#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kc0 n GLY 15 N 0.00 -0.09 0.26 0.00 0.00 -1.26 -3.10 105.19 101.00 2kc0 n GLY 15 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2kc0 n GLY 15 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2kc0 h LEU 16 N 0.18 0.89 -1.44 0.99 3.38 -1.94 -2.21 115.31 115.15 2kc0 h LEU 16 Ca 0.00 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.58 2kc0 h LEU 16 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2kc0 h LEU 16 CO 0.00 1.04 -0.05 0.00 0.09 0.00 0.00 178.44 179.52 2kc0 h ALA 17 N 0.89 1.55 0.56 1.53 0.00 -1.75 -1.19 119.26 120.85 2kc0 h ALA 17 Ca 0.12 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2kc0 h ALA 17 Cb 0.64 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.33 2kc0 h ALA 17 CO 0.04 0.33 -0.27 0.22 0.00 0.00 0.00 179.25 179.57 2kc0 h ASP 18 N 0.29 -0.64 1.60 0.00 3.58 -1.75 -2.68 116.42 116.82 2kc0 h ASP 18 Ca 0.06 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2kc0 h ASP 18 Cb 0.28 0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.50 2kc0 h ASP 18 CO 0.01 -0.31 0.00 0.00 -2.88 0.00 0.00 179.24 176.06 2kc0 h ALA 19 N -0.68 1.00 0.00 -0.78 0.00 -1.29 -1.63 119.26 115.88 2kc0 h ALA 19 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2kc0 h ALA 19 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2kc0 h ALA 19 CO 0.13 0.00 -0.80 1.28 0.00 0.00 0.00 179.25 179.86 2kc0 n LEU 20 N -3.02 0.68 -0.12 0.00 7.99 -0.46 -4.50 117.00 117.56 2kc0 n LEU 20 Ca 0.03 -0.15 -0.23 0.00 -0.01 0.00 0.00 56.01 55.64 2kc0 n LEU 20 Cb 0.44 -0.13 -0.10 0.00 -0.11 0.00 0.00 43.42 43.52 2kc0 n LEU 20 CO 0.31 0.14 -1.33 0.35 -1.51 0.00 0.00 177.39 175.35 2kc0 n THR 21 N -1.63 1.37 -3.53 -5.08 -2.24 -1.01 -4.53 114.28 97.62 2kc0 n THR 21 Ca 0.04 -0.40 -0.33 0.00 -2.27 0.00 0.00 64.05 61.08 2kc0 n THR 21 Cb 0.36 -1.68 -0.05 0.00 -2.10 0.00 0.00 70.33 66.86 2kc0 n THR 21 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2kc0 s ALA 22 N -2.46 3.68 0.67 6.98 0.00 -0.62 -5.09 121.76 124.93 2kc0 s ALA 22 Ca -0.34 -0.36 -0.15 0.00 0.00 0.00 0.00 51.96 51.11 2kc0 s ALA 22 Cb 0.12 -2.31 0.01 0.00 0.00 0.00 0.00 23.12 20.93 2kc0 s ALA 22 CO 0.47 0.56 1.12 -1.25 0.00 0.00 0.00 175.76 176.66 2kc0 s PRO 23 N -2.28 2.71 0.00 0.00 0.04 -1.26 -4.67 135.00 129.54 2kc0 s PRO 23 Ca 0.39 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2kc0 s PRO 23 Cb -0.13 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2kc0 s PRO 23 CO 0.20 -1.33 0.00 -0.11 0.04 0.00 0.00 177.00 175.81 2kc0 n LEU 24 N -2.51 0.00 -4.84 -3.56 -0.00 -1.26 -5.08 117.00 99.75 2kc0 n LEU 24 Ca 0.11 0.00 -0.31 0.00 -0.00 0.00 0.00 56.01 55.81 2kc0 n LEU 24 Cb 0.52 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 43.98 2kc0 n LEU 24 CO 0.48 -0.13 0.72 -0.62 -0.00 0.00 0.00 177.39 177.84 2kc0 s ASP 25 N -0.58 5.55 -0.03 1.96 -1.08 -1.26 -5.06 116.67 116.16 2kc0 s ASP 25 Ca 0.00 1.43 -0.02 0.00 -0.52 0.00 0.00 52.55 53.45 2kc0 s ASP 25 Cb 0.00 -2.34 -0.01 0.00 -1.46 0.00 0.00 42.92 39.11 2kc0 s ASP 25 CO 0.00 -1.31 0.15 0.45 0.52 0.00 0.00 175.17 174.98 2kc0 h HIS 26 N -0.63 -0.06 0.00 -5.34 3.86 -2.01 -3.46 115.15 107.52 2kc0 h HIS 26 Ca -0.44 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 2kc0 h HIS 26 Cb 1.22 0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.71 2kc0 h HIS 26 CO 0.59 -0.04 0.00 0.36 0.86 0.00 0.00 177.93 179.71 2kc0 n LYS 27 N -3.04 0.00 0.00 2.45 -0.00 -1.26 -5.02 118.16 111.29 2kc0 n LYS 27 Ca -0.01 -0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.11 2kc0 n LYS 27 Cb 0.02 -0.40 0.00 0.00 -0.00 0.00 0.00 35.03 34.66 2kc0 n LYS 27 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2kc0 n ASP 28 N 0.00 0.00 0.00 -5.58 9.92 -1.26 -3.36 116.55 116.27 2kc0 n ASP 28 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2kc0 n ASP 28 Cb 0.37 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.85 2kc0 n ASP 28 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 2kc0 n LYS 29 N 0.00 0.00 0.00 -1.24 2.85 -1.26 -5.15 118.16 113.36 2kc0 n LYS 29 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2kc0 n LYS 29 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2kc0 n LYS 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2kc0 n GLY 30 N -0.06 3.98 3.67 2.58 0.00 -1.21 -5.13 105.19 109.01 2kc0 n GLY 30 Ca 0.00 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 2kc0 n GLY 30 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kc0 s LEU 31 N 0.00 4.42 0.00 0.99 0.20 -1.26 -4.83 118.68 118.20 2kc0 s LEU 31 Ca 0.00 2.65 0.00 0.00 0.69 0.00 0.00 54.13 57.47 2kc0 s LEU 31 Cb 0.00 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.22 2kc0 s LEU 31 CO 0.00 -1.03 0.27 0.00 -0.29 0.00 0.00 176.35 175.30 2kc0 n GLN 32 N 7.15 0.00 -3.93 1.98 -0.00 -1.26 -4.68 117.38 116.65 2kc0 n GLN 32 Ca 0.19 -0.27 -0.09 0.00 -0.00 0.00 0.00 57.00 56.82 2kc0 n GLN 32 Cb 0.41 -0.40 -0.06 0.00 -0.00 0.00 0.00 30.24 30.19 2kc0 n GLN 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2kc0 s SER 33 N 0.00 -0.07 -0.04 2.61 0.15 -1.26 -0.80 113.70 114.29 2kc0 s SER 33 Ca 0.00 -0.81 0.01 0.00 0.70 0.00 0.00 55.95 55.85 2kc0 s SER 33 Cb 0.00 0.52 0.02 0.00 -1.71 0.00 0.00 66.02 64.85 2kc0 s SER 33 CO 0.00 -1.02 -0.05 -0.22 1.20 0.00 0.00 173.24 173.15 2kc0 s LEU 34 N -2.97 1.48 -0.09 3.45 0.20 -1.04 -4.93 118.68 114.78 2kc0 s LEU 34 Ca 0.18 -0.13 -0.05 0.00 0.69 0.00 0.00 54.13 54.82 2kc0 s LEU 34 Cb 0.01 -0.43 -0.04 0.00 -0.43 0.00 0.00 46.19 45.30 2kc0 s LEU 34 CO 0.03 -0.02 0.11 -0.89 -0.29 0.00 0.00 176.35 175.28 2kc0 s THR 35 N 0.67 5.15 -0.38 3.68 2.01 -1.26 -0.34 115.64 125.18 2kc0 s THR 35 Ca -0.09 0.02 0.06 0.00 0.31 0.00 0.00 61.69 61.99 2kc0 s THR 35 Cb -0.12 -3.25 0.56 0.00 0.01 0.00 0.00 72.50 69.70 2kc0 s THR 35 CO 0.00 0.57 1.59 0.18 -0.69 0.00 0.00 174.62 176.27 2kc0 n LEU 36 N 1.87 5.32 0.33 4.42 4.32 -0.24 -4.74 117.00 128.28 2kc0 n LEU 36 Ca -0.18 -2.77 0.22 0.00 -0.02 0.00 0.00 56.01 53.25 2kc0 n LEU 36 Cb 0.54 -0.71 1.14 0.00 -1.62 0.00 0.00 43.42 42.77 2kc0 n LEU 36 CO 0.32 0.75 1.16 -0.78 -1.22 0.00 0.00 177.39 177.62 2kc0 h ASP 37 N 1.73 0.00 0.00 -1.43 1.82 -1.85 -0.75 116.42 115.95 2kc0 h ASP 37 Ca 0.28 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.89 2kc0 h ASP 37 Cb 2.09 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 42.09 2kc0 h ASP 37 CO 0.64 0.00 -1.56 0.00 -1.61 0.00 0.00 179.24 176.72 2kc0 n GLN 38 N -3.16 0.62 0.10 0.28 0.00 -1.26 -4.61 117.38 109.35 2kc0 n GLN 38 Ca -0.03 -0.09 -0.12 0.00 0.00 0.00 0.00 57.00 56.76 2kc0 n GLN 38 Cb 0.10 -1.27 -0.06 0.00 0.00 0.00 0.00 30.24 29.00 2kc0 n GLN 38 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 2kc0 h SER 39 N 0.00 -0.32 -4.20 2.61 0.87 -1.53 -3.46 113.55 107.51 2kc0 h SER 39 Ca -0.04 0.04 -0.57 0.00 -1.23 0.00 0.00 61.79 59.98 2kc0 h SER 39 Cb 0.69 0.12 -0.23 0.00 -0.44 0.00 0.00 62.40 62.54 2kc0 h SER 39 CO 0.00 -0.18 -0.83 0.54 -0.53 0.00 0.00 176.83 175.83 2kc0 s VAL 40 N -6.15 1.72 0.78 2.23 0.11 -0.46 -5.14 120.40 113.50 2kc0 s VAL 40 Ca -0.14 -1.43 -0.12 0.00 -2.93 0.00 0.00 61.98 57.36 2kc0 s VAL 40 Cb 0.07 -1.54 0.06 0.00 -1.53 0.00 0.00 36.38 33.43 2kc0 s VAL 40 CO 0.66 0.04 1.13 -0.13 -3.33 0.00 0.00 175.10 173.47 2kc0 s ARG 41 N -1.65 2.27 0.00 1.54 1.81 -1.26 -4.72 118.95 116.93 2kc0 s ARG 41 Ca 0.07 0.34 0.11 0.00 -1.72 0.00 0.00 55.73 54.53 2kc0 s ARG 41 Cb -0.10 -1.96 0.66 0.00 -0.45 0.00 0.00 34.95 33.10 2kc0 s ARG 41 CO 0.03 -1.43 1.14 1.63 -0.68 0.00 0.00 175.30 176.00 2kc0 n LYS 42 N -3.25 0.59 0.00 3.54 5.02 -1.26 -2.50 118.16 120.31 2kc0 n LYS 42 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 2kc0 n LYS 42 Cb 0.59 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.30 2kc0 n LYS 42 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2kc0 n ASN 43 N -0.79 0.41 -4.59 4.39 3.02 -1.26 -4.77 115.26 111.66 2kc0 n ASN 43 Ca 0.08 -0.42 -0.27 0.00 -0.03 0.00 0.00 54.58 53.95 2kc0 n ASN 43 Cb 0.04 0.93 -0.09 0.00 -0.61 0.00 0.00 39.78 40.04 2kc0 n ASN 43 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2kc0 s GLU 44 N -1.01 2.13 0.13 3.52 2.12 -1.04 -4.75 118.70 119.81 2kc0 s GLU 44 Ca 0.00 -1.25 0.10 0.00 