#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 0.67 0.13 0.00 0.00 -1.26 -3.69 105.19 101.04 2kc0 n GLY 15 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 1.39 0.25 -0.60 0.99 3.38 -1.97 -3.33 115.31 115.43 2kc0 h LEU 16 Ca 0.00 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2kc0 h LEU 16 Cb 0.31 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2kc0 h LEU 16 CO 0.00 0.99 0.31 0.00 0.09 0.00 0.00 178.44 179.83 2kc0 h ALA 17 N 1.00 0.77 -0.23 1.53 0.00 -1.76 -3.27 119.26 117.28 2kc0 h ALA 17 Ca -0.04 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.80 2kc0 h ALA 17 Cb 1.46 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 2kc0 h ALA 17 CO 0.13 0.30 -0.02 0.22 0.00 0.00 0.00 179.25 179.88 2kc0 h ASP 18 N 0.81 -0.14 0.24 0.00 3.58 -1.88 0.26 116.42 119.29 2kc0 h ASP 18 Ca 0.21 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.72 2kc0 h ASP 18 Cb 0.07 0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.24 2kc0 h ASP 18 CO -0.03 -0.04 0.00 0.00 -2.88 0.00 0.00 179.24 176.29 2kc0 n ALA 19 N -2.39 2.08 -0.06 -0.78 0.00 -1.24 -1.70 120.51 116.42 2kc0 n ALA 19 Ca -0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 53.44 53.28 2kc0 n ALA 19 Cb 0.13 -1.31 -0.11 0.00 0.00 0.00 0.00 19.45 18.16 2kc0 n ALA 19 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kc0 n LEU 20 N -1.20 0.00 0.11 0.00 7.99 -0.50 -4.62 117.00 118.78 2kc0 n LEU 20 Ca 0.11 0.00 0.07 0.00 -0.01 0.00 0.00 56.01 56.18 2kc0 n LEU 20 Cb 0.12 0.27 0.02 0.00 -0.11 0.00 0.00 43.42 43.72 2kc0 n LEU 20 CO 0.13 0.27 0.17 0.71 -1.51 0.00 0.00 177.39 177.17 2kc0 h THR 21 N 0.00 0.28 -3.51 -5.08 1.35 -0.83 -3.42 112.91 101.70 2kc0 h THR 21 Ca -0.30 -1.47 -0.13 0.00 -0.55 0.00 0.00 66.41 63.96 2kc0 h THR 21 Cb 1.62 1.90 -0.19 0.00 -1.73 0.00 0.00 68.15 69.75 2kc0 h THR 21 CO 0.02 0.16 -0.43 0.00 -0.25 0.00 0.00 175.52 175.02 2kc0 s ALA 22 N -3.15 -0.36 0.81 6.62 0.00 -0.69 -5.09 121.76 119.90 2kc0 s ALA 22 Ca 0.01 -0.20 -0.12 0.00 0.00 0.00 0.00 51.96 51.66 2kc0 s ALA 22 Cb 0.08 0.19 0.08 0.00 0.00 0.00 0.00 23.12 23.47 2kc0 s ALA 22 CO 0.76 -0.29 1.10 -1.25 0.00 0.00 0.00 175.76 176.09 2kc0 s PRO 23 N -2.01 1.99 0.00 0.00 0.04 -1.26 -4.28 135.00 129.48 2kc0 s PRO 23 Ca -0.10 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.52 2kc0 s PRO 23 Cb -0.04 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2kc0 s PRO 23 CO -0.01 -1.67 0.00 1.28 0.04 0.00 0.00 177.00 176.64 2kc0 n LEU 24 N -3.46 0.00 -3.81 -3.56 7.99 -1.26 -5.02 117.00 107.88 2kc0 n LEU 24 Ca 0.07 0.00 -0.12 0.00 -0.01 0.00 0.00 56.01 55.95 2kc0 n LEU 24 Cb 0.57 -0.05 -0.09 0.00 -0.11 0.00 0.00 43.42 43.74 2kc0 n LEU 24 CO 0.57 -0.12 -0.05 -0.62 -1.51 0.00 0.00 177.39 175.66 2kc0 s ASP 25 N -0.99 -0.08 0.05 -1.43 -1.08 -1.26 -5.10 116.67 106.79 2kc0 s ASP 25 Ca 0.00 -0.13 -0.25 0.00 -0.52 0.00 0.00 52.55 51.65 2kc0 s ASP 25 Cb 0.00 0.29 -0.17 0.00 -1.46 0.00 0.00 42.92 41.58 2kc0 s ASP 25 CO 0.00 -0.48 1.54 0.45 0.52 0.00 0.00 175.17 177.20 2kc0 h HIS 26 N 3.78 -0.15 0.00 -5.34 3.86 -1.99 -3.42 115.15 111.89 2kc0 h HIS 26 Ca -0.31 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 2kc0 h HIS 26 Cb 1.19 0.05 0.00 0.00 1.06 0.00 0.00 27.41 29.71 2kc0 h HIS 26 CO 0.53 0.05 -0.05 