#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k70 n SER 2 N 0.00 0.00 -2.72 1.61 7.64 -1.26 -4.97 113.62 113.92 2k70 n SER 2 Ca 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.84 2k70 n SER 2 Cb 0.00 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.29 2k70 n SER 2 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2k70 n PHE 3 N 0.00 -0.73 -2.04 1.43 3.72 -1.26 -4.94 117.46 113.65 2k70 n PHE 3 Ca 0.00 -2.06 -0.05 0.00 -0.05 0.00 0.00 57.45 55.29 2k70 n PHE 3 Cb 0.00 0.77 -0.03 0.00 -0.94 0.00 0.00 39.48 39.28 2k70 n PHE 3 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 2k70 n THR 4 N -0.83 0.00 -3.92 4.37 5.66 -1.26 -4.85 114.28 113.45 2k70 n THR 4 Ca -0.03 -0.14 -0.11 0.00 -3.05 0.00 0.00 64.05 60.72 2k70 n THR 4 Cb 0.84 0.50 -0.00 0.00 -1.55 0.00 0.00 70.33 70.12 2k70 n THR 4 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2k70 s GLU 5 N 0.02 2.09 0.17 1.09 1.03 -1.26 -4.91 118.70 116.93 2k70 s GLU 5 Ca 0.01 -1.54 -0.12 0.00 0.03 0.00 0.00 54.97 53.36 2k70 s GLU 5 Cb 0.06 0.56 0.00 0.00 -0.80 0.00 0.00 34.13 33.96 2k70 s GLU 5 CO -0.02 -0.94 0.36 0.20 -1.33 0.00 0.00 175.26 173.53 2k70 s GLY 6 N -3.13 0.27 -0.01 -3.83 0.00 -1.26 -0.94 107.32 98.43 2k70 s GLY 6 Ca 0.21 -0.65 -0.26 0.00 0.00 0.00 0.00 44.72 44.02 2k70 s GLY 6 CO 0.14 -0.64 0.57 0.66 0.00 0.00 0.00 173.10 173.83 2k70 s TRP 7 N -3.93 -0.51 0.02 1.90 -2.14 -0.25 -4.25 118.94 109.78 2k70 s TRP 7 Ca 0.14 0.79 -0.06 0.00 2.66 0.00 0.00 56.10 59.63 2k70 s TRP 7 Cb 0.02 0.34 -0.05 0.00 -3.10 0.00 0.00 33.47 30.68 2k70 s TRP 7 CO -0.01 -0.59 0.27 0.08 -2.66 0.00 0.00 176.95 174.04 2k70 s VAL 8 N -1.60 5.30 -0.30 -0.66 1.01 0.19 -1.74 120.40 122.59 2k70 s VAL 8 Ca -0.10 0.10 0.25 0.00 0.00 0.00 0.00 61.98 62.24 2k70 s VAL 8 Cb -0.01 -3.57 0.27 0.00 0.00 0.00 0.00 36.38 33.06 2k70 s VAL 8 CO 0.05 0.32 1.77 -0.09 0.00 0.00 0.00 175.10 177.15 2k70 h ARG 9 N 3.80 0.00 -0.48 2.72 1.12 -1.35 -0.37 114.38 119.82 2k70 h ARG 9 Ca -0.49 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.38 2k70 h ARG 9 Cb 1.19 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.15 2k70 h ARG 9 CO 0.68 0.00 -0.12 0.34 -3.11 0.00 0.00 179.97 177.75 2k70 n PHE 10 N -2.40 -0.56 -3.65 2.20 7.35 -1.24 -3.77 117.46 115.39 2k70 n PHE 10 Ca 0.01 0.30 0.00 0.00 -0.76 0.00 0.00 57.45 57.00 2k70 n PHE 10 Cb 0.20 -1.07 -0.06 0.00 0.35 0.00 0.00 39.48 38.89 2k70 n PHE 10 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2k70 s SER 11 N -2.84 -0.06 0.05 -2.13 0.15 0.64 -4.80 113.70 104.71 2k70 s SER 11 Ca 0.00 0.10 0.27 0.00 0.70 0.00 0.00 55.95 57.02 2k70 s SER 11 Cb 0.00 0.68 0.94 0.00 -1.71 0.00 0.00 66.02 65.93 2k70 s SER 11 CO 0.00 -0.02 1.75 -0.81 1.20 0.00 0.00 173.24 175.37 2k70 n PRO 12 N 2.52 0.08 -2.62 5.44 -0.04 -1.26 -1.07 135.00 138.05 2k70 n PRO 12 Ca -0.15 0.05 -0.22 0.00 -0.04 0.00 0.00 63.50 63.15 2k70 n PRO 12 Cb 0.56 -1.58 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 -3.18 1.79 0.36 0.55 0.00 -1.26 -4.64 107.32 100.94 2k70 s GLY 13 Ca 0.12 -1.25 0.26 0.00 0.00 0.00 0.00 44.72 43.86 2k70 s GLY 13 CO 0.59 -0.96 1.80 -0.56 0.00 0.00 0.00 173.10 173.96 2k70 h PRO 14 N 0.03 0.00 -5.70 2.90 0.13 -1.94 -3.42 132.00 124.00 2k70 h PRO 14 Ca -0.43 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.03 2k70 h PRO 14 Cb 1.29 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.34 2k70 h PRO 14 CO 0.54 0.00 -0.50 -0.80 -0.23 0.00 0.00 178.00 177.00 2k70 s ASN 15 N -4.41 6.22 0.28 1.44 -0.87 -1.26 -0.83 114.94 115.51 2k70 s ASN 15 Ca -0.00 0.41 -0.03 0.00 -1.57 0.00 0.00 52.86 51.67 2k70 s ASN 15 Cb 0.08 -1.98 0.01 0.00 -0.02 0.00 0.00 41.25 39.35 2k70 s ASN 15 CO 0.33 0.39 0.41 0.00 -2.57 0.00 0.00 177.10 175.66 2k70 n ALA 16 N 1.91 -0.43 -3.35 0.60 0.00 -0.33 -4.73 120.51 114.18 2k70 n ALA 16 Ca -0.19 -1.20 -0.15 0.00 0.00 0.00 0.00 53.44 51.90 2k70 n ALA 16 Cb 0.55 0.97 -0.08 0.00 0.00 0.00 0.00 19.45 