32 3.70 -0.23 5.41 0.00 -1.26 -2.35 121.76 124.70 2wob s ALA 11 Ca 0.34 -0.58 -0.27 0.00 0.00 0.00 0.00 51.96 51.46 2wob s ALA 11 Cb 0.21 -2.21 0.11 0.00 0.00 0.00 0.00 23.12 21.23 2wob s ALA 11 CO 0.43 0.27 0.93 0.45 0.00 0.00 0.00 175.76 177.84 2wob s SER 12 N -0.02 -0.51 0.04 0.00 0.15 -1.26 -4.74 113.70 107.35 2wob s SER 12 Ca 0.13 0.87 -0.01 0.00 0.70 0.00 0.00 55.95 57.64 2wob s SER 12 Cb -0.12 0.85 -0.03 0.00 -1.71 0.00 0.00 66.02 65.00 2wob s SER 12 CO 0.02 -0.25 -0.02 0.27 1.20 0.00 0.00 173.24 174.46 2wob s ILE 13 N -0.14 0.17 0.23 6.45 -4.36 -1.26 -1.53 121.20 120.76 2wob s ILE 13 Ca 0.00 -1.43 0.03 0.00 -0.26 0.00 0.00 60.65 59.00 2wob s ILE 13 Cb -0.04 -1.02 -0.05 0.00 1.25 0.00 0.00 42.46 42.60 2wob s ILE 13 CO -0.02 -0.79 0.00 -0.94 0.24 0.00 0.00 174.94 173.44 2wob s SER 14 N -2.34 1.73 -0.06 4.36 1.04 -0.24 -4.60 113.70 113.58 2wob s SER 14 Ca -0.02 -1.22 0.04 0.00 0.48 0.00 0.00 55.95 55.23 2wob s SER 14 Cb 0.01 0.03 -0.00 0.00 0.10 0.00 0.00 66.02 66.16 2wob s SER 14 CO -0.06 -0.53 -0.19 -0.69 0.98 0.00 0.00 173.24 172.74 2wob s VAL 15 N -3.46 1.63 0.32 5.02 1.01 -1.26 -0.59 120.40 123.06 2wob s VAL 15 Ca 0.28 -0.80 0.09 0.00 0.00 0.00 0.00 61.98 61.55 2wob s VAL 15 Cb 0.06 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.99 2wob s VAL 15 CO 0.08 0.46 0.06 -0.94 0.00 0.00 0.00 175.10 174.77 2wob s SER 16 N 0.19 4.49 -0.04 3.32 1.04 -0.65 -4.46 113.70 117.60 2wob s SER 16 Ca -0.09 -0.80 -0.03 0.00 0.48 0.00 0.00 55.95 55.51 2wob s SER 16 Cb -0.14 -0.70 0.01 0.00 0.10 0.00 0.00 66.02 65.29 2wob s SER 16 CO 0.04 -0.20 0.09 -0.47 0.98 0.00 0.00 173.24 173.69 2wob s TYR 17 N -2.42 -0.10 -0.08 5.02 5.04 0.17 -0.86 117.35 124.12 2wob s TYR 17 Ca 0.35 0.25 0.02 0.00 -2.44 0.00 0.00 57.07 55.25 2wob s TYR 17 Cb -0.03 0.02 0.01 0.00 0.35 0.00 0.00 41.96 42.32 2wob s TYR 17 CO 0.21 -0.05 -0.12 0.21 -1.34 0.00 0.00 175.55 174.45 2wob s LYS 18 N 0.11 1.75 0.37 4.97 2.20 -0.09 -0.72 119.74 128.33 2wob s LYS 18 Ca -0.01 -0.41 -0.26 0.00 -0.36 0.00 0.00 55.97 54.93 2wob s LYS 18 Cb -0.01 -1.48 -0.09 0.00 -1.51 0.00 0.00 37.83 34.73 2wob s LYS 18 CO -0.00 -0.01 1.11 0.00 -0.36 0.00 0.00 175.35 176.08 2wob n GLY 20 N 0.68 1.30 0.32 0.00 0.00 -0.29 -4.66 105.19 102.52 2wob n GLY 20 Ca 0.03 -1.96 -0.10 0.00 0.00 0.00 0.00 46.02 43.99 2wob n GLY 20 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wob h VAL 21 N -0.03 0.00 0.00 1.61 2.07 -1.96 -3.47 116.25 114.47 2wob h VAL 21 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2wob h VAL 21 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 2wob h VAL 21 CO 0.00 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.88 2wob n LYS 22 N -4.52 0.00 0.00 1.57 5.02 -1.26 -5.04 118.16 113.92 2wob n LYS 22 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 2wob n LYS 22 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 2wob n LYS 22 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2wob n ASP 23 N 1.26 0.00 0.00 4.39 9.92 -1.26 -4.48 116.55 126.38 2wob n ASP 23 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2wob n ASP 23 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2wob n ASP 23 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2wob n GLY 24 N 0.00 0.51 0.02 0.44 0.00 -1.26 -5.07 105.19 99.82 2wob n GLY 24 Ca 0.00 -1.83 0.12 0.00 0.00 0.00 0.00 46.02 44.31 2wob n GLY 24 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2wob n THR 25 N 3.50 0.08 -0.71 2.61 5.66 -1.26 -4.96 114.28 119.21 2wob n THR 25 Ca 0.00 -0.08 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 2wob n THR 25 Cb 0.00 0.23 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 2wob n THR 25 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2wob n LYS 26 N -1.67 0.00 -0.58 1.09 5.02 -1.26 -4.88 118.16 115.88 2wob n LYS 26 Ca 0.05 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.44 2wob n LYS 26 Cb 0.37 -2.42 0.36 0.00 -0.02 0.00 0.00 35.03 33.32 2wob n LYS 26 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2wob n ASN 27 N 0.00 4.69 -4.00 4.39 0.23 -1.26 -1.13 115.26 118.17 2wob n ASN 27 Ca 0.00 -2.36 -0.25 0.00 -0.53 0.00 0.00 54.58 51.44 2wob n ASN 27 Cb 0.00 -0.57 -0.17 0.00 -2.08 0.00 0.00 39.78 36.96 2wob n ASN 27 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2wob s THR 28 N -1.69 1.10 -0.16 5.53 2.01 -1.26 -0.57 115.64 120.60 2wob s THR 28 Ca 0.52 -0.43 -0.18 0.00 0.31 0.00 0.00 61.69 61.90 2wob s THR 28 Cb 0.32 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.76 2wob s THR 28 CO 0.27 0.35 0.50 -0.63 -0.69 0.00 0.00 174.62 174.43 2wob s ILE 29 N 0.88 5.14 -0.10 1.82 1.01 0.09 -4.90 121.20 125.13 2wob s ILE 29 Ca -0.11 0.96 0.03 0.00 0.00 0.00 0.00 60.65 61.54 2wob s ILE 29 Cb -0.15 -3.83 -0.01 0.00 0.01 0.00 0.00 42.46 38.48 2wob s ILE 29 CO 0.01 0.24 -0.20 -0.13 0.00 0.00 0.00 174.94 174.86 2wob s ARG 30 N 1.20 3.04 0.13 2.79 0.52 -1.26 -0.36 118.95 125.00 2wob s ARG 30 Ca 0.25 -0.81 -0.09 0.00 -0.52 0.00 0.00 55.73 54.56 2wob s ARG 30 Cb -0.15 -2.38 -0.01 0.00 0.52 0.00 0.00 34.95 32.93 2wob s ARG 30 CO 0.10 0.25 0.24 0.00 0.02 