0.36 0.86 0.00 0.00 177.93 179.67 2kc0 n LYS 27 N -5.08 3.05 0.00 2.45 2.85 -1.26 -5.02 118.16 115.15 2kc0 n LYS 27 Ca -0.08 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.18 2kc0 n LYS 27 Cb 0.16 -0.30 0.00 0.00 -0.65 0.00 0.00 35.03 34.23 2kc0 n LYS 27 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2kc0 n ASP 28 N -0.13 0.00 -0.01 -5.58 -0.08 -1.26 -3.84 116.55 105.64 2kc0 n ASP 28 Ca 0.00 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.36 2kc0 n ASP 28 Cb 0.00 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.32 2kc0 n ASP 28 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2kc0 n LYS 29 N 13.73 0.60 0.00 -0.67 2.85 -1.26 -5.08 118.16 128.33 2kc0 n LYS 29 Ca 0.00 -0.15 0.00 0.00 -1.05 0.00 0.00 58.31 57.11 2kc0 n LYS 29 Cb 0.00 -1.43 0.00 0.00 -0.65 0.00 0.00 35.03 32.95 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 1.51 4.73 3.68 2.58 0.00 -1.25 -5.13 105.19 111.31 2kc0 n GLY 30 Ca -0.05 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 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 4.25 0.00 0.99 2.96 -1.26 -4.85 118.68 120.77 2kc0 s LEU 31 Ca 0.00 1.74 0.00 0.00 -0.22 0.00 0.00 54.13 55.65 2kc0 s LEU 31 Cb 0.00 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.14 2kc0 s LEU 31 CO 0.00 -0.59 0.34 0.00 -1.32 0.00 0.00 176.35 174.77 2kc0 n GLN 32 N 5.41 0.00 -3.81 1.98 -0.00 -1.26 -4.44 117.38 115.26 2kc0 n GLN 32 Ca 0.11 -0.30 -0.02 0.00 -0.00 0.00 0.00 57.00 56.78 2kc0 n GLN 32 Cb 0.46 -0.27 0.00 0.00 -0.00 0.00 0.00 30.24 30.44 2kc0 n GLN 32 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2kc0 s SER 33 N -0.07 -0.06 -0.03 2.61 1.04 -1.26 -0.24 113.70 115.68 2kc0 s SER 33 Ca 0.00 -0.49 0.03 0.00 0.48 0.00 0.00 55.95 55.97 2kc0 s SER 33 Cb 0.00 0.44 -0.00 0.00 0.10 0.00 0.00 66.02 66.56 2kc0 s SER 33 CO 0.00 -0.84 -0.13 -0.22 0.98 0.00 0.00 173.24 173.03 2kc0 s LEU 34 N -3.22 1.86 -0.23 2.42 0.20 -0.10 -4.91 118.68 114.71 2kc0 s LEU 34 Ca 0.18 -0.26 -0.15 0.00 0.69 0.00 0.00 54.13 54.59 2kc0 s LEU 34 Cb -0.01 -0.73 -0.04 0.00 -0.43 0.00 0.00 46.19 44.98 2kc0 s LEU 34 CO 0.03 0.11 0.39 -0.89 -0.29 0.00 0.00 176.35 175.70 2kc0 s THR 35 N 0.08 5.19 -0.94 3.68 2.01 -1.26 -1.42 115.64 122.98 2kc0 s THR 35 Ca -0.02 0.65 -0.02 0.00 0.31 0.00 0.00 61.69 62.60 2kc0 s THR 35 Cb -0.09 -3.71 0.29 0.00 0.01 0.00 0.00 72.50 69.00 2kc0 s THR 35 CO 0.01 0.21 2.03 0.18 -0.69 0.00 0.00 174.62 176.37 2kc0 n LEU 36 N 4.82 7.42 0.27 4.42 4.32 -1.08 -4.75 117.00 132.42 2kc0 n LEU 36 Ca -0.08 -5.02 0.13 0.00 -0.02 0.00 0.00 56.01 51.01 2kc0 n LEU 36 Cb 0.51 -1.15 0.76 0.00 -1.62 0.00 0.00 43.42 41.92 2kc0 n LEU 36 CO 0.39 1.91 1.01 0.44 -1.22 0.00 0.00 177.39 179.92 2kc0 h ASP 37 N 3.66 0.00 0.00 -1.43 3.32 -1.91 -3.21 116.42 116.86 2kc0 h ASP 37 Ca 0.55 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.57 2kc0 h ASP 37 Cb 0.23 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2kc0 h ASP 37 CO 1.28 0.09 -1.13 0.00 -1.72 0.00 0.00 179.24 177.76 2kc0 n GLN 38 N -3.76 2.97 -0.33 3.56 10.64 -1.26 -4.74 117.38 124.47 2kc0 n GLN 38 Ca -0.02 0.00 0.21 0.00 -1.83 0.00 0.00 57.00 55.36 2kc0 n GLN 38 Cb 0.19 -1.05 0.40 0.00 -0.86 0.00 0.00 30.24 28.93 2kc0 n GLN 38 CO 0.00 0.00 0.00 1.03 -1.83 0.00 