#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nko s ASN 22 N 0.00 5.30 0.58 4.04 3.84 -1.26 -4.94 114.94 122.50 1nko s ASN 22 Ca 0.00 -0.45 0.34 0.00 0.21 0.00 0.00 52.86 52.96 1nko s ASN 22 Cb 0.00 -1.95 1.78 0.00 -0.55 0.00 0.00 41.25 40.54 1nko s ASN 22 CO 0.00 -0.13 2.17 0.08 -2.79 0.00 0.00 177.10 176.42 1nko h ARG 23 N 8.28 0.00 0.00 0.43 0.11 -2.06 -0.60 114.38 120.54 1nko h ARG 23 Ca -0.34 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.74 1nko h ARG 23 Cb 1.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.23 1nko h ARG 23 CO 0.60 0.05 0.00 1.63 0.10 0.00 0.00 179.97 182.35 1nko n LYS 24 N -3.38 0.06 -0.04 0.08 4.01 -1.26 -2.07 118.16 115.56 1nko n LYS 24 Ca -0.02 0.32 0.11 0.00 -0.51 0.00 0.00 58.31 58.21 1nko n LYS 24 Cb 0.18 -1.61 0.50 0.00 -0.51 0.00 0.00 35.03 33.59 1nko n LYS 24 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1nko n ASP 25 N -1.72 1.00 -4.13 4.39 8.00 -0.23 -4.82 116.55 119.05 1nko n ASP 25 Ca 0.03 -1.53 -0.25 0.00 0.71 0.00 0.00 54.79 53.74 1nko n ASP 25 Cb 0.17 -0.05 -0.16 0.00 -0.02 0.00 0.00 41.12 41.06 1nko n ASP 25 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1nko s TYR 26 N -1.90 1.58 0.10 1.24 1.51 -0.88 -3.50 117.35 115.50 1nko s TYR 26 Ca 0.33 -0.39 -0.10 0.00 -1.01 0.00 0.00 57.07 55.90 1nko s TYR 26 Cb 0.17 -1.05 0.00 0.00 -0.11 0.00 0.00 41.96 40.97 1nko s TYR 26 CO 0.27 -0.11 0.23 -1.54 -1.11 0.00 0.00 175.55 173.29 1nko s SER 27 N -0.11 0.06 -0.08 2.29 1.04 -0.89 -4.97 113.70 111.04 1nko s SER 27 Ca 0.00 -0.60 -0.04 0.00 0.48 0.00 0.00 55.95 55.79 1nko s SER 27 Cb -0.09 0.36 0.04 0.00 0.10 0.00 0.00 66.02 66.43 1nko s SER 27 CO 0.01 -0.75 0.19 -0.22 0.98 0.00 0.00 173.24 173.44 1nko s LEU 28 N -2.85 0.64 -0.21 2.42 0.20 -1.26 -0.42 118.68 117.19 1nko s LEU 28 Ca 0.05 0.39 -0.01 0.00 0.69 0.00 0.00 54.13 55.25 1nko s LEU 28 Cb 0.04 0.52 0.01 0.00 -0.43 0.00 0.00 46.19 46.34 1nko s LEU 28 CO -0.11 -0.15 -0.12 -0.89 -0.29 0.00 0.00 176.35 174.79 1nko s THR 29 N 1.14 2.65 -0.22 3.68 2.01 0.18 -4.99 115.64 120.09 1nko s THR 29 Ca -0.09 -0.86 -0.29 0.00 0.31 0.00 0.00 61.69 60.76 1nko s THR 29 Cb -0.10 -2.23 0.15 0.00 0.01 0.00 0.00 72.50 70.33 1nko s THR 29 CO -0.07 0.40 1.15 -0.32 -0.69 0.00 0.00 174.62 175.09 1nko s MET 30 N 1.35 0.37 0.63 4.92 0.00 -1.26 -1.78 119.30 123.53 1nko s MET 30 Ca 0.03 0.14 -0.17 0.00 0.00 0.00 0.00 55.69 55.69 1nko s MET 30 Cb -0.15 0.18 -0.02 0.00 0.00 0.00 0.00 34.83 34.84 1nko s MET 30 CO -0.08 -0.11 1.18 1.14 0.00 0.00 0.00 175.02 177.15 1nko s GLN 31 N -0.87 2.82 0.10 4.11 -2.07 -1.26 -4.92 119.66 117.56 1nko s GLN 31 Ca 0.03 1.69 0.24 0.00 -1.82 0.00 0.00 55.36 55.50 1nko s GLN 31 Cb -0.01 -1.92 0.23 0.00 -1.09 0.00 0.00 33.01 30.21 1nko s GLN 31 CO -0.03 -1.29 1.21 0.45 -1.32 0.00 0.00 175.29 174.30 1nko n SER 32 N -1.95 0.67 -3.84 12.60 2.88 -1.26 -4.77 113.62 117.95 1nko n SER 32 Ca 0.13 0.03 -0.10 0.00 -1.33 0.00 0.00 58.87 57.59 1nko n SER 32 Cb 0.50 0.39 -0.08 0.00 -0.75 0.00 0.00 64.21 64.27 1nko n SER 32 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1nko s SER 33 N -4.19 0.04 0.02 -3.46 0.01 -1.26 -0.80 113.70 104.05 1nko s SER 33 Ca 0.05 -0.42 -0.02 0.00 1.31 0.00 0.00 55.95 56.86 1nko s SER 33 Cb 0.13 0.31 -0.02 0.00 0.21 0.00 0.00 66.02 66.66 1nko s SER 33 CO 0.75 -0.60 0.02 0.54 0.41 0.00 0.00 173.24 174.36 1nko s VAL 34 N -2.89 0.12 -0.07 3.43 0.11 -0.19 -4.92 120.40 115.99 1nko s VAL 34 Ca -0.03 -0.98 0.05 0.00 -2.93 0.00 0.00 61.98 58.10 1nko s VAL 34 Cb 0.00 -0.50 -0.01 0.00 -1.53 0.00 0.00 36.38 34.34 1nko s VAL 34 CO -0.06 -0.54 -0.24 -0.89 -3.33 0.00 0.00 175.10 170.04 1nko s THR 35 N -1.84 2.01 0.03 5.04 2.01 -1.26 -1.34 115.64 120.29 1nko s THR 35 Ca -0.12 -1.03 0.05 0.00 0.31 0.00 0.00 61.69 60.90 1nko s THR 35 Cb -0.07 -1.71 -0.02 0.00 0.01 0.00 0.00 72.50 70.71 1nko s THR 35 CO -0.02 0.56 -0.14 0.54 -0.69 0.00 0.00 174.62 174.86 1nko s VAL 36 N 0.02 1.15 0.27 3.82 0.11 -0.44 -4.98 120.40 120.34 1nko s VAL 36 Ca -0.09 -0.97 -0.27 0.00 -2.93 0.00 0.00 61.98 57.72 