0.00 0.00 175.30 175.91 2wob s ALA 31 N 0.19 -0.10 -0.04 2.13 0.00 -0.86 -1.14 121.76 121.93 2wob s ALA 31 Ca -0.12 -0.76 0.04 0.00 0.00 0.00 0.00 51.96 51.12 2wob s ALA 31 Cb -0.16 0.68 -0.00 0.00 0.00 0.00 0.00 23.12 23.64 2wob s ALA 31 CO 0.07 -0.58 -0.16 0.99 0.00 0.00 0.00 175.76 176.08 2wob s THR 32 N -3.92 1.31 0.33 0.00 2.01 -0.44 -0.47 115.64 114.46 2wob s THR 32 Ca 0.11 -0.65 0.10 0.00 0.31 0.00 0.00 61.69 61.57 2wob s THR 32 Cb 0.04 -1.14 -0.06 0.00 0.01 0.00 0.00 72.50 71.35 2wob s THR 32 CO -0.05 0.38 -0.12 0.27 -0.69 0.00 0.00 174.62 174.41 2wob s ILE 33 N 0.11 2.26 -0.05 1.82 -4.36 -0.94 -0.91 121.20 119.14 2wob s ILE 33 Ca -0.05 -2.24 -0.01 0.00 -0.26 0.00 0.00 60.65 58.09 2wob s ILE 33 Cb -0.11 -2.56 0.03 0.00 1.25 0.00 0.00 42.46 41.06 2wob s ILE 33 CO 0.02 -0.25 0.01 0.21 0.24 0.00 0.00 174.94 175.17 2wob s ASN 34 N -3.58 1.01 -0.18 4.36 3.84 -0.04 -1.32 114.94 119.03 2wob s ASN 34 Ca 0.32 -0.04 -0.08 0.00 0.21 0.00 0.00 52.86 53.27 2wob s ASN 34 Cb 0.01 -0.31 -0.04 0.00 -0.55 0.00 0.00 41.25 40.36 2wob s ASN 34 CO 0.16 -0.15 0.07 -0.63 -2.79 0.00 0.00 177.10 173.76 2wob s ILE 35 N 1.53 4.85 -0.01 -5.21 1.01 -1.26 -1.63 121.20 120.48 2wob s ILE 35 Ca -0.02 -0.01 0.06 0.00 0.00 0.00 0.00 60.65 60.68 2wob s ILE 35 Cb -0.13 -3.19 -0.02 0.00 0.01 0.00 0.00 42.46 39.13 2wob s ILE 35 CO -0.03 0.46 -0.21 -0.75 0.00 0.00 0.00 174.94 174.41 2wob s LYS 36 N 0.37 1.67 -0.46 2.79 2.20 0.24 -1.59 119.74 124.96 2wob s LYS 36 Ca 0.04 -0.76 -0.22 0.00 -0.36 0.00 0.00 55.97 54.67 2wob s LYS 36 Cb -0.12 -1.63 0.03 0.00 -1.51 0.00 0.00 37.83 34.60 2wob s LYS 36 CO -0.00 0.44 0.72 1.21 -0.36 0.00 0.00 175.35 177.36 2wob s ASN 37 N -0.54 6.34 0.00 1.43 3.84 0.23 -1.08 114.94 125.17 2wob s ASN 37 Ca 0.08 -0.33 0.17 0.00 0.21 0.00 0.00 52.86 52.99 2wob s ASN 37 Cb -0.08 -2.35 0.40 0.00 -0.55 0.00 0.00 41.25 38.67 2wob s ASN 37 CO -0.01 -0.88 1.32 0.35 -2.79 0.00 0.00 177.10 175.10 2wob n THR 38 N 5.95 0.73 -1.71 -5.21 -2.24 -0.58 -1.16 114.28 110.06 2wob n THR 38 Ca -0.01 -0.87 0.00 0.00 -2.27 0.00 0.00 64.05 60.91 2wob n THR 38 Cb 0.48 0.73 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 2wob n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wob n GLY 39 N 1.11 1.57 0.30 3.38 0.00 -0.85 -4.87 105.19 105.84 2wob n GLY 39 Ca 0.17 -1.98 0.03 0.00 0.00 0.00 0.00 46.02 44.23 2wob n GLY 39 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wob n THR 40 N 0.00 0.54 -4.16 2.61 -2.24 -0.99 -4.48 114.28 105.55 2wob n THR 40 Ca 0.00 -0.77 -0.16 0.00 -2.27 0.00 0.00 64.05 60.85 2wob n THR 40 Cb 0.00 0.79 -0.12 0.00 -2.10 0.00 0.00 70.33 68.90 2wob n THR 40 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2wob s THR 41 N -0.77 0.78 0.57 4.28 -4.23 -1.26 -4.87 115.64 110.14 2wob s THR 41 Ca 0.10 -1.00 -0.18 0.00 -1.18 0.00 0.00 61.69 59.43 2wob s THR 41 Cb 0.06 -0.76 -0.04 0.00 1.34 0.00 0.00 72.50 73.09 2wob s THR 41 CO 0.08 -0.19 1.14 -2.84 -0.54 0.00 0.00 174.62 172.26 2wob s PRO 42 N -1.32 3.19 -0.04 3.99 0.02 -1.26 -4.37 135.00 135.20 2wob s PRO 42 Ca -0.04 1.60 0.03 0.00 0.02 0.00 0.00 61.00 62.60 2wob s PRO 42 Cb -0.08 -1.98 0.01 0.00 0.02 0.00 0.00 34.50 32.46 2wob s PRO 42 CO 0.01 -0.98 -0.11 0.08 -0.33 0.00 0.00 177.00 175.67 2wob s VAL 43 N -1.86 0.95 0.02 3.83 1.01 -0.67 -4.98 120.40 118.71 2wob s VAL 43 Ca 0.72 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 2wob s VAL 43 Cb -0.24 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 2wob s VAL 43 CO 0.31 0.30 1.22 0.20 0.00 0.00 0.00 175.10 177.13 2wob s ASN 44 N 0.38 7.04 0.47 3.32 0.01 -1.26 -0.72 114.94 124.18 2wob s ASN 44 Ca -0.07 1.98 0.21 0.00 -0.71 0.00 0.00 52.86 54.27 2wob s ASN 44 Cb -0.12 -2.57 1.22 0.00 0.41 0.00 0.00 41.25 40.19 2wob s ASN 44 CO 0.02 -0.53 1.91 -0.07 -1.51 0.00 0.00 177.10 176.92 2wob h LEU 45 N 7.33 0.24 -0.94 0.60 3.38 -1.57 0.15 115.31 124.50 2wob h LEU 45 Ca -0.39 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2wob h LEU 45 Cb 1.20 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2wob h LEU 45 CO 0.84 0.11 0.00 0.77 0.09 0.00 0.00 178.44 180.25 2wob h SER 46 N 0.24 0.00 0.12 -0.43 4.64 -1.76 -0.38 113.55 115.98 2wob h SER 46 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2wob h SER 46 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2wob h SER 46 CO -0.09 0.00 -0.07 0.47 -0.87 0.00 0.00 176.83 176.27 2wob n ASP 47 N -2.36 0.94 -4.67 4.97 8.00 0.04 -4.77 116.55 118.71 2wob n ASP 47 Ca 0.01 -1.10 -0.35 0.00 0.71 0.00 0.00 54.79 54.07 2wob n ASP 47 Cb 0.21 0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.22 2wob n ASP 47 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wob s ILE 48 N -2.20 4.81 0.07 0.53 1.01 -0.15 -0.58 121.20 124.69 2wob s ILE 48 Ca 0.35 -0.03 0.08 0.00 0.00 0.00 0.00 60.65 61.05 2wob s ILE 48 Cb 0.21 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.50 2wob s ILE 48 CO 0.41 0.50 -0.22 -0.54 0.00 0.00 0.00 174.94 175.08 2wob s LYS 49 N 0.05 1.39 -0.02 2.79 1.02 -0.86 -4.27 119.74 119.84 2wob s LYS 49 Ca 0.06 -1.08 0.05 0.00 0.02 0.00 0.00 55.97 55.02 2wob