0.00 177.06 176.26 2kc0 h SER 39 N 0.00 -0.05 -2.38 2.61 0.87 -1.93 -3.43 113.55 109.24 2kc0 h SER 39 Ca -0.05 0.25 -0.57 0.00 -1.23 0.00 0.00 61.79 60.19 2kc0 h SER 39 Cb 1.11 0.34 -0.14 0.00 -0.44 0.00 0.00 62.40 63.28 2kc0 h SER 39 CO 0.00 -0.32 -0.71 0.54 -0.53 0.00 0.00 176.83 175.81 2kc0 s VAL 40 N -5.81 2.11 0.40 2.23 0.11 -1.21 -5.15 120.40 113.08 2kc0 s VAL 40 Ca -0.11 -2.24 0.04 0.00 -2.93 0.00 0.00 61.98 56.74 2kc0 s VAL 40 Cb 0.30 -2.44 -0.05 0.00 -1.53 0.00 0.00 36.38 32.66 2kc0 s VAL 40 CO 0.78 -0.32 0.05 0.00 -3.33 0.00 0.00 175.10 172.28 2kc0 s ARG 41 N -3.61 1.90 0.00 1.54 1.70 -1.26 -4.85 118.95 114.36 2kc0 s ARG 41 Ca 0.30 -2.12 0.00 0.00 -0.47 0.00 0.00 55.73 53.44 2kc0 s ARG 41 Cb 0.00 -1.15 0.00 0.00 -0.57 0.00 0.00 34.95 33.24 2kc0 s ARG 41 CO 0.14 -0.25 0.89 1.63 -1.08 0.00 0.00 175.30 176.63 2kc0 n LYS 42 N -0.92 0.00 -3.06 3.89 5.02 -1.26 -3.21 118.16 118.62 2kc0 n LYS 42 Ca -0.07 0.40 -0.16 0.00 -2.02 0.00 0.00 58.31 56.45 2kc0 n LYS 42 Cb 0.66 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 34.13 2kc0 n LYS 42 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2kc0 n ASN 43 N -1.39 1.02 -3.69 4.39 0.23 -1.26 -4.81 115.26 109.75 2kc0 n ASN 43 Ca 0.00 -2.94 -0.18 0.00 -0.53 0.00 0.00 54.58 50.93 2kc0 n ASN 43 Cb 0.03 -0.60 -0.17 0.00 -2.08 0.00 0.00 39.78 36.97 2kc0 n ASN 43 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2kc0 s GLU 44 N -2.61 -0.02 -0.23 -3.83 0.41 -1.20 -4.95 118.70 106.28 2kc0 s GLU 44 Ca 0.37 0.41 -0.07 0.00 -0.41 0.00 0.00 54.97 55.27 2kc0 s GLU 44 Cb 0.38 -0.37 -0.03 0.00 -1.78 0.00 0.00 34.13 32.33 2kc0 s GLU 44 CO -0.05 -0.28 0.06 0.21 -0.49 0.00 0.00 175.26 174.70 2kc0 s LYS 45 N 1.96 3.73 -0.01 1.61 2.20 -0.83 -3.97 119.74 124.43 2kc0 s LYS 45 Ca 0.01 -0.45 -0.03 0.00 -0.36 0.00 0.00 55.97 55.14 2kc0 s LYS 45 Cb -0.12 -3.27 -0.00 0.00 -1.51 0.00 0.00 37.83 32.93 2kc0 s LYS 45 CO -0.04 -0.05 0.07 -0.48 -0.36 0.00 0.00 175.35 174.49 2kc0 s LEU 46 N 1.23 1.80 -0.09 5.43 2.34 -0.59 -0.17 118.68 128.64 2kc0 s LEU 46 Ca 0.05 -0.10 0.01 0.00 0.06 0.00 0.00 54.13 54.14 2kc0 s LEU 46 Cb -0.14 0.33 -0.03 0.00 -0.56 0.00 0.00 46.19 45.79 2kc0 s LEU 46 CO 0.03 -0.18 -0.09 -1.59 -1.06 0.00 0.00 176.35 173.46 2kc0 s LYS 47 N -0.71 2.92 0.39 1.48 -2.85 -0.60 -0.48 119.74 119.90 2kc0 s LYS 47 Ca -0.08 -0.59 -0.14 0.00 -1.00 0.00 0.00 55.97 54.16 2kc0 s LYS 47 Cb -0.05 -2.60 -0.08 0.00 -2.06 0.00 0.00 37.83 33.04 2kc0 s LYS 47 CO 0.00 0.53 0.80 -0.51 0.10 0.00 0.00 175.35 176.28 2kc0 s LEU 48 N -0.47 3.89 -0.14 2.77 2.01 0.53 -2.14 118.68 125.13 2kc0 s LEU 48 Ca 0.07 1.29 -0.08 0.00 0.01 0.00 0.00 54.13 55.42 2kc0 s LEU 48 Cb -0.12 -4.15 0.05 0.00 0.01 0.00 0.00 46.19 41.98 2kc0 s LEU 48 CO 0.02 -0.35 0.34 0.00 1.01 0.00 0.00 176.35 177.36 2kc0 s ALA 49 N -2.26 -0.83 -0.28 4.21 0.00 -0.58 -1.85 121.76 120.18 2kc0 s ALA 49 Ca 0.54 1.27 -0.21 0.00 0.00 0.00 0.00 51.96 53.56 2kc0 s ALA 49 Cb -0.10 -0.78 0.08 0.00 0.00 0.00 0.00 23.12 22.32 2kc0 s ALA 49 CO 0.25 -0.23 0.76 0.00 0.00 0.00 0.00 175.76 176.54 2kc0 s ALA 50 N 1.27 -1.87 -1.44 0.00 0.00 -0.27 -2.22 121.76 117.24 2kc0 s ALA 50 Ca -0.09 2.16 -0.05 0.00 0.00 0.00 0.00 51.96 53.97 2kc0 s ALA 50 Cb -0.09 -1.33 0.04 0.00 0.00 0.00 