1nko s VAL 36 Cb -0.15 -1.03 -0.09 0.00 -1.53 0.00 0.00 36.38 33.58 1nko s VAL 36 CO 0.05 0.05 0.90 -1.58 -3.33 0.00 0.00 175.10 171.19 1nko s GLN 37 N -1.07 4.64 0.10 1.54 0.74 -1.26 -1.20 119.66 123.15 1nko s GLN 37 Ca 0.02 1.32 -0.36 0.00 0.05 0.00 0.00 55.36 56.39 1nko s GLN 37 Cb -0.08 -3.01 -0.16 0.00 1.10 0.00 0.00 33.01 30.86 1nko s GLN 37 CO 0.01 0.40 1.38 -1.91 -0.55 0.00 0.00 175.29 174.62 1nko n GLU 38 N 0.98 1.33 -0.25 1.67 2.13 0.45 -1.19 120.64 125.76 1nko n GLU 38 Ca -0.01 0.48 0.00 0.00 0.66 0.00 0.00 57.16 58.29 1nko n GLU 38 Cb 0.49 -2.14 0.00 0.00 0.27 0.00 0.00 31.44 30.06 1nko n GLU 38 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nko n GLY 39 N 2.66 1.84 0.96 8.31 0.00 0.11 -4.79 105.19 114.28 1nko n GLY 39 Ca 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.15 1nko n GLY 39 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1nko n MET 40 N -2.00 1.03 -4.09 1.61 2.81 -0.34 -3.96 117.12 112.19 1nko n MET 40 Ca 0.00 -0.80 -0.13 0.00 -1.81 0.00 0.00 57.70 54.96 1nko n MET 40 Cb 0.00 -0.01 -0.11 0.00 -0.71 0.00 0.00 33.22 32.39 1nko n MET 40 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1nko s VAL 42 N -1.86 0.04 -0.14 0.00 0.11 -0.09 -4.92 120.40 113.54 1nko s VAL 42 Ca -0.05 -0.35 -0.01 0.00 -2.93 0.00 0.00 61.98 58.64 1nko s VAL 42 Cb -0.07 -0.42 -0.01 0.00 -1.53 0.00 0.00 36.38 34.35 1nko s VAL 42 CO -0.01 -0.19 -0.12 -1.00 -3.33 0.00 0.00 175.10 170.46 1nko s HIS 43 N -0.71 2.84 -0.35 1.54 3.76 -1.26 -1.25 115.29 119.86 1nko s HIS 43 Ca -0.08 -0.68 -0.03 0.00 -0.15 0.00 0.00 55.06 54.12 1nko s HIS 43 Cb -0.05 -1.88 0.07 0.00 1.11 0.00 0.00 32.58 31.83 1nko s HIS 43 CO 0.02 -0.25 0.10 0.08 -0.85 0.00 0.00 174.74 173.83 1nko s VAL 44 N 0.50 3.21 0.32 -0.90 1.01 0.11 -4.98 120.40 119.67 1nko s VAL 44 Ca -0.08 -1.63 -0.29 0.00 0.00 0.00 0.00 61.98 59.98 1nko s VAL 44 Cb -0.16 -2.99 -0.12 0.00 0.00 0.00 0.00 36.38 33.12 1nko s VAL 44 CO 0.04 -0.36 1.56 -1.14 0.00 0.00 0.00 175.10 175.20 1nko n ARG 45 N 4.63 2.67 -3.75 2.72 0.63 -1.26 -1.96 116.66 120.35 1nko n ARG 45 Ca -0.08 0.95 -0.13 0.00 -0.92 0.00 0.00 57.85 57.67 1nko n ARG 45 Cb 0.43 -2.71 -0.11 0.00 0.45 0.00 0.00 32.46 30.52 1nko n ARG 45 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1nko s SER 47 N 0.45 1.54 0.14 0.00 1.04 -0.73 -1.26 113.70 114.87 1nko s SER 47 Ca -0.02 -0.99 -0.05 0.00 0.48 0.00 0.00 55.95 55.36 1nko s SER 47 Cb -0.04 0.03 -0.02 0.00 0.10 0.00 0.00 66.02 66.09 1nko s SER 47 CO -0.02 -0.37 0.17 0.72 0.98 0.00 0.00 173.24 174.72 1nko s PHE 48 N -3.33 0.56 0.04 5.02 -0.71 -0.77 -0.65 117.98 118.14 1nko s PHE 48 Ca 0.14 -0.94 -0.02 0.00 -1.04 0.00 0.00 56.93 55.07 1nko s PHE 48 Cb 0.03 -0.24 -0.03 0.00 -1.21 0.00 0.00 43.02 41.58 1nko s PHE 48 CO -0.01 -0.61 -0.00 -1.54 -1.34 0.00 0.00 175.22 171.72 1nko s SER 49 N -2.99 0.32 0.17 1.98 1.04 0.43 -4.73 113.70 109.93 1nko s SER 49 Ca 0.18 -0.70 -0.21 0.00 0.48 0.00 0.00 55.95 55.70 1nko s SER 49 Cb 0.05 0.17 0.05 0.00 0.10 0.00 0.00 66.02 66.39 1nko s SER 49 CO -0.01 -0.47 0.56 -0.72 0.98 0.00 0.00 173.24 173.59 1nko s TYR 50 N -2.69 -0.38 -0.30 5.02 1.13 -1.25 -2.09 117.35 116.79 1nko s TYR 50 Ca -0.04 0.10 -0.29 0.00 -1.41 0.00 0.00 57.07 55.43 1nko s TYR 50 Cb -0.01 0.49 -0.00 0.00 -1.10 0.00 0.00 41.96 41.34 1nko s TYR 50 CO -0.05 -0.87 1.32 -1.25 -2.51 0.00 0.00 175.55 172.19 1nko s PRO 51 N -3.80 3.90 -0.14 -3.49 0.04 -1.23 -4.97 135.00 125.31 1nko s PRO 51 Ca 0.04 1.26 -0.17 0.00 0.04 0.00 0.00 61.00 62.17 1nko s PRO 51 Cb -0.01 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.60 1nko s PRO 51 CO -0.09 -1.15 0.44 0.08 0.04 0.00 0.00 177.00 176.32 1nko s VAL 52 N 4.46 5.20 0.09 -0.36 1.01 -1.26 -5.05 120.40 124.50 1nko s VAL 52 Ca 0.57 0.86 0.08 0.00 0.00 0.00 0.00 61.98 63.50 1nko s VAL 52 Cb -0.17 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1nko s VAL 52 CO 0.24 0.31 -0.19 -1.81 0.00 0.00 0.00 175.10 173.65 1nko s ASP 53 N 0.71 3.81 0.27 3.32 1.11 -1.26 -5.02 116.67 119.60 1nko s ASP 53 Ca 0.23 -0.52 -0.00 0.00 