20.88 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 -2.39 -1.15 0.04 0.00 0.00 -1.26 -1.07 121.76 115.93 2k70 s ALA 17 Ca 0.21 0.87 0.02 0.00 0.00 0.00 0.00 51.96 53.05 2k70 s ALA 17 Cb -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 2k70 s ALA 17 CO 0.15 -0.28 -0.07 0.00 0.00 0.00 0.00 175.76 175.57 2k70 s ALA 18 N -0.85 0.46 0.01 0.00 0.00 0.44 -1.24 121.76 120.59 2k70 s ALA 18 Ca -0.09 -0.71 0.07 0.00 0.00 0.00 0.00 51.96 51.23 2k70 s ALA 18 Cb -0.03 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 2k70 s ALA 18 CO 0.05 -0.05 -0.20 0.71 0.00 0.00 0.00 175.76 176.26 2k70 s TYR 19 N -1.38 2.50 0.00 0.00 2.02 -0.71 -1.81 117.35 117.97 2k70 s TYR 19 Ca -0.11 -0.30 -0.28 0.00 -0.37 0.00 0.00 57.07 56.00 2k70 s TYR 19 Cb -0.10 -1.50 0.10 0.00 -0.40 0.00 0.00 41.96 40.07 2k70 s TYR 19 CO 0.00 0.15 0.87 -0.48 -1.57 0.00 0.00 175.55 174.53 2k70 s LEU 20 N -1.07 -0.37 0.02 -1.29 -0.00 -1.12 -1.09 118.68 113.77 2k70 s LEU 20 Ca 0.12 -0.00 0.02 0.00 -0.00 0.00 0.00 54.13 54.26 2k70 s LEU 20 Cb -0.10 2.05 -0.02 0.00 -0.00 0.00 0.00 46.19 48.12 2k70 s LEU 20 CO 0.02 -0.64 -0.06 -0.89 -0.00 0.00 0.00 176.35 174.78 2k70 s THR 21 N -3.15 0.40 -0.23 5.48 2.01 -0.11 -0.64 115.64 119.40 2k70 s THR 21 Ca 0.05 -0.78 -0.16 0.00 0.31 0.00 0.00 61.69 61.10 2k70 s THR 21 Cb -0.01 -0.45 0.07 0.00 0.01 0.00 0.00 72.50 72.12 2k70 s THR 21 CO -0.09 -0.26 0.58 -0.22 -0.69 0.00 0.00 174.62 173.94 2k70 s LEU 22 N -1.12 -0.46 0.28 4.42 1.98 0.26 -4.19 118.68 119.84 2k70 s LEU 22 Ca -0.08 1.24 -0.05 0.00 -2.89 0.00 0.00 54.13 52.35 2k70 s LEU 22 Cb -0.07 1.99 -0.05 0.00 0.66 0.00 0.00 46.19 48.72 2k70 s LEU 22 CO 0.00 -0.21 0.55 -1.61 -1.89 0.00 0.00 176.35 173.18 2k70 s GLU 23 N 1.04 3.64 -0.92 1.98 2.02 -1.26 0.15 118.70 125.34 2k70 s GLU 23 Ca -0.06 0.02 -0.07 0.00 0.02 0.00 0.00 54.97 54.89 2k70 s GLU 23 Cb -0.05 -2.65 0.23 0.00 0.10 0.00 0.00 34.13 31.75 2k70 s GLU 23 CO -0.10 0.23 0.85 1.21 0.02 0.00 0.00 175.26 177.47 2k70 s ASN 24 N -3.08 6.50 0.00 -0.19 2.47 0.04 -4.89 114.94 115.79 2k70 s ASN 24 Ca 0.44 -3.39 0.18 0.00 0.42 0.00 0.00 52.86 50.51 2k70 s ASN 24 Cb -0.11 -2.06 0.93 0.00 -1.45 0.00 0.00 41.25 38.56 2k70 s ASN 24 CO 0.29 -0.31 1.52 -0.81 -3.72 0.00 0.00 177.10 174.07 2k70 n PRO 25 N 2.90 0.31 -2.06 0.43 -0.04 -1.26 -1.10 135.00 134.18 2k70 n PRO 25 Ca 0.19 0.10 -0.27 0.00 -0.04 0.00 0.00 63.50 63.48 2k70 n PRO 25 Cb 0.40 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.47 1.64 0.00 0.55 0.00 -1.26 -4.78 107.32 101.00 2k70 s GLY 26 Ca 0.19 -0.78 0.22 0.00 0.00 0.00 0.00 44.72 44.35 2k70 s GLY 26 CO 0.26 -0.34 1.13 1.22 0.00 0.00 0.00 173.10 175.37 2k70 n ASP 27 N -3.10 2.44 -4.55 1.64 9.92 -1.26 -2.65 116.55 118.99 2k70 n ASP 27 Ca 0.08 -1.72 -0.24 0.00 -0.53 0.00 0.00 54.79 52.38 2k70 n ASP 27 Cb 0.61 0.22 -0.09 0.00 -0.64 0.00 0.00 41.12 41.22 2k70 n ASP 27 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2k70 s LEU 28 N -2.11 2.87 0.81 0.64 1.43 -1.26 -4.78 118.68 116.27 2k70 s LEU 28 Ca 0.22 -0.84 -0.11 0.00 -1.03 0.00 0.00 54.13 52.37 2k70 s LEU 28 Cb 0.18 -1.39 0.09 0.00 0.03 0.00 0.00 46.19 45.09 2k70 s LEU 28 CO 0.40 0.03 1.16 -2.16 0.23 0.00 0.00 176.35 176.01 2k70 s PRO 29 N -3.53 1.88 0.09 1.29 0.04 -1.26 -4.10 135.00 129.41 2k70 s PRO 29 Ca 0.30 -0.01 0.09 0.00 0.04 0.00 0.00 61.00 61.42 2k70 s PRO 29 Cb -0.06 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 2k70 s PRO 29 CO 0.17 -1.61 -0.20 -0.51 0.04 0.00 0.00 177.00 174.89 2k70 s LEU 30 N -5.55 2.57 -0.18 -3.56 1.43 0.03 -4.85 118.68 108.56 2k70 s LEU 30 Ca 0.63 -0.54 -0.04 0.00 -1.03 0.00 0.00 54.13 53.14 2k70 s LEU 30 Cb -0.10 -1.47 0.06 0.00 0.03 0.00 0.00 46.19 44.71 2k70 s LEU 30 CO 0.49 0.21 0.08 -0.60 0.23 0.00 0.00 176.35 176.75 2k70 s ARG 31 N -1.82 0.22 -0.46 1.70 3.52 -1.26 -0.39 118.95 120.46 2k70 s ARG 31 Ca 0.16 -0.19 -0.26 0.00 -0.13 0.00 0.00 55.73 55.31 2k70 s ARG 31 Cb -0.10 -1.89 0.03 0.00 -1.56 0.00 0.00 34.95 31.43 2k70 s ARG 31 CO 0.07 -0.68 0.93 -1.17 -0.81 0.00 0.00 175.30 173.65 2k70 s LEU 32 N 2.06 4.00 -0.01 -0.88 2.96 0.30 -1.20 118.68 125.92 2k70 s LEU 32 Ca 0.01 0.14 0.14 0.00 -0.22 0.00 0.00 54.13 54.21 2k70 s LEU 32 Cb -0.16 -3.21 -0.19 0.00 0.50 0.00 0.00 46.19 43.14 2k70 s LEU 32 CO -0.10 -1.05 0.46 1.33 -1.32 0.00 0.00 176.35 175.68 2k70 n VAL 33 N 6.41 0.00 -3.79 1.68 0.24 0.29 -0.69 118.33 122.48 2k70 n VAL 33 Ca 0.06 -0.25 -0.09 0.00 -2.04 0.00 0.00 64.34 62.02 2k70 n VAL 33 Cb 0.48 0.60 0.01 0.00 -1.47 0.00 0.00 33.84 33.47 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 1.50 1.32 3.12 7.63 0.00 -0.89 -4.78 105.19 113.09 2k70 n GLY 34 Ca 0.00 -1.32 -0.16 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.79 0.14 -3.87 4.61 0.00 -1.26 -0.84 120.51 118.50 2k70 n ALA 35 Ca -0.15 -1.68 -0.08 0.00 0.00 0.00 0.00 53.44 51.54 2k70 n ALA 35 Cb 0.54 1.36 -0.01 0.00 0.00 0.00 0.00 19.45 21.34 2k70 n ALA 35 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2k70 n ARG 36 N -0.57 0.81 -3.58 0.00 1.85 -1.06 -4.85 116.66 109.26 2k70 n ARG 36 Ca 0.04 -2.37 -0.08 0.00 -1.00 0.00 0.00 57.85 54.44 2k70 n ARG 36 Cb 0.56 2.52 -0.04 0.00 -1.05 0.00 0.00 32.46 34.45 2k70 n ARG 36 CO 0.00 0.00 0.00 -0.08 -0.01 0.00 0.00 177.63 177.54 2k70 s THR 37 N -2.54 0.00 -1.68 8.89 -1.32 -1.26 -1.31 115.64 116.42 2k70 s THR 37 Ca 0.22 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.98 2k70 s THR 37 Cb -0.02 -1.00 0.63 0.00 -1.51 0.00 0.00 72.50 70.60 2k70 s THR 37 CO 0.16 0.00 2.00 -0.81 -2.21 0.00 0.00 174.62 173.75 2k70 n PRO 38 N 0.42 0.62 -1.89 7.08 -0.04 -1.26 -4.02 135.00 135.91 2k70 n PRO 38 Ca -0.06 0.01 -0.22 0.00 -0.04 0.00 0.00 63.50 63.19 2k70 n PRO 38 Cb 0.59 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.58 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 -1.16 2.55 -3.75 0.52 0.24 -1.26 -4.66 118.33 110.81 2k70 n VAL 39 Ca 0.17 -4.09 -0.08 0.00 -2.04 0.00 0.00 64.34 58.29 2k70 n VAL 39 Cb 0.17 -1.07 -0.02 0.00 -1.47 0.00 0.00 33.84 31.44 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 -3.58 -1.25 -0.26 2.33 0.00 -1.26 -3.67 121.76 114.07 2k70 s ALA 40 Ca 0.51 -0.14 -0.15 0.00 0.00 0.00 0.00 51.96 52.18 2k70 s ALA 40 Cb 0.41 0.87 -0.12 0.00 0.00 0.00 0.00 23.12 24.28 2k70 s ALA 40 CO 0.03 -0.95 -0.28 -1.91 0.00 0.00 0.00 175.76 172.65 2k70 n GLU 41 N -0.43 0.58 -4.94 0.00 4.07 -0.26 -4.84 120.64 114.82 2k70 n GLU 41 Ca -0.07 0.30 -0.33 0.00 -0.06 0.00 0.00 57.16 57.00 2k70 n GLU 41 Cb 0.61 -1.52 -0.14 0.00 -0.06 0.00 0.00 31.44 30.33 2k70 n GLU 41 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 2k70 s ARG 42 N -2.52 2.50 0.08 5.31 3.52 -0.57 -5.04 118.95 122.24 2k70 s ARG 42 Ca -0.36 -0.73 0.05 0.00 -0.13 0.00 0.00 55.73 54.55 2k70 s ARG 42 Cb 0.13 -2.34 -0.04 0.00 -1.56 0.00 0.00 34.95 31.13 2k70 s ARG 42 CO 0.49 0.59 -0.01 0.54 -0.81 0.00 0.00 175.30 176.10 2k70 s VAL 43 N -0.64 3.96 0.10 7.11 0.11 -1.26 -0.79 120.40 129.00 2k70 s VAL 43 Ca 0.10 -0.98 0.07 0.00 -2.93 0.00 0.00 61.98 58.23 2k70 s VAL 43 Cb -0.11 -2.88 -0.03 0.00 -1.53 0.00 0.00 36.38 31.83 2k70 s VAL 43 CO 0.01 0.14 -0.17 -1.61 -3.33 0.00 0.00 175.10 170.14 2k70 s GLU 44 N -2.24 1.02 -0.13 1.54 2.02 -0.25 -4.94 118.70 115.71 2k70 s GLU 44 Ca 0.25 -1.14 -0.07 0.00 0.02 0.00 0.00 54.97 54.02 2k70 s GLU 44 Cb -0.12 -1.