#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k70 s SER 2 N 0.00 0.34 0.00 1.61 1.04 -1.26 -4.72 113.70 110.70 2k70 s SER 2 Ca 0.00 0.93 0.00 0.00 0.48 0.00 0.00 55.95 57.36 2k70 s SER 2 Cb 0.00 -1.37 0.00 0.00 0.10 0.00 0.00 66.02 64.75 2k70 s SER 2 CO 0.00 -4.52 0.00 2.22 0.98 0.00 0.00 173.24 171.92 2k70 n PHE 3 N -5.07 0.00 0.00 5.02 -1.74 -1.26 -5.11 117.46 109.30 2k70 n PHE 3 Ca 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.99 2k70 n PHE 3 Cb 0.58 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.58 2k70 n PHE 3 CO 0.00 0.00 0.00 -2.37 -0.56 0.00 0.00 176.76 173.83 2k70 n THR 4 N 0.00 0.00 -2.83 1.97 5.66 -1.26 -4.91 114.28 112.90 2k70 n THR 4 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 2k70 n THR 4 Cb 0.00 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 68.80 2k70 n THR 4 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 2k70 n GLU 5 N 0.00 0.68 -3.71 1.09 2.13 -1.26 -5.07 120.64 114.50 2k70 n GLU 5 Ca 0.00 -2.05 -0.09 0.00 0.66 0.00 0.00 57.16 55.68 2k70 n GLU 5 Cb 0.00 -1.45 -0.03 0.00 0.27 0.00 0.00 31.44 30.23 2k70 n GLU 5 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2k70 s GLY 6 N -0.85 -0.21 0.00 8.31 0.00 -1.26 -0.56 107.32 112.75 2k70 s GLY 6 Ca 0.32 -0.09 -0.23 0.00 0.00 0.00 0.00 44.72 44.72 2k70 s GLY 6 CO -0.18 -0.10 0.51 0.66 0.00 0.00 0.00 173.10 174.00 2k70 s TRP 7 N -3.86 -0.43 0.04 1.90 -2.14 0.22 -3.98 118.94 110.68 2k70 s TRP 7 Ca 0.08 0.61 -0.19 0.00 2.66 0.00 0.00 56.10 59.26 2k70 s TRP 7 Cb -0.03 0.30 -0.06 0.00 -3.10 0.00 0.00 33.47 30.58 2k70 s TRP 7 CO -0.01 -0.57 0.57 0.08 -2.66 0.00 0.00 176.95 174.36 2k70 s VAL 8 N -1.78 4.83 -1.54 -0.66 1.01 -0.62 -1.52 120.40 120.12 2k70 s VAL 8 Ca -0.09 1.20 0.04 0.00 0.00 0.00 0.00 61.98 63.13 2k70 s VAL 8 Cb -0.02 -3.90 0.08 0.00 0.00 0.00 0.00 36.38 32.54 2k70 s VAL 8 CO 0.03 0.50 0.90 -1.14 0.00 0.00 0.00 175.10 175.40 2k70 n ARG 9 N 2.15 0.07 -0.55 2.72 0.63 -0.34 -1.29 116.66 120.04 2k70 n ARG 9 Ca -0.09 0.20 0.07 0.00 -0.92 0.00 0.00 57.85 57.11 2k70 n ARG 9 Cb 0.51 -1.50 -0.04 0.00 0.45 0.00 0.00 32.46 31.88 2k70 n ARG 9 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2k70 n PHE 10 N -1.23 -1.48 -3.64 -0.14 -0.00 -1.20 -3.62 117.46 106.15 2k70 n PHE 10 Ca 0.02 0.82 -0.06 0.00 -0.00 0.00 0.00 57.45 58.23 2k70 n PHE 10 Cb 0.03 -1.35 -0.07 0.00 -0.00 0.00 0.00 39.48 38.09 2k70 n PHE 10 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2k70 s SER 11 N -5.23 -0.46 0.00 -2.13 0.15 0.01 -4.72 113.70 101.32 2k70 s SER 11 Ca 0.00 0.82 0.29 0.00 0.70 0.00 0.00 55.95 57.77 2k70 s SER 11 Cb 0.00 0.99 1.34 0.00 -1.71 0.00 0.00 66.02 66.64 2k70 s SER 11 CO 0.00 -0.14 1.95 -0.81 1.20 0.00 0.00 173.24 175.45 2k70 n PRO 12 N 2.84 0.34 -3.88 5.44 -0.04 -1.26 -2.55 135.00 135.88 2k70 n PRO 12 Ca -0.15 -0.04 -0.24 0.00 -0.04 0.00 0.00 63.50 63.03 2k70 n PRO 12 Cb 0.57 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.48 2k70 n PRO 12 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k70 s GLY 13 N -2.69 2.29 0.22 0.55 0.00 -1.26 -4.97 107.32 101.46 2k70 s GLY 13 Ca 0.24 -1.82 0.17 0.00 0.00 0.00 0.00 44.72 43.31 2k70 s GLY 13 CO 0.50 -1.85 1.52 -1.55 0.00 0.00 0.00 173.10 171.72 2k70 n PRO 14 N -1.46 0.11 -4.74 2.90 -0.04 -1.26 -4.65 135.00 125.86 2k70 n PRO 14 Ca 0.00 0.54 -0.27 0.00 -0.04 0.00 0.00 63.50 63.73 2k70 n PRO 14 Cb 0.64 -1.82 -0.14 0.00 -0.04 0.00 0.00 33.50 32.14 2k70 n PRO 14 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2k70 s ASN 15 N -3.79 2.65 0.22 3.54 -0.87 -1.26 -2.13 114.94 113.30 2k70 s ASN 15 Ca 0.00 -0.53 0.05 0.00 -1.57 0.00 0.00 52.86 50.81 2k70 s ASN 15 Cb 0.06 -0.23 -0.02 0.00 -0.02 0.00 0.00 41.25 41.04 2k70 s ASN 15 CO 0.20 0.19 0.20 0.00 -2.57 0.00 0.00 177.10 175.12 2k70 n ALA 16 N 1.88 0.42 -2.99 0.60 0.00 -0.32 -4.81 120.51 115.30 2k70 n ALA 16 Ca -0.17 -1.28 -0.11 0.00 0.00 0.00 0.00 53.44 51.87 2k70 n ALA 16 Cb 0.53 1.04 -0.08 0.00 0.00 0.00 0.00 19.45 20.94 2k70 