0.18 0.00 0.00 52.55 52.44 1nko s ASP 53 Cb -0.15 -0.54 0.57 0.00 1.07 0.00 0.00 42.92 43.87 1nko s ASP 53 CO 0.09 0.21 1.74 -1.28 1.18 0.00 0.00 175.17 177.11 1nko h SER 54 N 4.04 0.44 -2.23 0.27 0.87 -1.99 -2.13 113.55 112.83 1nko h SER 54 Ca -0.49 0.11 -0.67 0.00 -1.23 0.00 0.00 61.79 59.51 1nko h SER 54 Cb 1.16 0.05 -0.37 0.00 -0.44 0.00 0.00 62.40 62.81 1nko h SER 54 CO 0.46 0.15 -0.04 0.47 -0.53 0.00 0.00 176.83 177.34 1nko n ASP 55 N -4.93 5.54 0.00 6.23 10.43 -1.26 -2.91 116.55 129.65 1nko n ASP 55 Ca 0.18 -3.70 0.00 0.00 2.57 0.00 0.00 54.79 53.84 1nko n ASP 55 Cb 0.48 -0.77 0.00 0.00 1.84 0.00 0.00 41.12 42.68 1nko n ASP 55 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1nko n THR 56 N -0.21 0.00 -0.29 -3.53 -2.24 -0.93 -5.01 114.28 102.07 1nko n THR 56 Ca 0.37 0.00 0.24 0.00 -2.27 0.00 0.00 64.05 62.40 1nko n THR 56 Cb 0.36 0.00 0.45 0.00 -2.10 0.00 0.00 70.33 69.04 1nko n THR 56 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1nko n ASP 57 N -0.41 0.20 -0.07 3.42 4.64 -0.84 0.82 116.55 124.32 1nko n ASP 57 Ca 0.00 1.48 0.12 0.00 -1.38 0.00 0.00 54.79 55.01 1nko n ASP 57 Cb 0.00 -0.67 0.30 0.00 -1.04 0.00 0.00 41.12 39.70 1nko n ASP 57 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 1nko n SER 58 N -5.08 0.62 -4.77 1.67 3.41 -1.26 -4.94 113.62 103.27 1nko n SER 58 Ca 0.30 -0.41 -0.38 0.00 -0.26 0.00 0.00 58.87 58.13 1nko n SER 58 Cb 1.02 0.20 -0.01 0.00 -0.26 0.00 0.00 64.21 65.16 1nko n SER 58 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1nko s ASP 59 N -2.86 6.36 0.53 4.04 -0.00 0.24 -4.99 116.67 119.99 1nko s ASP 59 Ca 0.15 2.38 -0.20 0.00 -0.00 0.00 0.00 52.55 54.88 1nko s ASP 59 Cb 0.18 -2.61 -0.06 0.00 -0.00 0.00 0.00 42.92 40.43 1nko s ASP 59 CO 0.65 -0.79 1.15 -2.16 -0.00 0.00 0.00 175.17 174.01 1nko s PRO 60 N -2.43 3.43 -0.23 8.23 0.04 -1.26 -4.92 135.00 137.86 1nko s PRO 60 Ca 0.59 1.67 -0.09 0.00 0.04 0.00 0.00 61.00 63.22 1nko s PRO 60 Cb -0.31 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 1nko s PRO 60 CO 0.39 -0.80 0.10 0.08 0.04 0.00 0.00 177.00 176.81 1nko s VAL 61 N -1.70 4.83 -0.13 -0.36 1.01 -1.26 -4.40 120.40 118.39 1nko s VAL 61 Ca 0.71 -0.01 -0.07 0.00 0.00 0.00 0.00 61.98 62.62 1nko s VAL 61 Cb -0.26 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1nko s VAL 61 CO 0.29 0.36 0.12 -1.00 0.00 0.00 0.00 175.10 174.88 1nko s HIS 62 N 1.13 3.51 0.03 5.22 3.76 0.11 -4.57 115.29 124.49 1nko s HIS 62 Ca 0.05 0.45 0.09 0.00 -0.15 0.00 0.00 55.06 55.50 1nko s HIS 62 Cb -0.14 -1.94 -0.03 0.00 1.11 0.00 0.00 32.58 31.58 1nko s HIS 62 CO 0.04 0.64 -0.25 0.20 -0.85 0.00 0.00 174.74 174.52 1nko s GLY 63 N -0.83 1.41 -0.05 -2.22 0.00 -1.26 -0.93 107.32 103.44 1nko s GLY 63 Ca 0.14 -1.23 -0.03 0.00 0.00 0.00 0.00 44.72 43.60 1nko s GLY 63 CO 0.03 -1.10 0.11 -0.19 0.00 0.00 0.00 173.10 171.96 1nko s TYR 64 N -0.79 -0.12 -0.12 1.90 1.51 -0.18 -2.69 117.35 116.86 1nko s TYR 64 Ca 0.12 0.33 -0.02 0.00 -1.01 0.00 0.00 57.07 56.49 1nko s TYR 64 Cb -0.10 -0.02 -0.03 0.00 -0.11 0.00 0.00 41.96 41.70 1nko s TYR 64 CO 0.02 -0.09 -0.03 -1.58 -1.11 0.00 0.00 175.55 172.76 1nko s TRP 65 N 0.49 3.06 0.06 2.71 0.52 -0.01 -0.56 118.94 125.21 1nko s TRP 65 Ca -0.04 -0.07 0.08 0.00 0.02 0.00 0.00 56.10 56.09 1nko s TRP 65 Cb -0.05 -1.86 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 1nko s TRP 65 CO -0.02 0.20 -0.21 -0.06 0.02 0.00 0.00 176.95 176.87 1nko s PHE 66 N -0.24 1.86 0.15 -1.98 0.40 -0.08 -0.08 117.98 118.01 1nko s PHE 66 Ca 0.05 -0.39 -0.30 0.00 -0.60 0.00 0.00 56.93 55.69 1nko s PHE 66 Cb -0.13 -1.08 -0.07 0.00 0.51 0.00 0.00 43.02 42.25 1nko s PHE 66 CO 0.02 0.14 1.15 0.50 0.70 0.00 0.00 175.22 177.73 1nko s ARG 67 N -1.42 4.52 0.00 0.44 3.52 -1.26 -1.08 118.95 123.67 1nko s ARG 67 Ca 0.08 1.77 -0.03 0.00 -0.13 0.00 0.00 55.73 57.43 1nko s ARG 67 Cb -0.09 -3.28 -0.12 0.00 -1.56 0.00 0.00 34.95 29.90 1nko s ARG 67 CO 0.03 -0.05 1.87 0.00 -0.81 0.00 0.00 175.30 176.33 1nko n ALA 68 N 2.78 3.36 -1.59 6.12 0.00 0.01 -4.90 120.51 126.30 1nko n ALA 68 Ca 