0.00 23.12 21.74 2kc0 s ALA 50 CO -0.10 -0.34 0.69 1.04 0.00 0.00 0.00 175.76 177.05 2kc0 n GLN 51 N 3.24 -4.37 -0.21 0.00 3.00 -1.26 -1.04 117.38 116.74 2kc0 n GLN 51 Ca -0.16 0.52 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 2kc0 n GLN 51 Cb 0.57 -5.04 0.00 0.00 0.00 0.00 0.00 30.24 25.76 2kc0 n GLN 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2kc0 n GLY 52 N -1.71 1.38 3.91 1.08 0.00 -1.26 -4.65 105.19 103.93 2kc0 n GLY 52 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.26 3.51 -0.21 4.61 0.00 -0.20 -5.09 121.76 122.12 2kc0 s ALA 53 Ca 0.00 -0.53 -0.21 0.00 0.00 0.00 0.00 51.96 51.22 2kc0 s ALA 53 Cb 0.00 -2.43 0.06 0.00 0.00 0.00 0.00 23.12 20.74 2kc0 s ALA 53 CO 0.00 -0.03 0.59 -1.83 0.00 0.00 0.00 175.76 174.50 2kc0 s GLU 54 N -4.09 0.71 -0.05 0.00 -1.05 -1.26 -1.12 118.70 111.84 2kc0 s GLU 54 Ca 0.46 0.78 -0.02 0.00 -0.15 0.00 0.00 54.97 56.03 2kc0 s GLU 54 Cb -0.10 0.35 0.03 0.00 -0.44 0.00 0.00 34.13 33.97 2kc0 s GLU 54 CO 0.36 -0.10 0.12 0.15 0.95 0.00 0.00 175.26 176.73 2kc0 s LYS 55 N 0.20 0.07 -0.11 -4.83 -0.14 -0.77 -4.89 119.74 109.27 2kc0 s LYS 55 Ca -0.01 0.29 -0.16 0.00 -1.36 0.00 0.00 55.97 54.74 2kc0 s LYS 55 Cb -0.04 -0.15 -0.05 0.00 -1.68 0.00 0.00 37.83 35.92 2kc0 s LYS 55 CO 0.01 -0.14 0.39 0.99 -0.76 0.00 0.00 175.35 175.85 2kc0 s THR 56 N 0.94 5.21 0.19 2.17 2.01 -1.26 -0.35 115.64 124.55 2kc0 s THR 56 Ca -0.07 0.78 -0.03 0.00 0.31 0.00 0.00 61.69 62.68 2kc0 s THR 56 Cb -0.10 -3.73 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 2kc0 s THR 56 CO -0.04 0.40 0.16 -0.72 -0.69 0.00 0.00 174.62 173.72 2kc0 s TYR 57 N 0.26 0.97 -2.13 4.92 1.13 0.37 -4.98 117.35 117.90 2kc0 s TYR 57 Ca 0.22 -1.25 0.00 0.00 -1.41 0.00 0.00 57.07 54.63 2kc0 s TYR 57 Cb -0.15 -0.44 0.00 0.00 -1.10 0.00 0.00 41.96 40.28 2kc0 s TYR 57 CO 0.08 -0.66 0.00 0.41 -2.51 0.00 0.00 175.55 172.87 2kc0 n GLY 58 N -0.24 -1.66 2.16 5.49 0.00 -1.26 -1.54 105.19 108.14 2kc0 n GLY 58 Ca -0.00 -1.08 -0.14 0.00 0.00 0.00 0.00 46.02 44.80 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 1.28 -3.82 -0.77 1.61 5.15 -1.25 -3.99 115.26 113.47 2kc0 n ASN 59 Ca 0.00 0.29 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 2kc0 n ASN 59 Cb 0.00 -3.46 0.00 0.00 -0.53 0.00 0.00 39.78 35.79 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 -0.42 -1.03 3.09 8.20 0.00 -1.26 -4.88 105.19 108.89 2kc0 n GLY 60 Ca -0.15 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 2kc0 n GLY 60 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kc0 n ASP 61 N -0.09 -1.39 -4.34 1.61 -0.08 -1.26 -5.06 116.55 105.95 2kc0 n ASP 61 Ca 0.00 -2.64 -0.24 0.00 -1.51 0.00 0.00 54.79 50.40 2kc0 n ASP 61 Cb 0.00 2.52 -0.12 0.00 2.34 0.00 0.00 41.12 45.86 2kc0 n ASP 61 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2kc0 s SER 62 N -2.93 2.79 -0.21 1.67 1.04 -1.26 -2.65 113.70 112.15 2kc0 s SER 62 Ca 0.24 -0.80 -0.07 0.00 0.48 0.00 0.00 55.95 55.79 2kc0 s SER 62 Cb -0.02 -0.17 -0.04 0.00 0.10 0.00 0.00 66.02 65.90 2kc0 s SER 62 CO 0.17 0.03 0.07 -0.22 0.98 0.00 0.00 173.24 174.27 2kc0 s LEU 63 N -2.40 3.67 0.77 2.42 2.96 -0.51 -4.96 118.68 120.64 2kc0 s LEU 63 Ca 0.14 -0.04 -0.12 0.00 -0.22 0.00 0.00 54.13 53.89 2kc0 s LEU 63 Cb -0.08 -1.95 