n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k70 s ALA 17 N -2.86 -0.60 0.02 0.00 0.00 -1.26 -0.75 121.76 116.30 2k70 s ALA 17 Ca 0.26 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.19 2k70 s ALA 17 Cb 0.01 0.28 -0.01 0.00 0.00 0.00 0.00 23.12 23.40 2k70 s ALA 17 CO 0.18 -0.38 -0.04 0.00 0.00 0.00 0.00 175.76 175.53 2k70 s ALA 18 N -2.42 0.24 0.03 0.00 0.00 0.41 -1.20 121.76 118.83 2k70 s ALA 18 Ca -0.06 -0.45 0.09 0.00 0.00 0.00 0.00 51.96 51.53 2k70 s ALA 18 Cb -0.01 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 2k70 s ALA 18 CO -0.03 -0.06 -0.25 0.71 0.00 0.00 0.00 175.76 176.13 2k70 s TYR 19 N -0.94 2.24 -0.18 0.00 2.02 -0.57 -1.92 117.35 118.00 2k70 s TYR 19 Ca -0.09 -0.41 -0.30 0.00 -0.37 0.00 0.00 57.07 55.90 2k70 s TYR 19 Cb -0.07 -1.36 0.14 0.00 -0.40 0.00 0.00 41.96 40.27 2k70 s TYR 19 CO -0.00 0.09 1.08 -0.48 -1.57 0.00 0.00 175.55 174.67 2k70 s LEU 20 N -1.11 -0.28 0.33 -1.29 0.05 -1.24 -0.61 118.68 114.54 2k70 s LEU 20 Ca 0.11 0.26 -0.26 0.00 0.05 0.00 0.00 54.13 54.29 2k70 s LEU 20 Cb -0.10 1.67 -0.10 0.00 -2.05 0.00 0.00 46.19 45.61 2k70 s LEU 20 CO 0.01 -0.29 0.96 -0.89 -0.55 0.00 0.00 176.35 175.60 2k70 s THR 21 N -1.35 4.11 -0.15 5.48 2.01 0.27 -0.57 115.64 125.44 2k70 s THR 21 Ca 0.02 1.75 0.00 0.00 0.31 0.00 0.00 61.69 63.77 2k70 s THR 21 Cb -0.01 -3.97 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 2k70 s THR 21 CO -0.02 0.14 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.15 2k70 s LEU 22 N -2.08 2.56 -0.13 4.42 2.01 0.87 -4.86 118.68 121.47 2k70 s LEU 22 Ca 0.51 -0.42 0.03 0.00 0.01 0.00 0.00 54.13 54.25 2k70 s LEU 22 Cb -0.20 -1.58 0.00 0.00 0.01 0.00 0.00 46.19 44.42 2k70 s LEU 22 CO 0.25 0.11 -0.21 -1.61 1.01 0.00 0.00 176.35 175.90 2k70 s GLU 23 N 0.66 3.09 -0.72 1.70 8.01 -1.26 -0.57 118.70 129.61 2k70 s GLU 23 Ca -0.07 -0.83 -0.14 0.00 0.01 0.00 0.00 54.97 53.93 2k70 s GLU 23 Cb -0.16 -2.43 0.19 0.00 -4.31 0.00 0.00 34.13 27.42 2k70 s GLU 23 CO 0.02 0.09 0.67 1.21 0.01 0.00 0.00 175.26 177.25 2k70 s ASN 24 N 0.59 6.52 0.00 -0.19 3.84 0.19 -4.69 114.94 121.20 2k70 s ASN 24 Ca -0.12 -2.39 0.24 0.00 0.21 0.00 0.00 52.86 50.80 2k70 s ASN 24 Cb -0.16 -2.20 1.09 0.00 -0.55 0.00 0.00 41.25 39.42 2k70 s ASN 24 CO 0.03 -0.66 1.79 -0.81 -2.79 0.00 0.00 177.10 174.66 2k70 n PRO 25 N 4.38 0.09 -2.47 0.43 -0.04 -1.26 -1.18 135.00 134.95 2k70 n PRO 25 Ca 0.04 0.08 -0.27 0.00 -0.04 0.00 0.00 63.50 63.31 2k70 n PRO 25 Cb 0.44 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.42 2k70 n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k70 s GLY 26 N -2.89 1.56 0.00 0.55 0.00 -1.26 -4.67 107.32 100.62 2k70 s GLY 26 Ca 0.15 -0.58 0.23 0.00 0.00 0.00 0.00 44.72 44.51 2k70 s GLY 26 CO 0.42 -0.35 1.48 1.22 0.00 0.00 0.00 173.10 175.87 2k70 n ASP 27 N -2.45 2.42 -4.38 1.64 9.92 -1.26 -1.70 116.55 120.73 2k70 n ASP 27 Ca 0.03 -1.82 -0.25 0.00 -0.53 0.00 0.00 54.79 52.22 2k70 n ASP 27 Cb 0.56 -0.12 -0.12 0.00 -0.64 0.00 0.00 41.12 40.81 2k70 n ASP 27 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 2k70 s LEU 28 N -1.67 2.43 0.41 0.64 0.05 -1.26 -4.83 118.68 114.44 2k70 s LEU 28 Ca 0.34 -0.85 -0.23 0.00 0.05 0.00 0.00 54.13 53.44 2k70 s LEU 28 Cb 0.20 -1.02 -0.09 0.00 -2.05 0.00 0.00 46.19 43.23 2k70 s LEU 28 CO 0.30 0.06 1.03 -2.16 -0.55 0.00 0.00 176.35 175.03 2k70 s PRO 29 N -2.67 4.12 0.04 1.48 0.04 -1.26 -4.24 135.00 132.51 2k70 s PRO 29 Ca 0.18 1.44 0.01 0.00 0.04 0.00 0.00 61.00 62.67 2k70 s PRO 29 Cb -0.07 -2.44 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 2k70 s PRO 29 CO 0.08 -0.17 0.10 -0.51 0.04 0.00 0.00 177.00 176.54 2k70 s LEU 30 N -2.82 3.92 -0.31 -3.56 1.43 -0.33 -4.97 118.68 112.05 2k70 s LEU 30 Ca 0.60 0.10 -0.02 0.00 -1.03 0.00 0.00 54.13 53.77 2k70 s LEU 30 Cb -0.20 -2.45 0.10 0.00 0.03 0.00 0.00 46.19 43.67 2k70 s LEU 30 CO 0.25 0.22 0.13 -0.60 0.23 0.00 0.00 176.35 176.57 2k70 s ARG 31 N -2.11 0.44 -0.57 1.70 3.52 -1.26 -0.27 118.95 120.40 2k70 s ARG 31 Ca 0.27 -0.83 -0.28 0.00 -0.13 