0.05 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.69 1nko n ALA 68 Cb 0.46 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1nko n ALA 68 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1nko n TRP 74 N 2.78 -3.08 0.43 0.00 8.01 -1.26 -5.02 117.44 119.29 1nko n TRP 74 Ca 0.19 1.85 0.12 0.00 -1.31 0.00 0.00 57.50 58.35 1nko n TRP 74 Cb 0.40 -3.09 0.19 0.00 -2.01 0.00 0.00 31.31 26.80 1nko n TRP 74 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1nko h LYS 75 N 2.68 0.00 -6.45 -0.99 1.57 -2.03 -3.45 116.57 107.90 1nko h LYS 75 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 1nko h LYS 75 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1nko h LYS 75 CO 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 179.45 178.85 1nko s ALA 76 N -3.20 3.51 0.70 3.86 0.00 -1.26 -5.05 121.76 120.31 1nko s ALA 76 Ca 0.06 -0.08 -0.15 0.00 0.00 0.00 0.00 51.96 51.79 1nko s ALA 76 Cb 0.11 -2.60 0.02 0.00 0.00 0.00 0.00 23.12 20.65 1nko s ALA 76 CO 0.70 0.42 1.17 -1.25 0.00 0.00 0.00 175.76 176.80 1nko s PRO 77 N -2.30 2.42 0.28 0.00 0.04 -1.26 -4.51 135.00 129.67 1nko s PRO 77 Ca 0.43 1.61 0.18 0.00 0.04 0.00 0.00 61.00 63.26 1nko s PRO 77 Cb -0.14 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.61 1nko s PRO 77 CO 0.20 -1.59 1.36 -0.39 0.04 0.00 0.00 177.00 176.62 1nko h VAL 78 N -0.13 0.56 -2.52 -0.36 -1.51 -0.85 -1.03 116.25 110.41 1nko h VAL 78 Ca -0.47 -1.83 -0.09 0.00 -1.23 0.00 0.00 66.70 63.08 1nko h VAL 78 Cb 1.28 2.20 -0.20 0.00 -2.13 0.00 0.00 31.29 32.44 1nko h VAL 78 CO 0.52 0.32 -0.04 0.00 -1.23 0.00 0.00 177.57 177.13 1nko s ALA 79 N -3.04 -1.28 -0.03 5.19 0.00 -1.16 -4.64 121.76 116.80 1nko s ALA 79 Ca 0.03 0.83 -0.29 0.00 0.00 0.00 0.00 51.96 52.53 1nko s ALA 79 Cb 0.07 0.03 0.10 0.00 0.00 0.00 0.00 23.12 23.33 1nko s ALA 79 CO 0.74 -0.32 0.87 -0.08 0.00 0.00 0.00 175.76 176.97 1nko s THR 80 N -1.25 0.00 -2.56 0.00 -1.32 -1.26 -0.83 115.64 108.41 1nko s THR 80 Ca -0.12 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.59 1nko s THR 80 Cb -0.03 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.36 1nko s THR 80 CO 0.07 0.00 1.39 -0.46 -2.21 0.00 0.00 174.62 173.41 1nko n ASN 81 N 0.04 3.37 -4.58 8.08 6.94 -1.10 -4.80 115.26 123.21 1nko n ASN 81 Ca -0.11 -1.99 -0.42 0.00 -0.02 0.00 0.00 54.58 52.04 1nko n ASN 81 Cb 0.61 -0.21 -0.06 0.00 -2.36 0.00 0.00 39.78 37.76 1nko n ASN 81 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1nko s ASN 82 N -1.57 6.50 0.00 0.53 3.84 -1.26 -4.92 114.94 118.05 1nko s ASN 82 Ca 0.37 0.25 0.14 0.00 0.21 0.00 0.00 52.86 53.83 1nko s ASN 82 Cb 0.22 -2.37 0.68 0.00 -0.55 0.00 0.00 41.25 39.24 1nko s ASN 82 CO 0.32 -0.69 1.41 -0.81 -2.79 0.00 0.00 177.10 174.53 1nko n PRO 83 N 6.30 0.14 -0.15 0.43 -0.04 -1.26 -2.07 135.00 138.34 1nko n PRO 83 Ca 0.01 0.19 0.08 0.00 -0.04 0.00 0.00 63.50 63.74 1nko n PRO 83 Cb 0.48 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.69 1nko n PRO 83 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nko n ALA 84 N -1.36 2.47 -3.99 0.55 0.00 -1.26 -4.75 120.51 112.17 1nko n ALA 84 Ca 0.06 -0.63 -0.30 0.00 0.00 0.00 0.00 53.44 52.57 1nko n ALA 84 Cb 0.13 -1.01 -0.16 0.00 0.00 0.00 0.00 19.45 18.41 1nko n ALA 84 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1nko s TRP 85 N -1.59 2.11 0.17 0.00 0.52 -0.88 -5.11 118.94 114.16 1nko s TRP 85 Ca 0.28 -1.24 -0.30 0.00 0.02 0.00 0.00 56.10 54.86 1nko s TRP 85 Cb 0.15 -1.54 -0.07 0.00 -1.15 0.00 0.00 33.47 30.85 1nko s TRP 85 CO 0.21 -0.67 0.98 0.00 0.02 0.00 0.00 176.95 177.49 1nko s ALA 86 N 1.50 3.30 0.74 0.98 0.00 -1.26 -4.92 121.76 122.11 1nko s ALA 86 Ca 0.03 0.64 -0.10 0.00 0.00 0.00 0.00 51.96 52.53 1nko s ALA 86 Cb -0.14 -3.27 0.06 0.00 0.00 0.00 0.00 23.12 19.77 1nko s ALA 86 CO -0.10 0.03 1.10 0.14 0.00 0.00 0.00 175.76 176.93 1nko s VAL 87 N -0.49 2.50 0.08 0.00 -7.23 -1.26 -4.59 120.40 109.40 1nko s VAL 87 Ca 0.45 0.02 -0.37 0.00 -1.81 0.00 0.00 61.98 60.28 1nko s VAL 87 Cb -0.25 -3.13 -0.16 0.00 0.56 0.00 0.00 36.38 33.39 1nko s VAL 87 