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.99 2k70 s GLU 44 CO 0.17 0.23 0.12 -0.48 0.02 0.00 0.00 175.26 175.33 2k70 s LEU 45 N -2.08 4.28 0.24 1.80 2.34 -1.26 -0.28 118.68 123.72 2k70 s LEU 45 Ca 0.05 0.40 0.09 0.00 0.06 0.00 0.00 54.13 54.74 2k70 s LEU 45 Cb -0.08 -2.05 -0.05 0.00 -0.56 0.00 0.00 46.19 43.45 2k70 s LEU 45 CO 0.04 0.37 -0.16 -1.00 -1.06 0.00 0.00 176.35 174.53 2k70 s HIS 46 N -0.79 1.96 0.56 3.48 3.76 0.20 -0.60 115.29 123.87 2k70 s HIS 46 Ca 0.14 -0.48 0.08 0.00 -0.15 0.00 0.00 55.06 54.65 2k70 s HIS 46 Cb -0.12 -0.89 0.07 0.00 1.11 0.00 0.00 32.58 32.75 2k70 s HIS 46 CO 0.03 0.51 0.62 -1.83 -0.85 0.00 0.00 174.74 173.22 2k70 s GLU 47 N -3.59 2.28 -0.11 1.40 4.04 -0.18 -1.07 118.70 121.47 2k70 s GLU 47 Ca 0.26 -1.81 -0.10 0.00 0.04 0.00 0.00 54.97 53.36 2k70 s GLU 47 Cb -0.02 -2.40 0.03 0.00 0.02 0.00 0.00 34.13 31.75 2k70 s GLU 47 CO 0.10 -0.75 0.30 0.99 -1.84 0.00 0.00 175.26 174.06 2k70 s THR 48 N -2.71 -0.00 0.35 1.83 2.01 -1.09 -3.80 115.64 112.21 2k70 s THR 48 Ca 0.49 0.01 -0.03 0.00 0.31 0.00 0.00 61.69 62.48 2k70 s THR 48 Cb -0.04 -0.43 0.00 0.00 0.01 0.00 0.00 72.50 72.05 2k70 s THR 48 CO 0.31 0.00 0.48 0.72 -0.69 0.00 0.00 174.62 175.45 2k70 s PHE 49 N 0.26 1.04 0.02 4.92 -0.71 -0.24 -4.61 117.98 118.66 2k70 s PHE 49 Ca -0.01 -1.28 0.03 0.00 -1.04 0.00 0.00 56.93 54.63 2k70 s PHE 49 Cb -0.03 -0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.69 2k70 s PHE 49 CO -0.00 -1.15 -0.04 0.00 -1.34 0.00 0.00 175.22 172.68 2k70 s MET 50 N -3.02 2.58 0.12 1.99 0.23 -1.26 -1.02 119.30 118.91 2k70 s MET 50 Ca 0.30 -0.73 0.07 0.00 -1.03 0.00 0.00 55.69 54.30 2k70 s MET 50 Cb -0.01 -2.53 -0.04 0.00 -1.53 0.00 0.00 34.83 30.72 2k70 s MET 50 CO 0.20 0.59 -0.17 1.03 -2.03 0.00 0.00 175.02 174.65 2k70 s ARG 51 N -1.62 1.08 0.09 3.16 0.52 0.10 -4.88 118.95 117.39 2k70 s ARG 51 Ca 0.19 -1.21 -0.14 0.00 -0.52 0.00 0.00 55.73 54.05 2k70 s ARG 51 Cb -0.11 -1.12 -0.06 0.00 0.52 0.00 0.00 34.95 34.17 2k70 s ARG 51 CO 0.10 0.24 0.48 -2.00 0.02 0.00 0.00 175.30 174.14 2k70 s GLU 52 N -2.35 3.94 -0.03 3.54 2.56 -1.26 -0.55 118.70 124.55 2k70 s GLU 52 Ca 0.08 0.43 -0.01 0.00 0.00 0.00 0.00 54.97 55.47 2k70 s GLU 52 Cb -0.07 -3.05 0.03 0.00 2.00 0.00 0.00 34.13 33.04 2k70 s GLU 52 CO 0.04 0.56 0.05 0.08 -0.56 0.00 0.00 175.26 175.43 2k70 s VAL 53 N -1.32 -0.07 -1.49 3.70 1.01 0.08 -4.94 120.40 117.36 2k70 s VAL 53 Ca 0.32 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.57 2k70 s VAL 53 Cb -0.16 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.12 2k70 s VAL 53 CO 0.18 0.11 0.00 1.21 0.00 0.00 0.00 175.10 176.60 2k70 n GLU 54 N 4.45 -1.19 -0.89 2.72 2.13 -1.26 -1.27 120.64 125.32 2k70 n GLU 54 Ca -0.22 0.89 0.00 0.00 0.66 0.00 0.00 57.16 58.49 2k70 n GLU 54 Cb 0.50 -5.17 0.00 0.00 0.27 0.00 0.00 31.44 27.04 2k70 n GLU 54 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k70 n GLY 55 N -1.03 0.59 3.07 8.31 0.00 -1.26 -5.03 105.19 109.84 2k70 n GLY 55 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.11 2.60 -0.32 1.61 1.02 -0.40 -5.11 119.74 119.04 2k70 s LYS 56 Ca 0.00 -0.73 -0.21 0.00 0.02 0.00 0.00 55.97 55.04 2k70 s LYS 56 Cb 0.00 -2.37 -0.00 0.00 -0.52 0.00 0.00 37.83 34.93 2k70 s LYS 56 CO 0.00 -0.25 0.69 -1.59 -0.92 0.00 0.00 175.35 173.28 2k70 s LYS 57 N 1.37 3.86 -0.12 1.68 0.00 -1.26 -0.75 119.74 124.53 2k70 s LYS 57 Ca 0.04 0.34 -0.11 0.00 0.00 0.00 0.00 55.97 56.24 2k70 s LYS 57 Cb -0.13 -3.75 0.03 0.00 0.00 0.00 0.00 37.83 33.98 2k70 s LYS 57 CO -0.11 -0.66 0.33 0.08 0.00 0.00 0.00 175.35 174.98 2k70 s VAL 58 N 2.78 -0.00 0.75 1.79 1.01 0.28 -5.00 120.40 122.01 2k70 s VAL 58 Ca 0.28 0.00 -0.08 0.00 0.00 0.00 0.00 61.98 62.18 2k70 s VAL 58 Cb -0.14 -0.46 0.08 0.00 0.00 0.00 0.00 36.38 35.85 2k70 s VAL 58 CO 0.13 0.00 1.07 -0.04 0.00 0.00 0.00 175.10 176.26 2k70 s MET 59 N 0.21 2.01 0.17 2.72 -1.94 -1.26 -0.72 119.30 120.50 2k70 s MET 59 Ca -0.00 -0.22 -0.10 0.00 -1.71 0.00 0.00 55.69 53.66 2k70 s MET 59 Cb -0.02 -2.10 -0.01 0.00 2.01 0.00 0.00 34.83 34.71 2k70 s MET 59 CO 0.00 -1.41 0.32 0.20 -0.01 0.00 0.00 175.02 174.12 2k70 s GLY 60 N -4.57 0.44 -0.10 -0.03 0.00 -0.19 -4.77 107.32 98.11 2k70 s GLY 60 Ca 0.62 -0.83 -0.10 0.00 0.00 0.00 0.00 44.72 44.40 2k70 s GLY 60 CO 0.46 -0.77 0.29 -0.29 0.00 0.00 0.00 173.10 172.79 2k70 s MET 61 N -3.97 0.38 0.09 2.90 1.75 -1.26 -1.08 119.30 118.11 2k70 s MET 61 Ca 0.17 0.31 -0.10 0.00 -1.25 0.00 0.00 55.69 54.82 2k70 