0.00 0.00 55.73 54.77 2k70 s ARG 31 Cb -0.12 -1.51 0.03 0.00 -1.56 0.00 0.00 34.95 31.79 2k70 s ARG 31 CO 0.19 -1.02 1.16 -1.17 -0.81 0.00 0.00 175.30 173.65 2k70 s LEU 32 N 1.80 3.54 -0.03 -0.88 2.96 0.49 -0.58 118.68 125.98 2k70 s LEU 32 Ca 0.10 0.09 0.22 0.00 -0.22 0.00 0.00 54.13 54.31 2k70 s LEU 32 Cb -0.17 -3.16 -0.30 0.00 0.50 0.00 0.00 46.19 43.05 2k70 s LEU 32 CO -0.29 -1.44 0.48 1.33 -1.32 0.00 0.00 176.35 175.11 2k70 n VAL 33 N 6.63 0.21 -3.60 1.68 0.24 0.32 -0.80 118.33 123.02 2k70 n VAL 33 Ca 0.08 -0.55 -0.07 0.00 -2.04 0.00 0.00 64.34 61.77 2k70 n VAL 33 Cb 0.49 -0.08 0.02 0.00 -1.47 0.00 0.00 33.84 32.79 2k70 n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k70 n GLY 34 N 1.31 1.34 2.46 7.63 0.00 -1.04 -4.75 105.19 112.14 2k70 n GLY 34 Ca -0.07 -1.22 -0.13 0.00 0.00 0.00 0.00 46.02 44.61 2k70 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k70 n ALA 35 N -1.24 0.16 -4.06 4.61 0.00 -1.26 -1.24 120.51 117.48 2k70 n ALA 35 Ca -0.12 -1.34 -0.16 0.00 0.00 0.00 0.00 53.44 51.82 2k70 n ALA 35 Cb 0.43 1.08 -0.04 0.00 0.00 0.00 0.00 19.45 20.92 2k70 n ALA 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k70 n ARG 36 N -0.45 0.62 -3.61 0.00 1.74 -0.93 -4.85 116.66 109.17 2k70 n ARG 36 Ca 0.03 -2.86 -0.05 0.00 -0.77 0.00 0.00 57.85 54.20 2k70 n ARG 36 Cb 0.45 2.65 -0.04 0.00 -1.02 0.00 0.00 32.46 34.49 2k70 n ARG 36 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2k70 s THR 37 N -2.93 0.00 -1.37 0.55 -1.32 -1.26 -1.27 115.64 108.04 2k70 s THR 37 Ca 0.31 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 61.06 2k70 s THR 37 Cb -0.00 -1.00 0.43 0.00 -1.51 0.00 0.00 72.50 70.42 2k70 s THR 37 CO 0.22 0.00 1.91 -0.81 -2.21 0.00 0.00 174.62 173.73 2k70 n PRO 38 N 0.46 0.33 -2.12 7.08 -0.04 -1.26 -3.83 135.00 135.63 2k70 n PRO 38 Ca -0.03 0.03 -0.28 0.00 -0.04 0.00 0.00 63.50 63.18 2k70 n PRO 38 Cb 0.58 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.57 2k70 n PRO 38 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2k70 n VAL 39 N -1.31 2.72 -3.90 0.52 0.24 -1.26 -4.59 118.33 110.75 2k70 n VAL 39 Ca 0.12 -4.38 -0.08 0.00 -2.04 0.00 0.00 64.34 57.96 2k70 n VAL 39 Cb 0.23 -1.21 -0.02 0.00 -1.47 0.00 0.00 33.84 31.37 2k70 n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k70 s ALA 40 N -3.66 -0.80 -0.07 2.33 0.00 -1.25 -3.95 121.76 114.36 2k70 s ALA 40 Ca 0.51 -0.58 0.15 0.00 0.00 0.00 0.00 51.96 52.05 2k70 s ALA 40 Cb 0.42 0.89 -0.23 0.00 0.00 0.00 0.00 23.12 24.20 2k70 s ALA 40 CO -0.12 -0.97 0.25 -1.91 0.00 0.00 0.00 175.76 173.01 2k70 n GLU 41 N -0.46 0.85 -3.69 0.00 4.07 0.80 -4.81 120.64 117.40 2k70 n GLU 41 Ca -0.04 -0.10 -0.10 0.00 -0.06 0.00 0.00 57.16 56.86 2k70 n GLU 41 Cb 0.60 -1.39 -0.05 0.00 -0.06 0.00 0.00 31.44 30.54 2k70 n GLU 41 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2k70 s ARG 42 N -2.87 1.05 -0.26 5.31 0.52 -0.66 -5.02 118.95 117.01 2k70 s ARG 42 Ca -0.07 -0.78 -0.07 0.00 -0.52 0.00 0.00 55.73 54.29 2k70 s ARG 42 Cb 0.08 0.44 0.13 0.00 0.52 0.00 0.00 34.95 36.13 2k70 s ARG 42 CO 0.66 -0.40 0.55 0.54 0.02 0.00 0.00 175.30 176.68 2k70 s VAL 43 N -3.83 -0.86 -0.05 3.52 0.11 -1.26 -1.28 120.40 116.75 2k70 s VAL 43 Ca 0.04 0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.16 2k70 s VAL 43 Cb 0.02 -0.88 0.02 0.00 -1.53 0.00 0.00 36.38 34.01 2k70 s VAL 43 CO -0.11 0.01 -0.09 -1.61 -3.33 0.00 0.00 175.10 169.98 2k70 s GLU 44 N 2.78 1.28 -0.19 1.54 8.01 -0.21 -4.62 118.70 127.29 2k70 s GLU 44 Ca 0.00 -0.29 -0.26 0.00 0.01 0.00 0.00 54.97 54.44 2k70 s GLU 44 Cb -0.13 -1.13 -0.01 0.00 -4.31 0.00 0.00 34.13 28.56 2k70 s GLU 44 CO -0.17 0.00 0.88 -1.17 0.01 0.00 0.00 175.26 174.81 2k70 s LEU 45 N 0.69 4.15 0.24 1.80 2.96 -1.26 -0.44 118.68 126.82 2k70 s LEU 45 Ca -0.12 1.22 0.09 0.00 -0.22 0.00 0.00 54.13 55.09 2k70 s LEU 45 Cb -0.14 -3.31 -0.05 0.00 0.50 0.00 0.00 46.19 43.19 2k70 s LEU 45 CO 0.02 -0.47 -0.14 -1.00 -1.32 0.00 0.00 176.35 173.43 2k70 s HIS 46 N 2.45 1.89 0.16 5.38 3.76 -0.22 -0.52 