0.36 0.00 0.00 54.97 54.18 2kc0 s GLU 44 Cb 0.00 -2.20 -0.04 0.00 0.26 0.00 0.00 34.13 32.16 2kc0 s GLU 44 CO 0.00 0.43 -0.23 0.21 -0.54 0.00 0.00 175.26 175.13 2kc0 s LYS 45 N -2.89 1.29 0.02 4.30 2.20 -0.46 -3.74 119.74 120.47 2kc0 s LYS 45 Ca 0.26 -1.30 0.01 0.00 -0.36 0.00 0.00 55.97 54.57 2kc0 s LYS 45 Cb -0.09 -1.64 -0.02 0.00 -1.51 0.00 0.00 37.83 34.57 2kc0 s LYS 45 CO 0.16 0.38 -0.04 -0.48 -0.36 0.00 0.00 175.35 175.01 2kc0 s LEU 46 N -2.13 2.23 -0.28 5.43 2.34 -0.83 -1.06 118.68 124.38 2kc0 s LEU 46 Ca 0.12 -0.48 -0.08 0.00 0.06 0.00 0.00 54.13 53.75 2kc0 s LEU 46 Cb -0.09 0.03 -0.01 0.00 -0.56 0.00 0.00 46.19 45.56 2kc0 s LEU 46 CO 0.06 -0.26 0.10 -0.75 -1.06 0.00 0.00 176.35 174.44 2kc0 s LYS 47 N -1.40 3.38 -0.16 1.48 2.47 0.03 -1.38 119.74 124.16 2kc0 s LYS 47 Ca -0.14 -0.67 -0.05 0.00 -1.56 0.00 0.00 55.97 53.55 2kc0 s LYS 47 Cb -0.09 -3.41 -0.03 0.00 -1.46 0.00 0.00 37.83 32.83 2kc0 s LYS 47 CO -0.01 -0.34 0.01 -1.17 0.16 0.00 0.00 175.35 174.01 2kc0 s LEU 48 N 1.58 3.53 -0.10 5.43 1.98 -0.33 -1.13 118.68 129.65 2kc0 s LEU 48 Ca 0.05 -0.01 -0.24 0.00 -2.89 0.00 0.00 54.13 51.04 2kc0 s LEU 48 Cb -0.16 -1.87 0.05 0.00 0.66 0.00 0.00 46.19 44.87 2kc0 s LEU 48 CO 0.04 0.19 0.56 0.00 -1.89 0.00 0.00 176.35 175.25 2kc0 s ALA 49 N 0.24 -1.42 -0.09 5.97 0.00 -0.29 -0.73 121.76 125.45 2kc0 s ALA 49 Ca 0.00 1.18 -0.31 0.00 0.00 0.00 0.00 51.96 52.84 2kc0 s ALA 49 Cb -0.13 -0.29 0.09 0.00 0.00 0.00 0.00 23.12 22.79 2kc0 s ALA 49 CO 0.02 -0.31 0.82 0.00 0.00 0.00 0.00 175.76 176.28 2kc0 s ALA 50 N -0.74 -1.84 -1.44 0.00 0.00 -0.60 -2.16 121.76 114.98 2kc0 s ALA 50 Ca -0.08 1.43 -0.10 0.00 0.00 0.00 0.00 51.96 53.21 2kc0 s ALA 50 Cb -0.03 -0.29 0.06 0.00 0.00 0.00 0.00 23.12 22.86 2kc0 s ALA 50 CO 0.06 -0.35 0.72 0.94 0.00 0.00 0.00 175.76 177.13 2kc0 n GLN 51 N 0.81 -4.64 -0.42 0.00 7.27 -1.26 -1.82 117.38 117.32 2kc0 n GLN 51 Ca -0.15 0.63 0.00 0.00 0.07 0.00 0.00 57.00 57.55 2kc0 n GLN 51 Cb 0.57 -5.45 0.00 0.00 2.41 0.00 0.00 30.24 27.78 2kc0 n GLN 51 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2kc0 n GLY 52 N -1.47 0.78 3.21 1.69 0.00 -1.26 -4.39 105.19 103.75 2kc0 n GLY 52 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2kc0 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kc0 s ALA 53 N -2.14 1.23 -0.18 4.61 0.00 -0.76 -5.00 121.76 119.53 2kc0 s ALA 53 Ca 0.00 -1.45 -0.19 0.00 0.00 0.00 0.00 51.96 50.32 2kc0 s ALA 53 Cb 0.00 0.18 0.05 0.00 0.00 0.00 0.00 23.12 23.35 2kc0 s ALA 53 CO 0.00 -0.20 0.52 -1.83 0.00 0.00 0.00 175.76 174.26 2kc0 s GLU 54 N -3.81 0.64 0.07 0.00 1.03 -1.26 -1.56 118.70 113.80 2kc0 s GLU 54 Ca 0.16 0.65 0.03 0.00 0.03 0.00 0.00 54.97 55.85 2kc0 s GLU 54 Cb 0.04 0.31 -0.03 0.00 -0.80 0.00 0.00 34.13 33.65 2kc0 s GLU 54 CO -0.01 -0.09 -0.10 0.21 -1.33 0.00 0.00 175.26 173.94 2kc0 s LYS 55 N 0.11 0.74 -0.05 -4.83 2.20 0.10 -4.95 119.74 113.05 2kc0 s LYS 55 Ca -0.01 -1.00 -0.02 0.00 -0.36 0.00 0.00 55.97 54.58 2kc0 s LYS 55 Cb -0.04 -0.49 -0.04 0.00 -1.51 0.00 0.00 37.83 35.75 2kc0 s LYS 55 CO 0.01 0.09 0.07 0.95 -0.36 0.00 0.00 175.35 176.11 2kc0 s THR 56 N -1.93 4.73 0.07 3.43 -4.23 -1.26 -1.18 115.64 115.27 2kc0 s THR 56 Ca -0.01 -0.25 -0.00 0.00 -1.18 0.00 0.00 61.69 60.25 2kc0 s THR 56 Cb -0.06 -3.09 -0.04 0.00 1.34 0.00 0.00 72.50 70.65 2kc0 s THR 56 CO 0.00 0.48 -0.04 -0.31 -0.54 0.00 0.00 174.62 174.21 2kc0 s TYR 57 N -1.07 0.65 0.00 3.99 2.02 -0.48 -5.00 117.35 117.46 2kc0 s TYR 57 Ca 0.18 -1.03 0.00 0.00 -0.37 0.00 0.00 57.07 55.86 2kc0 s TYR 57 Cb -0.12 -0.43 0.00 0.00 -0.40 0.00 0.00 41.96 41.01 2kc0 s TYR 57 CO 0.08 -0.31 0.00 0.41 -1.57 0.00 0.00 175.55 174.16 2kc0 n GLY 58 N 0.05 3.82 2.50 0.71 0.00 -1.26 -1.96 105.19 109.06 2kc0 n GLY 58 Ca -0.13 -0.47 -0.20 0.00 0.00 0.00 0.00 46.02 45.22 2kc0 n GLY 58 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2kc0 n ASN 59 N 0.00 -5.20 0.00 1.61 5.15 -1.21 -4.52 115.26 111.10 2kc0 n ASN 59 Ca 0.00 0.46 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 2kc0 n ASN 59 Cb 0.00 -4.60 0.00 0.00 -0.53 0.00 0.00 39.78 34.65 2kc0 n ASN 59 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2kc0 n GLY 60 N -0.40 0.00 3.66 8.20 0.00 -1.26 -4.93 105.19 110.46 2kc0 n GLY 60 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 2kc0 n GLY 60 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2kc0 s ASP 61 N 0.00 5.22 0.02 1.61 -4.77 -1.26 -5.05 116.67 112.44 2kc0 s ASP 61 Ca 0.00 0.11 0.03 0.00 -3.30 0.00 0.00 52.55 49.39 2kc0 s ASP 61 Cb 0.00 -1.54 -0.02 0.00 -1.09 0.00 0.00 42.92 40.27 2kc0 s ASP 61 CO 0.00 0.34 -0.10 -0.94 0.70 0.00 0.00 175.17 175.17 2kc0 s SER 62 N -0.66 1.16 -0.39 2.11 1.04 -1.26 -1.07 113.70 114.62 2kc0 s SER 62 Ca 0.11 -0.36 -0.21 0.00 0.48 0.00 0.00 55.95 55.97 2kc0 s SER 62 Cb -0.12 -0.07 0.01 0.00 0.10 0.00 0.00 66.02 65.95 2kc0 s SER 62 CO 0.02 -0.01 0.66 -0.22 0.98 0.00 0.00 173.24 174.67 2kc0 s LEU 63 N -0.89 4.31 -0.02 2.42 0.20 0.54 -4.85 118.68 120.38 2kc0 s LEU 63 Ca -0.01 0.00 -0.30 0.00 0.69 0.00 0.00 54.13 54.52 2kc0 s LEU 63 Cb -0.06 -2.80 -0.06 0.00 -0.43 0.00 0.00 46.19 42.84 2kc0 s LEU 63 CO 0.00 -0.68 1.65 0.20 -0.29 0.00 0.00 176.35 177.24 2kc0 s ASN 64 N 1.88 6.66 -0.39 3.68 -0.87 -1.26 -2.50 114.94 122.15 2kc0 s ASN 64 Ca 0.25 2.29 0.11 0.00 -1.57 0.00 0.00 52.86 53.94 2kc0 s ASN 64 Cb -0.14 -2.54 0.39 0.00 -0.02 0.00 0.00 41.25 38.93 2kc0 s ASN 64 CO 0.17 -0.91 1.07 1.07 -2.57 0.00 0.00 177.10 175.93 2kc0 n THR 65 N 5.29 0.24 -1.95 1.60 5.66 0.02 -4.98 114.28 120.16 2kc0 n THR 65 Ca 0.17 -2.54 -0.32 0.00 -3.05 0.00 0.00 64.05 58.31 2kc0 n THR 65 Cb 0.42 0.77 -0.04 0.00 -1.55 0.00 0.00 70.33 69.93 2kc0 n THR 65 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2kc0 s GLY 66 N -1.99 0.04 0.00 1.09 0.00 -0.91 -4.46 107.32 101.09 2kc0 s GLY 66 Ca 0.27 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 44.08 2kc0 s GLY 66 CO -0.04 3.59 0.00 0.28 0.00 0.00 0.00 173.10 176.93 2kc0 n LYS 67 N 9.02 0.00 0.00 2.90 4.01 -1.26 -4.93 118.16 127.90 2kc0 n LYS 67 Ca 0.32 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.12 2kc0 n LYS 67 Cb 0.50 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.02 2kc0 n LYS 67 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2kc0 n LEU 68 N 0.00 0.00 -3.79 -0.35 4.32 -1.26 -4.48 117.00 111.43 2kc0 n LEU 68 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.86 2kc0 n LEU 68 Cb 0.00 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 41.70 2kc0 n LEU 68 CO 0.00 0.00 -0.06 -0.54 -1.22 0.00 0.00 177.39 175.57 2kc0 s LYS 69 N 0.00 0.49 0.68 3.23 -0.14 -1.26 -5.18 119.74 117.55 2kc0 s LYS 69 Ca 0.00 -0.01 0.05 0.00 -1.36 0.00 0.00 55.97 54.64 2kc0 s LYS 69 Cb 0.00 0.22 0.13 0.00 -1.68 0.00 0.00 37.83 36.49 2kc0 s LYS 69 CO 0.00 -0.11 0.94 0.54 -0.76 0.00 0.00 175.35 175.96 2kc0 s ASN 70 N -0.76 4.56 -1.32 2.83 4.22 -1.26 -4.72 114.94 118.49 2kc0 s ASN 70 Ca -0.08 -0.70 -0.11 0.00 -2.14 0.00 0.00 52.86 49.82 2kc0 s ASN 70 Cb -0.04 0.34 0.09 0.00 1.28 0.00 0.00 41.25 42.92 2kc0 s ASN 70 CO 0.02 -1.74 0.53 0.47 -2.04 0.00 0.00 177.10 174.34 2kc0 n ASP 71 N -2.62 -3.47 -4.17 3.54 8.00 -0.22 -4.92 116.55 112.68 2kc0 n ASP 71 Ca 0.17 -0.49 -0.11 0.00 0.71 0.00 0.00 54.79 55.07 2kc0 n ASP 71 Cb 0.61 -2.88 -0.10 0.00 -0.02 0.00 0.00 41.12 38.74 2kc0 n ASP 71 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2kc0 s LYS 72 N -6.18 0.93 -0.23 -1.24 -2.85 -0.17 -4.97 119.74 105.03 2kc0 s LYS 72 Ca 0.46 -1.43 -0.06 0.00 -1.00 0.00 0.00 55.97 53.95 2kc0 s LYS 72 Cb -0.25 0.01 -0.02 0.00 -2.06 0.00 0.00 37.83 35.51 2kc0 s LYS 72 CO 0.57 -0.16 0.03 0.08 0.10 0.00 0.00 175.35 175.96 2kc0 s VAL 73 N -3.85 4.02 0.44 1.79 1.01 -1.26 -0.50 120.40 122.06 2kc0 s VAL 73 Ca 0.20 -0.27 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 2kc0 s VAL 73 Cb 0.07 -2.86 -0.10 0.00 0.00 0.00 0.00 36.38 33.49 2kc0 s VAL 73 CO -0.00 0.38 0.94 -0.55 0.00 0.00 0.00 175.10 175.87 2kc0 s SER 74 N 1.44 6.84 -0.23 3.32 0.15 0.36 -4.95 113.70 120.63 2kc0 s SER 74 Ca 0.05 1.62 -0.06 0.00 0.70 0.00 0.00 55.95 58.26 2kc0 s SER 74 Cb -0.15 -2.52 -0.02 0.00 -1.71 0.00 0.00 66.02 61.63 2kc0 s SER 74 CO 0.02 -0.41 0.02 0.00 1.20 0.00 