s LYS 49 Cb -0.12 -1.60 -0.01 0.00 -0.52 0.00 0.00 37.83 35.58 2wob s LYS 49 CO 0.01 0.40 -0.16 0.08 -0.92 0.00 0.00 175.35 174.75 2wob s VAL 50 N -0.92 1.33 -0.06 3.17 1.01 -0.39 -1.50 120.40 123.04 2wob s VAL 50 Ca 0.09 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.42 2wob s VAL 50 Cb -0.09 -1.12 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 2wob s VAL 50 CO 0.03 0.38 -0.23 -0.13 0.00 0.00 0.00 175.10 175.15 2wob s ARG 51 N -0.21 2.41 -0.21 2.72 0.52 0.71 -0.68 118.95 124.21 2wob s ARG 51 Ca 0.02 -0.82 -0.03 0.00 -0.52 0.00 0.00 55.73 54.38 2wob s ARG 51 Cb -0.08 -2.02 -0.01 0.00 0.52 0.00 0.00 34.95 33.36 2wob s ARG 51 CO 0.00 0.31 -0.05 -0.47 0.02 0.00 0.00 175.30 175.11 2wob s TYR 52 N -0.03 2.94 -0.14 -0.53 5.04 -0.15 -1.82 117.35 122.66 2wob s TYR 52 Ca -0.06 -0.88 -0.05 0.00 -2.44 0.00 0.00 57.07 53.65 2wob s TYR 52 Cb -0.14 -2.07 -0.03 0.00 0.35 0.00 0.00 41.96 40.07 2wob s TYR 52 CO 0.04 -0.48 0.02 -1.58 -1.34 0.00 0.00 175.55 172.20 2wob s TRP 53 N 1.29 3.18 0.27 4.97 0.52 -1.26 -0.48 118.94 127.43 2wob s TRP 53 Ca 0.03 0.04 -0.20 0.00 0.02 0.00 0.00 56.10 55.99 2wob s TRP 53 Cb -0.14 -1.94 0.05 0.00 -1.15 0.00 0.00 33.47 30.28 2wob s TRP 53 CO -0.02 0.24 0.84 -0.59 0.02 0.00 0.00 176.95 177.43 2wob s PHE 54 N -0.12 -0.05 -0.11 -1.98 -0.12 -0.46 -1.81 117.98 113.33 2wob s PHE 54 Ca 0.05 -0.44 -0.03 0.00 -0.05 0.00 0.00 56.93 56.46 2wob s PHE 54 Cb -0.12 0.73 -0.03 0.00 -0.63 0.00 0.00 43.02 42.97 2wob s PHE 54 CO 0.02 -1.21 0.01 0.95 -0.05 0.00 0.00 175.22 174.94 2wob s THR 55 N -3.05 4.38 -1.59 -4.49 -4.23 -1.23 -1.30 115.64 104.13 2wob s THR 55 Ca 0.14 -0.21 0.25 0.00 -1.18 0.00 0.00 61.69 60.69 2wob s THR 55 Cb -0.04 -2.87 0.15 0.00 1.34 0.00 0.00 72.50 71.08 2wob s THR 55 CO 0.07 0.57 1.44 -1.54 -0.54 0.00 0.00 174.62 174.63 2wob n SER 56 N 2.49 1.03 -3.68 3.99 3.41 -1.26 -4.82 113.62 114.78 2wob n SER 56 Ca -0.18 -0.84 -0.23 0.00 -0.26 0.00 0.00 58.87 57.36 2wob n SER 56 Cb 0.53 0.25 0.05 0.00 -0.26 0.00 0.00 64.21 64.78 2wob n SER 56 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2wob n ASP 57 N -0.80 -2.71 0.00 4.04 8.00 -1.26 -1.02 116.55 122.81 2wob n ASP 57 Ca 0.10 -0.74 0.00 0.00 0.71 0.00 0.00 54.79 54.86 2wob n ASP 57 Cb 0.36 -4.36 0.00 0.00 -0.02 0.00 0.00 41.12 37.10 2wob n ASP 57 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wob n GLY 58 N -1.56 1.57 3.70 0.44 0.00 -1.26 -4.92 105.19 103.16 2wob n GLY 58 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2wob n GLY 58 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wob s ASN 59 N -3.27 6.91 -0.18 1.61 0.01 -0.18 -4.91 114.94 114.92 2wob s ASN 59 Ca 0.00 2.12 -0.24 0.00 -0.71 0.00 0.00 52.86 54.03 2wob s ASN 59 Cb 0.00 -2.57 -0.22 0.00 0.41 0.00 0.00 41.25 38.87 2wob s ASN 59 CO 0.00 -0.64 0.42 -0.33 -1.51 0.00 0.00 177.10 175.04 2wob h GLU 60 N 7.32 0.01 -5.26 -0.60 4.39 -1.95 -3.46 114.58 115.04 2wob h GLU 60 Ca -0.39 -0.01 -0.65 0.00 0.34 0.00 0.00 59.36 58.65 2wob h GLU 60 Cb 1.19 0.00 -0.24 0.00 -0.10 0.00 0.00 28.75 29.61 2wob h GLU 60 CO 0.87 1.01 -0.70 1.14 -1.16 0.00 0.00 179.01 180.17 2wob s GLN 61 N -2.32 3.55 -0.16 2.33 -2.07 -1.26 -5.08 119.66 114.65 2wob s GLN 61 Ca -0.25 -0.58 0.01 0.00 -1.82 0.00 0.00 55.36 52.72 2wob s GLN 61 Cb 0.03 -2.86 0.02 0.00 -1.09 0.00 0.00 33.01 29.11 2wob s GLN 61 CO 0.63 0.17 -0.17 -0.80 -1.32 0.00 0.00 175.29 173.80 2wob s ASN 62 N 0.54 2.92 -0.18 12.60 0.01 -1.26 -4.40 114.94 125.16 2wob s ASN 62 Ca -0.05 -0.58 -0.06 0.00 -0.71 0.00 0.00 52.86 51.46 2wob s ASN 62 Cb -0.15 -1.32 -0.04 0.00 0.41 0.00 0.00 41.25 40.16 2wob s ASN 62 CO 0.03 -0.04 0.03 0.20 -1.51 0.00 0.00 177.10 175.82 2wob s ASN 63 N 1.39 5.39 0.05 -1.22 0.01 0.54 -4.71 114.94 116.39 2wob s ASN 63 Ca 0.05 0.02 -0.25 0.00 -0.71 0.00 0.00 52.86 51.96 2wob s ASN 63 Cb -0.13 -1.91 -0.05 0.00 0.41 0.00 0.00 41.25 39.56 2wob s ASN 63 CO -0.12 0.17 0.78 0.12 -1.51 0.00 0.00 177.10 176.54 2wob s PHE 64 N 0.38 3.74 -0.05 2.20 5.36 -1.26 -0.08 117.98 128.27 2wob s PHE 64 Ca 0.01 1.50 0.02 0.00 -0.96 0.00 0.00 56.93 57.49 2wob s PHE 64 Cb -0.13 -2.84 0.02 0.00 -0.34 0.00 0.00 43.02 39.73 2wob s PHE 64 CO 0.01 0.27 -0.07 0.08 -1.46 0.00 0.00 175.22 174.04 2wob s VAL 65 N -0.05 0.75 -0.24 3.12 1.01 0.04 -4.94 120.40 120.09 2wob s VAL 65 Ca 0.39 -0.26 -0.13 0.00 0.00 0.00 0.00 61.98 61.98 2wob s VAL 65 Cb -0.21 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 2wob s VAL 65 CO 0.23 0.26 0.26 0.00 0.00 0.00 0.00 175.10 175.86 2wob h ASP 67 N 7.68 0.09 -3.79 0.00 3.32 -1.02 -3.48 116.42 119.23 2wob h ASP 67 Ca -0.36 -0.10 0.03 0.00 0.02 0.00 0.00 57.03 56.62 2wob h ASP 67 Cb 1.17 -0.03 -0.24 0.00 0.22 0.00 0.00 39.33 40.45 2wob h ASP 67 CO 0.66 1.08 0.37 -0.47 -1.72 0.00 0.00 179.24 179.16 2wob s TYR 68 N -2.70 -0.54 -0.06 4.55 5.04 -1.23 -4.99 117.35 117.42 2wob s TYR 68 Ca -0.00 1.20 -0.16 0.00 -2.44 0.00 0.00 57.07 55.67 2wob s TYR 68 Cb 0.09 0.37 0.03 0.00 0.35 0.00 0.00 41.96 42.80 2wob s TYR 68 CO 0.83 -0.33 0.38 0.00 -1.34 0.00 0.00 175.55 175.09 2wob s ALA 69 N -0.21 -0.95 0.36 3.97 0.00 -1.26 -3.72 121.76 119.96 2wob s ALA 69 Ca -0.00 0.69 0.05 0.00 0.00 0.00 0.00 51.96 52.69 2wob s ALA 69 Cb -0.03 -0.17 0.71 0.00 0.00 0.00 0.00 23.12 23.63 2wob s ALA 69 CO -0.01 -0.25 1.99 0.00 0.00 0.00 0.00 175.76 177.50 2wob h ALA 70 N 4.32 1.64 -0.18 0.00 0.00 -1.82 -1.75 119.26 121.47 2wob h ALA 70 Ca -0.28 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2wob h ALA 70 Cb 1.17 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2wob h ALA 70 CO 0.35 0.29 0.00 1.97 0.00 0.00 0.00 179.25 181.86 2wob n PHE 71 N -4.46 0.22 0.00 0.00 1.16 -1.26 -5.00 117.46 108.11 2wob n PHE 71 Ca 0.08 -0.11 0.00 0.00 -1.87 0.00 0.00 57.45 55.55 2wob n PHE 71 Cb 0.13 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.00 2wob n PHE 71 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2wob n GLY 72 N 1.30 3.77 0.31 4.97 0.00 -0.66 -4.79 105.19 110.08 2wob n GLY 72 Ca 0.17 -1.28 0.18 0.00 0.00 0.00 0.00 46.02 45.09 2wob n GLY 72 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2wob h THR 73 N 0.00 0.24 0.00 2.61 1.35 -1.91 -1.34 112.91 113.86 2wob h THR 73 Ca 0.00 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2wob h THR 73 Cb 0.00 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 2wob h THR 73 CO 0.00 0.03 0.00 -0.90 -0.25 0.00 0.00 175.52 174.40 2wob n ASP 74 N -3.37 0.00 -0.34 5.36 5.75 -1.26 -2.66 116.55 120.03 2wob n ASP 74 Ca -0.02 -0.05 0.04 0.00 -0.01 0.00 0.00 54.79 54.75 2wob n ASP 74 Cb 0.14 -0.07 0.03 0.00 -1.03 0.00 0.00 41.12 40.20 2wob n ASP 74 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2wob n LYS 75 N -1.07 0.38 -3.88 0.11 4.76 -0.50 -4.92 118.16 113.04 2wob n LYS 75 Ca 0.03 -0.98 -0.35 0.00 -2.87 0.00 0.00 58.31 54.13 2wob n LYS 75 Cb 0.02 -1.16 -0.14 0.00 -1.84 0.00 0.00 35.03 31.92 2wob n LYS 75 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wob s VAL 76 N -0.77 3.49 -0.03 -0.18 1.01 -1.09 -1.74 120.40 121.09 2wob s VAL 76 Ca 0.10 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 2wob s VAL 76 Cb 0.07 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 2wob s VAL 76 CO 0.12 0.34 0.11 -0.54 0.00 0.00 0.00 175.10 175.13 2wob s LYS 77 N 1.48 3.23 -0.02 2.72 1.02 0.83 -4.92 119.74 124.08 2wob s LYS 77 Ca 0.05 -0.37 0.02 0.00 0.02 0.00 0.00 55.97 55.68 2wob s LYS 77 Cb -0.15 -2.98 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 2wob s LYS 77 CO -0.02 0.68 -0.06 0.20 -0.92 0.00 0.00 175.35 175.23 2wob s GLY 78 N -1.59 0.35 -0.00 -3.33 0.00 -1.26 -1.08 107.32 100.40 2wob s GLY 78 Ca 0.22 -0.21 0.03 0.00 0.00 0.00 0.00 44.72 44.76 2wob s GLY 78 CO 0.12 -0.04 -0.11 -1.50 0.00 0.00 0.00 173.10 171.57 2wob s ILE 79 N 0.14 0.84 -0.18 0.90 2.07 -0.17 -4.82 121.20 119.98 2wob s ILE 79 Ca -0.01 -0.51 -0.02 0.00 -1.41 0.00 0.00 60.65 58.70 2wob s ILE 79 Cb -0.06 -0.71 -0.01 0.00 0.13 0.00 0.00 42.46 41.81 2wob s ILE 79 CO -0.00 0.20 -0.10 -0.69 -1.91 0.00 0.00 174.94 172.44 2wob s VAL 80 N -0.33 3.08 0.04 4.00 1.01 -1.26 -0.18 120.40 126.76 2wob s VAL 80 Ca 0.03 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.46 2wob s VAL 80 Cb -0.05 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 2wob s VAL 80 CO -0.00 0.48 -0.17 -0.54 0.00 0.00 0.00 175.10 174.86 2wob s LYS 81 N 1.00 1.14 0.42 2.72 1.02 0.86 -4.97 119.74 121.94 2wob s LYS 81 Ca -0.01 -0.86 -0.24 0.00 0.02 0.00 0.00 55.97 54.89 2wob s LYS 81 Cb -0.15 -1.21 -0.08 0.00 -0.52 0.00 0.00 37.83 35.87 2wob s LYS 81 CO -0.01 0.30 1.15 0.15 -0.92 0.00 0.00 175.35 176.02 2wob s LYS 82 N -1.19 3.95 -0.22 1.68 -0.14 -1.26 -0.30 119.74 122.26 2wob s LYS 82 Ca 0.04 1.76 -0.10 0.00 -1.36 0.00 0.00 55.97 56.32 2wob s LYS 82 Cb -0.08 -2.54 -0.05 0.00 -1.68 0.00 0.00 37.83 33.48 2wob s LYS 82 CO 0.02 -0.39 0.13 0.42 -0.76 0.00 0.00 175.35 174.76 2wob s ILE 83 N -1.50 5.18 0.06 2.17 1.01 0.89 -4.86 121.20 124.14 2wob s ILE 83 Ca 0.60 0.11 -0.17 0.00 0.00 0.00 0.00 60.65 61.19 2wob s ILE 83 Cb -0.28 -3.39 -0.15 0.00 0.01 0.00 0.00 42.46 38.65 2wob s ILE 83 CO 0.35 0.39 1.29 -0.08 0.00 0.00 0.00 174.94 176.89 2wob h GLU 84 N 7.22 0.57 -3.29 2.79 4.81 -1.96 -3.36 114.58 121.37 2wob h GLU 84 Ca -0.38 -0.41 -0.77 0.00 -0.13 0.00 0.00 59.36 57.67 2wob h GLU 84 Cb 1.17 0.07 -0.31 0.00 0.63 0.00 0.00 28.75 30.31 2wob h GLU 84 CO 0.68 1.02 0.34 0.09 -0.73 0.00 0.00 179.01 180.42 2wob n ASN 85 N -4.25 5.31 -4.87 1.04 3.02 -1.26 -5.04 115.26 109.21 2wob n ASN 85 Ca -0.07 -3.17 -0.31 0.00 -0.03 0.00 0.00 54.58 51.01 2wob n ASN 85 Cb 0.56 -1.24 0.01 0.00 -0.61 0.00 0.00 39.78 38.50 2wob n ASN 85 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wob s SER 86 N 0.05 6.21 0.23 6.41 1.04 -1.26 -4.88 113.70 121.50 2wob s SER 86 Ca 0.31 1.41 0.03 0.00 0.48 0.00 0.00 55.95 58.18 2wob s SER 86 Cb -0.05 -2.45 -0.05 0.00 0.10 0.00 0.00 66.02 63.57 2wob s SER 86 CO -0.05 -0.88 0.00 0.68 0.98 0.00 0.00 173.24 173.97 2wob s VAL 87 N -3.18 0.99 0.27 5.02 -7.23 -0.68 -5.02 120.40 110.57 2wob s VAL 87 Ca 0.55 -2.03 -0.30 0.00 -1.81 0.00 0.00 61.98 58.39 2wob s VAL 87 Cb -0.11 -2.35 -0.13 0.00 0.56 0.00 0.00 36.38 34.35 2wob s VAL 87 CO 0.54 -0.31 1.44 -2.65 -0.31 0.00 0.00 175.10 173.80 2wob n PRO 88 N -0.41 2.24 0.00 4.82 -0.02 -1.26 -0.90 135.00 139.46 2wob n PRO 88 Ca -0.05 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2wob n PRO 88 Cb 0.64 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2wob n PRO 88 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wob n GLY 89 N 1.88 2.43 2.89 -1.23 0.00 -1.26 -4.82 105.19 105.08 2wob n GLY 89 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 2wob n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wob s ALA 90 N -2.23 -1.06 -0.31 4.61 0.00 -0.08 -1.33 121.76 121.37 2wob s ALA 90 Ca 0.00 0.35 0.03 0.00 0.00 0.00 0.00 51.96 52.34 2wob s ALA 90 Cb 0.00 -1.91 0.01 0.00 0.00 0.00 0.00 23.12 21.22 2wob s ALA 90 CO 0.00 -1.60 0.51 -0.40 0.00 0.00 0.00 175.76 174.28 2wob n ASP 91 N 5.35 1.06 -3.93 0.00 5.68 -0.94 -1.69 116.55 122.08 2wob n ASP 91 Ca -0.01 -1.03 -0.10 0.00 -0.50 0.00 0.00 54.79 53.15 2wob n ASP 91 Cb 0.49 0.16 -0.11 0.00 -1.14 0.00 0.00 41.12 40.52 2wob n ASP 91 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2wob s THR 92 N -0.39 0.08 0.04 2.12 2.01 -0.42 -0.08 115.64 119.00 2wob s THR 92 Ca 0.03 -0.67 0.01 0.00 0.31 0.00 0.00 61.69 61.37 2wob s THR 92 Cb 0.02 -0.26 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 2wob s THR 92 CO 0.05 -0.37 -0.06 -0.72 -0.69 0.00 0.00 174.62 172.82 2wob s TYR 93 N -1.14 0.54 -0.27 4.92 -0.85 0.59 -1.36 117.35 119.79 2wob s TYR 93 Ca -0.12 -0.52 -0.10 0.00 -0.52 0.00 0.00 57.07 55.81 2wob s TYR 93 Cb -0.07 -0.34 -0.04 0.00 0.38 0.00 0.00 41.96 41.88 2wob s TYR 93 CO -0.00 -0.12 0.15 0.00 -1.52 0.00 0.00 175.55 174.06 2wob s GLU 95 N 1.62 3.78 -0.13 0.00 2.12 0.74 -0.98 118.70 125.86 2wob s GLU 95 Ca 0.07 -0.41 -0.03 0.00 0.36 0.00 0.00 54.97 54.95 2wob s GLU 95 Cb -0.15 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 30.78 2wob s GLU 95 CO 0.08 -0.15 -0.03 0.42 -0.54 0.00 0.00 175.26 175.05 2wob s ILE 96 N 1.55 4.03 0.34 -3.70 1.01 0.14 -1.00 121.20 123.57 2wob s ILE 96 Ca 0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 60.65 60.34 2wob s ILE 96 Cb -0.15 -2.74 0.01 0.00 0.01 0.00 0.00 42.46 39.59 2wob s ILE 96 CO 0.06 0.53 0.50 -0.94 0.00 0.00 0.00 174.94 175.08 2wob s SER 97 N -0.06 0.75 0.04 3.58 1.04 -0.24 -1.26 113.70 117.54 2wob s SER 97 Ca 0.02 -1.41 0.04 0.00 0.48 0.00 0.00 55.95 55.08 2wob s SER 97 Cb -0.13 0.67 -0.02 0.00 0.10 0.00 0.00 66.02 66.64 2wob s SER 97 CO 0.02 -1.31 -0.11 -0.36 0.98 0.00 0.00 173.24 172.46 2wob s PHE 98 N -3.08 0.97 0.63 5.02 0.40 -1.26 -0.12 117.98 120.54 2wob s PHE 98 Ca 0.29 -0.37 -0.11 0.00 -0.60 0.00 0.00 56.93 56.14 2wob s PHE 98 Cb -0.01 -0.58 -0.03 0.00 0.51 0.00 0.00 43.02 42.91 2wob s PHE 98 CO 0.19 -0.00 1.04 0.95 0.70 0.00 0.00 175.22 178.09 2wob s THR 99 N -0.94 4.55 0.50 0.64 -4.23 -0.71 -4.37 115.64 111.08 2wob s THR 99 Ca -0.02 0.82 0.33 0.00 -1.18 0.00 0.00 61.69 61.64 2wob s THR 99 Cb -0.08 -3.82 0.53 0.00 1.34 0.00 0.00 72.50 70.47 2wob s THR 99 CO 0.01 -1.08 1.76 -0.33 -0.54 0.00 0.00 174.62 174.44 2wob h GLU 100 N -0.36 0.10 -0.65 3.99 5.08 -1.93 -1.56 114.58 119.24 2wob h GLU 100 Ca -0.44 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2wob h GLU 100 Cb 1.20 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2wob h GLU 100 CO 0.62 0.07 0.00 -0.40 -1.00 0.00 0.00 179.01 178.30 2wob n ASP 101 N -4.32 3.96 0.26 1.42 5.75 -1.26 -4.26 116.55 118.11 2wob n ASP 101 Ca 0.28 -2.22 0.11 0.00 -0.01 0.00 0.00 54.79 52.96 2wob n ASP 101 Cb 1.25 -0.50 0.73 0.00 -1.03 0.00 0.00 41.12 41.57 2wob n ASP 101 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wob h ALA 102 N 4.10 1.49 0.00 2.12 0.00 -1.61 -3.50 119.26 121.86 2wob h ALA 102 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2wob h ALA 102 Cb 1.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2wob h ALA 102 CO 0.11 0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.89 2wob n GLY 103 N -1.00 -1.14 3.16 0.00 0.00 -1.26 -4.91 105.19 100.04 2wob n GLY 103 Ca -0.02 -2.11 -0.10 0.00 0.00 0.00 0.00 46.02 43.79 2wob n GLY 103 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wob s ARG 104 N 0.00 0.88 -0.22 1.61 1.70 -1.26 -1.38 118.95 120.28 2wob s ARG 104 Ca 0.00 -1.39 -0.03 0.00 -0.47 0.00 0.00 55.73 53.83 2wob s ARG 104 Cb 0.00 0.03 -0.00 0.00 -0.57 0.00 0.00 34.95 34.41 2wob s ARG 104 CO 0.00 -0.15 -0.05 -0.51 -1.08 0.00 0.00 175.30 173.51 2wob s LEU 105 N -3.05 2.89 0.79 -1.89 1.43 0.10 -4.89 118.68 114.06 2wob s LEU 105 Ca 0.18 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.70 2wob s LEU 105 Cb 0.07 -1.72 0.06 0.00 0.03 0.00 0.00 46.19 44.63 2wob s LEU 105 CO -0.02 -0.03 1.10 0.00 0.23 0.00 0.00 176.35 177.63 2wob s ALA 106 N 1.45 2.32 0.39 4.21 0.00 -1.26 -1.68 121.76 127.20 2wob s ALA 106 Ca 0.05 -0.20 -0.26 0.00 0.00 0.00 0.00 51.96 51.55 2wob s ALA 106 Cb -0.14 -3.10 -0.11 0.00 0.00 0.00 0.00 23.12 19.76 2wob s ALA 106 CO -0.04 -1.66 1.16 -2.30 0.00 0.00 0.00 175.76 172.93 2wob n PRO 107 N -3.38 1.72 -0.77 0.00 -0.02 -1.26 -0.61 135.00 130.68 2wob n PRO 107 Ca 0.07 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2wob