CO 0.32 -0.16 1.38 0.00 -0.31 0.00 0.00 175.10 176.32 1nko n GLN 88 N -3.09 1.23 0.24 4.82 1.13 -0.39 -4.83 117.38 116.49 1nko n GLN 88 Ca 0.07 0.44 0.08 0.00 -1.94 0.00 0.00 57.00 55.65 1nko n GLN 88 Cb 0.60 -2.10 0.62 0.00 0.11 0.00 0.00 30.24 29.47 1nko n GLN 88 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1nko h GLU 89 N 4.79 0.03 0.00 -1.09 5.08 -1.93 -1.55 114.58 119.91 1nko h GLU 89 Ca -0.47 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1nko h GLU 89 Cb 1.33 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1nko h GLU 89 CO 0.79 0.03 0.00 0.93 -1.00 0.00 0.00 179.01 179.76 1nko h GLU 90 N 0.04 0.00 -0.01 2.33 3.07 -2.00 -3.05 114.58 114.96 1nko h GLU 90 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1nko h GLU 90 Cb 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1nko h GLU 90 CO -0.00 0.00 -0.00 0.25 -1.40 0.00 0.00 179.01 177.86 1nko n THR 91 N -2.46 0.00 -1.69 1.13 -2.24 -0.63 -4.91 114.28 103.48 1nko n THR 91 Ca 0.02 -0.50 -0.45 0.00 -2.27 0.00 0.00 64.05 60.85 1nko n THR 91 Cb 0.24 1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 69.52 1nko n THR 91 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1nko n ARG 92 N 0.22 2.34 -0.84 -0.78 0.63 -0.91 -0.97 116.66 116.35 1nko n ARG 92 Ca 0.02 0.84 0.00 0.00 -0.92 0.00 0.00 57.85 57.80 1nko n ARG 92 Cb 0.10 -2.62 0.00 0.00 0.45 0.00 0.00 32.46 30.39 1nko n ARG 92 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1nko n ASP 93 N 3.32 -3.17 -0.02 6.15 8.00 -1.26 -4.72 116.55 124.84 1nko n ASP 93 Ca 0.15 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.63 1nko n ASP 93 Cb 0.31 -2.49 -0.03 0.00 -0.02 0.00 0.00 41.12 38.89 1nko n ASP 93 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1nko n ARG 94 N -0.73 3.16 -4.40 -1.24 1.74 -0.15 -4.93 116.66 110.11 1nko n ARG 94 Ca 0.00 -0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 1nko n ARG 94 Cb 0.23 -1.10 -0.10 0.00 -1.02 0.00 0.00 32.46 30.47 1nko n ARG 94 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1nko s PHE 95 N -2.10 3.10 -0.01 -1.55 0.40 -0.49 -0.87 117.98 116.46 1nko s PHE 95 Ca -0.02 0.06 0.02 0.00 -0.60 0.00 0.00 56.93 56.39 1nko s PHE 95 Cb 0.01 -1.83 0.00 0.00 0.51 0.00 0.00 43.02 41.72 1nko s PHE 95 CO 0.16 0.33 -0.05 -1.01 0.70 0.00 0.00 175.22 175.35 1nko s HIS 96 N -0.55 0.54 -0.94 0.36 3.76 -0.14 -4.76 115.29 113.55 1nko s HIS 96 Ca 0.09 -0.11 -0.21 0.00 -0.15 0.00 0.00 55.06 54.69 1nko s HIS 96 Cb -0.12 -0.39 0.09 0.00 1.11 0.00 0.00 32.58 33.27 1nko s HIS 96 CO 0.02 -0.04 1.25 -1.17 -0.85 0.00 0.00 174.74 173.94 1nko s LEU 97 N 0.10 4.34 0.16 0.89 2.96 -1.26 -0.35 118.68 125.53 1nko s LEU 97 Ca -0.01 -1.69 -0.01 0.00 -0.22 0.00 0.00 54.13 52.20 1nko s LEU 97 Cb -0.05 -2.47 0.02 0.00 0.50 0.00 0.00 46.19 44.19 1nko s LEU 97 CO -0.00 -1.29 1.40 -0.07 -1.32 0.00 0.00 176.35 175.07 1nko h LEU 98 N 11.49 0.46 -9.99 -0.68 3.38 -1.29 -3.45 115.31 115.24 1nko h LEU 98 Ca 0.13 -0.32 -0.52 0.00 0.09 0.00 0.00 57.88 57.25 1nko h LEU 98 Cb 1.02 -0.14 0.09 0.00 0.09 0.00 0.00 40.66 41.72 1nko h LEU 98 CO 1.24 1.08 0.56 -0.83 0.09 0.00 0.00 178.44 180.59 1nko s GLY 99 N -4.36 2.86 -0.34 0.83 0.00 -0.60 -4.91 107.32 100.81 1nko s GLY 99 Ca -0.05 1.14 -0.22 0.00 0.00 0.00 0.00 44.72 45.59 1nko s GLY 99 CO 0.84 1.66 0.70 -0.35 0.00 0.00 0.00 173.10 175.96 1nko s ASP 100 N -1.01 6.52 0.66 1.64 -1.08 -1.21 -4.71 116.67 117.48 1nko s ASP 100 Ca 0.62 0.38 0.40 0.00 -0.52 0.00 0.00 52.55 53.43 1nko s ASP 100 Cb -0.35 -2.36 2.21 0.00 -1.46 0.00 0.00 42.92 40.96 1nko s ASP 100 CO 0.43 -0.61 2.27 -0.65 0.52 0.00 0.00 175.17 177.14 1nko h PRO 101 N 8.33 0.00 0.00 4.34 0.11 -1.81 -0.75 132.00 142.22 1nko h PRO 101 Ca -0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 1nko h PRO 101 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1nko h PRO 101 CO 0.86 0.00 -0.13 0.37 -0.21 0.00 0.00 178.00 178.89 1nko h GLN 102 N 0.00 0.00 -0.44 1.05 4.15 -1.87 -2.48 115.11 115.51 1nko h GLN 102 Ca 0.01 0.00 -0.28 0.00 0.77 0.00 0.00 58.65 59.15 1nko h GLN 