0.00 173.24 174.06 2kc0 s ARG 75 N -3.42 3.56 0.02 5.44 1.70 -1.26 -2.62 118.95 122.37 2kc0 s ARG 75 Ca 0.60 -0.53 0.01 0.00 -0.47 0.00 0.00 55.73 55.34 2kc0 s ARG 75 Cb -0.09 -3.17 -0.02 0.00 -0.57 0.00 0.00 34.95 31.10 2kc0 s ARG 75 CO 0.19 -0.14 -0.04 -0.06 -1.08 0.00 0.00 175.30 174.16 2kc0 s PHE 76 N 1.42 0.38 0.08 5.89 0.08 -0.93 -4.88 117.98 120.02 2kc0 s PHE 76 Ca 0.05 -0.41 0.04 0.00 0.12 0.00 0.00 56.93 56.73 2kc0 s PHE 76 Cb -0.15 -0.25 -0.04 0.00 -0.57 0.00 0.00 43.02 42.02 2kc0 s PHE 76 CO 0.01 -0.11 0.03 0.34 -0.10 0.00 0.00 175.22 175.39 2kc0 s ASP 77 N -1.19 5.24 0.05 1.36 -1.08 -0.92 -1.60 116.67 118.53 2kc0 s ASP 77 Ca -0.10 -0.10 -0.17 0.00 -0.52 0.00 0.00 52.55 51.66 2kc0 s ASP 77 Cb -0.08 -1.33 0.03 0.00 -1.46 0.00 0.00 42.92 40.09 2kc0 s ASP 77 CO -0.00 0.18 0.40 0.72 0.52 0.00 0.00 175.17 176.99 2kc0 s PHE 78 N -1.33 -0.24 -0.03 -5.34 -0.71 -0.88 -1.13 117.98 108.31 2kc0 s PHE 78 Ca 0.27 0.18 0.04 0.00 -1.04 0.00 0.00 56.93 56.38 2kc0 s PHE 78 Cb -0.12 0.21 -0.00 0.00 -1.21 0.00 0.00 43.02 41.89 2kc0 s PHE 78 CO 0.19 -0.57 -0.14 0.42 -1.34 0.00 0.00 175.22 173.78 2kc0 s ILE 79 N -2.54 1.16 0.82 -4.49 1.09 -0.28 -2.18 121.20 114.79 2kc0 s ILE 79 Ca -0.05 -0.59 -0.12 0.00 -1.10 0.00 0.00 60.65 58.79 2kc0 s ILE 79 Cb -0.01 -0.99 0.09 0.00 -1.06 0.00 0.00 42.46 40.49 2kc0 s ILE 79 CO -0.03 0.34 1.13 -0.13 -0.10 0.00 0.00 174.94 176.15 2kc0 s ARG 80 N -0.07 1.87 -0.28 2.79 0.52 -0.15 -0.79 118.95 122.84 2kc0 s ARG 80 Ca 0.00 0.36 -0.17 0.00 -0.52 0.00 0.00 55.73 55.41 2kc0 s ARG 80 Cb -0.08 -1.92 0.09 0.00 0.52 0.00 0.00 34.95 33.55 2kc0 s ARG 80 CO 0.01 -1.71 0.73 -1.14 0.02 0.00 0.00 175.30 173.21 2kc0 s GLN 81 N -5.34 0.68 0.08 3.54 0.74 -0.23 -4.32 119.66 114.82 2kc0 s GLN 81 Ca 0.62 1.15 -0.13 0.00 0.05 0.00 0.00 55.36 57.04 2kc0 s GLN 81 Cb -0.13 0.16 0.02 0.00 1.10 0.00 0.00 33.01 34.16 2kc0 s GLN 81 CO 0.52 -0.14 0.31 -1.50 -0.55 0.00 0.00 175.29 173.94 2kc0 s ILE 82 N 1.49 0.09 -0.07 -2.34 2.07 -1.21 -1.35 121.20 119.88 2kc0 s ILE 82 Ca -0.09 -0.76 -0.17 0.00 -1.41 0.00 0.00 60.65 58.22 2kc0 s ILE 82 Cb -0.05 -1.11 -0.05 0.00 0.13 0.00 0.00 42.46 41.39 2kc0 s ILE 82 CO -0.18 -0.42 0.46 -0.70 -1.91 0.00 0.00 174.94 172.19 2kc0 s GLU 83 N -3.24 4.21 -0.18 3.50 2.12 -1.26 -3.54 118.70 120.31 2kc0 s GLU 83 Ca -0.00 0.45 0.01 0.00 0.36 0.00 0.00 54.97 55.78 2kc0 s GLU 83 Cb 0.01 -3.36 0.04 0.00 0.26 0.00 0.00 34.13 31.08 2kc0 s GLU 83 CO -0.08 0.36 -0.11 0.08 -0.54 0.00 0.00 175.26 174.97 2kc0 s VAL 84 N -0.02 1.57 -1.80 3.70 1.01 -0.08 -4.80 120.40 119.97 2kc0 s VAL 84 Ca 0.25 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.39 2kc0 s VAL 84 Cb -0.16 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.63 2kc0 s VAL 84 CO 0.12 0.27 0.00 0.47 0.00 0.00 0.00 175.10 175.95 2kc0 n ASP 85 N 4.73 -4.96 0.00 3.32 9.92 -1.26 -0.24 116.55 128.06 2kc0 n ASP 85 Ca -0.15 0.42 0.00 0.00 -0.53 0.00 0.00 54.79 54.53 2kc0 n ASP 85 Cb 0.48 -4.28 0.00 0.00 -0.64 0.00 0.00 41.12 36.68 2kc0 n ASP 85 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kc0 n GLY 86 N -0.23 0.64 3.54 0.44 0.00 -1.26 -5.09 105.19 103.23 2kc0 n GLY 86 Ca -0.17 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2kc0 n GLY 86 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kc0 s GLN 87 N -0.92 2.20 -0.27 1.61 -1.52 0.67 -5.13 119.66 116.30 2kc0 s GLN 87 Ca 0.00 -0.94 -0.01 0.00 -1.95 0.00 0.00 55.36 52.46 2kc0 s GLN 87 Cb 0.00 -2.31 0.04 0.00 -0.22 0.00 0.00 33.01 30.52 2kc0 s GLN 87 CO 0.00 0.54 -0.04 -0.51 -0.25 0.00 0.00 175.29 175.02 2kc0 s LEU 88 N -1.80 3.53 -0.06 2.90 1.02 -1.26 -0.91 118.68 122.10 2kc0 s LEU 88 Ca 0.18 -1.13 0.04 0.00 0.02 0.00 0.00 54.13 53.25 2kc0 s LEU 88 Cb -0.11 -1.66 -0.00 0.00 0.02 0.00 0.00 46.19 44.43 2kc0 s LEU 88 CO 0.10 -0.19 -0.20 -0.63 0.02 0.00 0.00 176.35 175.45 2kc0 s ILE 89 N 1.26 1.65 -0.45 -0.59 1.01 -1.23 -5.07 121.20 117.77 2kc0 s ILE 89 Ca -0.04 -0.82 0.07 0.00 0.00 0.00 0.00 60.65 59.86 2kc0 s ILE 89 Cb -0.18 -1.42 0.23 0.00 0.01 0.00 0.00 42.46 41.09 2kc0 s ILE 89 CO -0.03 0.47 0.69 1.07 0.00 0.00 0.00 174.94 177.14 2kc0 n THR 90 N 3.25 -0.36 -2.11 2.92 5.66 -1.26 -3.32 114.28 119.06 2kc0 n THR 90 Ca -0.19 -2.46 -0.01 0.00 -3.05 0.00 0.00 64.05 58.34 2kc0 n THR 90 Cb 0.53 -0.04 -0.01 0.00 -1.55 0.00 0.00 70.33 69.26 2kc0 n THR 90 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2kc0 n LEU 91 N 1.87 -0.00 -4.44 1.09 -0.00 -1.26 -4.92 117.00 109.33 2kc0 n LEU 91 Ca 0.16 -1.44 -0.35 0.00 -0.00 0.00 0.00 56.01 54.39 2kc0 n LEU 91 Cb 0.57 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.87 2kc0 n LEU 91 CO 0.08 0.79 -0.34 -1.61 -0.00 0.00 0.00 177.39 176.31 2kc0 s GLU 92 N 0.00 3.60 0.12 1.96 2.02 -1.26 -3.21 118.70 121.93 2kc0 s GLU 92 Ca 0.07 -0.53 -0.16 0.00 0.02 0.00 0.00 54.97 54.37 2kc0 s GLU 92 Cb 0.08 -3.04 0.04 0.00 0.10 0.00 0.00 34.13 31.31 2kc0 s GLU 92 CO -0.04 0.04 0.40 -1.54 0.02 0.00 0.00 175.26 174.14 2kc0 s SER 93 N 0.92 -0.23 0.00 -0.19 1.04 -1.26 -0.98 113.70 113.00 2kc0 s SER 93 Ca 0.01 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.12 2kc0 s SER 93 Cb -0.14 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2kc0 s SER 93 CO 0.02 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 173.99 2kc0 n GLY 94 N -0.22 0.75 3.43 7.32 0.00 -0.93 -4.67 105.19 110.87 2kc0 n GLY 94 Ca -0.16 -0.54 -0.44 0.00 0.00 0.00 0.00 46.02 44.88 2kc0 n GLY 94 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kc0 s GLU 95 N 1.14 3.05 -0.75 1.61 2.12 0.25 -2.08 118.70 124.04 2kc0 s GLU 95 Ca 0.00 -1.08 -0.27 0.00 0.36 0.00 0.00 54.97 53.98 2kc0 s GLU 95 Cb 0.00 -4.09 0.03 0.00 0.26 0.00 0.00 34.13 30.33 2kc0 s GLU 95 CO 0.00 -1.06 1.31 0.12 -0.54 0.00 0.00 175.26 175.09 2kc0 s PHE 96 N 2.07 2.27 -0.22 5.30 5.36 -0.63 -1.09 117.98 131.05 2kc0 s PHE 96 Ca 0.09 -0.06 -0.16 0.00 -0.96 0.00 0.00 56.93 55.84 2kc0 s PHE 96 Cb -0.21 -4.61 -0.04 0.00 -0.34 0.00 0.00 43.02 37.82 2kc0 s PHE 96 CO 0.10 -2.08 0.42 -0.65 -1.46 0.00 0.00 175.22 171.55 2kc0 s GLN 97 N 5.76 4.15 -0.28 10.12 -0.21 -0.93 -2.20 119.66 136.07 2kc0 s GLN 97 Ca 0.37 0.22 0.00 0.00 0.02 0.00 0.00 55.36 55.97 2kc0 s GLN 97 Cb -0.08 -3.57 0.08 0.00 1.00 0.00 0.00 33.01 30.45 2kc0 s GLN 97 CO 0.14 -0.11 0.05 0.08 -2.12 0.00 0.00 175.29 173.32 2kc0 s VAL 98 N 1.54 1.19 0.11 1.09 1.01 -1.08 -1.24 120.40 123.03 2kc0 s VAL 98 Ca 0.19 -1.38 -0.30 0.00 0.00 0.00 0.00 61.98 60.49 2kc0 s VAL 98 Cb -0.15 -1.76 -0.06 0.00 0.00 0.00 0.00 36.38 34.40 2kc0 s VAL 98 CO 0.09 -0.46 1.06 -0.47 0.00 0.00 0.00 175.10 175.32 2kc0 s TYR 99 N 1.49 3.63 -0.29 5.22 6.14 0.30 -0.48 117.35 133.36 2kc0 s TYR 99 Ca 0.05 1.61 0.01 0.00 0.64 0.00 0.00 57.07 59.38 2kc0 s TYR 99 Cb -0.18 -3.22 0.08 0.00 0.42 0.00 0.00 41.96 39.06 2kc0 s TYR 99 CO -0.16 -0.43 0.02 0.21 0.64 0.00 0.00 175.55 175.83 2kc0 s LYS 100 N 0.20 1.34 0.18 4.97 2.36 0.35 -1.83 119.74 127.30 2kc0 s LYS 100 Ca 0.51 -1.28 -0.02 0.00 -2.55 0.00 0.00 55.97 52.63 2kc0 s LYS 100 Cb -0.27 -2.62 0.04 0.00 -1.05 0.00 0.00 37.83 33.93 2kc0 s LYS 100 CO 0.31 -0.80 0.24 0.94 1.55 0.00 0.00 175.35 177.59 2kc0 n GLN 101 N 4.59 0.13 0.20 4.03 -0.06 -0.98 -0.99 117.38 124.29 2kc0 n GLN 101 Ca -0.05 -0.50 0.04 0.00 -2.00 0.00 0.00 57.00 54.49 2kc0 n GLN 101 Cb 0.43 -0.21 0.44 0.00 -4.06 0.00 0.00 30.24 26.85 2kc0 n GLN 101 CO 0.00 0.00 0.00 0.77 -0.20 0.00 0.00 177.06 177.63 2kc0 h SER 102 N -0.23 0.03 0.00 1.69 0.02 -1.95 -3.36 113.55 109.74 2kc0 h SER 102 Ca -0.08 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2kc0 h SER 102 Cb 0.25 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2kc0 h SER 102 CO 0.07 0.27 -0.48 1.41 -1.14 0.00 0.00 176.83 176.95 2kc0 n HIS 103 N -4.25 0.00 -1.89 3.45 8.25 -1.26 -4.98 115.22 114.55 2kc0 n HIS 103 Ca -0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.14 2kc0 n HIS 103 Cb 0.30 0.24 0.16 0.00 1.12 0.00 0.00 29.99 31.81 2kc0 n HIS 103 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2kc0 s SER 104 N -4.89 3.38 -0.12 0.41 1.04 -1.26 -4.77 113.70 107.50 2kc0 s SER 104 Ca 0.00 0.42 -0.29 0.00 0.48 0.00 0.00 55.95 56.56 2kc0 s SER 104 Cb 0.00 -0.59 0.08 0.00 0.10 0.00 0.00 66.02 65.61 2kc0 s