n PRO 107 Cb 0.56 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2wob n PRO 107 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wob n GLY 108 N 0.96 0.49 3.88 -1.23 0.00 -0.31 -5.03 105.19 103.96 2wob n GLY 108 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 2wob n GLY 108 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wob s GLY 109 N -2.00 2.24 0.03 -0.02 0.00 0.22 -4.86 107.32 102.93 2wob s GLY 109 Ca 0.00 -0.31 -0.05 0.00 0.00 0.00 0.00 44.72 44.36 2wob s GLY 109 CO 0.00 -0.17 0.08 -1.35 0.00 0.00 0.00 173.10 171.66 2wob s SER 110 N -2.44 0.18 0.33 1.64 1.04 -1.26 -0.60 113.70 112.60 2wob s SER 110 Ca 0.47 -0.52 0.17 0.00 0.48 0.00 0.00 55.95 56.55 2wob s SER 110 Cb -0.11 0.21 0.45 0.00 0.10 0.00 0.00 66.02 66.67 2wob s SER 110 CO 0.22 -0.48 1.62 0.71 0.98 0.00 0.00 173.24 176.29 2wob h THR 111 N 3.79 0.92 -0.37 2.02 1.35 -1.66 -3.49 112.91 115.48 2wob h THR 111 Ca -0.32 -1.84 0.04 0.00 -0.55 0.00 0.00 66.41 63.73 2wob h THR 111 Cb 1.19 2.13 -0.01 0.00 -1.73 0.00 0.00 68.15 69.73 2wob h THR 111 CO 0.49 0.44 -0.05 0.61 -0.25 0.00 0.00 175.52 176.77 2wob n GLY 112 N 0.59 -2.14 3.68 5.82 0.00 -1.26 -4.63 105.19 107.24 2wob n GLY 112 Ca 0.00 -1.45 -0.45 0.00 0.00 0.00 0.00 46.02 44.12 2wob n GLY 112 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wob n THR 113 N -1.07 0.05 -3.86 2.61 -2.24 -1.26 -4.45 114.28 104.06 2wob n THR 113 Ca 0.00 -0.01 -0.30 0.00 -2.27 0.00 0.00 64.05 61.47 2wob n THR 113 Cb 0.06 -1.66 -0.13 0.00 -2.10 0.00 0.00 70.33 66.49 2wob n THR 113 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2wob s ILE 114 N 1.24 2.20 0.25 2.28 1.01 -0.44 -4.61 121.20 123.13 2wob s ILE 114 Ca 0.79 -3.15 -0.21 0.00 0.00 0.00 0.00 60.65 58.09 2wob s ILE 114 Cb -0.64 -2.52 -0.09 0.00 0.01 0.00 0.00 42.46 39.22 2wob s ILE 114 CO 0.38 -0.85 0.77 -2.16 0.00 0.00 0.00 174.94 173.07 2wob s PRO 115 N -0.18 4.30 0.12 2.79 0.04 -1.24 -2.21 135.00 138.63 2wob s PRO 115 Ca 0.18 0.95 -0.03 0.00 0.04 0.00 0.00 61.00 62.14 2wob s PRO 115 Cb -0.23 -2.84 -0.03 0.00 0.04 0.00 0.00 34.50 31.43 2wob s PRO 115 CO -0.02 0.36 0.08 -0.59 0.04 0.00 0.00 177.00 176.88 2wob s PHE 116 N -1.56 0.71 0.04 0.56 -0.12 0.38 -0.31 117.98 117.69 2wob s PHE 116 Ca 0.45 -1.11 0.05 0.00 -0.05 0.00 0.00 56.93 56.26 2wob s PHE 116 Cb -0.17 -0.39 -0.02 0.00 -0.63 0.00 0.00 43.02 41.82 2wob s PHE 116 CO 0.21 -0.53 -0.14 1.03 -0.05 0.00 0.00 175.22 175.74 2wob s ARG 117 N -4.01 0.91 -0.16 1.99 0.52 0.83 -2.03 118.95 117.01 2wob s ARG 117 Ca 0.20 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.64 2wob s ARG 117 Cb 0.07 -0.92 0.02 0.00 0.52 0.00 0.00 34.95 34.63 2wob s ARG 117 CO -0.01 0.22 -0.20 0.42 0.02 0.00 0.00 175.30 175.76 2wob s ILE 118 N -0.92 1.99 -0.10 1.52 1.01 0.51 -0.78 121.20 124.44 2wob s ILE 118 Ca 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.75 2wob s ILE 118 Cb -0.08 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 2wob s ILE 118 CO 0.01 0.53 -0.11 -1.61 0.00 0.00 0.00 174.94 173.77 2wob s GLU 119 N 1.08 3.08 0.49 2.79 2.02 0.89 -0.73 118.70 128.31 2wob s GLU 119 Ca -0.01 -0.64 0.02 0.00 0.02 0.00 0.00 54.97 54.36 2wob s GLU 119 Cb -0.14 -2.60 -0.01 0.00 0.10 0.00 0.00 34.13 31.48 2wob s GLU 119 CO -0.08 0.41 0.05 0.20 0.02 0.00 0.00 175.26 175.86 2wob s GLY 120 N -0.16 2.95 -0.03 -1.39 0.00 0.26 -0.34 107.32 108.62 2wob s GLY 120 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 44.72 44.22 2wob s GLY 120 CO 0.03 -2.09 0.73 0.00 0.00 0.00 0.00 173.10 171.77 2wob h ALA 121 N 1.45 0.43 -1.97 3.20 0.00 -1.84 -3.45 119.26 117.07 2wob h ALA 121 Ca -0.41 -1.25 -0.48 0.00 0.00 0.00 0.00 54.91 52.78 2wob h ALA 121 Cb 1.31 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 19.47 2wob h ALA 121 CO 0.68 1.29 -0.43 0.00 0.00 0.00 0.00 179.25 180.78 2wob s ALA 122 N -2.60 3.91 0.09 0.00 0.00 -1.26 -4.97 121.76 116.92 2wob s ALA 122 Ca -0.10 -1.48 -0.34 0.00 0.00 0.00 0.00 51.96 50.04 2wob s ALA 122 Cb 0.07 -1.43 -0.13 0.00 0.00 0.00 0.00 23.12 21.63 2wob s ALA 122 CO 0.83 0.09 1.67 -1.91 0.00 0.00 0.00 175.76 176.44 2wob n GLU 123 N -1.41 2.15 -3.02 0.00 2.13 -1.26 -4.50 120.64 114.72 2wob n GLU 123 Ca -0.04 0.78 -0.38 0.00 0.66 0.00 0.00 57.16 58.18 2wob n GLU 123 Cb 0.58 -2.57 -0.06 0.00 0.27 0.00 0.00 31.44 29.66 2wob n GLU 123 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2wob s TYR 124 N 1.86 3.81 -0.49 4.31 1.51 -0.29 -4.89 117.35 123.17 2wob s TYR 124 Ca 0.83 1.55 -0.13 0.00 -1.01 0.00 0.00 57.07 58.30 2wob s TYR 124 Cb -0.69 -2.71 0.11 0.00 -0.11 0.00 0.00 41.96 38.56 2wob s TYR 124 CO 0.42 0.45 0.41 0.34 -1.11 0.00 0.00 175.55 176.06 2wob s ASP 125 N -1.33 5.98 0.11 2.29 -1.08 -1.26 -4.87 116.67 116.51 2wob s ASP 125 Ca 0.38 -1.69 0.27 0.00 -0.52 0.00 0.00 52.55 50.99 2wob s ASP 125 Cb -0.21 -2.12 1.01 0.00 -1.46 0.00 0.00 42.92 40.14 2wob s ASP 125 CO 0.24 -0.73 1.83 0.00 0.52 0.00 0.00 175.17 177.03 2wob n GLN 126 N 5.11 0.13 0.20 4.34 6.02 -1.26 -4.13 117.38 127.80 2wob n GLN 126 Ca -0.12 0.13 0.05 0.00 -0.01 0.00 0.00 57.00 57.05 2wob n GLN 