102 Cb 0.14 0.00 -0.18 0.00 0.21 0.00 0.00 27.48 27.65 1nko h GLN 102 CO -0.00 0.13 -0.23 0.25 -1.93 0.00 0.00 178.83 177.05 1nko n THR 103 N -3.83 2.60 -2.92 2.39 -2.24 -0.35 -4.95 114.28 104.97 1nko n THR 103 Ca -0.02 -3.17 -0.22 0.00 -2.27 0.00 0.00 64.05 58.36 1nko n THR 103 Cb 0.22 -0.56 0.03 0.00 -2.10 0.00 0.00 70.33 67.92 1nko n THR 103 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1nko n LYS 104 N -1.02 -4.34 -4.10 -0.78 5.02 -0.93 -4.98 118.16 107.02 1nko n LYS 104 Ca 0.36 0.92 -0.35 0.00 -2.02 0.00 0.00 58.31 57.23 1nko n LYS 104 Cb 0.94 -5.75 -0.13 0.00 -0.02 0.00 0.00 35.03 30.06 1nko n LYS 104 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1nko s ASN 105 N -2.59 4.50 -0.09 4.39 3.84 -0.82 -1.85 114.94 122.33 1nko s ASN 105 Ca 0.25 -0.29 0.13 0.00 0.21 0.00 0.00 52.86 53.15 1nko s ASN 105 Cb -0.11 -1.76 0.33 0.00 -0.55 0.00 0.00 41.25 39.16 1nko s ASN 105 CO 0.31 0.05 1.25 0.00 -2.79 0.00 0.00 177.10 175.92 1nko n THR 107 N -0.39 0.38 -5.07 0.00 -1.04 -1.17 -4.67 114.28 102.33 1nko n THR 107 Ca 0.14 -0.10 -0.32 0.00 -2.04 0.00 0.00 64.05 61.73 1nko n THR 107 Cb 0.60 -0.95 -0.15 0.00 -1.82 0.00 0.00 70.33 68.02 1nko n THR 107 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1nko s LEU 108 N 0.56 2.43 -0.06 -4.42 2.96 -0.83 -0.79 118.68 118.54 1nko s LEU 108 Ca 0.79 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 54.39 1nko s LEU 108 Cb -0.87 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 1nko s LEU 108 CO 0.48 0.31 -0.12 -0.55 -1.32 0.00 0.00 176.35 175.15 1nko s SER 109 N -0.54 4.24 -0.07 3.68 0.15 0.53 0.04 113.70 121.73 1nko s SER 109 Ca 0.07 -0.14 0.03 0.00 0.70 0.00 0.00 55.95 56.62 1nko s SER 109 Cb -0.11 -0.96 0.01 0.00 -1.71 0.00 0.00 66.02 63.24 1nko s SER 109 CO 0.01 0.35 -0.17 -0.63 1.20 0.00 0.00 173.24 174.00 1nko s ILE 110 N -0.75 1.50 0.25 6.45 -1.09 -0.38 -0.97 121.20 126.21 1nko s ILE 110 Ca 0.12 -0.70 0.01 0.00 -2.23 0.00 0.00 60.65 57.85 1nko s ILE 110 Cb -0.11 -1.33 -0.05 0.00 -1.58 0.00 0.00 42.46 39.40 1nko s ILE 110 CO 0.01 0.44 0.09 0.00 -1.23 0.00 0.00 174.94 174.25 1nko s ARG 111 N 0.46 1.38 -1.53 2.79 1.70 -0.05 -0.91 118.95 122.79 1nko s ARG 111 Ca -0.15 -1.74 -0.09 0.00 -0.47 0.00 0.00 55.73 53.29 1nko s ARG 111 Cb -0.16 -0.23 0.07 0.00 -0.57 0.00 0.00 34.95 34.06 1nko s ARG 111 CO 0.05 -0.29 0.64 -0.25 -1.08 0.00 0.00 175.30 174.37 1nko n ASP 112 N -0.44 -2.03 -4.76 -2.89 8.00 -1.02 -4.79 116.55 108.62 1nko n ASP 112 Ca -0.00 -0.97 -0.41 0.00 0.71 0.00 0.00 54.79 54.12 1nko n ASP 112 Cb 0.66 -3.09 0.01 0.00 -0.02 0.00 0.00 41.12 38.68 1nko n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nko n ALA 113 N -4.43 2.10 -2.45 2.24 0.00 -0.73 -4.56 120.51 112.68 1nko n ALA 113 Ca -0.12 0.30 -0.26 0.00 0.00 0.00 0.00 53.44 53.36 1nko n ALA 113 Cb 0.59 -2.39 -0.11 0.00 0.00 0.00 0.00 19.45 17.54 1nko n ALA 113 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1nko s ARG 114 N -2.23 1.61 0.41 0.00 1.70 -1.26 0.08 118.95 119.25 1nko s ARG 114 Ca 0.57 -1.58 0.12 0.00 -0.47 0.00 0.00 55.73 54.36 1nko s ARG 114 Cb -0.47 -1.85 0.94 0.00 -0.57 0.00 0.00 34.95 33.00 1nko s ARG 114 CO 0.61 0.38 1.95 0.52 -1.08 0.00 0.00 175.30 177.68 1nko h MET 115 N 2.89 0.51 0.00 3.89 2.86 -1.94 0.40 114.93 123.54 1nko h MET 115 Ca -0.44 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 1nko h MET 115 Cb 1.22 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.77 1nko h MET 115 CO 0.52 0.34 0.00 0.43 1.06 0.00 0.00 176.91 179.26 1nko n SER 116 N -4.48 0.00 0.13 1.22 7.64 -1.26 -2.01 113.62 114.85 1nko n SER 116 Ca 0.12 0.12 0.13 0.00 1.01 0.00 0.00 58.87 60.24 1nko n SER 116 Cb 0.37 -0.33 0.45 0.00 -1.01 0.00 0.00 64.21 63.70 1nko n SER 116 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1nko h ASP 117 N 0.00 0.00 -3.96 6.43 3.32 -1.31 -3.46 116.42 117.44 1nko h ASP 117 Ca 0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 1nko h ASP 117 Cb 0.20 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.86 1nko h ASP 117 CO 0.00 0.00 0.77 0.00 -1.72 0.00 0.00 179.24 178.29 1nko s ALA 118 N -3.23 3.51 0.00 3.45 0.00 -0.85 -4.83 121.76 119.80 1nko s ALA 118 Ca 0.07 1.57 0.00 0.00 0.00 0.00 0.00 51.96 53.60 1nko s ALA 118 Cb 0.10 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1nko s ALA 118 CO 0.50 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.57 1nko n GLY 119 N 0.47 0.63 3.76 0.00 0.00 -0.23 -4.97 105.19 104.84 1nko n GLY 119 Ca 0.02 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.95 1nko n GLY 119 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nko s ARG 120 N -2.00 2.87 0.10 1.61 0.52 -1.26 -0.11 118.95 120.67 1nko s ARG 120 Ca 0.00 -0.68 0.05 0.00 -0.52 0.00 0.00 55.73 54.58 1nko s ARG 120 Cb 0.00 -2.72 -0.03 0.00 0.52 0.00 0.00 34.95 32.71 1nko s ARG 120 CO 0.00 0.58 -0.13 0.71 0.02 0.00 0.00 175.30 176.48 1nko s TYR 121 N -1.34 1.23 0.05 -0.53 1.51 -0.18 -0.81 117.35 117.27 1nko s TYR 121 Ca 0.28 -0.54 0.01 0.00 -1.01 0.00 0.00 57.07 55.80 1nko s TYR 121 Cb -0.12 -0.67 -0.03 0.00 -0.11 0.00 0.00 41.96 41.03 1nko s TYR 121 CO 0.20 0.07 -0.05 -0.59 -1.11 0.00 0.00 175.55 174.07 1nko s PHE 122 N -1.88 0.57 0.00 2.71 -0.12 -0.24 -1.12 117.98 117.90 1nko s PHE 122 Ca 0.04 -0.71 -0.07 0.00 -0.05 0.00 0.00 56.93 56.14 1nko s PHE 122 Cb -0.06 -0.36 -0.05 0.00 -0.63 0.00 0.00 43.02 41.92 1nko s PHE 122 CO 0.02 -0.19 0.26 0.12 -0.05 0.00 0.00 175.22 175.39 1nko s PHE 123 N -2.37 3.58 -0.03 3.49 5.36 -1.26 -0.90 117.98 125.85 1nko s PHE 123 Ca -0.04 0.57 0.04 0.00 -0.96 0.00 0.00 56.93 56.54 1nko s PHE 123 Cb -0.03 -1.99 -0.00 0.00 -0.34 0.00 0.00 43.02 40.65 1nko s PHE 123 CO -0.03 0.62 -0.14 0.50 -1.46 0.00 0.00 175.22 174.70 1nko s ARG 124 N -1.73 1.38 0.27 10.12 3.52 0.28 -0.21 118.95 132.58 1nko s ARG 124 Ca 0.27 -0.50 0.11 0.00 -0.13 0.00 0.00 55.73 55.48 1nko s ARG 124 Cb -0.13 -1.25 -0.05 0.00 -1.56 0.00 0.00 34.95 31.96 1nko s ARG 124 CO 0.16 0.23 -0.10 0.00 -0.81 0.00 0.00 175.30 174.78 1nko s MET 125 N -0.04 1.99 -0.11 5.12 0.23 -0.26 -1.02 119.30 125.23 1nko s MET 125 Ca -0.01 -1.59 -0.05 0.00 -1.03 0.00 0.00 55.69 53.02 1nko s MET 125 Cb -0.09 -1.97 0.05 0.00 -1.53 0.00 0.00 34.83 31.29 1nko s MET 125 CO 0.01 0.35 0.23 -1.21 -2.03 0.00 0.00 175.02 172.37 1nko s GLU 126 N -3.58 0.15 -0.28 3.16 2.02 -0.11 -1.32 118.70 118.75 1nko s GLU 126 Ca 0.31 0.58 -0.03 0.00 0.02 0.00 0.00 54.97 55.84 1nko s GLU 126 Cb -0.06 -0.12 0.10 0.00 0.10 0.00 0.00 34.13 34.16 1nko s GLU 126 CO 0.17 -0.22 0.16 0.21 0.02 0.00 0.00 175.26 175.61 1nko s LYS 127 N 1.73 0.20 7.98 1.61 2.20 0.10 0.09 119.74 133.65 1nko s LYS 127 Ca -0.05 -0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.19 1nko s LYS 127 Cb -0.11 -1.12 0.00 0.00 -1.51 0.00 0.00 37.83 35.09 1nko s LYS 127 CO -0.08 -0.97 0.00 0.41 -0.36 0.00 0.00 175.35 174.35 1nko n GLY 128 N 5.27 4.03 0.04 5.54 0.00 -1.26 -1.37 105.19 117.45 1nko n GLY 128 Ca -0.05 0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.15 1nko n GLY 128 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1nko n ASN 129 N 7.53 0.24 -4.61 1.61 2.04 -1.26 -4.75 115.26 116.06 1nko n ASN 129 Ca 0.00 -0.17 -0.42 0.00 -0.44 0.00 0.00 54.58 53.54 1nko n ASN 129 Cb 0.00 -0.19 -0.04 0.00 -2.53 0.00 0.00 39.78 37.01 1nko n ASN 129 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 1nko s ILE 130 N -2.68 4.70 -0.02 1.53 1.09 -0.47 -5.03 121.20 120.32 1nko s ILE 130 Ca 0.23 1.16 -0.00 0.00 -1.10 0.00 0.00 60.65 60.95 1nko s ILE 130 Cb 0.20 -4.23 0.03 0.00 -1.06 0.00 0.00 42.46 37.39 1nko s ILE 130 CO 0.51 -0.38 0.03 -0.54 -0.10 0.00 0.00 174.94 174.45 1nko s LYS 131 N 3.18 -0.04 -0.19 2.79 1.02 -1.26 0.03 119.74 125.27 1nko s LYS 131 Ca 0.35 0.17 -0.13 0.00 0.02 0.00 0.00 55.97 56.38 1nko s LYS 131 Cb -0.13 -0.22 0.06 0.00 -0.52 0.00 0.00 37.83 37.01 1nko s LYS 131 CO 0.15 -0.15 0.48 -0.46 -0.92 0.00 0.00 175.35 174.45 1nko s TRP 132 N 0.96 -0.67 -0.26 3.18 -0.11 -0.43 -5.00 118.94 116.62 1nko s TRP 132 Ca -0.08 1.45 -0.11 0.00 1.22 0.00 0.00 56.10 58.58 1nko s TRP 132 Cb -0.12 0.31 -0.05 0.00 -1.50 0.00 0.00 