0.06 0.00 0.50 0.00 0.00 46.19 44.72 2kc0 s LEU 63 CO 0.06 0.08 1.13 0.20 -1.32 0.00 0.00 176.35 176.51 2kc0 s ASN 64 N 0.91 4.22 0.00 3.68 -0.87 -1.26 -0.92 114.94 120.70 2kc0 s ASN 64 Ca 0.04 2.04 0.00 0.00 -1.57 0.00 0.00 52.86 53.37 2kc0 s ASN 64 Cb -0.14 -2.55 0.00 0.00 -0.02 0.00 0.00 41.25 38.54 2kc0 s ASN 64 CO 0.03 -2.23 0.00 0.35 -2.57 0.00 0.00 177.10 172.68 2kc0 n THR 65 N -3.29 0.00 -0.90 1.60 -2.24 -0.76 -4.81 114.28 103.88 2kc0 n THR 65 Ca 0.11 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.01 2kc0 n THR 65 Cb 0.52 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.72 2kc0 n THR 65 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kc0 n GLY 66 N 0.20 -1.88 2.09 3.38 0.00 0.67 -4.26 105.19 105.38 2kc0 n GLY 66 Ca 0.00 -1.29 -0.20 0.00 0.00 0.00 0.00 46.02 44.53 2kc0 n GLY 66 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2kc0 n LYS 67 N -3.21 2.51 -3.52 1.61 4.81 -1.26 -4.42 118.16 114.68 2kc0 n LYS 67 Ca -0.00 -1.36 -0.42 0.00 -0.87 0.00 0.00 58.31 55.66 2kc0 n LYS 67 Cb 0.41 -2.24 -0.06 0.00 0.02 0.00 0.00 35.03 33.17 2kc0 n LYS 67 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2kc0 s LEU 68 N 0.04 6.02 -0.69 3.14 1.43 -1.26 -5.02 118.68 122.33 2kc0 s LEU 68 Ca 0.68 -2.76 -0.26 0.00 -1.03 0.00 0.00 54.13 50.76 2kc0 s LEU 68 Cb 0.28 -2.04 -0.07 0.00 0.03 0.00 0.00 46.19 44.40 2kc0 s LEU 68 CO -0.02 -0.48 2.14 -0.75 0.23 0.00 0.00 176.35 177.48 2kc0 s LYS 69 N 0.07 2.25 -0.04 1.70 2.36 -1.26 -4.80 119.74 120.01 2kc0 s LYS 69 Ca 0.17 0.56 0.07 0.00 -2.55 0.00 0.00 55.97 54.22 2kc0 s LYS 69 Cb -0.15 -4.69 -0.10 0.00 -1.05 0.00 0.00 37.83 31.83 2kc0 s LYS 69 CO -0.06 -3.41 0.10 0.09 1.55 0.00 0.00 175.35 173.62 2kc0 n ASN 70 N 15.17 3.26 -4.05 1.43 3.02 -1.19 -5.03 115.26 127.87 2kc0 n ASN 70 Ca 0.35 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.60 2kc0 n ASN 70 Cb 0.50 1.04 -0.02 0.00 -0.61 0.00 0.00 39.78 40.69 2kc0 n ASN 70 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2kc0 n ASP 71 N -1.99 -1.76 -3.75 6.41 8.00 -0.72 -4.95 116.55 117.79 2kc0 n ASP 71 Ca -0.06 -0.99 -0.10 0.00 0.71 0.00 0.00 54.79 54.35 2kc0 n ASP 71 Cb 0.44 -3.00 -0.06 0.00 -0.02 0.00 0.00 41.12 38.47 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 -6.71 0.91 -0.33 -1.24 -2.85 0.17 -4.97 119.74 104.72 2kc0 s LYS 72 Ca 0.33 -0.72 -0.22 0.00 -1.00 0.00 0.00 55.97 54.36 2kc0 s LYS 72 Cb -0.18 0.39 0.00 0.00 -2.06 0.00 0.00 37.83 35.98 2kc0 s LYS 72 CO 0.90 -0.32 0.71 0.14 0.10 0.00 0.00 175.35 176.88 2kc0 s VAL 73 N -3.40 4.84 0.01 1.79 -7.23 -1.26 -0.77 120.40 114.39 2kc0 s VAL 73 Ca 0.01 0.87 0.06 0.00 -1.81 0.00 0.00 61.98 61.10 2kc0 s VAL 73 Cb 0.02 -4.11 -0.03 0.00 0.56 0.00 0.00 36.38 32.82 2kc0 s VAL 73 CO -0.09 -0.28 -0.16 -0.94 -0.31 0.00 0.00 175.10 173.32 2kc0 s SER 74 N 1.72 3.92 0.53 4.85 1.04 -0.36 -4.95 113.70 120.46 2kc0 s SER 74 Ca 0.28 -0.34 -0.16 0.00 0.48 0.00 0.00 55.95 56.21 2kc0 s SER 74 Cb -0.14 -0.71 -0.07 0.00 0.10 0.00 0.00 66.02 65.20 2kc0 s SER 74 CO 0.14 0.28 1.00 0.00 0.98 0.00 0.00 173.24 175.64 2kc0 s ARG 75 N -1.24 3.83 -0.17 4.02 3.03 -1.26 -1.26 118.95 125.90 2kc0 s ARG 75 Ca 0.14 0.98 -0.19 0.00 2.03 0.00 0.00 55.73 58.68 2kc0 s ARG 75 Cb -0.11 -2.12 0.05 0.00 -1.03 0.00 