SER 104 CO 0.00 -2.58 0.73 0.00 0.98 0.00 0.00 173.24 172.37 2kc0 s ALA 105 N -3.77 -1.79 0.02 5.32 0.00 -1.09 -2.31 121.76 118.14 2kc0 s ALA 105 Ca 0.71 1.52 0.01 0.00 0.00 0.00 0.00 51.96 54.20 2kc0 s ALA 105 Cb -0.06 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 2kc0 s ALA 105 CO 0.52 -0.35 -0.05 -0.48 0.00 0.00 0.00 175.76 175.40 2kc0 s LEU 106 N -0.80 2.17 0.19 0.00 0.05 -0.76 -1.55 118.68 117.98 2kc0 s LEU 106 Ca -0.07 -0.38 0.05 0.00 0.05 0.00 0.00 54.13 53.78 2kc0 s LEU 106 Cb -0.01 -0.08 -0.04 0.00 -2.05 0.00 0.00 46.19 44.01 2kc0 s LEU 106 CO 0.07 -0.16 0.23 0.28 -0.55 0.00 0.00 176.35 176.22 2kc0 s THR 107 N -0.99 4.87 0.04 5.48 -1.32 -1.24 -0.54 115.64 121.93 2kc0 s THR 107 Ca -0.08 -1.02 -0.10 0.00 -1.21 0.00 0.00 61.69 59.28 2kc0 s THR 107 Cb -0.07 -3.55 0.01 0.00 -1.51 0.00 0.00 72.50 67.37 2kc0 s THR 107 CO -0.00 -0.20 0.20 0.00 -2.21 0.00 0.00 174.62 172.41 2kc0 s ALA 108 N -1.87 -0.39 -0.11 11.08 0.00 -0.37 -0.97 121.76 129.13 2kc0 s ALA 108 Ca 0.33 -0.24 -0.08 0.00 0.00 0.00 0.00 51.96 51.96 2kc0 s ALA 108 Cb -0.10 0.27 -0.04 0.00 0.00 0.00 0.00 23.12 23.25 2kc0 s ALA 108 CO 0.26 -0.35 0.18 -0.06 0.00 0.00 0.00 175.76 175.79 2kc0 s PHE 109 N -2.47 3.61 -0.34 0.00 0.40 -0.69 -2.18 117.98 116.31 2kc0 s PHE 109 Ca -0.06 0.59 -0.01 0.00 -0.60 0.00 0.00 56.93 56.86 2kc0 s PHE 109 Cb -0.01 -2.01 0.13 0.00 0.51 0.00 0.00 43.02 41.64 2kc0 s PHE 109 CO -0.03 0.70 0.21 -1.14 0.70 0.00 0.00 175.22 175.66 2kc0 s GLN 110 N -0.95 0.47 0.09 0.44 0.74 -0.25 -3.64 119.66 116.57 2kc0 s GLN 110 Ca 0.16 -1.07 0.08 0.00 0.05 0.00 0.00 55.36 54.57 2kc0 s GLN 110 Cb -0.13 -1.19 -0.03 0.00 1.10 0.00 0.00 33.01 32.76 2kc0 s GLN 110 CO 0.05 -1.16 -0.20 -0.08 -0.55 0.00 0.00 175.29 173.35 2kc0 s THR 111 N 1.37 1.64 0.00 -0.34 -1.32 -1.15 -0.58 115.64 115.26 2kc0 s THR 111 Ca 0.16 -1.46 0.00 0.00 -1.21 0.00 0.00 61.69 59.17 2kc0 s THR 111 Cb -0.20 -1.49 0.00 0.00 -1.51 0.00 0.00 72.50 69.30 2kc0 s THR 111 CO -0.09 -0.04 0.00 -0.62 -2.21 0.00 0.00 174.62 171.67 2kc0 n GLU 112 N 1.23 2.65 -3.72 7.08 -0.58 -1.26 -0.41 120.64 125.62 2kc0 n GLU 112 Ca -0.19 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.43 2kc0 n GLU 112 Cb 0.54 -0.74 -0.11 0.00 -0.57 0.00 0.00 31.44 30.55 2kc0 n GLU 112 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2kc0 s GLN 113 N -1.17 0.39 0.26 3.49 1.03 -1.26 -1.40 119.66 121.00 2kc0 s GLN 113 Ca 0.00 0.63 -0.12 0.00 0.04 0.00 0.00 55.36 55.91 2kc0 s GLN 113 Cb 0.00 0.07 -0.00 0.00 0.03 0.00 0.00 33.01 33.11 2kc0 s GLN 113 CO 0.00 -0.11 0.49 0.96 -2.54 0.00 0.00 175.29 174.09 2kc0 s ILE 114 N 0.83 0.00 0.64 3.63 -4.36 -0.49 -4.61 121.20 116.84 2kc0 s ILE 114 Ca -0.05 -1.42 -0.15 0.00 -0.26 0.00 0.00 60.65 58.77 2kc0 s ILE 114 Cb -0.06 -2.28 -0.01 0.00 1.25 0.00 0.00 42.46 41.36 2kc0 s ILE 114 CO -0.06 0.00 1.10 -1.58 0.24 0.00 0.00 174.94 174.64 2kc0 s GLN 115 N -3.84 2.94 -0.24 0.37 0.74 -1.20 -1.13 119.66 117.29 2kc0 s GLN 115 Ca 0.23 1.36 -0.08 0.00 0.05 0.00 0.00 55.36 56.92 2kc0 s GLN 115 Cb -0.01 -1.97 -0.03 0.00 1.10 0.00 0.00 33.01 32.10 2kc0 s GLN 115 CO 0.10 -1.14 0.09 0.34 -0.55 0.00 0.00 175.29 174.13 2kc0 s ASP 116 N -2.59 5.35 0.00 6.67 -1.08 0.44 -4.71 116.67 120.75 2kc0 s ASP 116 Ca 0.67 -0.13 0.19 0.00 -0.52 0.00 0.00 52.55 52.75 2kc0 s ASP 116 Cb -0.20 -1.96 -0.03 0.00 -1.46 0.00 0.00 42.92 39.27 2kc0 s ASP 116 CO 0.40 -0.01 0.94 -1.20 0.52 0.00 0.00 175.17 175.82 2kc0 n SER 117 N 4.75 1.71 0.08 -0.34 7.64 -1.26 -1.37 113.62 124.83 2kc0 n SER 117 Ca -0.16 -1.35 0.12 0.00 1.01 0.00 0.00 58.87 58.49 2kc0 n SER 117 Cb 0.52 0.54 0.27 0.00 -1.01 0.00 0.00 64.21 64.53 2kc0 n SER 117 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2kc0 n GLU 118 N -0.24 0.28 -0.24 1.43 1.02 -1.26 -3.82 120.64 117.81 2kc0 n GLU 118 Ca 0.07 0.14 0.06 0.00 -0.02 0.00 0.00 57.16 57.41 2kc0 n GLU 118 Cb 0.39 -1.73 0.08 0.00 -0.02 0.00 0.00 31.44 30.15 2kc0 n GLU 118 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2kc0 n HIS 119 N -2.17 0.00 -3.79 -0.32 -0.00 -1.26 -5.08 115.22 102.60 2kc0 n HIS 119 Ca 0.04 -0.59 -0.28 0.00 0.46 0.00 0.00 57.72 57.36 2kc0 n HIS 119 Cb 0.43 -0.11 0.00 0.00 -0.12 0.00 0.00 29.99 30.20 2kc0 n HIS 119 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2kc0 n SER 120 N -0.84 -4.34 0.00 0.26 2.88 -1.07 -3.82 113.62 106.69 2kc0 n SER 120 Ca 0.09 -0.99 0.00 0.00 -1.33 0.00 0.00 58.87 56.65 2kc0 n SER 120 Cb 0.66 -1.48 0.00 0.00 -0.75 0.00 0.00 64.21 62.63 2kc0 n SER 120 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kc0 n GLY 121 N -1.67 1.12 1.10 0.46 0.00 -0.47 -5.02 105.19 100.72 2kc0 n GLY 121 Ca -0.27 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.66 2kc0 n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kc0 n LYS 122 N 0.00 -1.76 -3.64 1.61 5.02 -1.24 -4.79 118.16 113.35 2kc0 n LYS 122 Ca 0.00 -0.55 -0.10 0.00 -2.02 0.00 0.00 58.31 55.64 2kc0 n LYS 122 Cb 0.00 -0.52 -0.04 0.00 -0.02 0.00 0.00 35.03 34.44 2kc0 n LYS 122 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kc0 s MET 123 N -3.78 1.12 0.02 1.97 0.23 -1.26 -0.42 119.30 117.18 2kc0 s MET 123 Ca 0.22 -0.72 0.00 0.00 -1.03 0.00 0.00 55.69 54.16 2kc0 s MET 123 Cb -0.02 0.48 -0.02 0.00 -1.53 0.00 0.00 34.83 33.74 2kc0 s MET 123 CO 0.17 -0.45 -0.03 0.14 -2.03 0.00 0.00 175.02 172.83 2kc0 s VAL 124 N -3.81 0.11 -0.60 5.16 -7.23 -0.29 -4.83 120.40 108.91 2kc0 s VAL 124 Ca 0.04 -0.85 -0.02 0.00 -1.81 0.00 0.00 61.98 59.34 2kc0 s VAL 124 Cb 0.01 -0.25 0.16 0.00 0.56 0.00 0.00 36.38 36.86 2kc0 s VAL 124 CO -0.11 -0.47 0.41 0.00 -0.31 0.00 0.00 175.10 174.62 2kc0 s ALA 125 N -1.36 3.53 -0.05 1.32 0.00 -1.26 -1.40 121.76 122.54 2kc0 s ALA 125 Ca -0.15 -3.23 0.04 0.00 0.00 0.00 0.00 51.96 48.62 2kc0 s ALA 125 Cb -0.09 -2.59 -0.00 0.00 0.00 0.00 0.00 23.12 20.44 2kc0 s ALA 125 CO -0.01 -2.08 -0.18 0.15 0.00 0.00 0.00 175.76 173.64 2kc0 s LYS 126 N -0.05 1.95 -0.54 0.00 3.01 -0.49 -4.92 119.74 118.71 2kc0 s LYS 126 Ca 0.17 -0.66 -0.25 0.00 -1.01 0.00 0.00 55.97 54.22 2kc0 s LYS 126 Cb -0.21 -1.67 -0.23 0.00 -1.01 0.00 0.00 37.83 34.71 2kc0 s LYS 126 CO -0.03 0.25 1.82 2.89 0.51 0.00 0.00 175.35 180.79 2kc0 n ARG 127 N 3.16 0.98 -2.14 1.68 1.85 -1.26 -4.10 116.66 116.83 2kc0 n ARG 127 Ca -0.18 -1.59 -0.42 0.00 -1.00 0.00 0.00 57.85 54.66 2kc0 n ARG 127 Cb 0.53 -2.84 -0.01 0.00 -1.05 0.00 0.00 32.46 29.09 2kc0 n ARG 127 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 2kc0 n GLN 128 N 7.41 2.86 -3.75 2.89 7.27 0.45 -4.95 117.38 129.58 2kc0 n GLN 128 Ca 0.48 -2.88 -0.36 0.00 0.07 0.00 0.00 57.00 54.31 2kc0 n GLN 128 Cb 0.41 -3.40 -0.07 0.00 2.41 0.00 0.00 30.24 29.59 2kc0 n GLN 128 CO 0.00 0.00 0.00 0.12 0.07 0.00 0.00 177.06 177.25 2kc0 s PHE 129 N 4.32 3.49 0.03 3.69 2.19 -1.26 -2.92 117.98 127.52 2kc0 s PHE 129 Ca 0.52 0.46 -0.09 0.00 0.33 0.00 0.00 56.93 58.15 2kc0 s PHE 129 Cb 0.08 -2.12 0.00 0.00 -1.31 0.00 0.00 43.02 39.68 2kc0 s PHE 129 CO 0.02 0.45 0.18 1.03 1.83 0.00 0.00 175.22 178.73 2kc0 s ARG 130 N -0.15 0.64 0.48 10.12 1.81 -1.24 -4.84 118.95 125.77 2kc0 s ARG 130 Ca 0.12 -0.57 -0.19 0.00 -1.72 0.00 0.00 55.73 53.37 2kc0 s ARG 130 Cb -0.12 0.27 -0.09 0.00 -0.45 0.00 0.00 34.95 34.56 2kc0 s ARG 130 CO 0.01 -0.18 0.98 -1.50 -0.68 0.00 0.00 175.30 173.94 2kc0 s ILE 131 N -2.27 4.31 0.00 1.52 1.10 -1.26 -1.71 121.20 122.90 2kc0 s ILE 131 Ca -0.07 1.30 0.00 0.00 -0.51 0.00 0.00 60.65 61.36 2kc0 s ILE 131 Cb -0.03 -3.60 0.00 0.00 0.15 0.00 0.00 42.46 38.98 2kc0 s ILE 131 CO -0.02 -0.45 0.00 0.61 -2.11 0.00 0.00 174.94 172.96 2kc0 n GLY 132 N -0.94 3.23 3.77 1.50 0.00 -0.14 -4.87 105.19 107.73 2kc0 n GLY 132 Ca 0.07 -2.14 -0.39 0.00 0.00 0.00 0.00 46.02 43.57 2kc0 n GLY 132 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kc0 s ASP 133 N -0.82 7.19 -0.98 1.61 -1.08 -1.26 -4.75 116.67 116.57 2kc0 s ASP 133 Ca 0.00 2.07 -0.12 0.00 -0.52 0.00 0.00 52.55 53.99 2kc0 s ASP 133 Cb 0.00 -2.60 0.25 0.00 -1.46 0.00 0.00 42.92 39.10 2kc0 s ASP 133 CO 0.00 -0.19 0.96 -0.63 0.52 0.00 0.00 175.17 175.84 2kc0 s ILE 134 N -1.39 5.79 0.24 4.11 -1.09 -1.26 -3.70 121.20 123.89 2kc0 s ILE 134 Ca 0.49 -2.94 -0.29 0.00 -2.23 0.00 0.00 60.65 55.67 2kc0 s