115.29 128.19 2k70 s HIS 46 Ca 0.40 -0.53 0.05 0.00 -0.15 0.00 0.00 55.06 54.83 2k70 s HIS 46 Cb -0.16 -0.90 -0.04 0.00 1.11 0.00 0.00 32.58 32.59 2k70 s HIS 46 CO 0.11 0.44 0.09 -1.83 -0.85 0.00 0.00 174.74 172.70 2k70 s GLU 47 N -3.62 2.75 -0.08 1.40 -1.05 0.09 -1.33 118.70 116.86 2k70 s GLU 47 Ca 0.25 -0.92 0.01 0.00 -0.15 0.00 0.00 54.97 54.17 2k70 s GLU 47 Cb -0.01 -2.57 -0.03 0.00 -0.44 0.00 0.00 34.13 31.08 2k70 s GLU 47 CO 0.10 0.49 -0.08 0.99 0.95 0.00 0.00 175.26 177.70 2k70 s THR 48 N -1.69 3.57 0.32 1.83 2.01 -0.40 -1.64 115.64 119.65 2k70 s THR 48 Ca 0.30 -0.52 0.03 0.00 0.31 0.00 0.00 61.69 61.81 2k70 s THR 48 Cb -0.10 -2.46 -0.04 0.00 0.01 0.00 0.00 72.50 69.91 2k70 s THR 48 CO 0.22 0.58 0.14 0.72 -0.69 0.00 0.00 174.62 175.59 2k70 s PHE 49 N -0.60 1.67 -0.01 4.92 -0.12 0.04 -4.56 117.98 119.31 2k70 s PHE 49 Ca 0.09 -1.29 0.04 0.00 -0.05 0.00 0.00 56.93 55.72 2k70 s PHE 49 Cb -0.12 -0.96 -0.03 0.00 -0.63 0.00 0.00 43.02 41.28 2k70 s PHE 49 CO 0.02 -0.41 -0.11 1.41 -0.05 0.00 0.00 175.22 176.08 2k70 s MET 50 N -3.82 2.44 0.04 1.99 -2.45 -1.26 -1.14 119.30 115.09 2k70 s MET 50 Ca 0.34 -0.76 0.01 0.00 -1.25 0.00 0.00 55.69 54.02 2k70 s MET 50 Cb 0.05 -2.40 -0.03 0.00 1.25 0.00 0.00 34.83 33.71 2k70 s MET 50 CO 0.16 0.60 -0.05 1.03 1.05 0.00 0.00 175.02 177.81 2k70 s ARG 51 N -1.20 0.48 0.08 4.11 0.52 -0.18 -4.93 118.95 117.83 2k70 s ARG 51 Ca 0.15 -0.83 -0.07 0.00 -0.52 0.00 0.00 55.73 54.46 2k70 s ARG 51 Cb -0.11 -0.03 -0.05 0.00 0.52 0.00 0.00 34.95 35.28 2k70 s ARG 51 CO 0.05 -0.03 0.35 -2.00 0.02 0.00 0.00 175.30 173.69 2k70 s GLU 52 N -2.15 3.64 -0.12 3.54 2.56 -1.26 -0.44 118.70 124.48 2k70 s GLU 52 Ca -0.07 -0.02 -0.07 0.00 0.00 0.00 0.00 54.97 54.81 2k70 s GLU 52 Cb -0.05 -2.97 0.05 0.00 2.00 0.00 0.00 34.13 33.16 2k70 s GLU 52 CO -0.02 0.55 0.29 0.14 -0.56 0.00 0.00 175.26 175.66 2k70 s VAL 53 N -1.47 -0.03 -1.11 3.70 -7.23 0.35 -4.93 120.40 109.68 2k70 s VAL 53 Ca 0.34 0.12 0.00 0.00 -1.81 0.00 0.00 61.98 60.64 2k70 s VAL 53 Cb -0.13 -0.44 0.00 0.00 0.56 0.00 0.00 36.38 36.37 2k70 s VAL 53 CO 0.20 0.05 0.00 -0.62 -0.31 0.00 0.00 175.10 174.42 2k70 n GLU 54 N 4.15 -1.43 -0.86 4.82 1.02 -1.26 -0.76 120.64 126.31 2k70 n GLU 54 Ca -0.24 0.84 0.00 0.00 -0.02 0.00 0.00 57.16 57.74 2k70 n GLU 54 Cb 0.54 -5.10 0.00 0.00 -0.02 0.00 0.00 31.44 26.86 2k70 n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k70 n GLY 55 N -0.29 0.50 3.16 0.62 0.00 -1.26 -5.06 105.19 102.86 2k70 n GLY 55 Ca -0.10 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.94 2k70 n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k70 s LYS 56 N -1.22 3.04 -0.15 1.61 1.02 0.06 -5.12 119.74 118.98 2k70 s LYS 56 Ca 0.00 -0.82 -0.18 0.00 0.02 0.00 0.00 55.97 54.99 2k70 s LYS 56 Cb 0.00 -2.55 -0.04 0.00 -0.52 0.00 0.00 37.83 34.72 2k70 s LYS 56 CO 0.00 -0.12 0.46 -1.59 -0.92 0.00 0.00 175.35 173.18 2k70 s LYS 57 N 1.10 4.29 -0.04 1.68 -2.85 -1.26 -0.50 119.74 122.16 2k70 s LYS 57 Ca 0.00 0.38 -0.05 0.00 -1.00 0.00 0.00 55.97 55.31 2k70 s LYS 57 Cb -0.14 -3.47 0.01 0.00 -2.06 0.00 0.00 37.83 32.17 2k70 s LYS 57 CO -0.08 0.09 0.13 0.08 0.10 0.00 0.00 175.35 175.67 2k70 s VAL 58 N 0.87 0.02 0.61 1.79 1.01 0.42 -4.99 120.40 120.12 2k70 s VAL 58 Ca 0.24 -0.13 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 2k70 s VAL 58 Cb -0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 36.38 36.00 2k70 s VAL 58 CO 0.09 -0.07 0.96 -0.04 0.00 0.00 0.00 175.10 176.04 2k70 s MET 59 N -0.19 3.14 0.29 2.72 -1.94 -1.26 -1.01 119.30 121.05 2k70 s MET 59 Ca -0.03 0.30 -0.07 0.00 -1.71 0.00 0.00 55.69 54.18 2k70 s MET 59 Cb -0.02 -2.19 0.03 0.00 2.01 0.00 0.00 34.83 34.66 2k70 s MET 59 CO 0.00 -0.68 0.51 0.41 -0.01 0.00 0.00 175.02 175.26 2k70 n GLY 60 N -2.67 1.66 3.39 -0.03 0.00 -0.29 -4.87 105.19 102.37 2k70 n GLY 60 Ca 0.05 -1.34 -0.15 0.00 0.00 0.00 0.00 46.02 44.58 2k70 n GLY 60 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2k70 s MET 61 N -2.28 0.82 0.03 1.61 1.75 -1.26 -0.78 119.30 119.18 2k70 s MET 61 Ca 0.16 0.16 -0.22 0.00 -1.25 0.00 0.00 55.69 54.53 2k70 s MET 61 Cb -0.03 0.38 0.05 0.00 2.84 0.00 0.00 34.83 38.08 2k70 s MET 61 CO 0.12 -0.23 0.51 -0.98 -0.65 0.00 0.00 175.02 173.79 2k70 s ARG 62 N -0.99 0.99 0.61 4.11 1.70 -0.65 -5.00 118.95 119.73 2k70 s ARG 62 Ca -0.10 -0.18 -0.14 0.00 -0.47 0.00 0.00 55.73 54.84 2k70 s ARG 62 Cb -0.03 0.45 -0.03 0.00 -0.57 0.00 0.00 34.95 34.78 2k70 s ARG 62 CO 0.06 -0.34 1.04 -1.25 -1.08 0.00 0.00 175.30 173.73 2k70 s PRO 63 N -2.19 3.33 0.04 3.89 0.04 -1.26 -0.73 135.00 138.11 2k70 s PRO 63 Ca -0.07 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.04 2k70 s PRO 63 Cb -0.01 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 2k70 s PRO 63 CO 0.00 -0.79 -0.04 0.14 0.04 0.00 0.00 177.00 176.35 2k70 s VAL 64 N -2.70 0.27 -0.18 -0.36 -7.23 0.32 -4.79 120.40 105.72 2k70 s VAL 64 Ca 0.61 -1.23 0.16 0.00 -1.81 0.00 0.00 61.98 59.71 2k70 s VAL 64 Cb -0.14 -0.72 0.08 0.00 0.56 0.00 0.00 36.38 36.15 2k70 s VAL 64 CO 0.42 -0.62 1.44 1.55 -0.31 0.00 0.00 175.10 177.58 2k70 h PRO 65 N 4.15 0.00 -1.50 4.82 0.13 -1.95 -3.42 132.00 134.23 2k70 h PRO 65 Ca -0.33 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.09 2k70 h PRO 65 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 2k70 h PRO 65 CO 0.48 0.46 0.81 -0.59 -0.23 0.00 0.00 178.00 178.93 2k70 s PHE 66 N -2.98 -0.07 0.15 1.56 -0.12 -1.26 -4.67 117.98 110.59 2k70 s PHE 66 Ca 0.04 -0.02 0.06 0.00 -0.05 0.00 0.00 56.93 56.96 2k70 s PHE 66 Cb 0.07 0.54 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 2k70 s PHE 66 CO 0.74 -0.28 0.02 -0.51 -0.05 0.00 0.00 175.22 175.14 2k70 s LEU 67 N -2.74 3.42 -0.01 -1.99 1.43 0.02 -4.96 118.68 113.84 2k70 s LEU 67 Ca 0.13 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 52.94 2k70 s LEU 67 Cb 0.03 -2.09 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 2k70 s LEU 67 CO -0.04 0.11 -0.03 -0.70 0.23 0.00 0.00 176.35 175.93 2k70 s GLU 68 N -2.78 2.73 -0.05 1.70 2.56 -1.26 -0.38 118.70 121.22 2k70 s GLU 68 Ca 0.27 -0.62 -0.01 0.00 0.00 0.00 0.00 54.97 54.62 2k70 s GLU 68 Cb -0.10 -2.62 0.03 0.00 2.00 0.00 0.00 34.13 33.43 2k70 s GLU 68 CO 0.19 0.63 0.01 0.08 -0.56 0.00 0.00 175.26 175.61 2k70 s VAL 69 N -1.01 0.25 0.88 3.70 1.01 0.63 -4.98 120.40 120.87 2k70 s VAL 69 Ca 0.17 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 2k70 s VAL 69 Cb -0.11 -0.39 0.12 0.00 0.00 0.00 0.00 36.38 36.00 2k70 s VAL 69 CO 0.08 0.20 1.09 -2.16 0.00 0.00 0.00 175.10 174.31 2k70 s PRO 70 N 1.57 1.38 0.56 2.72 0.04 -1.26 -1.19 135.00 138.82 2k70 s PRO 70 Ca -0.02 0.86 -0.21 0.00 0.04 0.00 0.00 61.00 61.67 2k70 s PRO 70 Cb -0.13 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2k70 s PRO 70 CO -0.03 -2.17 1.27 -1.25 0.04 0.00 0.00 177.00 174.86 2k70 s PRO 71 N -4.93 3.13 0.00 0.56 0.04 -1.26 -3.33 135.00 129.21 2k70 s PRO 71 Ca 0.63 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.68 2k70 s PRO 71 Cb -0.18 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.22 2k70 s PRO 71 CO 0.57 -1.12 0.00 1.63 0.04 0.00 0.00 177.00 178.11 2k70 n LYS 72 N -1.20 0.00 -2.33 4.56 4.76 -0.32 -4.97 118.16 118.66 2k70 n LYS 72 Ca 0.11 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.31 2k70 n LYS 72 Cb 0.47 -2.58 0.09 0.00 -1.84 0.00 0.00 35.03 31.17 2k70 n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k70 s GLY 73 N -1.60 1.74 0.00 0.72 0.00 -1.17 -4.78 107.32 102.23 2k70 s GLY 73 Ca 0.00 -1.21 -0.01 0.00 0.00 0.00 0.00 44.72 43.50 2k70 s GLY 73 CO 0.00 -0.75 0.01 1.09 0.00 0.00 0.00 173.10 173.46 2k70 s ARG 74 N -5.21 0.15 0.09 2.90 1.04 -1.26 -0.64 118.95 116.02 2k70 s ARG 74 Ca 0.63 -0.21 -0.14 0.00 -1.04 0.00 0.00 55.73 54.97 2k70 s ARG 74 Cb -0.09 0.06 0.02 0.00 -2.04 0.00 0.00 34.95 32.90 2k70 s ARG 74 CO 0.44 -0.03 0.33 0.08 -0.04 0.00 0.00 175.30 176.09 2k70 s VAL 75 N -0.56 0.09 0.14 4.99 1.01 0.26 -4.99 120.40 121.33 2k70 s VAL 75 Ca -0.06 -0.74 0.09 0.00 0.00 0.00 0.00 61.98 61.27 