s MET 61 Cb 0.03 0.18 0.01 0.00 2.84 0.00 0.00 34.83 37.88 2k70 s MET 61 CO 0.01 -0.06 0.23 1.03 -0.65 0.00 0.00 175.02 175.58 2k70 s ARG 62 N -0.05 0.87 0.58 4.11 0.52 -1.25 -5.02 118.95 118.71 2k70 s ARG 62 Ca -0.02 -0.89 -0.17 0.00 -0.52 0.00 0.00 55.73 54.13 2k70 s ARG 62 Cb -0.03 0.36 -0.04 0.00 0.52 0.00 0.00 34.95 35.76 2k70 s ARG 62 CO 0.01 -0.29 1.07 -1.25 0.02 0.00 0.00 175.30 174.86 2k70 s PRO 63 N -3.75 3.33 0.23 3.54 0.04 -1.26 -1.01 135.00 136.11 2k70 s PRO 63 Ca 0.04 1.34 0.09 0.00 0.04 0.00 0.00 61.00 62.51 2k70 s PRO 63 Cb 0.04 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 2k70 s PRO 63 CO -0.11 -0.82 -0.17 0.14 0.04 0.00 0.00 177.00 176.08 2k70 s VAL 64 N -2.22 2.03 -0.11 -0.36 -7.23 0.24 -4.77 120.40 107.97 2k70 s VAL 64 Ca 0.66 -2.25 0.14 0.00 -1.81 0.00 0.00 61.98 58.72 2k70 s VAL 64 Cb -0.18 -2.12 -0.01 0.00 0.56 0.00 0.00 36.38 34.63 2k70 s VAL 64 CO 0.33 -0.49 1.32 1.55 -0.31 0.00 0.00 175.10 177.50 2k70 h PRO 65 N 2.53 0.00 -1.04 4.82 0.13 -1.96 -3.42 132.00 133.05 2k70 h PRO 65 Ca -0.39 0.00 0.38 0.00 -0.87 0.00 0.00 66.00 65.11 2k70 h PRO 65 Cb 1.23 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.21 2k70 h PRO 65 CO 0.60 0.54 0.99 -0.59 -0.23 0.00 0.00 178.00 179.31 2k70 s PHE 66 N -2.92 -0.01 0.14 1.56 -0.12 -1.26 -4.76 117.98 110.61 2k70 s PHE 66 Ca 0.02 -0.00 0.07 0.00 -0.05 0.00 0.00 56.93 56.97 2k70 s PHE 66 Cb 0.08 0.50 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 2k70 s PHE 66 CO 0.77 -0.02 -0.06 -0.51 -0.05 0.00 0.00 175.22 175.35 2k70 s LEU 67 N -2.72 3.16 -0.02 -1.99 1.43 0.14 -4.98 118.68 113.69 2k70 s LEU 67 Ca 0.14 -0.40 0.08 0.00 -1.03 0.00 0.00 54.13 52.91 2k70 s LEU 67 Cb 0.05 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 2k70 s LEU 67 CO -0.05 0.14 -0.25 -0.70 0.23 0.00 0.00 176.35 175.71 2k70 s GLU 68 N -2.55 2.12 -0.09 1.70 2.56 -1.26 -0.53 118.70 120.64 2k70 s GLU 68 Ca 0.24 -0.90 -0.06 0.00 0.00 0.00 0.00 54.97 54.25 2k70 s GLU 68 Cb -0.10 -2.01 0.03 0.00 2.00 0.00 0.00 34.13 34.05 2k70 s GLU 68 CO 0.16 0.52 0.22 0.08 -0.56 0.00 0.00 175.26 175.68 2k70 s VAL 69 N -0.53 -0.02 0.90 3.70 1.01 0.47 -5.00 120.40 120.94 2k70 s VAL 69 Ca 0.08 0.07 -0.12 0.00 0.00 0.00 0.00 61.98 62.00 2k70 s VAL 69 Cb -0.10 -0.33 0.13 0.00 0.00 0.00 0.00 36.38 36.08 2k70 s VAL 69 CO -0.00 0.03 1.12 -2.16 0.00 0.00 0.00 175.10 174.09 2k70 s PRO 70 N 0.61 1.23 0.40 2.72 0.04 -1.26 -0.79 135.00 137.95 2k70 s PRO 70 Ca -0.04 0.39 -0.27 0.00 0.04 0.00 0.00 61.00 61.12 2k70 s PRO 70 Cb -0.05 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 2k70 s PRO 70 CO -0.03 -2.16 1.47 -0.35 0.04 0.00 0.00 177.00 175.97 2k70 n PRO 71 N -3.76 2.54 -0.72 0.56 -0.04 -1.26 -2.34 135.00 129.98 2k70 n PRO 71 Ca 0.06 0.89 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 2k70 n PRO 71 Cb 0.58 -2.66 0.00 0.00 -0.04 0.00 0.00 33.50 31.39 2k70 n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k70 n LYS 72 N 0.23 -0.25 -1.25 0.54 4.76 -0.25 -4.99 118.16 116.94 2k70 n LYS 72 Ca 0.03 0.06 -0.16 0.00 -2.87 0.00 0.00 58.31 55.37 2k70 n LYS 72 Cb 0.40 -3.96 0.11 0.00 -1.84 0.00 0.00 35.03 29.73 2k70 n LYS 72 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k70 n GLY 73 N -1.68 -0.88 3.18 0.72 0.00 -0.99 -4.86 105.19 100.69 2k70 n GLY 73 Ca 0.00 -1.76 -0.12 0.00 0.00 0.00 0.00 46.02 44.14 2k70 n GLY 73 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k70 s ARG 74 N -4.52 0.60 -0.47 1.61 1.70 -1.26 -0.78 118.95 115.83 2k70 s ARG 74 Ca 0.42 -0.32 -0.17 0.00 -0.47 0.00 0.00 55.73 55.20 2k70 s ARG 74 Cb -0.01 0.26 0.06 0.00 -0.57 0.00 0.00 34.95 34.69 2k70 s ARG 74 CO 0.29 -0.16 0.45 0.08 -1.08 0.00 0.00 175.30 174.88 2k70 s VAL 75 N -1.48 5.13 -0.23 4.99 1.01 0.12 -4.96 120.40 124.99 2k70 s VAL 75 Ca -0.13 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.04 2k70 s VAL 75 Cb -0.06 -4.15 0.06 0.00 0.00 0.00 0.00 36.38 32.24 2k70 s VAL 