126 Cb 0.41 -1.66 0.49 0.00 1.02 0.00 0.00 30.24 30.51 2wob n GLN 126 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 2wob h THR 127 N 0.00 1.13 0.00 5.09 1.35 -1.98 -2.04 112.91 116.46 2wob h THR 127 Ca 0.00 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 2wob h THR 127 Cb 0.60 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2wob h THR 127 CO 0.00 0.17 -0.88 -0.90 -0.25 0.00 0.00 175.52 173.67 2wob n ASP 128 N -4.34 0.65 -4.64 5.36 3.85 -1.26 -4.94 116.55 111.24 2wob n ASP 128 Ca -0.02 -0.35 -0.48 0.00 -0.71 0.00 0.00 54.79 53.23 2wob n ASP 128 Cb 0.23 0.67 -0.05 0.00 -1.35 0.00 0.00 41.12 40.63 2wob n ASP 128 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2wob n ASP 129 N -1.77 2.54 -0.25 -1.12 8.00 -0.77 -4.09 116.55 119.09 2wob n ASP 129 Ca 0.03 1.10 -0.01 0.00 0.71 0.00 0.00 54.79 56.62 2wob n ASP 129 Cb 0.39 -1.34 0.06 0.00 -0.02 0.00 0.00 41.12 40.21 2wob n ASP 129 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2wob h TYR 130 N 5.32 -0.59 -0.01 1.24 3.20 -1.24 -2.74 116.97 122.15 2wob h TYR 130 Ca -0.46 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.48 2wob h TYR 130 Cb 1.28 0.37 0.00 0.00 1.54 0.00 0.00 36.73 39.92 2wob h TYR 130 CO 0.61 -0.34 -0.24 0.43 -1.64 0.00 0.00 178.16 176.98 2wob n SER 131 N -5.47 0.82 -4.70 -2.11 7.64 -0.75 -4.86 113.62 104.19 2wob n SER 131 Ca 0.08 -0.73 -0.42 0.00 1.01 0.00 0.00 58.87 58.81 2wob n SER 131 Cb 0.37 0.08 -0.03 0.00 -1.01 0.00 0.00 64.21 63.63 2wob n SER 131 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2wob s TYR 132 N -2.55 3.31 -0.34 1.43 5.04 -1.04 -4.81 117.35 118.40 2wob s TYR 132 Ca 0.24 1.27 -0.01 0.00 -2.44 0.00 0.00 57.07 56.13 2wob s TYR 132 Cb 0.19 -3.41 0.12 0.00 0.35 0.00 0.00 41.96 39.21 2wob s TYR 132 CO 0.52 -1.23 0.16 1.21 -1.34 0.00 0.00 175.55 174.87 2wob s ASN 133 N 1.29 3.54 0.57 4.32 3.84 -1.26 -4.92 114.94 122.32 2wob s ASN 133 Ca 0.57 -1.86 0.36 0.00 0.21 0.00 0.00 52.86 52.14 2wob s ASN 133 Cb -0.26 -0.62 1.60 0.00 -0.55 0.00 0.00 41.25 41.41 2wob s ASN 133 CO 0.25 -0.37 2.07 0.77 -2.79 0.00 0.00 177.10 177.04 2wob h SER 134 N 7.66 0.00 0.58 -4.21 4.64 -1.99 -0.98 113.55 119.25 2wob h SER 134 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2wob h SER 134 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2wob h SER 134 CO 0.41 0.02 0.00 -0.62 -0.87 0.00 0.00 176.83 175.76 2wob n GLU 135 N -3.13 0.05 -2.13 4.77 -0.58 -1.26 -3.26 120.64 115.09 2wob n GLU 135 Ca -0.00 0.28 -0.36 0.00 -0.42 0.00 0.00 57.16 56.65 2wob n GLU 135 Cb 0.25 -1.58 0.03 0.00 -0.57 0.00 0.00 31.44 29.57 2wob n GLU 135 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 2wob n MET 136 N -1.67 3.10 0.01 3.49 2.81 -0.37 -4.68 117.12 119.80 2wob n MET 136 Ca 0.03 -3.88 -0.00 0.00 -1.81 0.00 0.00 57.70 52.04 2wob n MET 136 Cb 0.19 -2.28 -0.10 0.00 -0.71 0.00 0.00 33.22 30.32 2wob n MET 136 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2wob n SER 137 N -0.49 0.62 -0.05 7.83 7.64 -1.20 -1.65 113.62 126.31 2wob n SER 137 Ca 0.49 0.27 -0.12 0.00 1.01 0.00 0.00 58.87 60.52 2wob n SER 137 Cb 0.35 0.52 -0.14 0.00 -1.01 0.00 0.00 64.21 63.92 2wob n SER 137 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2wob n ASP 138 N -2.79 0.94 -3.89 6.43 8.00 -1.26 -4.80 116.55 119.18 2wob n ASP 138 Ca -0.13 0.19 -0.12 0.00 0.71 0.00 0.00 54.79 55.44 2wob n ASP 138 Cb 0.85 0.09 -0.08 0.00 -0.02 0.00 0.00 41.12 41.97 2wob n ASP 138 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2wob s ASP 139 N -6.11 0.39 0.18 -2.24 -1.08 -1.26 -5.13 116.67 101.42 2wob s ASP 139 Ca -0.13 -1.32 -0.30 0.00 -0.52 0.00 0.00 52.55 50.28 2wob s ASP 139 Cb 0.07 0.50 -0.08 0.00 -1.46 0.00 0.00 42.92 41.96 2wob s ASP 139 CO 0.79 -1.02 1.05 -0.36 0.52 0.00 0.00 175.17 176.15 2wob s PHE 140 N -3.85 3.69 0.40 -5.34 0.40 -1.26 -4.67 117.98 107.34 2wob s PHE 140 Ca 0.33 1.69 0.05 0.00 -0.60 0.00 0.00 56.93 58.40 2wob s PHE 140 Cb 0.03 -3.20 -0.02 0.00 0.51 0.00 0.00 43.02 40.34 2wob s PHE 140 CO 0.14 -0.31 0.17 0.20 0.70 0.00 0.00 175.22 176.13 2wob s GLY 141 N -0.30 2.63 -1.06 4.36 0.00 0.10 -4.83 107.32 108.22 2wob s GLY 141 Ca 0.47 -1.34 -0.14 0.00 0.00 0.00 0.00 44.72 43.71 2wob s GLY 141 CO 0.34 -1.76 1.18 -0.35 0.00 0.00 0.00 173.10 172.51 2wob s ASP 142 N -3.58 6.98 -0.69 1.64 2.15 -1.26 -0.66 116.67 121.26 2wob s ASP 142 Ca 0.26 -2.87 -0.18 0.00 0.43 0.00 0.00 52.55 50.19 2wob s ASP 142 Cb 0.02 -2.32 0.13 0.00 -0.30 0.00 0.00 42.92 40.44 2wob s ASP 142 CO 0.18 -0.68 0.79 0.21 -0.17 0.00 0.00 175.17 175.49 2wob s ASN 143 N 2.54 6.36 0.00 -0.34 3.84 -1.26 -4.90 114.94 121.18 2wob s ASN 143 Ca 0.34 -1.75 0.05 0.00 0.21 0.00 0.00 52.86 51.71 2wob s ASN 143 Cb -0.06 -2.30 0.25 0.00 -0.55 0.00 0.00 41.25 38.59 2wob s ASN 143 CO -0.06 -1.02 1.17 0.35 -2.79 0.00 0.00 177.10 174.76 2wob n THR 144 N 5.27 0.08 0.84 -5.21 -2.24 -1.26 -2.63 114.28 109.14 2wob n THR 144 Ca 0.00 -0.09 0.11 0.00 -2.27 0.00 0.00 64.05 61.80 2wob n THR 144 Cb 0.44 0.01 0.29 0.00 -2.10 0.00 0.00 70.33 68.97 2wob n THR 144 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2wob