2k70 s VAL 75 Cb -0.04 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 2k70 s VAL 75 CO -0.00 -0.41 -0.20 -1.83 0.00 0.00 0.00 175.10 172.66 2k70 s GLU 76 N -3.44 1.24 -0.76 2.72 4.04 -1.26 -0.09 118.70 121.14 2k70 s GLU 76 Ca 0.01 -1.31 -0.26 0.00 0.04 0.00 0.00 54.97 53.45 2k70 s GLU 76 Cb 0.02 -1.42 -0.13 0.00 0.02 0.00 0.00 34.13 32.62 2k70 s GLU 76 CO -0.09 0.31 2.42 1.28 -1.84 0.00 0.00 175.26 177.34 2k70 n LEU 77 N 0.65 1.87 -4.65 1.83 4.32 0.26 -4.88 117.00 116.40 2k70 n LEU 77 Ca -0.16 -1.38 -0.52 0.00 -0.02 0.00 0.00 56.01 53.92 2k70 n LEU 77 Cb 0.55 -1.66 -0.06 0.00 -1.62 0.00 0.00 43.42 40.64 2k70 n LEU 77 CO 0.26 -2.52 1.13 1.17 -1.22 0.00 0.00 177.39 176.21 2k70 n LYS 78 N 8.83 1.41 0.13 3.23 3.00 -1.03 -3.59 118.16 130.14 2k70 n LYS 78 Ca 0.46 0.51 0.09 0.00 -0.00 0.00 0.00 58.31 59.37 2k70 n LYS 78 Cb 0.44 -2.21 0.46 0.00 0.00 0.00 0.00 35.03 33.73 2k70 n LYS 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2k70 n PRO 79 N 3.95 0.11 0.00 1.64 -0.04 -1.26 -0.34 135.00 139.06 2k70 n PRO 79 Ca 0.21 0.59 0.06 0.00 -0.04 0.00 0.00 63.50 64.31 2k70 n PRO 79 Cb 0.20 -1.85 0.03 0.00 -0.04 0.00 0.00 33.50 31.84 2k70 n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k70 n GLY 80 N -1.21 -0.25 0.00 0.55 0.00 -1.26 -5.01 105.19 98.00 2k70 n GLY 80 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2k70 n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k70 n GLY 81 N 0.73 1.68 3.76 -0.02 0.00 0.54 -4.74 105.19 107.13 2k70 n GLY 81 Ca 0.06 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 2k70 n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k70 s TYR 82 N 1.38 3.44 -0.06 1.61 1.51 -1.17 -1.27 117.35 122.79 2k70 s TYR 82 Ca 0.00 1.59 -0.31 0.00 -1.01 0.00 0.00 57.07 57.34 2k70 s TYR 82 Cb 0.00 -3.39 0.07 0.00 -0.11 0.00 0.00 41.96 38.53 2k70 s TYR 82 CO 0.00 -0.94 0.69 -3.38 -1.11 0.00 0.00 175.55 170.81 2k70 s HIS 83 N -0.96 -0.66 -0.03 2.71 -3.43 -0.44 -2.45 115.29 110.03 2k70 s HIS 83 Ca 0.47 1.14 -0.27 0.00 -0.80 0.00 0.00 55.06 55.60 2k70 s HIS 83 Cb -0.34 0.41 -0.03 0.00 -1.43 0.00 0.00 32.58 31.19 2k70 s HIS 83 CO 0.43 -0.60 0.84 -0.06 -2.00 0.00 0.00 174.74 173.35 2k70 s PHE 84 N -1.15 3.62 0.07 0.38 0.08 -0.81 -1.06 117.98 119.13 2k70 s PHE 84 Ca -0.10 1.48 -0.30 0.00 0.12 0.00 0.00 56.93 58.12 2k70 s PHE 84 Cb -0.00 -2.96 -0.05 0.00 -0.57 0.00 0.00 43.02 39.44 2k70 s PHE 84 CO 0.10 0.04 0.97 1.41 -0.10 0.00 0.00 175.22 177.63 2k70 s MET 85 N 0.89 4.65 -0.18 0.44 1.75 0.42 -0.45 119.30 126.82 2k70 s MET 85 Ca 0.45 1.44 -0.04 0.00 -1.25 0.00 0.00 55.69 56.29 2k70 s MET 85 Cb -0.19 -3.40 -0.02 0.00 2.84 0.00 0.00 34.83 34.05 2k70 s MET 85 CO 0.23 0.13 -0.03 -0.51 -0.65 0.00 0.00 175.02 174.19 2k70 s LEU 86 N 0.33 3.17 -0.10 4.11 1.02 0.07 -1.05 118.68 126.23 2k70 s LEU 86 Ca 0.49 -0.20 0.03 0.00 0.02 0.00 0.00 54.13 54.47 2k70 s LEU 86 Cb -0.23 -1.78 -0.00 0.00 0.02 0.00 0.00 46.19 44.20 2k70 s LEU 86 CO 0.29 0.11 -0.22 -0.76 0.02 0.00 0.00 176.35 175.79 2k70 s LEU 87 N 0.71 2.21 -0.03 1.79 2.01 -0.40 -1.17 118.68 123.80 2k70 s LEU 87 Ca -0.02 -0.52 -0.00 0.00 0.01 0.00 0.00 54.13 53.61 2k70 s LEU 87 Cb -0.14 -1.45 -0.00 0.00 0.01 0.00 0.00 46.19 44.61 2k70 s LEU 87 CO 0.02 0.16 0.02 0.61 1.01 0.00 0.00 176.35 178.18 2k70 n GLY 88 N 3.51 0.64 3.56 -3.19 0.00 -0.90 -0.14 105.19 108.66 2k70 n GLY 88 Ca -0.19 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 2k70 n GLY 88 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2k70 n LEU 89 N -1.29 1.98 -0.01 0.99 -0.00 -1.11 -1.76 117.00 115.79 2k70 n LEU 89 Ca -0.00 0.43 -0.00 0.00 -0.00 0.00 0.00 56.01 56.44 2k70 n LEU 89 Cb 0.50 -1.36 -0.03 0.00 -0.00 0.00 0.00 43.42 42.53 2k70 n LEU 89 CO 0.01 -2.72 -0.59 0.29 -0.00 0.00 0.00 177.39 174.39 2k70 n LYS 90 N -2.80 1.96 -4.35 1.47 4.76 -1.25 -4.82 118.16 113.12 2k70 n LYS 90 Ca 0.10 -0.02 -0.28 0.00 -2.87 0.00 0.00 58.31 55.24 2k70 n LYS 90 Cb 0.52 -1.10 -0.11 0.00 -1.84 0.00 0.00 35.03 32.50 2k70 n LYS 90 