75 CO 0.02 -0.60 -0.05 -1.83 0.00 0.00 0.00 175.10 172.64 2k70 s GLU 76 N 1.94 1.59 -1.28 2.72 -1.05 -1.26 -0.57 118.70 120.78 2k70 s GLU 76 Ca 0.08 -0.94 -0.16 0.00 -0.15 0.00 0.00 54.97 53.80 2k70 s GLU 76 Cb -0.22 -2.54 0.10 0.00 -0.44 0.00 0.00 34.13 31.03 2k70 s GLU 76 CO 0.09 -0.59 1.69 1.28 0.95 0.00 0.00 175.26 178.68 2k70 n LEU 77 N 4.70 5.27 -4.76 1.83 4.32 0.19 -4.86 117.00 123.69 2k70 n LEU 77 Ca -0.12 -4.14 -0.40 0.00 -0.02 0.00 0.00 56.01 51.33 2k70 n LEU 77 Cb 0.44 -1.69 -0.04 0.00 -1.62 0.00 0.00 43.42 40.52 2k70 n LEU 77 CO 0.18 0.47 0.82 -1.59 -1.22 0.00 0.00 177.39 176.05 2k70 s LYS 78 N 3.12 4.53 0.44 3.23 -2.85 -1.12 -2.79 119.74 124.30 2k70 s LYS 78 Ca 0.49 1.85 -0.26 0.00 -1.00 0.00 0.00 55.97 57.06 2k70 s LYS 78 Cb 0.03 -3.09 -0.09 0.00 -2.06 0.00 0.00 37.83 32.62 2k70 s LYS 78 CO 0.04 0.09 1.42 -1.25 0.10 0.00 0.00 175.35 175.75 2k70 s PRO 79 N -1.63 3.75 0.00 1.78 0.04 -1.26 -2.36 135.00 135.32 2k70 s PRO 79 Ca 0.47 2.41 0.00 0.00 0.04 0.00 0.00 61.00 63.92 2k70 s PRO 79 Cb -0.32 -2.69 0.00 0.00 0.04 0.00 0.00 34.50 31.52 2k70 s PRO 79 CO 0.42 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 177.11 2k70 n GLY 80 N 0.58 2.42 0.00 0.56 0.00 -1.26 -4.89 105.19 102.61 2k70 n GLY 80 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.00 2.14 3.74 -0.02 0.00 -1.00 -4.63 105.19 103.43 2k70 n GLY 81 Ca 0.00 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 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 1.95 3.62 -0.02 1.61 2.02 -1.19 -2.68 117.35 122.66 2k70 s TYR 82 Ca 0.00 1.64 -0.29 0.00 -0.37 0.00 0.00 57.07 58.05 2k70 s TYR 82 Cb 0.00 -3.26 0.08 0.00 -0.40 0.00 0.00 41.96 38.38 2k70 s TYR 82 CO 0.00 -0.52 0.71 -3.38 -1.57 0.00 0.00 175.55 170.79 2k70 s HIS 83 N -0.52 -0.59 0.18 2.71 -3.43 -0.23 -2.78 115.29 110.63 2k70 s HIS 83 Ca 0.48 0.88 -0.25 0.00 -0.80 0.00 0.00 55.06 55.36 2k70 s HIS 83 Cb -0.30 0.45 -0.08 0.00 -1.43 0.00 0.00 32.58 31.22 2k70 s HIS 83 CO 0.36 -0.62 0.78 -0.06 -2.00 0.00 0.00 174.74 173.20 2k70 s PHE 84 N -1.76 3.89 -0.19 0.38 0.08 -0.75 -0.62 117.98 119.01 2k70 s PHE 84 Ca -0.07 1.63 -0.09 0.00 0.12 0.00 0.00 56.93 58.52 2k70 s PHE 84 Cb -0.00 -2.77 -0.05 0.00 -0.57 0.00 0.00 43.02 39.63 2k70 s PHE 84 CO 0.04 0.50 0.12 1.41 -0.10 0.00 0.00 175.22 177.19 2k70 s MET 85 N -1.22 4.06 -0.18 0.44 1.75 0.62 -0.42 119.30 124.36 2k70 s MET 85 Ca 0.37 -0.23 -0.04 0.00 -1.25 0.00 0.00 55.69 54.54 2k70 s MET 85 Cb -0.23 -3.36 -0.02 0.00 2.84 0.00 0.00 34.83 34.06 2k70 s MET 85 CO 0.26 0.36 -0.03 -0.51 -0.65 0.00 0.00 175.02 174.45 2k70 s LEU 86 N 0.18 3.18 -0.10 4.11 1.02 -0.23 -1.09 118.68 125.74 2k70 s LEU 86 Ca 0.08 -0.20 0.03 0.00 0.02 0.00 0.00 54.13 54.06 2k70 s LEU 86 Cb -0.11 -1.78 0.01 0.00 0.02 0.00 0.00 46.19 44.32 2k70 s LEU 86 CO -0.01 0.10 -0.19 -0.76 0.02 0.00 0.00 176.35 175.51 2k70 s LEU 87 N 0.75 1.93 -0.06 1.79 2.01 0.03 -1.19 118.68 123.95 2k70 s LEU 87 Ca -0.01 -0.49 -0.00 0.00 0.01 0.00 0.00 54.13 53.64 2k70 s LEU 87 Cb -0.14 -1.23 -0.00 0.00 0.01 0.00 0.00 46.19 44.82 2k70 s LEU 87 CO 0.02 0.09 0.05 0.61 1.01 0.00 0.00 176.35 178.13 2k70 n GLY 88 N 3.83 0.48 3.32 -3.19 0.00 -0.01 -1.11 105.19 108.51 2k70 n GLY 88 Ca -0.20 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 2k70 n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k70 n LEU 89 N -1.25 -1.59 -0.65 0.99 4.77 -1.09 -1.79 117.00 116.38 2k70 n LEU 89 Ca -0.01 0.45 0.07 0.00 -0.03 0.00 0.00 56.01 56.49 2k70 n LEU 89 Cb 0.51 -1.06 0.11 0.00 -2.33 0.00 0.00 43.42 40.65 2k70 n LEU 89 CO 0.03 -4.13 0.55 0.29 -1.33 0.00 0.00 177.39 172.80 2k70 n LYS 90 N 0.11 1.75 -3.56 3.23 4.76 -1.24 -4.82 118.16 118.39 2k70 n LYS 90 Ca 0.06 -1.69 -0.10 0.00 -2.87 0.00 0.00 58.31 53.71 2k70 n LYS 90 Cb 0.52 -1.29 -0.02 0.00 -1.84 0.00 0.00 35.03 32.40 2k70 n LYS 90 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2k70 s ARG 91 N -1.08 1.34 -0.17 1.97 1.70 -1.26 -5.03 118.95 116.43 2k70 s ARG 91 Ca 0.21 -0.59 -0.29 0.00 -0.47 0.00 0.00 55.73 54.59 2k70 s ARG 91 Cb 0.13 0.56 -0.02 0.00 -0.57 0.00 0.00 34.95 35.04 2k70 s ARG 91 CO 0.18 -0.60 1.44 -1.25 -1.08 0.00 0.00 175.30 173.99 2k70 s PRO 92 N -3.69 4.09 -1.16 3.89 0.04 -1.26 -4.92 135.00 131.99 2k70 s PRO 92 Ca 0.05 1.74 -0.09 0.00 0.04 0.00 0.00 61.00 62.74 2k70 s PRO 92 Cb -0.02 -3.89 -0.14 0.00 0.04 0.00 0.00 34.50 30.49 2k70 s PRO 92 CO -0.07 -0.91 3.15 1.28 0.04 0.00 0.00 177.00 180.49 2k70 n LEU 93 N 7.24 7.77 -4.50 -3.56 4.32 -0.23 -4.90 117.00 123.15 2k70 n LEU 93 Ca 0.16 -4.04 -0.29 0.00 -0.02 0.00 0.00 56.01 51.82 2k70 n LEU 93 Cb 0.45 -1.52 0.24 0.00 -1.62 0.00 0.00 43.42 40.96 2k70 n LEU 93 CO 0.60 1.97 0.48 2.29 -1.22 0.00 0.00 177.39 181.51 2k70 n LYS 94 N 3.25 -2.04 -1.66 3.23 2.85 -1.26 -0.26 118.16 122.27 2k70 n LYS 94 Ca 0.69 -0.56 -0.47 0.00 -1.05 0.00 0.00 58.31 56.92 2k70 n LYS 94 Cb 0.43 -2.18 -0.04 0.00 -0.65 0.00 0.00 35.03 32.58 2k70 n LYS 94 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k70 n ALA 95 N -4.81 1.01 -2.30 0.58 0.00 -1.26 -2.85 120.51 110.87 2k70 n ALA 95 Ca 0.05 0.44 -0.02 0.00 0.00 0.00 0.00 53.44 53.91 2k70 n ALA 95 Cb 0.54 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.66 2k70 n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k70 n GLY 96 N 3.40 0.53 2.74 0.00 0.00 -0.27 -5.03 105.19 106.56 2k70 n GLY 96 Ca 0.18 -0.71 -0.17 0.00 0.00 0.00 0.00 46.02 45.32 2k70 n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k70 n GLU 97 N -1.07 -0.03 -3.90 1.61 -0.58 -1.13 -4.95 120.64 110.59 2k70 n GLU 97 Ca -0.01 -1.86 -0.10 0.00 -0.42 0.00 0.00 57.16 54.77 2k70 n GLU 97 Cb 0.51 -0.53 -0.09 0.00 -0.57 0.00 0.00 31.44 30.76 2k70 n GLU 97 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 2k70 s GLU 98 N -4.40 0.60 0.07 3.49 -1.05 -1.26 -0.29 118.70 115.85 2k70 s GLU 98 Ca 0.48 -0.66 -0.12 0.00 -0.15 0.00 0.00 54.97 54.52 2k70 s GLU 98 Cb -0.02 0.24 0.01 0.00 -0.44 0.00 0.00 34.13 33.92 2k70 s GLU 98 CO 0.32 -0.15 0.26 0.08 0.95 0.00 0.00 175.26 176.72 2k70 s VAL 99 N -2.37 0.11 0.17 1.83 1.01 0.18 -4.90 120.40 116.42 2k70 s VAL 99 Ca -0.07 -0.88 0.11 0.00 0.00 0.00 0.00 61.98 61.14 2k70 s VAL 99 Cb -0.02 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 2k70 s VAL 99 CO -0.03 -0.48 -0.24 -1.83 0.00 0.00 0.00 175.10 172.51 2k70 s GLU 100 N -3.26 1.45 -0.03 2.72 -1.05 -1.26 -0.87 118.70 116.40 2k70 s GLU 100 Ca 0.00 -1.45 0.05 0.00 -0.15 0.00 0.00 54.97 53.42 2k70 s GLU 100 Cb 0.02 -1.80 -0.01 0.00 -0.44 0.00 0.00 34.13 31.90 2k70 s GLU 100 CO -0.08 0.40 -0.17 -0.51 0.95 0.00 0.00 175.26 175.85 2k70 s LEU 101 N -2.45 1.97 0.21 1.83 1.02 -0.20 -4.15 118.68 116.91 2k70 s LEU 101 Ca 0.18 -0.34 -0.12 0.00 0.02 0.00 0.00 54.13 53.87 2k70 s LEU 101 Cb -0.08 -0.94 -0.07 0.00 0.02 0.00 0.00 46.19 45.11 2k70 s LEU 101 CO 0.08 0.18 0.57 -1.81 0.02 0.00 0.00 176.35 175.39 2k70 s ASP 102 N -0.18 6.71 -0.26 2.29 1.01 -0.42 -0.33 116.67 125.49 2k70 s ASP 102 Ca 0.01 1.01 -0.04 0.00 0.71 0.00 0.00 52.55 54.25 2k70 s ASP 102 Cb -0.09 -2.26 0.02 0.00 1.01 0.00 0.00 42.92 41.59 2k70 s ASP 102 CO 0.01 -0.03 -0.01 -0.76 0.21 0.00 0.00 175.17 174.59 2k70 s LEU 103 N -2.55 3.36 -0.41 1.23 1.02 0.45 -2.57 118.68 119.21 2k70 s LEU 103 Ca 0.45 -0.75 -0.19 0.00 0.02 0.00 0.00 54.13 53.66 2k70 s LEU 103 Cb -0.12 -1.75 0.02 0.00 0.02 0.00 0.00 46.19 44.36 2k70 s LEU 103 CO 0.20 -0.13 0.54 -0.76 0.02 0.00 0.00 176.35 176.22 2k70 s LEU 104 N 1.40 4.58 -0.19 1.79 1.43 -0.02 -2.95 118.68 124.71 2k70 s LEU 104 Ca 0.02 -0.37 -0.04 0.00 -1.03 0.00 0.00 54.13 52.71 2k70 s LEU 104 Cb -0.16 -2.58 -0.02 0.00 0.03 0.00 0.00 46.19 43.46 2k70 s LEU 104 CO -0.02 -0.63 -0.03 -0.36 0.23 0.00 0.00 176.35 175.54 2k70 s PHE 105 N 2.48 2.99 0.12 0.29 0.08 -0.71 -0.54 117.98 122.68 2k70 s PHE 105 Ca 0.18 -0.60 0.33 0.00 0.12 0.00 0.00 56.93 56.96 2k70 s PHE 105 Cb -0.15 -2.05 1.62 0.00 -0.57 0.00 0.00 43.02 41.87 2k70 s PHE 105 CO 0.16 -0.30 1.99 0.00 -0.10 0.00 0.00 175.22 176.96 2k70 h ALA 106 N 7.49 1.00 0.00 5.36 0.00 -1.41 -2.86 119.26 128.84 2k70 h ALA 106 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2k70 h ALA 106 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2k70 h ALA 106 CO 0.60 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.26 2k70 n GLY 107 N -0.71 2.01 2.22 0.00 0.00 -1.26 -4.74 105.19 102.72 2k70 n GLY 107 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2k70 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k70 n GLY 108 N 1.41 0.18 3.01 -0.02 0.00 -1.20 -5.00 105.19 103.56 2k70 n GLY 108 Ca 0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 2k70 n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k70 s LYS 109 N -4.21 0.40 -0.01 1.61 1.02 -1.09 -5.09 119.74 112.37 2k70 s LYS 109 Ca 0.00 -0.77 -0.02 0.00 0.02 0.00 0.00 55.97 55.20 2k70 s LYS 109 Cb 0.00 0.14 -0.00 0.00 -0.52 0.00 0.00 37.83 37.45 2k70 s LYS 109 CO 0.00 -0.07 0.05 0.08 -0.92 0.00 0.00 175.35 174.49 2k70 s VAL 110 N -2.12 0.04 0.17 3.17 1.01 -1.26 -1.74 120.40 119.66 2k70 s VAL 110 Ca -0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 2k70 s VAL 110 Cb -0.05 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.10 2k70 s VAL 110 CO -0.03 -0.20 0.10 -0.76 0.00 0.00 0.00 175.10 174.21 2k70 s LEU 111 N -0.60 1.42 0.01 3.92 1.43 -1.15 -5.02 118.68 118.69 2k70 s LEU 111 Ca -0.07 -1.31 -0.11 0.00 -1.03 0.00 0.00 54.13 51.61 2k70 s LEU 111 Cb -0.04 0.34 0.01 0.00 0.03 0.00 0.00 46.19 46.53 2k70 s LEU 111 CO 0.00 -0.79 0.23 -1.59 0.23 0.00 0.00 176.35 174.43 2k70 s LYS 112 N -4.11 0.64 -0.00 1.70 -2.85 -1.26 -0.41 119.74 113.44 2k70 s LYS 112 Ca 0.33 -0.41 0.04 0.00 -1.00 0.00 0.00 55.97 54.93 2k70 s LYS 112 Cb 0.07 0.27 -0.01 0.00 -2.06 0.00 0.00 37.83 36.10 2k70 s LYS 112 CO 0.08 -0.18 -0.13 0.14 0.10 0.00 0.00 175.35 175.36 2k70 s VAL 113 N -1.83 1.05 0.14 1.79 -7.23 0.55 -4.98 120.40 109.89 2k70 s VAL 113 Ca -0.11 -0.65 -0.12 0.00 -1.81 0.00 0.00 61.98 59.30 2k70 s VAL 113 Cb -0.04 -0.89 -0.07 0.00 0.56 0.00 0.00 36.38 35.94 2k70 s VAL 113 CO 0.00 0.24 0.50 0.54 -0.31 0.00 0.00 175.10 176.07 2k70 s VAL 114 N -0.42 4.96 -0.18 1.32 0.11 -1.26 -1.03 120.40 123.90 2k70 s VAL 114 Ca 0.04 0.63 -0.23 0.00 -2.93 0.00 0.00 61.98 59.49 2k70 s VAL 114 Cb -0.06 -3.68 0.06 0.00 -1.53 0.00 0.00 36.38 31.17 2k70 s VAL 114 CO -0.00 0.20 0.61 -1.48 -3.33 0.00 0.00 175.10 171.11 2k70 s LEU 115 N -2.09 -0.35 0.80 2.54 2.34 -0.05 -4.75 118.68 117.10 2k70 s LEU 115 Ca 0.38 1.06 -0.12 0.00 0.06 0.00 0.00 54.13 55.52 2k70 s LEU 115 Cb -0.14 2.16 0.07 0.00 -0.56 0.00 0.00 46.19 47.72 2k70 s LEU 115 CO 0.19 -0.31 1.11 -2.16 -1.06 0.00 0.00 176.35 174.12 2k70 s PRO 116 N -0.10 2.10 -0.29 1.48 0.04 -1.26 -0.65 135.00 136.32 2k70 s PRO 116 Ca -0.03 0.49 -0.07 0.00 0.04 0.00 0.00 61.00 61.43 2k70 s PRO 116 Cb -0.04 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2k70 s PRO 116 CO 0.03 -1.57 0.08 0.08 0.04 0.00 0.00 177.00 175.66 2k70 s VAL 117 N -3.26 4.07 0.13 -0.36 1.01 0.60 -0.64 120.40 121.95 2k70 s VAL 117 Ca 0.61 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 62.07 2k70 s VAL 117 Cb -0.13 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 2k70 s VAL 117 CO 0.53 0.12 -0.17 -1.61 0.00 0.00 0.00 175.10 173.97 2k70 s GLU 118 N 1.53 1.12 -1.23 2.72 2.02 -0.15 -1.11 118.70 123.59 2k70 s GLU 118 Ca 0.03 -1.26 -0.05 0.00 0.02 0.00 0.00 54.97 53.70 2k70 s GLU 118 Cb -0.17 -1.14 0.10 0.00 0.10 0.00 0.00 34.13 33.02 2k70 s GLU 118 CO 0.03 0.24 2.48 0.00 0.02 0.00 0.00 175.26 178.02 2k70 n ALA 119 N 0.60 6.82 0.55 5.21 0.00 -1.26 -3.67 120.51 128.76 2k70 n ALA 119 Ca -0.16 -3.91 0.04 0.00 0.00 0.00 0.00 53.44 49.41 2k70 n ALA 119 Cb 0.56 -2.73 0.26 0.00 0.00 0.00 0.00 19.45 17.54 2k70 n ALA 119 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37