33.47 32.11 1nko s TRP 132 CO -0.03 -0.35 0.18 -0.80 -4.62 0.00 0.00 176.95 171.33 1nko s ASN 133 N 1.13 6.07 -1.39 5.86 0.01 -1.26 -1.10 114.94 124.26 1nko s ASN 133 Ca -0.07 0.05 -0.10 0.00 -0.71 0.00 0.00 52.86 52.03 1nko s ASN 133 Cb -0.06 -2.12 0.08 0.00 0.41 0.00 0.00 41.25 39.56 1nko s ASN 133 CO -0.10 -0.00 2.23 -1.22 -1.51 0.00 0.00 177.10 176.49 1nko n TYR 134 N 4.74 2.98 1.50 2.20 4.01 0.71 -4.72 117.16 128.58 1nko n TYR 134 Ca -0.14 -2.90 0.14 0.00 -0.16 0.00 0.00 57.90 54.84 1nko n TYR 134 Cb 0.52 -2.19 0.76 0.00 -0.31 0.00 0.00 39.34 38.12 1nko n TYR 134 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1nko n LYS 135 N 4.15 0.58 -0.24 -0.72 5.02 -1.26 -2.51 118.16 123.19 1nko n LYS 135 Ca 0.53 0.01 0.09 0.00 -2.02 0.00 0.00 58.31 56.92 1nko n LYS 135 Cb 0.33 -1.50 0.21 0.00 -0.02 0.00 0.00 35.03 34.06 1nko n LYS 135 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1nko n TYR 136 N -1.18 0.62 -2.69 2.13 4.01 -1.26 -4.39 117.16 114.40 1nko n TYR 136 Ca 0.16 -0.44 -0.16 0.00 -0.16 0.00 0.00 57.90 57.30 1nko n TYR 136 Cb 0.18 -0.01 0.01 0.00 -0.31 0.00 0.00 39.34 39.21 1nko n TYR 136 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1nko n ASP 137 N 1.04 2.48 -4.84 7.72 8.00 -1.04 -5.10 116.55 124.80 1nko n ASP 137 Ca 0.17 -3.09 -0.32 0.00 0.71 0.00 0.00 54.79 52.26 1nko n ASP 137 Cb 0.51 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 1nko n ASP 137 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1nko s GLN 138 N -3.18 3.54 -0.25 -1.24 -0.21 -1.26 -4.81 119.66 112.25 1nko s GLN 138 Ca 0.36 0.92 -0.10 0.00 0.02 0.00 0.00 55.36 56.56 1nko s GLN 138 Cb 0.42 -2.07 -0.04 0.00 1.00 0.00 0.00 33.01 32.31 1nko s GLN 138 CO -0.05 -0.62 0.14 -1.17 -2.12 0.00 0.00 175.29 171.48 1nko s LEU 139 N -4.81 3.92 -0.26 2.90 2.96 -0.27 -4.73 118.68 118.38 1nko s LEU 139 Ca 0.58 0.00 -0.15 0.00 -0.22 0.00 0.00 54.13 54.34 1nko s LEU 139 Cb -0.12 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 1nko s LEU 139 CO 0.45 0.01 0.37 -0.55 -1.32 0.00 0.00 176.35 175.31 1nko s SER 140 N 1.35 6.27 -0.22 3.68 0.15 0.02 -1.01 113.70 123.94 1nko s SER 140 Ca 0.07 0.31 -0.09 0.00 0.70 0.00 0.00 55.95 56.93 1nko s SER 140 Cb -0.15 -2.21 -0.05 0.00 -1.71 0.00 0.00 66.02 61.91 1nko s SER 140 CO 0.06 -0.17 0.12 -0.69 1.20 0.00 0.00 173.24 173.76 1nko s VAL 141 N 1.99 5.13 -0.09 4.45 1.01 0.84 -1.02 120.40 132.71 1nko s VAL 141 Ca 0.15 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1nko s VAL 141 Cb -0.16 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 1nko s VAL 141 CO 0.10 0.39 -0.07 0.20 0.00 0.00 0.00 175.10 175.72 1nko s ASN 142 N 0.78 4.57 -0.09 3.32 0.01 -0.45 -1.07 114.94 122.01 1nko s ASN 142 Ca 0.06 -0.08 0.04 0.00 -0.71 0.00 0.00 52.86 52.18 1nko s ASN 142 Cb -0.13 -1.28 -0.00 0.00 0.41 0.00 0.00 41.25 40.25 1nko s ASN 142 CO 0.02 0.32 -0.23 -0.69 -1.51 0.00 0.00 177.10 175.00 1nko s VAL 143 N -0.53 2.13 -0.27 1.60 1.01 -1.26 -1.33 120.40 121.75 1nko s VAL 143 Ca 0.08 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 1nko s VAL 143 Cb -0.12 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.41 1nko s VAL 143 CO 0.02 0.56 0.18 -0.89 0.00 0.00 0.00 175.10 174.97 1nko s THR 144 N 0.18 5.23 0.51 3.92 2.01 -0.34 -4.90 115.64 122.25 1nko s THR 144 Ca -0.14 0.14 -0.21 0.00 0.31 0.00 0.00 61.69 61.79 1nko s THR 144 Cb -0.17 -3.48 -0.06 0.00 0.01 0.00 0.00 72.50 68.80 1nko s THR 144 CO 0.07 0.27 1.16 0.00 -0.69 0.00 0.00 174.62 175.43 1nko s ALA 145 N 1.69 2.82 0.29 7.40 0.00 -1.26 -0.41 121.76 132.28 1nko s ALA 145 Ca 0.07 0.92 0.05 0.00 0.00 0.00 0.00 51.96 52.99 1nko s ALA 145 Cb -0.16 -3.39 0.44 0.00 0.00 0.00 0.00 23.12 20.02 1nko s ALA 145 CO 0.10 -0.78 1.72 -0.07 0.00 0.00 0.00 175.76 176.73 1nko h LEU 146 N 1.58 0.36 -0.08 0.00 3.38 -1.97 -3.45 115.31 115.14 1nko h LEU 146 Ca -0.50 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.34 1nko h LEU 146 Cb 1.26 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1nko h LEU 146 CO 0.58 0.68 0.00 0.35 0.09 0.00 0.00 178.44 180.14