ILE 134 Cb -0.26 -4.56 -0.09 0.00 -1.58 0.00 0.00 42.46 35.98 2kc0 s ILE 134 CO 0.32 -1.13 0.93 0.00 -1.23 0.00 0.00 174.94 173.83 2kc0 s ALA 135 N -0.48 3.33 0.00 9.38 0.00 -0.60 -4.98 121.76 128.42 2kc0 s ALA 135 Ca 0.25 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.80 2kc0 s ALA 135 Cb -0.10 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.84 2kc0 s ALA 135 CO -0.08 0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.30 2kc0 n GLY 136 N 1.40 4.51 3.52 0.00 0.00 -1.26 -2.66 105.19 110.69 2kc0 n GLY 136 Ca -0.02 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 2kc0 n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kc0 s GLU 137 N -3.69 3.94 -0.28 1.61 2.02 -1.26 -4.98 118.70 116.06 2kc0 s GLU 137 Ca 0.00 -2.11 -0.29 0.00 0.02 0.00 0.00 54.97 52.59 2kc0 s GLU 137 Cb 0.00 -5.25 -0.01 0.00 0.10 0.00 0.00 34.13 28.96 2kc0 s GLU 137 CO 0.00 -2.00 1.49 -3.38 0.02 0.00 0.00 175.26 171.39 2kc0 s HIS 138 N 3.07 2.33 0.00 1.61 -3.43 -1.26 -4.81 115.29 112.80 2kc0 s HIS 138 Ca 0.46 0.68 0.00 0.00 -0.80 0.00 0.00 55.06 55.40 2kc0 s HIS 138 Cb -0.00 -4.00 0.00 0.00 -1.43 0.00 0.00 32.58 27.14 2kc0 s HIS 138 CO 0.01 -2.38 0.32 -2.37 -2.00 0.00 0.00 174.74 168.32 2kc0 n THR 139 N 6.48 0.00 -2.69 -5.38 5.66 -1.26 -4.62 114.28 112.46 2kc0 n THR 139 Ca 0.17 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 61.12 2kc0 n THR 139 Cb 0.46 0.03 0.11 0.00 -1.55 0.00 0.00 70.33 69.38 2kc0 n THR 139 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2kc0 n SER 140 N 0.00 -1.29 0.06 1.09 3.41 -1.26 -4.84 113.62 110.79 2kc0 n SER 140 Ca 0.00 -2.41 -0.05 0.00 -0.26 0.00 0.00 58.87 56.15 2kc0 n SER 140 Cb 0.50 0.71 0.15 0.00 -0.26 0.00 0.00 64.21 65.31 2kc0 n SER 140 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2kc0 h PHE 141 N 1.88 0.43 0.00 7.33 3.57 -1.95 -3.05 116.94 125.15 2kc0 h PHE 141 Ca -0.30 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2kc0 h PHE 141 Cb 1.29 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.94 2kc0 h PHE 141 CO 0.13 0.77 0.00 -3.47 -2.23 0.00 0.00 178.31 173.51 2kc0 n ASP 142 N -3.98 0.00 -0.00 0.41 2.03 -1.26 -1.80 116.55 111.95 2kc0 n ASP 142 Ca -0.02 -0.50 0.04 0.00 0.52 0.00 0.00 54.79 54.83 2kc0 n ASP 142 Cb 0.54 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.89 2kc0 n ASP 142 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2kc0 n LYS 143 N -0.87 3.51 -2.30 -0.67 4.76 -1.15 -5.01 118.16 116.43 2kc0 n LYS 143 Ca 0.07 -0.01 -0.34 0.00 -2.87 0.00 0.00 58.31 55.16 2kc0 n LYS 143 Cb 0.03 -0.96 -0.01 0.00 -1.84 0.00 0.00 35.03 32.25 2kc0 n LYS 143 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2kc0 s LEU 144 N -2.60 3.70 0.48 -0.35 1.02 -0.75 -5.05 118.68 115.13 2kc0 s LEU 144 Ca 0.02 1.94 -0.21 0.00 0.02 0.00 0.00 54.13 55.90 2kc0 s LEU 144 Cb 0.06 -4.55 -0.08 0.00 0.02 0.00 0.00 46.19 41.64 2kc0 s LEU 144 CO 0.36 -1.01 1.06 -2.16 0.02 0.00 0.00 176.35 174.62 2kc0 s PRO 145 N -3.55 3.77 -0.34 1.29 0.04 -1.26 -4.97 135.00 129.99 2kc0 s PRO 145 Ca 0.67 1.46 0.03 0.00 0.04 0.00 0.00 61.00 63.20 2kc0 s PRO 145 Cb -0.18 -2.17 0.51 0.00 0.04 0.00 0.00 34.50 32.70 2kc0 s PRO 145 CO 0.27 -0.47 1.69 0.39 0.04 0.00 0.00 177.00 178.93 2kc0 n GLU 146 N -0.85 1.98 0.00 4.56 1.02 -1.26 -4.79 120.64 121.29 2kc0 n GLU 146 Ca 0.09 -2.28 0.00 0.00 -0.02 0.00 0.00 57.16 54.95 2kc0 n GLU 146 Cb 0.51 -1.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2kc0 n GLU 146 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kc0 n GLY 147 N -0.73 -1.16 0.00 0.62 0.00 -1.26 -4.41 105.19 98.25 2kc0 n GLY 147 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 2kc0 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kc0 n GLY 148 N 0.75 2.32 3.15 -0.02 0.00 -1.26 -4.74 105.19 105.38 2kc0 n GLY 148 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 2kc0 n GLY 148 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2kc0 s ARG 149 N 2.30 0.69 -0.14 1.61 1.70 -1.26 -1.20 118.95 122.66 2kc0 s ARG 149 Ca 0.00 -0.92 0.01 0.00 -0.47 0.00 0.00 55.73 54.35 2kc0 s ARG 149 Cb 0.00 0.27 0.02 0.00 -0.57 0.00 0.00 34.95 34.67 2kc0 s ARG 149 CO 0.00 -0.18 -0.16 0.00 -1.08 0.00 0.00 175.30 173.87 2kc0 s ALA 150 N -3.34 1.91 0.41 7.88 0.00 -0.54 -4.90 121.76 123.18 2kc0 s ALA 150 Ca 0.01 -0.91 -0.23 0.00 0.00 0.00 0.00 51.96 50.84 2kc0 s ALA 150 Cb 0.03 -0.98 -0.10 0.00 0.00 0.00 0.00 23.12 22.08 2kc0 s ALA 150 CO -0.08 -0.21 0.99 0.99 0.00 0.00 0.00 175.76 177.45 2kc0 s THR 151 N 1.17 4.07 0.05 0.00 2.01 -1.26 -1.74 115.64 119.95 2kc0 s THR 151 Ca -0.01 1.46 -0.10 0.00 0.31 0.00 0.00 61.69 63.34 2kc0 s THR 151 Cb -0.14 -3.69 0.01 0.00 0.01 0.00 0.00 72.50 68.69 2kc0 s THR 151 CO -0.06 -0.11 0.22 -0.31 -0.69 0.00 0.00 174.62 173.66 2kc0 s TYR 152 N -1.88 0.04 -0.01 4.92 2.02 0.01 -4.72 117.35 117.72 2kc0 s TYR 152 Ca 0.59 -0.29 0.02 0.00 -0.37 0.00 0.00 57.07 57.02 2kc0 s TYR 152 Cb -0.16 -0.01 0.00 0.00 -0.40 0.00 0.00 41.96 41.40 2kc0 s TYR 152 CO 0.20 -0.47 -0.05 0.50 -1.57 0.00 0.00 175.55 174.16 2kc0 s ARG 153 N -2.84 0.55 0.09 -0.62 3.00 -1.25 -1.74 118.95 116.14 2kc0 s ARG 153 Ca -0.03 -0.18 0.02 0.00 -1.00 0.00 0.00 55.73 54.54 2kc0 s ARG 153 Cb 0.00 -0.54 -0.04 0.00 0.00 0.00 0.00 34.95 34.37 2kc0 s ARG 153 CO -0.05 0.08 -0.07 0.20 0.00 0.00 0.00 175.30 175.46 2kc0 s GLY 154 N 0.11 0.75 -0.13 8.12 0.00 -0.20 -2.69 107.32 113.27 2kc0 s GLY 154 Ca -0.01 -1.29 -0.06 0.00 0.00 0.00 0.00 44.72 43.35 2kc0 s GLY 154 CO -0.00 -1.39 0.11 -1.59 0.00 0.00 0.00 173.10 170.22 2kc0 s THR 155 N -3.37 5.20 0.16 0.90 2.01 0.05 -1.98 115.64 118.62 2kc0 s THR 155 Ca 0.10 0.10 0.06 0.00 0.31 0.00 0.00 61.69 62.25 2kc0 s THR 155 Cb 0.04 -3.28 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 2kc0 s THR 155 CO -0.04 0.58 0.08 0.00 -0.69 0.00 0.00 174.62 174.55 2kc0 s ALA 156 N -0.68 3.43 -0.24 7.40 0.00 -1.26 -2.66 121.76 127.75 2kc0 s ALA 156 Ca 0.13 -1.26 -0.15 0.00 0.00 0.00 0.00 51.96 50.67 2kc0 s ALA 156 Cb -0.12 -1.23 0.07 0.00 0.00 0.00 0.00 23.12 21.85 2kc0 s ALA 156 CO 0.03 0.51 0.60 -0.59 0.00 0.00 0.00 175.76 176.30 2kc0 s PHE 157 N -1.72 -0.86 0.18 0.00 -0.71 -1.20 -4.73 117.98 108.93 2kc0 s PHE 157 Ca 0.29 1.81 -0.22 0.00 -1.04 0.00 0.00 56.93 57.78 2kc0 s PHE 157 Cb -0.10 0.46 0.06 0.00 -1.21 0.00 0.00 43.02 42.22 2kc0 s PHE 157 CO 0.21 -0.44 0.59 0.20 -1.34 0.00 0.00 175.22 174.45 2kc0 s GLY 158 N 1.31 -0.47 -1.23 1.99 0.00 -1.26 -2.04 107.32 105.61 2kc0 s GLY 158 Ca -0.08 0.28 -0.11 0.00 0.00 0.00 0.00 44.72 44.81 2kc0 s GLY 158 CO -0.14 0.05 1.64 -1.26 0.00 0.00 0.00 173.10 173.39 2kc0 n SER 159 N -0.37 5.24 0.00 1.64 2.88 -1.26 -3.49 113.62 118.25 2kc0 n SER 159 Ca -0.15 -3.07 0.00 0.00 -1.33 0.00 0.00 58.87 54.33 2kc0 n SER 159 Cb 0.64 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.60 2kc0 n SER 159 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2kc0 n ASP 160 N 4.43 0.00 0.00 -3.46 5.68 -1.26 -4.98 116.55 116.96 2kc0 n ASP 160 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.66 2kc0 n ASP 160 Cb 0.39 0.39 0.00 0.00 -1.14 0.00 0.00 41.12 40.76 2kc0 n ASP 160 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2kc0 n ASP 161 N -2.24 0.00 0.00 -1.12 5.68 -1.26 -5.02 116.55 112.59 2kc0 n ASP 161 Ca 0.00 -0.85 0.00 0.00 -0.50 0.00 0.00 54.79 53.44 2kc0 n ASP 161 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2kc0 n ASP 161 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2kc0 n ALA 162 N 0.00 0.00 0.00 2.12 0.00 -1.23 -4.59 120.51 116.81 2kc0 n ALA 162 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2kc0 n ALA 162 Cb 0.36 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2kc0 n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kc0 n GLY 163 N -1.02 1.33 0.00 0.00 0.00 -1.26 -3.27 105.19 100.96 2kc0 n GLY 163 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kc0 n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kc0 n GLY 164 N -1.33 0.34 3.77 -0.02 0.00 -1.25 -4.84 105.19 101.87 2kc0 n GLY 164 Ca 0.00 -1.39 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 2kc0 n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kc0 s LYS 165 N -5.16 4.25 0.16 1.61 -0.14 -1.26 -4.24 119.74 114.96 2kc0 s LYS 