0.00 34.95 31.75 2kc0 s ARG 75 CO 0.04 -0.38 0.52 -0.06 -1.13 0.00 0.00 175.30 174.30 2kc0 s PHE 76 N -2.64 -0.55 0.12 5.89 0.08 -0.51 -4.91 117.98 115.45 2kc0 s PHE 76 Ca 0.59 1.28 -0.07 0.00 0.12 0.00 0.00 56.93 58.85 2kc0 s PHE 76 Cb -0.11 0.21 -0.06 0.00 -0.57 0.00 0.00 43.02 42.49 2kc0 s PHE 76 CO 0.34 -0.32 0.39 -0.51 -0.10 0.00 0.00 175.22 175.01 2kc0 s ASP 77 N -0.02 6.55 0.01 1.36 1.11 -0.94 -1.91 116.67 122.83 2kc0 s ASP 77 Ca -0.02 0.68 -0.05 0.00 0.18 0.00 0.00 52.55 53.33 2kc0 s ASP 77 Cb -0.03 -2.13 -0.00 0.00 1.07 0.00 0.00 42.92 41.82 2kc0 s ASP 77 CO 0.02 0.10 0.09 0.72 1.18 0.00 0.00 175.17 177.28 2kc0 s PHE 78 N -1.55 0.10 -0.03 4.23 -0.71 -0.38 -1.53 117.98 118.10 2kc0 s PHE 78 Ca 0.38 -0.24 0.05 0.00 -1.04 0.00 0.00 56.93 56.08 2kc0 s PHE 78 Cb -0.13 -0.08 -0.01 0.00 -1.21 0.00 0.00 43.02 41.59 2kc0 s PHE 78 CO 0.21 -0.26 -0.18 0.42 -1.34 0.00 0.00 175.22 174.07 2kc0 s ILE 79 N -1.41 1.47 -0.22 -4.49 1.09 -0.91 -0.78 121.20 115.95 2kc0 s ILE 79 Ca -0.15 -0.76 0.01 0.00 -1.10 0.00 0.00 60.65 58.66 2kc0 s ILE 79 Cb -0.08 -1.24 0.05 0.00 -1.06 0.00 0.00 42.46 40.12 2kc0 s ILE 79 CO 0.01 0.42 -0.10 0.00 -0.10 0.00 0.00 174.94 175.16 2kc0 s ARG 80 N -0.13 2.09 -0.02 2.79 3.03 -0.32 -1.55 118.95 124.83 2kc0 s ARG 80 Ca -0.00 -1.00 0.07 0.00 2.03 0.00 0.00 55.73 56.83 2kc0 s ARG 80 Cb -0.10 -2.58 -0.02 0.00 -1.03 0.00 0.00 34.95 31.22 2kc0 s ARG 80 CO 0.01 -0.48 -0.24 1.14 -1.13 0.00 0.00 175.30 174.60 2kc0 s GLN 81 N 1.31 2.02 0.03 3.89 -2.07 0.76 -4.54 119.66 121.05 2kc0 s GLN 81 Ca -0.04 -0.86 -0.23 0.00 -1.82 0.00 0.00 55.36 52.41 2kc0 s GLN 81 Cb -0.17 -1.92 0.05 0.00 -1.09 0.00 0.00 33.01 29.88 2kc0 s GLN 81 CO -0.07 0.50 0.53 -1.50 -1.32 0.00 0.00 175.29 173.43 2kc0 s ILE 82 N -0.52 0.03 -1.26 3.63 -1.16 -1.26 -1.97 121.20 118.69 2kc0 s ILE 82 Ca 0.08 -0.23 -0.16 0.00 -0.51 0.00 0.00 60.65 59.84 2kc0 s ILE 82 Cb -0.10 -0.96 0.12 0.00 0.61 0.00 0.00 42.46 42.14 2kc0 s ILE 82 CO -0.00 -0.12 1.61 1.21 -2.81 0.00 0.00 174.94 174.82 2kc0 n GLU 83 N 0.51 3.29 -1.80 3.50 2.13 -1.26 -4.42 120.64 122.58 2kc0 n GLU 83 Ca -0.19 -3.55 -0.43 0.00 0.66 0.00 0.00 57.16 53.66 2kc0 n GLU 83 Cb 0.60 -3.26 -0.03 0.00 0.27 0.00 0.00 31.44 29.02 2kc0 n GLU 83 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2kc0 s VAL 84 N 2.81 3.25 -1.29 6.31 1.01 -0.29 -2.35 120.40 129.84 2kc0 s VAL 84 Ca 0.48 0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.69 2kc0 s VAL 84 Cb 0.01 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 33.09 2kc0 s VAL 84 CO 0.04 -0.19 0.19 0.47 0.00 0.00 0.00 175.10 175.61 2kc0 n ASP 85 N 10.70 -4.49 0.00 3.32 8.00 -1.26 -0.76 116.55 132.06 2kc0 n ASP 85 Ca 0.26 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.73 2kc0 n ASP 85 Cb 0.45 -3.75 0.00 0.00 -0.02 0.00 0.00 41.12 37.81 2kc0 n ASP 85 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kc0 n GLY 86 N -1.02 0.52 3.40 0.44 0.00 -0.99 -5.05 105.19 102.48 2kc0 n GLY 86 Ca -0.13 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.62 3.53 -0.45 1.61 -0.21 0.06 -5.07 119.66 118.51 2kc0 s GLN 87 Ca 0.00 -0.56 -0.17 0.00 0.02 0.00 0.00 55.36 54.65 2kc0 s GLN 87 Cb 0.00 -3.05 0.04 0.00 1.00 0.00 0.00 33.01 31.00 2kc0 s GLN 87 CO 0.00 -0.06 0.43 -1.17 -2.12 0.00 0.00 175.29 172.37 2kc0 s LEU 88 N 1.18 5.12 0.02 2.90 0.20 -1.26 -1.14 118.68 125.70 2kc0 s LEU 88 Ca 0.03 -0.92 0.07 0.00 0.69 0.00 0.00 54.13 54.00 2kc0 s LEU 88 Cb -0.14 -2.30 -0.02 0.00 -0.43 0.00 0.00 46.19 43.29 2kc0 s LEU 88 CO 0.01 -0.62 -0.22 -0.63 -0.29 0.00 0.00 176.35 174.59 2kc0 s ILE 89 N 2.00 1.76 -0.38 6.68 1.01 -1.26 -5.07 121.20 125.93 2kc0 s ILE 89 Ca 0.09 -1.14 0.10 0.00 0.00 0.00 0.00 60.65 59.70 2kc0 s ILE 89 Cb -0.20 -1.50 0.30 0.00 0.01 0.00 0.00 42.46 41.07 2kc0 s ILE 89 CO 0.11 0.32 0.64 0.35 0.00 0.00 0.00 174.94 176.36 2kc0 n THR 90 N 2.06 -0.42 -1.56 2.92 -2.24 -1.26 -4.49 114.28 109.28 2kc0 n THR 90 Ca -0.17 -4.20 0.00 0.00 -2.27 0.00 0.00 64.05 57.41 2kc0 n THR 90 Cb 0.53 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 67.73 2kc0 n THR 90 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2kc0 n LEU 91 N 0.86 0.00 -4.43 3.22 0.00 -1.26 -5.08 117.00 110.31 2kc0 n LEU 91 Ca 0.22 -0.52 -0.35 0.00 0.00 0.00 0.00 56.01 55.36 2kc0 n LEU 91 Cb 0.60 0.00 -0.13 0.00 0.00 0.00 0.00 43.42 43.89 2kc0 n LEU 91 CO 0.19 0.22 -0.35 -1.61 0.00 0.00 0.00 177.39 175.84 2kc0 s GLU 92 N 0.00 3.58 0.20 1.96 8.01 -1.26 -3.77 118.70 127.42 2kc0 s GLU 92 Ca 0.00 -0.54 -0.08 0.00 0.01 0.00 0.00 54.97 54.35 2kc0 s GLU 92 Cb 0.00 -3.04 -0.01 0.00 -4.31 0.00 0.00 34.13 26.77 2kc0 s GLU 92 CO 0.00 0.01 0.32 -1.54 0.01 0.00 0.00 175.26 174.06 2kc0 s SER 93 N 0.99 0.02 0.00 -0.19 1.04 -1.26 -1.18 113.70 113.12 2kc0 s SER 93 Ca 0.01 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.43 2kc0 s SER 93 Cb -0.14 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2kc0 s SER 93 CO 0.01 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.87 2kc0 n GLY 94 N -0.29 1.28 3.92 7.32 0.00 0.04 -4.62 105.19 112.84 2kc0 n GLY 94 Ca -0.03 -0.76 -0.21 0.00 0.00 0.00 0.00 46.02 45.03 2kc0 n GLY 94 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kc0 s GLU 95 N -0.38 3.11 -0.16 1.61 2.02 0.36 -1.25 118.70 124.02 2kc0 s GLU 95 Ca 0.00 -0.99 -0.06 0.00 0.02 0.00 0.00 54.97 53.94 2kc0 s GLU 95 Cb 0.00 -2.72 0.07 0.00 0.10 0.00 0.00 34.13 31.58 2kc0 s GLU 95 CO 0.00 0.27 0.34 0.12 0.02 0.00 0.00 175.26 176.01 2kc0 s PHE 96 N -2.12 -0.59 -0.18 1.61 5.36 -0.80 -2.34 117.98 118.92 2kc0 s PHE 96 Ca 0.38 1.21 0.00 0.00 -0.96 0.00 0.00 56.93 57.57 2kc0 s PHE 96 Cb -0.08 0.14 0.01 0.00 -0.34 0.00 0.00 43.02 42.75 2kc0 s PHE 96 CO 0.28 -0.39 -0.17 -1.14 -1.46 0.00 0.00 175.22 172.33 2kc0 s GLN 97 N 2.29 3.08 -0.20 10.12 -0.44 -0.32 -1.43 119.66 132.76 2kc0 s GLN 97 Ca -0.02 -0.79 0.01 0.00 -2.50 0.00 0.00 55.36 52.06 2kc0 s GLN 97 Cb -0.11 -2.62 0.04 0.00 -1.64 0.00 0.00 33.01 28.67 2kc0 s GLN 97 CO -0.11 -0.15 -0.13 0.08 0.50 0.00 0.00 175.29 175.48 2kc0 s VAL 98 N 1.18 1.88 -0.07 1.34 1.01 -0.39 -1.01 120.40 124.35 2kc0 s VAL 98 Ca 0.02 -1.11 -0.27 0.00 0.00 0.00 0.00 61.98 60.62 2kc0 s VAL 98 Cb -0.14 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 2kc0 s VAL 98 CO -0.08 0.25 0.86 -0.47 0.00 0.00 0.00 175.10 175.65 2kc0 s TYR 99 N 1.30 3.57 -0.16 5.22 6.14 -0.41 -1.23 117.35 131.79 2kc0 s TYR 99 Ca -0.01 1.45 -0.02 0.00 0.64 0.00 0.00 57.07 59.13 2kc0 s TYR 99 Cb -0.16 -3.00 -0.02 0.00 0.42 0.00 0.00 41.96 39.20 2kc0 s TYR 