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2k70 s ARG 91 N -2.17 1.67 0.32 1.97 1.81 -1.26 -5.06 118.95 116.23 2k70 s ARG 91 Ca -0.02 -1.33 -0.28 0.00 -1.72 0.00 0.00 55.73 52.38 2k70 s ARG 91 Cb 0.02 -2.00 -0.10 0.00 -0.45 0.00 0.00 34.95 32.42 2k70 s ARG 91 CO 0.16 0.44 1.19 -1.25 -0.68 0.00 0.00 175.30 175.16 2k70 s PRO 92 N -2.38 4.44 -0.89 3.54 0.04 -1.26 -4.99 135.00 133.50 2k70 s PRO 92 Ca 0.19 1.96 -0.16 0.00 0.04 0.00 0.00 61.00 63.03 2k70 s PRO 92 Cb -0.09 -3.06 0.19 0.00 0.04 0.00 0.00 34.50 31.57 2k70 s PRO 92 CO 0.10 -0.02 0.94 -0.51 0.04 0.00 0.00 177.00 177.55 2k70 s LEU 93 N -1.74 6.05 0.99 -3.56 1.02 -1.06 -5.02 118.68 115.37 2k70 s LEU 93 Ca 0.48 -2.51 -0.15 0.00 0.02 0.00 0.00 54.13 51.97 2k70 s LEU 93 Cb -0.35 -2.29 0.19 0.00 0.02 0.00 0.00 46.19 43.77 2k70 s LEU 93 CO 0.45 -0.75 1.18 -1.59 0.02 0.00 0.00 176.35 175.67 2k70 s LYS 94 N 1.08 0.44 0.42 1.70 -2.85 -1.26 -0.81 119.74 118.46 2k70 s LYS 94 Ca 0.25 0.00 -0.23 0.00 -1.00 0.00 0.00 55.97 54.99 2k70 s LYS 94 Cb -0.08 -1.78 -0.08 0.00 -2.06 0.00 0.00 37.83 33.82 2k70 s LYS 94 CO -0.09 -2.62 1.08 0.00 0.10 0.00 0.00 175.35 173.82 2k70 s ALA 95 N -3.39 3.04 -0.69 0.59 0.00 -1.26 -3.98 121.76 116.06 2k70 s ALA 95 Ca 0.68 0.76 -0.02 0.00 0.00 0.00 0.00 51.96 53.38 2k70 s ALA 95 Cb -0.10 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2k70 s ALA 95 CO 0.54 -0.34 0.23 0.41 0.00 0.00 0.00 175.76 176.60 2k70 n GLY 96 N 0.31 0.13 3.99 0.00 0.00 -0.35 -4.99 105.19 104.29 2k70 n GLY 96 Ca 0.06 -0.40 -0.21 0.00 0.00 0.00 0.00 46.02 45.47 2k70 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k70 s GLU 97 N -4.96 2.24 -0.05 1.61 0.41 -1.22 -4.96 118.70 111.78 2k70 s GLU 97 Ca 0.12 -1.09 0.00 0.00 -0.41 0.00 0.00 54.97 53.59 2k70 s GLU 97 Cb -0.05 -2.49 0.02 0.00 -1.78 0.00 0.00 34.13 29.83 2k70 s GLU 97 CO 0.14 -0.93 -0.02 -1.21 -0.49 0.00 0.00 175.26 172.74 2k70 s GLU 98 N -4.83 0.65 -0.17 1.61 2.02 -1.26 -0.12 118.70 116.60 2k70 s GLU 98 Ca 0.61 -0.02 -0.16 0.00 0.02 0.00 0.00 54.97 55.43 2k70 s GLU 98 Cb -0.08 -0.77 0.04 0.00 0.10 0.00 0.00 34.13 33.43 2k70 s GLU 98 CO 0.40 -0.14 0.45 0.08 0.02 0.00 0.00 175.26 176.07 2k70 s VAL 99 N 1.15 0.00 0.54 2.63 1.01 0.50 -4.93 120.40 121.29 2k70 s VAL 99 Ca -0.08 -0.00 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 2k70 s VAL 99 Cb -0.14 -0.63 -0.07 0.00 0.00 0.00 0.00 36.38 35.55 2k70 s VAL 99 CO -0.01 -0.00 1.01 -1.61 0.00 0.00 0.00 175.10 174.48 2k70 s GLU 100 N 0.23 3.75 -0.07 2.72 8.01 -1.26 -2.76 118.70 129.32 2k70 s GLU 100 Ca -0.00 1.02 0.02 0.00 0.01 0.00 0.00 54.97 56.03 2k70 s GLU 100 Cb -0.03 -2.10 -0.02 0.00 -4.31 0.00 0.00 34.13 27.66 2k70 s GLU 100 CO 0.01 -0.44 -0.14 -0.51 0.01 0.00 0.00 175.26 174.19 2k70 s LEU 101 N -4.23 2.76 0.45 1.80 1.02 -0.73 -4.32 118.68 115.42 2k70 s LEU 101 Ca 0.60 -0.22 -0.20 0.00 0.02 0.00 0.00 54.13 54.33 2k70 s LEU 101 Cb -0.12 -1.58 -0.10 0.00 0.02 0.00 0.00 46.19 44.41 2k70 s LEU 101 CO 0.34 0.30 0.96 -1.81 0.02 0.00 0.00 176.35 176.16 2k70 s ASP 102 N -0.45 6.83 -0.10 2.29 1.11 -0.40 -1.05 116.67 124.90 2k70 s ASP 102 Ca 0.06 1.70 0.03 0.00 0.18 0.00 0.00 52.55 54.51 2k70 s ASP 102 Cb -0.12 -2.54 0.01 0.00 1.07 0.00 0.00 42.92 41.34 2k70 s ASP 102 CO 0.02 -0.44 -0.18 -0.76 1.18 0.00 0.00 175.17 174.99 2k70 s LEU 103 N -3.34 1.86 -0.29 1.23 1.02 0.24 -2.19 118.68 117.22 2k70 s LEU 103 Ca 0.62 -0.46 -0.05 0.00 0.02 0.00 0.00 54.13 54.26 2k70 s LEU 103 Cb -0.10 -1.17 0.02 0.00 0.02 0.00 0.00 46.19 44.96 2k70 s LEU 103 CO 0.16 0.07 0.04 -0.76 0.02 0.00 0.00 176.35 175.88 2k70 s LEU 104 N 0.71 3.73 -0.19 1.79 1.43 -0.37 -1.69 118.68 124.09 2k70 s LEU 104 Ca -0.12 -0.83 -0.02 0.00 -1.03 0.00 0.00 54.13 52.13 2k70 s LEU 104 Cb -0.16 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.24 2k70 s LEU 104 CO 0.03 -0.19 -0.08 -0.36 0.23 0.00 0.00 176.35 175.97 2k70 s PHE 105 N 1.43 2.90 -0.93 0.29 0.08 -0.16 -0.52 117.98 121.07 2k70 s PHE 105 Ca 0.01 -0.88 -0.04 0.00 0.12 0.00 0.00 