165 Ca 0.00 1.91 0.06 0.00 -1.36 0.00 0.00 55.97 56.59 2kc0 s LYS 165 Cb 0.00 -2.87 -0.04 0.00 -1.68 0.00 0.00 37.83 33.23 2kc0 s LYS 165 CO 0.00 -0.17 -0.14 -0.48 -0.76 0.00 0.00 175.35 173.80 2kc0 s LEU 166 N -2.11 2.49 -0.01 3.17 -0.00 -0.84 -3.41 118.68 117.96 2kc0 s LEU 166 Ca 0.53 -0.93 0.02 0.00 -0.00 0.00 0.00 54.13 53.75 2kc0 s LEU 166 Cb -0.33 -0.58 -0.03 0.00 -0.00 0.00 0.00 46.19 45.25 2kc0 s LEU 166 CO 0.42 -0.18 -0.04 -0.89 -0.00 0.00 0.00 176.35 175.66 2kc0 s THR 167 N -2.66 3.85 0.02 5.48 2.01 -0.47 -1.04 115.64 122.83 2kc0 s THR 167 Ca 0.16 -0.66 -0.00 0.00 0.31 0.00 0.00 61.69 61.50 2kc0 s THR 167 Cb -0.02 -2.68 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 2kc0 s THR 167 CO 0.04 0.42 -0.03 -0.47 -0.69 0.00 0.00 174.62 173.89 2kc0 s TYR 168 N -1.00 0.26 -0.01 4.92 6.14 -0.71 -0.95 117.35 126.00 2kc0 s TYR 168 Ca 0.17 -0.54 -0.08 0.00 0.64 0.00 0.00 57.07 57.26 2kc0 s TYR 168 Cb -0.11 -0.19 0.01 0.00 0.42 0.00 0.00 41.96 42.08 2kc0 s TYR 168 CO 0.07 -0.20 0.17 -0.08 0.64 0.00 0.00 175.55 176.16 2kc0 s THR 169 N -1.51 0.07 -0.14 4.34 -1.32 -0.34 -0.81 115.64 115.91 2kc0 s THR 169 Ca -0.15 -0.55 -0.01 0.00 -1.21 0.00 0.00 61.69 59.76 2kc0 s THR 169 Cb -0.10 -0.44 0.04 0.00 -1.51 0.00 0.00 72.50 70.50 2kc0 s THR 169 CO -0.01 -0.30 -0.02 -0.51 -2.21 0.00 0.00 174.62 171.56 2kc0 s ILE 170 N -1.14 0.80 -0.95 5.08 2.07 -0.71 -1.61 121.20 124.74 2kc0 s ILE 170 Ca -0.12 -0.40 -0.21 0.00 -1.41 0.00 0.00 60.65 58.51 2kc0 s ILE 170 Cb -0.06 -1.03 -0.12 0.00 0.13 0.00 0.00 42.46 41.39 2kc0 s ILE 170 CO 0.02 0.11 1.94 0.47 -1.91 0.00 0.00 174.94 175.57 2kc0 n ASP 171 N 4.98 2.87 -0.35 4.50 8.00 -0.21 -1.47 116.55 134.87 2kc0 n ASP 171 Ca -0.10 -2.71 0.24 0.00 0.71 0.00 0.00 54.79 52.93 2kc0 n ASP 171 Cb 0.48 -1.34 0.49 0.00 -0.02 0.00 0.00 41.12 40.73 2kc0 n ASP 171 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2kc0 h PHE 172 N 8.21 0.86 -0.91 1.24 -1.00 -1.46 0.54 116.94 124.41 2kc0 h PHE 172 Ca 0.38 0.03 0.03 0.00 2.81 0.00 0.00 57.97 61.23 2kc0 h PHE 172 Cb 0.74 -0.23 -0.05 0.00 3.61 0.00 0.00 35.95 40.02 2kc0 h PHE 172 CO 1.26 -0.10 0.59 0.00 -1.61 0.00 0.00 178.31 178.44 2kc0 h ALA 173 N 1.77 1.20 -0.01 2.45 0.00 -1.47 -3.21 119.26 119.98 2kc0 h ALA 173 Ca 0.71 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.58 2kc0 h ALA 173 Cb 1.68 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2kc0 h ALA 173 CO -0.52 0.45 -0.11 0.00 0.00 0.00 0.00 179.25 179.08 2kc0 n ALA 174 N -2.35 2.69 -3.74 0.00 0.00 0.11 -5.01 120.51 112.21 2kc0 n ALA 174 Ca 0.12 -0.55 -0.24 0.00 0.00 0.00 0.00 53.44 52.76 2kc0 n ALA 174 Cb 0.09 -0.44 0.04 0.00 0.00 0.00 0.00 19.45 19.14 2kc0 n ALA 174 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2kc0 n LYS 175 N 0.35 -5.64 -4.46 0.00 4.01 0.17 -4.89 118.16 107.69 2kc0 n LYS 175 Ca 0.07 0.66 -0.33 0.00 -0.51 0.00 0.00 58.31 58.19 2kc0 n LYS 175 Cb 0.30 -5.43 -0.16 0.00 -0.51 0.00 0.00 35.03 29.24 2kc0 n LYS 175 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 2kc0 s GLN 176 N -6.18 3.12 -0.26 1.97 -0.21 -1.21 -2.42 119.66 114.48 2kc0 s GLN 176 Ca 0.30 -0.79 -0.05 0.00 0.02 0.00 0.00 55.36 54.83 2kc0 s GLN 176 Cb -0.14 -2.58 -0.00 0.00 1.00 0.00 0.00 33.01 31.29 2kc0 s GLN 176 CO 0.80 -0.05 0.03 0.20 -2.12 0.00 0.00 175.29 174.15 2kc0 s GLY 177 N 0.94 1.71 0.37 3.09 0.00 -0.29 -1.05 107.32 112.09 2kc0 s GLY 177 Ca -0.03 -1.32 0.04 0.00 0.00 0.00 0.00 44.72 43.40 2kc0 s GLY 177 CO -0.03 0.55 0.07 0.21 0.00 0.00 0.00 173.10 173.91 2kc0 s ASN 178 N 1.49 2.73 0.00 1.64 3.84 -0.63 -2.08 114.94 121.93 2kc0 s ASN 178 Ca 0.04 -1.50 0.00 0.00 0.21 0.00 0.00 52.86 51.61 2kc0 s ASN 178 Cb -0.16 0.16 0.00 0.00 -0.55 0.00 0.00 41.25 40.70 2kc0 s ASN 178 CO 0.00 -0.73 0.00 0.61 -2.79 0.00 0.00 177.10 174.19 2kc0 n GLY 179 N -0.83 0.81 3.63 1.21 0.00 -1.26 -1.20 105.19 107.55 2kc0 n GLY 179 Ca -0.05 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 2kc0 n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kc0 s LYS 180 N -1.88 0.69 0.09 1.61 -2.85 -0.12 -3.23 119.74 114.05 2kc0 s LYS 180 Ca 0.00 0.82 -0.06 0.00 -1.00 0.00 0.00 55.97 55.73 2kc0 s LYS 180 Cb 0.00 0.33 -0.05 0.00 -2.06 0.00 0.00 37.83 36.05 2kc0 s LYS 180 CO 0.00 -0.08 0.35 0.42 0.10 0.00 0.00 175.35 176.14 2kc0 s ILE 181 N 0.32 5.19 0.00 3.79 -1.09 -0.84 -1.37 121.20 127.20 2kc0 s ILE 181 Ca 0.01 0.15 0.08 0.00 -2.23 0.00 0.00 60.65 58.66 2kc0 s ILE 181 Cb -0.05 -3.62 0.13 0.00 -1.58 0.00 0.00 42.46 37.34 2kc0 s ILE 181 CO -0.02 0.18 0.96 1.21 -1.23 0.00 0.00 174.94 176.03 2kc0 n GLU 182 N 0.52 0.00 -3.19 2.79 2.13 -1.22 -4.06 120.64 117.61 2kc0 n GLU 182 Ca -0.06 -1.11 -0.21 0.00 0.66 0.00 0.00 57.16 56.44 2kc0 n GLU 182 Cb 0.52 0.08 -0.05 0.00 0.27 0.00 0.00 31.44 32.26 2kc0 n GLU 182 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 2kc0 n HIS 183 N 0.15 0.27 -4.32 4.31 8.25 -1.26 -4.97 115.22 117.64 2kc0 n HIS 183 Ca -0.07 -3.75 -0.18 0.00 -0.26 0.00 0.00 57.72 53.46 2kc0 n HIS 183 Cb 0.80 -0.40 -0.10 0.00 1.12 0.00 0.00 29.99 31.41 2kc0 n HIS 183 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2kc0 s LEU 184 N -2.03 2.55 0.27 2.41 2.01 -1.26 -3.80 118.68 118.82 2kc0 s LEU 184 Ca 0.39 -1.01 0.19 0.00 0.01 0.00 0.00 54.13 53.70 2kc0 s LEU 184 Cb 0.28 -0.61 1.01 0.00 0.01 0.00 0.00 46.19 46.87 2kc0 s LEU 184 CO -0.09 -0.20 1.59 2.29 1.01 0.00 0.00 176.35 180.94 2kc0 n LYS 185 N -0.32 0.13 -3.86 1.70 -0.00 -1.26 -4.49 118.16 110.06 2kc0 n LYS 185 Ca -0.09 0.60 -0.12 0.00 -0.00 0.00 0.00 58.31 58.70 2kc0 n LYS 185 Cb 0.60 -1.89 -0.13 0.00 -0.00 0.00 0.00 35.03 33.62 2kc0 n LYS 185 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2kc0 s SER 186 N -3.92 -0.04 0.34 -5.58 0.01 -1.26 -5.08 113.70 98.18 2kc0 s SER 186 Ca -0.01 0.06 0.07 0.00 1.31 0.00 0.00 55.95 57.38 2kc0 s SER 186 Cb 0.06 0.16 0.63 0.00 0.21 0.00 0.00 66.02 67.08 2kc0 s SER 186 CO 0.19 -0.09 1.84 1.55 0.41 0.00 0.00 173.24 177.14 2kc0 h PRO 187 N 5.72 0.32 0.00 12.44 0.13 -1.98 -1.82 132.00 146.80 2kc0 h PRO 187 Ca -0.26 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2kc0 h PRO 187 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2kc0 h PRO 187 CO 0.45 0.50 0.00 1.05 -0.23 0.00 0.00 178.00 179.77 2kc0 h GLU 188 N 0.29 0.00 0.00 0.86 4.11 -1.98 -1.48 114.58 116.38 2kc0 h GLU 188 Ca 0.05 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.42 2kc0 h GLU 188 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2kc0 h GLU 188 CO 0.03 0.00 -0.60 -0.07 0.07 0.00 0.00 179.01 178.44 2kc0 h LEU 189 N 0.00 0.00 -9.44 3.06 -0.00 -1.67 -3.27 115.31 103.99 2kc0 h LEU 189 Ca 0.00 0.00 -0.53 0.00 -0.00 0.00 0.00 57.88 57.35 2kc0 h LEU 189 Cb 0.08 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 40.77 2kc0 h LEU 189 CO 0.00 0.27 1.16 0.20 -0.00 0.00 0.00 178.44 180.07 2kc0 s ASN 190 N -6.06 6.44 0.06 -0.43 0.02 -0.56 -4.13 114.94 110.28 2kc0 s ASN 190 Ca 0.03 2.71 0.05 0.00 -1.02 0.00 0.00 52.86 54.63 2kc0 s ASN 190 Cb 0.07 -2.55 -0.04 0.00 0.02 0.00 0.00 41.25 38.76 2kc0 s ASN 190 CO 0.74 -1.02 -0.06 0.68 0.02 0.00 0.00 177.10 177.46 2kc0 s VAL 191 N 3.48 3.63 0.20 1.60 -7.23 -1.26 -4.70 120.40 116.13 2kc0 s VAL 191 Ca 0.84 -1.00 -0.30 0.00 -1.81 0.00 0.00 61.98 59.71 2kc0 s VAL 191 Cb -0.44 -2.66 -0.08 0.00 0.56 0.00 0.00 36.38 33.76 2kc0 s VAL 191 CO 0.38 0.23 1.02 -1.81 -0.31 0.00 0.00 175.10 174.62 2kc0 s ASP 192 N -1.90 7.44 -0.11 4.85 1.11 -1.26 -1.98 116.67 124.82 2kc0 s ASP 192 Ca 0.21 2.02 -0.16 0.00 0.18 0.00 0.00 52.55 54.80 2kc0 s ASP 192 Cb -0.11 -2.61 -0.05 0.00 1.07 0.00 0.00 42.92 41.22 2kc0 s ASP 192 CO 0.12 -0.05 0.39 -0.22 1.18 0.00 0.00 175.17 176.60 2kc0 s LEU 193 N -0.77 4.30 -0.24 1.23 0.20 -1.20 -4.23 118.68 117.97 2kc0 s LEU 193 Ca 0.45 0.73 -0.29 0.00 0.69 0.00 0.00 54.13 55.71 2kc0 s LEU 193 Cb -0.28 -2.55 -0.01 0.00 -0.43 0.00 0.00 46.19 42.93 2kc0 s LEU 193 CO 0.34 0.10 1.31 0.00 -0.29 0.00 0.00 176.35 177.81 2kc0 s ALA 194 N 0.25 3.47 0.11 5.97 0.00 -0.80 -4.23 121.76 126.52 2kc0 s ALA 194 Ca 0.22 0.26 -0.35 0.00 0.00 0.00 0.00 51.96 52.10 2kc0 s ALA 194 Cb -0.15 -3.72 -0.14 0.00 0.00 0.00 0.00 23.12 19.11 2kc0 s ALA 194 CO 0.08 -1.56 1.57 0.00 0.00 0.00 