n LYS 145 N -0.35 2.09 -4.20 -0.78 5.02 -1.26 0.04 118.16 118.72 2wob n LYS 145 Ca 0.05 -1.63 -0.35 0.00 -2.02 0.00 0.00 58.31 54.35 2wob n LYS 145 Cb 0.07 -1.45 -0.09 0.00 -0.02 0.00 0.00 35.03 33.55 2wob n LYS 145 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wob s ILE 146 N -1.69 4.68 0.23 -0.18 1.01 -1.08 -4.28 121.20 119.89 2wob s ILE 146 Ca 0.35 -0.10 0.10 0.00 0.00 0.00 0.00 60.65 60.99 2wob s ILE 146 Cb 0.20 -3.01 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 2wob s ILE 146 CO 0.29 0.59 -0.08 0.42 0.00 0.00 0.00 174.94 176.15 2wob s THR 147 N -0.72 3.15 0.00 2.92 -4.23 -0.76 -4.31 115.64 111.70 2wob s THR 147 Ca 0.12 -1.87 -0.09 0.00 -1.18 0.00 0.00 61.69 58.67 2wob s THR 147 Cb -0.12 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.11 2wob s THR 147 CO 0.02 -0.25 0.16 0.00 -0.54 0.00 0.00 174.62 174.02 2wob s ALA 148 N -2.05 -0.40 0.02 3.99 0.00 -0.45 -0.21 121.76 122.66 2wob s ALA 148 Ca 0.28 -0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.19 2wob s ALA 148 Cb -0.07 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 2wob s ALA 148 CO 0.17 -0.22 -0.07 0.71 0.00 0.00 0.00 175.76 176.35 2wob s TYR 149 N -1.40 0.61 -0.15 0.00 1.51 -0.56 -0.42 117.35 116.94 2wob s TYR 149 Ca -0.15 -0.29 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 2wob s TYR 149 Cb -0.07 -0.37 -0.00 0.00 -0.11 0.00 0.00 41.96 41.40 2wob s TYR 149 CO 0.02 -0.04 -0.15 0.42 -1.11 0.00 0.00 175.55 174.69 2wob s ILE 150 N -0.72 2.67 -1.63 2.71 1.01 -0.74 -2.02 121.20 122.47 2wob s ILE 150 Ca -0.03 -0.77 -0.10 0.00 0.00 0.00 0.00 60.65 59.74 2wob s ILE 150 Cb -0.06 -2.12 0.09 0.00 0.01 0.00 0.00 42.46 40.38 2wob s ILE 150 CO 0.00 0.52 0.44 0.29 0.00 0.00 0.00 174.94 176.19 2wob n LYS 151 N 3.99 -2.07 -0.99 2.79 5.02 0.26 -0.96 118.16 126.19 2wob n LYS 151 Ca -0.19 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 2wob n LYS 151 Cb 0.52 -4.46 0.00 0.00 -0.02 0.00 0.00 35.03 31.06 2wob n LYS 151 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2wob n ASP 152 N -2.76 -3.69 -4.64 4.39 8.00 -1.26 -5.01 116.55 111.58 2wob n ASP 152 Ca -0.12 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.03 2wob n ASP 152 Cb 0.59 -1.44 -0.10 0.00 -0.02 0.00 0.00 41.12 40.15 2wob n ASP 152 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2wob s LYS 153 N -0.64 4.01 0.18 -1.24 -0.14 -0.13 -5.04 119.74 116.74 2wob s LYS 153 Ca 0.00 -0.31 -0.32 0.00 -1.36 0.00 0.00 55.97 53.98 2wob s LYS 153 Cb 0.00 -3.36 -0.11 0.00 -1.68 0.00 0.00 37.83 32.68 2wob s LYS 153 CO 0.00 0.17 1.72 -1.17 -0.76 0.00 0.00 175.35 175.32 2wob s LEU 154 N 0.69 4.38 0.00 3.17 2.96 -1.26 -1.79 118.68 126.82 2wob s LEU 154 Ca 0.05 2.80 0.00 0.00 -0.22 0.00 0.00 54.13 56.77 2wob s LEU 154 Cb -0.13 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 42.97 2wob s LEU 154 CO 0.01 -0.96 0.00 0.29 -1.32 0.00 0.00 176.35 174.38 2wob n LYS 155 N 4.39 3.32 -3.69 1.98 4.76 0.44 -4.91 118.16 124.44 2wob n LYS 155 Ca 0.16 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.49 2wob n LYS 155 Cb 0.36 -0.56 -0.09 0.00 -1.84 0.00 0.00 35.03 32.90 2wob n LYS 155 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 2wob s TYR 156 N -0.93 -0.66 0.00 2.13 5.04 -0.71 -4.71 117.35 117.50 2wob s TYR 156 Ca 0.00 1.46 0.00 0.00 -2.44 0.00 0.00 57.07 56.09 2wob s TYR 156 Cb 0.00 0.29 0.00 0.00 0.35 0.00 0.00 41.96 42.60 2wob s TYR 156 CO 0.00 -0.34 0.00 0.41 -1.34 0.00 0.00 175.55 174.28 2wob n GLY 157 N 3.60 -2.96 3.05 8.97 0.00 -1.26 -1.34 105.19 115.25 2wob n GLY 157 Ca -0.18 -1.82 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 2wob n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wob s VAL 158 N -0.71 1.57 0.54 1.61 1.01 0.11 -4.93 120.40 119.59 2wob s VAL 158 Ca 0.00 -0.67 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 2wob s VAL 158 Cb 0.00 -1.44 -0.06 0.00 0.00 0.00 0.00 36.38 34.88 2wob s VAL 158 CO 0.00 0.46 1.15 -1.61 0.00 0.00 0.00 175.10 175.10 2wob s GLU 159 N 1.13 3.34 0.12 2.72 2.02 -1.26 -4.67 118.70 122.10 2wob s GLU 159 Ca -0.03 1.69 -0.03 0.00 0.02 0.00 0.00 54.97 56.63 2wob s GLU 159 Cb -0.14 -2.05 -0.15 0.00 0.10 0.00 0.00 34.13 31.88 2wob s GLU 159 CO -0.05 -0.88 1.26 0.00 0.02 0.00 0.00 175.26 175.61 2wob h ALA 160 N 1.27 0.30 -2.56 5.21 0.00 -1.98 -3.46 119.26 118.03 2wob h ALA 160 Ca -0.50 -0.78 -0.11 0.00 0.00 0.00 0.00 54.91 53.51 2wob h ALA 160 Cb 1.27 -0.02 -0.22 0.00 0.00 0.00 0.00 17.79 18.82 2wob h ALA 160 CO 0.57 0.91 -0.21 0.00 0.00 0.00 0.00 179.25 180.52 2wob s ALA 161 N -3.01 -0.98 0.15 0.00 0.00 -1.26 -4.88 121.76 111.77 2wob s ALA 161 Ca -0.04 0.79 -0.31 0.00 0.00 0.00 0.00 51.96 52.40 2wob s ALA 161 Cb 0.08 -0.26 -0.09 0.00 0.00 0.00 0.00 23.12 22.86 2wob s ALA 161 CO 0.86 -0.24 1.40 0.00 0.00 0.00 0.00 175.76 177.78 2wob s ALA 162 N -0.64 3.60 0.00 0.00 0.00 -1.26 -5.16 121.76 118.30 2wob s ALA 162 Ca -0.07 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.05 2wob s ALA 162 Cb -0.04 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2wob s ALA 162 CO 0.03 -0.63 0.00 1.28 0.00 0.00 0.00 175.76 176.44