56.93 56.14 2k70 s PHE 105 Cb -0.17 -2.00 0.03 0.00 -0.57 0.00 0.00 43.02 40.31 2k70 s PHE 105 CO 0.00 -0.44 0.18 0.00 -0.10 0.00 0.00 175.22 174.86 2k70 n ALA 106 N 4.32 -0.93 0.00 5.36 0.00 0.25 -2.02 120.51 127.49 2k70 n ALA 106 Ca -0.18 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2k70 n ALA 106 Cb 0.51 -1.73 0.00 0.00 0.00 0.00 0.00 19.45 18.23 2k70 n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k70 n GLY 107 N -0.87 2.16 0.11 0.00 0.00 -1.26 -4.70 105.19 100.63 2k70 n GLY 107 Ca -0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 46.02 45.73 2k70 n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2k70 h GLY 108 N 0.00 0.00 -6.89 -0.02 0.00 -1.95 -3.44 103.07 90.77 2k70 h GLY 108 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 2k70 h GLY 108 CO 0.00 0.00 0.68 0.54 0.00 0.00 0.00 176.54 177.76 2k70 s LYS 109 N -2.89 3.55 -0.14 4.80 1.02 -0.86 -4.96 119.74 120.26 2k70 s LYS 109 Ca 0.01 0.22 -0.10 0.00 0.02 0.00 0.00 55.97 56.12 2k70 s LYS 109 Cb 0.08 -3.94 -0.05 0.00 -0.52 0.00 0.00 37.83 33.41 2k70 s LYS 109 CO 0.78 -1.31 0.20 0.08 -0.92 0.00 0.00 175.35 174.18 2k70 s VAL 110 N 3.99 5.39 0.26 3.17 1.01 -1.26 -0.99 120.40 131.97 2k70 s VAL 110 Ca 0.39 0.34 0.01 0.00 0.00 0.00 0.00 61.98 62.72 2k70 s VAL 110 Cb -0.09 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 2k70 s VAL 110 CO 0.27 0.50 0.13 -0.76 0.00 0.00 0.00 175.10 175.25 2k70 s LEU 111 N -0.24 1.51 -0.08 3.92 1.02 -0.68 -5.02 118.68 119.10 2k70 s LEU 111 Ca 0.14 -1.45 -0.13 0.00 0.02 0.00 0.00 54.13 52.71 2k70 s LEU 111 Cb -0.12 0.20 0.03 0.00 0.02 0.00 0.00 46.19 46.32 2k70 s LEU 111 CO 0.03 -0.82 0.33 -0.75 0.02 0.00 0.00 176.35 175.16 2k70 s LYS 112 N -3.99 0.51 0.06 1.70 2.20 -1.26 -0.59 119.74 118.37 2k70 s LYS 112 Ca 0.38 0.21 0.03 0.00 -0.36 0.00 0.00 55.97 56.23 2k70 s LYS 112 Cb 0.07 0.24 -0.03 0.00 -1.51 0.00 0.00 37.83 36.60 2k70 s LYS 112 CO 0.15 -0.10 -0.10 0.08 -0.36 0.00 0.00 175.35 175.01 2k70 s VAL 113 N -0.42 0.78 -0.11 4.02 1.01 -0.21 -4.98 120.40 120.49 2k70 s VAL 113 Ca -0.05 -1.22 -0.14 0.00 0.00 0.00 0.00 61.98 60.56 2k70 s VAL 113 Cb -0.04 -0.85 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 2k70 s VAL 113 CO 0.02 -0.35 0.35 -0.69 0.00 0.00 0.00 175.10 174.43 2k70 s VAL 114 N -1.46 5.22 0.01 2.92 1.01 -1.26 -1.78 120.40 125.07 2k70 s VAL 114 Ca -0.06 0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2k70 s VAL 114 Cb -0.09 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 2k70 s VAL 114 CO 0.01 0.45 -0.03 -0.76 0.00 0.00 0.00 175.10 174.77 2k70 s LEU 115 N -0.03 2.14 0.89 3.92 1.43 -1.11 -4.92 118.68 120.99 2k70 s LEU 115 Ca 0.20 -0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 52.90 2k70 s LEU 115 Cb -0.14 -0.01 0.13 0.00 0.03 0.00 0.00 46.19 46.20 2k70 s LEU 115 CO 0.08 -0.15 1.10 -2.16 0.23 0.00 0.00 176.35 175.45 2k70 s PRO 116 N -0.84 1.26 -0.20 1.29 0.04 -1.26 -0.37 135.00 134.92 2k70 s PRO 116 Ca -0.08 1.14 -0.03 0.00 0.04 0.00 0.00 61.00 62.07 2k70 s PRO 116 Cb -0.06 -1.78 -0.01 0.00 0.04 0.00 0.00 34.50 32.69 2k70 s PRO 116 CO -0.00 -2.33 -0.06 0.08 0.04 0.00 0.00 177.00 174.73 2k70 s VAL 117 N -2.79 3.36 0.04 -0.36 1.01 0.83 -1.58 120.40 120.90 2k70 s VAL 117 Ca 0.64 -0.51 -0.09 0.00 0.00 0.00 0.00 61.98 62.02 2k70 s VAL 117 Cb -0.20 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.68 2k70 s VAL 117 CO 0.58 0.45 0.19 -1.61 0.00 0.00 0.00 175.10 174.70 2k70 s GLU 118 N 1.19 0.68 0.08 2.72 0.41 -0.41 -1.21 118.70 122.16 2k70 s GLU 118 Ca 0.02 -0.62 -0.16 0.00 -0.41 0.00 0.00 54.97 53.80 2k70 s GLU 118 Cb -0.14 0.28 -0.06 0.00 -1.78 0.00 0.00 34.13 32.42 2k70 s GLU 118 CO -0.01 -0.19 0.51 0.00 -0.49 0.00 0.00 175.26 175.07 2k70 s ALA 119 N -2.50 3.63 0.00 5.21 0.00 -1.26 -3.23 121.76 123.60 2k70 s ALA 119 Ca -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.79 2k70 s ALA 119 Cb -0.01 -2.51 0.00 0.00 0.00 0.00 0.00 23.12 20.60 2k70 s ALA 119 CO -0.04 0.45 0.00 2.89 0.00 0.00 0.00 175.76 179.07