0.00 175.76 175.85 2kc0 n ALA 195 N 7.31 0.83 -2.27 0.00 0.00 -1.26 -4.14 120.51 120.98 2kc0 n ALA 195 Ca 0.15 0.44 -0.15 0.00 0.00 0.00 0.00 53.44 53.88 2kc0 n ALA 195 Cb 0.46 -2.31 -0.10 0.00 0.00 0.00 0.00 19.45 17.49 2kc0 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kc0 s ALA 196 N 1.27 1.50 0.36 0.00 0.00 -0.88 -4.92 121.76 119.08 2kc0 s ALA 196 Ca 0.82 -1.61 0.08 0.00 0.00 0.00 0.00 51.96 51.25 2kc0 s ALA 196 Cb -0.74 0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 2kc0 s ALA 196 CO 0.42 -0.24 0.20 0.16 0.00 0.00 0.00 175.76 176.30 2kc0 s ASP 197 N -3.21 4.77 0.25 0.00 -4.77 -1.26 -1.14 116.67 111.31 2kc0 s ASP 197 Ca 0.23 -0.78 -0.30 0.00 -3.30 0.00 0.00 52.55 48.40 2kc0 s ASP 197 Cb 0.05 -0.70 -0.09 0.00 -1.09 0.00 0.00 42.92 41.09 2kc0 s ASP 197 CO 0.04 -0.39 1.14 -0.51 0.70 0.00 0.00 175.17 176.15 2kc0 s ILE 198 N -2.44 3.48 0.13 2.11 1.10 -1.01 -4.09 121.20 120.47 2kc0 s ILE 198 Ca 0.40 1.40 0.08 0.00 -0.51 0.00 0.00 60.65 62.02 2kc0 s ILE 198 Cb -0.02 -3.89 -0.04 0.00 0.15 0.00 0.00 42.46 38.66 2kc0 s ILE 198 CO 0.24 0.29 -0.14 -0.54 -2.11 0.00 0.00 174.94 172.69 2kc0 s LYS 199 N -1.04 1.94 0.00 3.50 1.02 -0.61 -4.98 119.74 119.57 2kc0 s LYS 199 Ca 0.48 -1.17 -0.00 0.00 0.02 0.00 0.00 55.97 55.29 2kc0 s LYS 199 Cb -0.33 -2.17 -0.02 0.00 -0.52 0.00 0.00 37.83 34.80 2kc0 s LYS 199 CO 0.40 0.47 2.07 -0.35 -0.92 0.00 0.00 175.35 177.02 2kc0 n PRO 200 N 0.55 1.04 -3.72 -1.68 -0.04 -1.26 -3.41 135.00 126.48 2kc0 n PRO 200 Ca -0.14 -0.06 -0.34 0.00 -0.04 0.00 0.00 63.50 62.93 2kc0 n PRO 200 Cb 0.53 -1.06 -0.05 0.00 -0.04 0.00 0.00 33.50 32.88 2kc0 n PRO 200 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2kc0 s ASP 201 N 2.00 6.52 0.00 3.54 1.01 -1.26 -4.93 116.67 123.55 2kc0 s ASP 201 Ca 0.04 0.60 0.00 0.00 0.71 0.00 0.00 52.55 53.90 2kc0 s ASP 201 Cb 0.02 -2.10 0.00 0.00 1.01 0.00 0.00 42.92 41.84 2kc0 s ASP 201 CO 0.00 0.22 0.00 0.61 0.21 0.00 0.00 175.17 176.21 2kc0 n GLY 202 N 0.95 -1.61 0.00 0.21 0.00 -1.26 -3.74 105.19 99.75 2kc0 n GLY 202 Ca -0.10 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2kc0 n GLY 202 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2kc0 n LYS 203 N 0.82 0.00 0.00 1.61 2.85 -1.26 -0.97 118.16 121.21 2kc0 n LYS 203 Ca 0.00 0.14 0.00 0.00 -1.05 0.00 0.00 58.31 57.40 2kc0 n LYS 203 Cb 0.00 -1.66 0.00 0.00 -0.65 0.00 0.00 35.03 32.72 2kc0 n LYS 203 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 2kc0 n ARG 204 N -1.03 0.00 0.00 -1.58 1.85 -1.26 -5.13 116.66 109.51 2kc0 n ARG 204 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2kc0 n ARG 204 Cb 0.16 -0.35 0.00 0.00 -1.05 0.00 0.00 32.46 31.22 2kc0 n ARG 204 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 2kc0 n HIS 205 N 0.00 0.00 -3.92 2.89 1.44 -0.14 -4.17 115.22 111.32 2kc0 n HIS 205 Ca 0.00 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.59 2kc0 n HIS 205 Cb 0.18 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.28 2kc0 n HIS 205 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2kc0 n ALA 206 N -3.00 -0.68 -3.19 1.59 0.00 -1.25 -4.69 120.51 109.29 2kc0 n ALA 206 Ca 0.00 -1.38 -0.09 0.00 0.00 0.00 0.00 53.44 51.97 2kc0 n ALA 206 Cb 0.00 1.11 -0.05 0.00 0.00 0.00 0.00 19.45 20.51 2kc0 n ALA 206 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2kc0 s VAL 207 N -2.61 0.01 -0.16 0.00 -7.23 -1.22 -4.77 120.40 104.41 2kc0 s VAL 207 Ca 0.23 -1.25 0.01 0.00 -1.81 0.00 0.00 61.98 59.16 2kc0 s VAL 207 Cb -0.02 -2.02 0.01 0.00 0.56 0.00 0.00 36.38 34.91 2kc0 s VAL 207 CO 0.17 -0.06 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.07 2kc0 s ILE 208 N -3.98 2.22 -0.12 -0.62 -1.09 -0.88 -1.57 121.20 115.16 2kc0 s ILE 208 Ca 0.18 -0.91 -0.04 0.00 -2.23 0.00 0.00 60.65 57.66 2kc0 s ILE 208 Cb -0.01 -1.92 0.05 0.00 -1.58 0.00 0.00 42.46 39.01 2kc0 s ILE 208 CO 0.05 0.53 0.08 -0.44 -1.23 0.00 0.00 174.94 173.94 2kc0 s SER 209 N 1.04 1.79 0.00 3.58 0.01 -1.26 -1.61 113.70 117.26 2kc0 s SER 209 Ca -0.01 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 56.95 2kc0 s SER 209 Cb -0.14 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 65.92 2kc0 s SER 209 CO -0.06 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 173.89 2kc0 n GLY 210 N 5.29 4.55 3.82 3.44 0.00 -0.61 -4.76 105.19 116.91 2kc0 n GLY 210 Ca -0.05 -1.69 -0.25 0.00 0.00 0.00 0.00 46.02 44.03 2kc0 n GLY 210 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kc0 s SER 211 N -0.40 5.58 -0.05 1.61 0.01 -1.26 -0.84 113.70 118.36 2kc0 s SER 211 Ca 0.00 -0.15 -0.02 0.00 1.31 0.00 0.00 55.95 57.09 2kc0 s SER 211 Cb 0.00 -1.46 0.03 0.00 0.21 0.00 0.00 66.02 64.80 2kc0 s SER 211 CO 0.00 0.03 0.09 -0.69 0.41 0.00 0.00 173.24 173.08 2kc0 s VAL 212 N -1.88 -0.10 0.71 3.43 1.01 -0.95 -1.90 120.40 120.72 2kc0 s VAL 212 Ca 0.32 0.27 -0.12 0.00 0.00 0.00 0.00 61.98 62.45 2kc0 s VAL 212 Cb -0.09 -0.17 0.17 0.00 0.00 0.00 0.00 36.38 36.29 2kc0 s VAL 212 CO 0.24 0.11 0.75 0.18 0.00 0.00 0.00 175.10 176.39 2kc0 n LEU 213 N 4.58 0.00 -3.55 3.92 4.77 -1.26 -0.58 117.00 124.87 2kc0 n LEU 213 Ca -0.19 -0.81 -0.01 0.00 -0.03 0.00 0.00 56.01 54.96 2kc0 n LEU 213 Cb 0.50 -0.64 -0.04 0.00 -2.33 0.00 0.00 43.42 40.91 2kc0 n LEU 213 CO 0.15 -1.48 0.20 -0.47 -1.33 0.00 0.00 177.39 174.46 2kc0 s TYR 214 N -2.49 -1.30 -1.46 -1.77 5.04 -0.35 -4.69 117.35 110.32 2kc0 s TYR 214 Ca 0.46 2.07 -0.09 0.00 -2.44 0.00 0.00 57.07 57.06 2kc0 s TYR 214 Cb -0.03 0.67 0.06 0.00 0.35 0.00 0.00 41.96 43.01 2kc0 s TYR 214 CO 0.34 -0.68 0.90 -1.71 -1.34 0.00 0.00 175.55 173.06 2kc0 n ASN 215 N 5.44 -3.72 -3.73 4.32 5.15 -1.26 -1.38 115.26 120.07 2kc0 n ASN 215 Ca -0.09 -0.79 -0.29 0.00 -0.60 0.00 0.00 54.58 52.81 2kc0 n ASN 215 Cb 0.49 -3.96 -0.01 0.00 -0.53 0.00 0.00 39.78 35.77 2kc0 n ASN 215 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kc0 n GLN 216 N -4.58 -3.39 0.00 1.20 1.13 -1.23 -4.88 117.38 105.63 2kc0 n GLN 216 Ca -0.07 0.42 0.00 0.00 -1.94 0.00 0.00 57.00 55.42 2kc0 n GLN 216 Cb 0.57 -5.15 0.00 0.00 0.11 0.00 0.00 30.24 25.78 2kc0 n GLN 216 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2kc0 n ALA 217 N -3.91 0.00 -1.38 -1.58 0.00 -0.48 -5.14 120.51 108.02 2kc0 n ALA 217 Ca 0.03 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.66 2kc0 n ALA 217 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 2kc0 n ALA 217 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2kc0 n GLU 218 N 0.00 -2.78 -3.39 0.00 4.07 -1.25 -1.21 120.64 116.07 2kc0 n GLU 218 Ca 0.00 1.85 -0.18 0.00 -0.06 0.00 0.00 57.16 58.76 2kc0 n GLU 218 Cb 0.00 -3.39 -0.09 0.00 -0.06 0.00 0.00 31.44 27.90 2kc0 n GLU 218 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2kc0 s LYS 219 N -2.23 0.48 0.25 5.31 1.02 -1.26 -4.62 119.74 118.68 2kc0 s LYS 219 Ca 0.00 -0.57 0.04 0.00 0.02 0.00 0.00 55.97 55.46 2kc0 s LYS 219 Cb 0.00 -0.76 0.04 0.00 -0.52 0.00 0.00 37.83 36.60 2kc0 s LYS 219 CO 0.00 -1.12 0.35 0.41 -0.92 0.00 0.00 175.35 174.07 2kc0 n GLY 220 N 4.74 1.91 3.31 -3.33 0.00 0.25 -4.00 105.19 108.07 2kc0 n GLY 220 Ca 0.05 -2.17 -0.09 0.00 0.00 0.00 0.00 46.02 43.81 2kc0 n GLY 220 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kc0 s SER 221 N -2.56 0.00 0.11 1.61 1.04 -0.75 -2.24 113.70 110.91 2kc0 s SER 221 Ca 0.26 -0.70 0.02 0.00 0.48 0.00 0.00 55.95 56.02 2kc0 s SER 221 Cb -0.02 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.48 2kc0 s SER 221 CO 0.17 -0.85 -0.07 -0.72 0.98 0.00 0.00 173.24 172.74 2kc0 s TYR 222 N -3.91 0.97 -0.04 5.02 1.13 -0.02 -1.10 117.35 119.40 2kc0 s TYR 222 Ca 0.11 -0.86 -0.07 0.00 -1.41 0.00 0.00 57.07 54.84 2kc0 s TYR 222 Cb 0.03 -0.54 0.01 0.00 -1.10 0.00 0.00 41.96 40.36 2kc0 s TYR 222 CO -0.05 -0.09 0.17 -1.54 -2.51 0.00 0.00 175.55 171.52 2kc0 s SER 223 N -3.01 -0.12 0.12 -0.18 1.04 -0.10 -1.58 113.70 109.86 2kc0 s SER 223 Ca 0.12 0.18 -0.14 0.00 0.48 0.00 0.00 55.95 56.59 2kc0 s SER 223 Cb 0.04 0.31 0.03 0.00 0.10 0.00 0.00 66.02 66.50 2kc0 s SER 223 CO -0.03 -0.16 0.35 -1.48 0.98 0.00 0.00 173.24 172.89 2kc0 s LEU 224 N -0.37 0.66 0.18 2.42 0.05 -0.63 -1.12 118.68 119.87 2kc0 s LEU 224 Ca -0.05 -0.40 0.08 0.00 0.05 0.00 0.00 54.13 53.81 2kc0 s LEU 224 Cb -0.03 1.63 -0.04 0.00 -2.05 0.00 0.00 46.19 45.70 2kc0 s LEU 224 CO 0.01 -0.82 -0.17 -0.83 -0.55 0.00 0.00 176.35 173.99 2kc0 s GLY 225 N -2.82 1.40 0.08 -3.48 0.00 -0.56 -2.07 107.32 99.87 2kc0 s GLY 225 Ca 0.03 -1.54 -0.20 0.00 0.00 0.00 0.00 44.72 43.01 2kc0 s GLY 225 CO -0.12 -1.61 0.60 -0.42 0.00 0.00 0.00 173.10 171.55 2kc0 s ILE 226 N -2.35 4.70 -0.01 0.90 -1.09 -1.26 -2.66 121.20 119.43 2kc0 s ILE 226 Ca 0.18 1.28 0.06 0.00 -2.23 0.00 0.00 60.65 59.94 2kc0 s ILE 226 Cb -0.04 -3.93 -0.02 0.00 -1.58 0.00 0.00 42.46 36.89 2kc0 s ILE 226 CO 0.07 0.54 -0.19 -0.36 -1.23 0.00 0.00 174.94 173.77 2kc0 s PHE 227 N -1.07 1.73 0.00 3.97 0.08 -0.58 -4.77 117.98 117.35 2kc0 s PHE 227 Ca 0.30 -0.33 0.00 0.00 0.12 0.00 0.00 56.93 57.02 2kc0 s PHE 227 Cb -0.20 -1.11 0.00 0.00 -0.57 0.00 0.00 43.02 41.14 2kc0 s PHE 227 CO 0.20 -0.02 0.00 0.41 -0.10 0.00 0.00 175.22 175.71 2kc0 n GLY 228 N 2.53 -2.54 0.33 4.36 0.00 -1.26 -1.61 105.19 107.00 2kc0 n GLY 228 Ca -0.15 -1.15 0.22 0.00 0.00 0.00 0.00 46.02 44.94 2kc0 n GLY 228 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kc0 h GLY 229 N 0.00 0.00 -2.69 -0.02 0.00 -1.97 -1.23 103.07 97.16 2kc0 h GLY 229 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.99 2kc0 h GLY 229 CO 0.00 0.00 -0.39 0.28 0.00 0.00 0.00 176.54 176.43 2kc0 n LYS 230 N -3.09 2.59 -3.28 4.80 5.02 -1.26 -4.62 118.16 118.33 2kc0 n LYS 230 Ca -0.03 -3.63 -0.14 0.00 -2.02 0.00 0.00 58.31 52.49 2kc0 n LYS 230 Cb 0.10 -2.01 0.05 0.00 -0.02 0.00 0.00 35.03 33.15 2kc0 n LYS 230 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kc0 n ALA 231 N -0.94 -2.51 0.03 7.82 0.00 -0.47 -4.96 120.51 119.48 2kc0 n ALA 231 Ca 0.37 0.04 -0.19 0.00 0.00 0.00 0.00 53.44 53.66 2kc0 n ALA 231 Cb 0.89 -4.26 -0.09 0.00 0.00 0.00 0.00 19.45 15.99 2kc0 n ALA 231 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2kc0 h GLN 232 N -0.76 0.70 -2.07 0.00 1.08 -1.47 -3.43 115.11 109.17 2kc0 h GLN 232 Ca -0.45 -0.70 0.17 0.00 -1.45 0.00 0.00 58.65 56.22 2kc0 h GLN 232 Cb 1.24 0.18 -0.14 0.00 -0.05 0.00 0.00 27.48 28.71 2kc0 h GLN 232 CO 0.41 1.29 0.58 -1.83 -0.95 0.00 0.00 178.83 178.32 2kc0 s GLU 233 N -3.44 0.76 -0.02 1.46 -1.05 -1.19 -1.46 118.70 113.77 2kc0 s GLU 233 Ca -0.10 -0.33 -0.02 0.00 -0.15 0.00 0.00 54.97 54.37 2kc0 s GLU 233 Cb 0.08 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 34.09 2kc0 s GLU 233 CO 0.91 -0.34 0.05 0.14 0.95 0.00 0.00 175.26 176.98 2kc0 s VAL 234 N -2.96 0.01 0.13 1.83 -7.23 -0.94 -1.53 120.40 109.71 2kc0 s VAL 234 Ca 0.08 -0.08 -0.12 0.00 -1.81 0.00 0.00 61.98 60.04 2kc0 s VAL 234 Cb -0.01 -0.11 0.01 0.00 0.56 0.00 0.00 36.38 36.84 2kc0 s VAL 234 CO -0.05 -0.05 0.32 0.00 -0.31 0.00 0.00 175.10 175.01 2kc0 s ALA 235 N -0.12 -0.53 0.00 1.32 0.00 -1.09 -1.47 121.76 119.87 2kc0 s ALA 235 Ca -0.02 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.54 2kc0 s ALA 235 Cb -0.01 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.77 2kc0 s ALA 235 CO 0.00 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.56 2kc0 n GLY 236 N -0.18 -0.66 3.47 0.00 0.00 -1.11 -1.49 105.19 105.22 2kc0 n GLY 236 Ca -0.14 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 2kc0 n GLY 236 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kc0 s SER 237 N -4.00 -0.51 -0.00 1.61 0.15 -0.27 -1.26 113.70 109.41 2kc0 s SER 237 Ca 0.00 0.13 0.08 0.00 0.70 0.00 0.00 55.95 56.86 2kc0 s SER 237 Cb 0.00 0.51 -0.02 0.00 -1.71 0.00 0.00 66.02 64.80 2kc0 s SER 237 CO 0.00 -0.78 -0.24 0.00 1.20 0.00 0.00 173.24 173.42 2kc0 s ALA 238 N -3.04 2.29 -0.17 5.45 0.00 -0.01 -0.93 121.76 125.36 2kc0 s ALA 238 Ca 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.82 2kc0 s ALA 238 Cb -0.01 -0.60 0.03 0.00 0.00 0.00 0.00 23.12 22.54 2kc0 s ALA 238 CO -0.08 0.54 -0.11 -1.21 0.00 0.00 0.00 175.76 174.90 2kc0 s GLU 239 N -0.87 2.02 -0.18 0.00 8.01 -0.26 -0.60 118.70 126.83 2kc0 s GLU 239 Ca 0.11 -0.63 -0.03 0.00 0.01 0.00 0.00 54.97 54.44 2kc0 s GLU 239 Cb -0.10 -2.16 -0.01 0.00 -4.31 0.00 0.00 34.13 27.55 2kc0 s GLU 239 CO 0.01 -0.33 -0.07 0.54 0.01 0.00 0.00 175.26 175.41 2kc0 s VAL 240 N 1.49 3.38 -0.14 2.63 0.11 -0.32 -1.81 120.40 125.75 2kc0 s VAL 240 Ca 0.02 -0.52 -0.09 0.00 -2.93 0.00 0.00 61.98 58.46 2kc0 s VAL 240 Cb -0.14 -2.49 -0.05 0.00 -1.53 0.00 0.00 36.38 32.17 2kc0 s VAL 240 CO -0.09 0.47 0.17 -1.59 -3.33 0.00 0.00 175.10 170.73 2kc0 s LYS 241 N 0.87 3.82 0.30 1.54 -2.85 -1.26 -0.89 119.74 121.27 2kc0 s LYS 241 Ca -0.02 -0.09 0.02 0.00 -1.00 0.00 0.00 55.97 54.88 2kc0 s LYS 241 Cb -0.15 -3.30 -0.01 0.00 -2.06 0.00 0.00 37.83 32.32 2kc0 s LYS 241 CO 0.01 0.55 0.36 0.25 0.10 0.00 0.00 175.35 176.62 2kc0 n THR 242 N 2.66 0.00 0.27 3.79 -2.24 0.19 -4.36 114.28 114.59 2kc0 n THR 242 Ca -0.17 -1.81 0.11 0.00 -2.27 0.00 0.00 64.05 59.90 2kc0 n THR 242 Cb 0.53 1.01 0.74 0.00 -2.10 0.00 0.00 70.33 70.51 2kc0 n THR 242 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2kc0 h VAL 243 N 1.92 0.80 0.00 2.28 3.04 -2.03 -0.95 116.25 121.31 2kc0 h VAL 243 Ca -0.23 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.35 2kc0 h VAL 243 Cb 1.05 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.40 2kc0 h VAL 243 CO 0.32 0.03 0.00 0.59 -1.01 0.00 0.00 177.57 177.50 2kc0 n ASN 244 N -4.19 0.00 0.00 3.17 3.02 -1.26 -5.03 115.26 110.97 2kc0 n ASN 244 Ca -0.03 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 2kc0 n ASN 244 Cb 0.12 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 2kc0 n ASN 244 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kc0 n GLY 245 N 0.55 -0.30 3.92 7.41 0.00 -0.36 -4.97 105.19 111.45 2kc0 n GLY 245 Ca 0.17 -1.27 -0.28 0.00 0.00 0.00 0.00 46.02 44.64 2kc0 n GLY 245 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kc0 s ILE 246 N 0.00 5.18 0.05 -0.61 2.07 -1.26 -0.64 121.20 125.99 2kc0 s ILE 246 Ca 0.00 -0.30 0.05 0.00 -1.41 0.00 0.00 60.65 58.99 2kc0 s ILE 246 Cb 0.00 -3.73 -0.02 0.00 0.13 0.00 0.00 42.46 38.84 2kc0 s ILE 246 CO 0.00 -0.19 -0.13 -0.60 -1.91 0.00 0.00 174.94 172.10 2kc0 s ARG 247 N -3.35 0.85 -0.12 3.50 6.06 -0.07 -4.98 118.95 120.83 2kc0 s ARG 247 Ca 0.39 -0.79 -0.02 0.00 -2.50 0.00 0.00 55.73 52.81 2kc0 s ARG 247 Cb -0.11 -0.83 -0.03 0.00 0.06 0.00 0.00 34.95 34.04 2kc0 s ARG 247 CO 0.29 0.20 -0.05 -1.01 -2.50 0.00 0.00 175.30 172.23 2kc0 s HIS 248 N -0.99 2.99 -0.08 5.12 3.76 -1.26 -1.18 115.29 123.66 2kc0 s HIS 248 Ca -0.00 -0.18 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 2kc0 s HIS 248 Cb -0.08 -1.86 0.02 0.00 1.11 0.00 0.00 32.58 31.77 2kc0 s HIS 248 CO 0.01 0.11 -0.06 0.42 -0.85 0.00 0.00 174.74 174.38 2kc0 s ILE 249 N -0.12 0.78 0.31 0.60 1.01 0.23 -4.62 121.20 119.40 2kc0 s ILE 249 Ca 0.02 -0.18 -0.28 0.00 0.00 0.00 0.00 60.65 60.20 2kc0 s ILE 249 Cb -0.13 -0.82 -0.09 0.00 0.01 0.00 0.00 42.46 41.43 2kc0 s ILE 249 CO 0.03 0.31 1.12 -0.83 0.00 0.00 0.00 174.94 175.57 2kc0 s GLY 250 N 1.44 3.00 -0.15 6.18 0.00 -0.87 -0.83 107.32 116.10 2kc0 s GLY 250 Ca -0.02 0.91 -0.11 0.00 0.00 0.00 0.00 44.72 45.50 2kc0 s GLY 250 CO -0.04 1.49 0.22 1.08 0.00 0.00 0.00 173.10 175.85 2kc0 s LEU 251 N -1.75 4.28 -0.28 0.66 2.01 -0.39 -3.61 118.68 119.60 2kc0 s LEU 251 Ca 0.48 0.46 -0.01 0.00 0.01 0.00 0.00 54.13 55.07 2kc0 s LEU 251 Cb -0.31 -2.25 0.13 0.00 0.01 0.00 0.00 46.19 43.77 2kc0 s LEU 251 CO 0.40 0.21 0.31 0.00 1.01 0.00 0.00 176.35 178.28 2kc0 s ALA 252 N -0.01 -0.59 0.19 4.21 0.00 -1.09 -2.75 121.76 121.72 2kc0 s ALA 252 Ca 0.14 -0.09 0.05 0.00 0.00 0.00 0.00 51.96 52.06 2kc0 s ALA 252 Cb -0.13 -1.78 -0.05 0.00 0.00 0.00 0.00 23.12 21.17 2kc0 s ALA 252 CO 0.03 -1.63 -0.09 0.00 0.00 0.00 0.00 175.76 174.07 2kc0 s ALA 253 N 2.40 1.73 -0.02 0.00 0.00 -0.55 -0.77 121.76 124.55 2kc0 s ALA 253 Ca 0.09 -1.62 -0.13 0.00 0.00 0.00 0.00 51.96 50.30 2kc0 s ALA 253 Cb -0.14 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.12 2kc0 s ALA 253 CO -0.29 -0.09 0.27 0.21 0.00 0.00 0.00 175.76 175.86 2kc0 s LYS 254 N -3.75 0.60 0.00 0.00 2.20 -1.10 -2.20 119.74 115.49 2kc0 s LYS 254 Ca 0.22 -0.18 0.16 0.00 -0.36 0.00 0.00 55.97 55.80 2kc0 s LYS 254 Cb 0.03 0.26 0.93 0.00 -1.51 0.00 0.00 37.83 37.54 2kc0 s LYS 254 CO 0.05 -0.16 1.34 0.94 -0.36 0.00 0.00 175.35 177.16