99 CO -0.09 -0.05 -0.08 0.15 0.64 0.00 0.00 175.55 176.12 2kc0 s LYS 100 N 1.28 3.48 0.00 4.97 3.01 0.05 -2.49 119.74 130.04 2kc0 s LYS 100 Ca 0.44 -0.62 0.00 0.00 -1.01 0.00 0.00 55.97 54.78 2kc0 s LYS 100 Cb -0.19 -2.81 0.00 0.00 -1.01 0.00 0.00 37.83 33.83 2kc0 s LYS 100 CO 0.20 0.14 0.00 0.94 0.51 0.00 0.00 175.35 177.14 2kc0 n GLN 101 N 3.80 0.12 -0.04 1.68 7.27 -0.72 -0.66 117.38 128.83 2kc0 n GLN 101 Ca -0.18 0.00 -0.04 0.00 0.07 0.00 0.00 57.00 56.85 2kc0 n GLN 101 Cb 0.52 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 33.16 2kc0 n GLN 101 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2kc0 n SER 102 N 0.00 0.83 -0.33 1.69 7.64 -1.26 -3.18 113.62 119.00 2kc0 n SER 102 Ca 0.00 0.18 0.08 0.00 1.01 0.00 0.00 58.87 60.14 2kc0 n SER 102 Cb 0.00 -0.61 0.16 0.00 -1.01 0.00 0.00 64.21 62.75 2kc0 n SER 102 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2kc0 n HIS 103 N -3.34 0.00 -3.85 1.43 8.25 -1.26 -4.87 115.22 111.58 2kc0 n HIS 103 Ca -0.06 -1.15 -0.11 0.00 -0.26 0.00 0.00 57.72 56.14 2kc0 n HIS 103 Cb 0.21 -0.19 -0.09 0.00 1.12 0.00 0.00 29.99 31.04 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 -2.93 0.00 -0.13 0.41 1.04 -1.26 -2.06 113.70 108.77 2kc0 s SER 104 Ca 0.33 -0.23 -0.24 0.00 0.48 0.00 0.00 55.95 56.29 2kc0 s SER 104 Cb 0.31 0.25 0.06 0.00 0.10 0.00 0.00 66.02 66.74 2kc0 s SER 104 CO -0.02 -0.45 0.60 0.00 0.98 0.00 0.00 173.24 174.35 2kc0 s ALA 105 N -1.84 -1.52 0.02 5.32 0.00 -0.41 -1.76 121.76 121.57 2kc0 s ALA 105 Ca -0.11 1.37 -0.12 0.00 0.00 0.00 0.00 51.96 53.10 2kc0 s ALA 105 Cb -0.05 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.64 2kc0 s ALA 105 CO -0.00 -0.32 0.27 -0.48 0.00 0.00 0.00 175.76 175.22 2kc0 s LEU 106 N -0.53 1.05 0.06 0.00 2.34 -1.04 -1.03 118.68 119.52 2kc0 s LEU 106 Ca -0.06 -0.16 0.05 0.00 0.06 0.00 0.00 54.13 54.01 2kc0 s LEU 106 Cb -0.03 1.18 -0.04 0.00 -0.56 0.00 0.00 46.19 46.75 2kc0 s LEU 106 CO 0.05 -0.54 -0.08 0.28 -1.06 0.00 0.00 176.35 175.00 2kc0 s THR 107 N -2.15 3.51 0.03 5.48 -1.32 -0.23 -1.29 115.64 119.68 2kc0 s THR 107 Ca -0.08 -1.03 0.06 0.00 -1.21 0.00 0.00 61.69 59.44 2kc0 s THR 107 Cb -0.03 -2.59 -0.02 0.00 -1.51 0.00 0.00 72.50 68.36 2kc0 s THR 107 CO -0.01 0.25 -0.19 0.00 -2.21 0.00 0.00 174.62 172.46 2kc0 s ALA 108 N -1.11 1.57 0.02 11.08 0.00 -0.18 -2.08 121.76 131.05 2kc0 s ALA 108 Ca 0.20 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 2kc0 s ALA 108 Cb -0.11 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 2kc0 s ALA 108 CO 0.11 0.35 0.18 -0.06 0.00 0.00 0.00 175.76 176.34 2kc0 s PHE 109 N -0.73 3.50 -0.29 0.00 0.08 0.17 -1.17 117.98 119.54 2kc0 s PHE 109 Ca 0.06 0.29 -0.02 0.00 0.12 0.00 0.00 56.93 57.38 2kc0 s PHE 109 Cb -0.08 -1.78 0.12 0.00 -0.57 0.00 0.00 43.02 40.71 2kc0 s PHE 109 CO 0.01 0.61 0.22 -0.65 -0.10 0.00 0.00 175.22 175.31 2kc0 s GLN 110 N -2.18 0.27 -0.09 0.44 -0.21 -0.99 -1.83 119.66 115.08 2kc0 s GLN 110 Ca 0.30 -0.37 -0.08 0.00 0.02 0.00 0.00 55.36 55.23 2kc0 s GLN 110 Cb -0.13 -0.91 -0.04 0.00 1.00 0.00 0.00 33.01 32.93 2kc0 s GLN 110 CO 0.22 -1.03 0.19 -0.08 -2.12 0.00 0.00 175.29 172.47 2kc0 s THR 111 N 2.18 5.42 0.04 -0.19 -1.32 -0.64 -0.48 115.64 120.65 2kc0 s THR 111 Ca 0.10 0.28 -0.00 0.00 -1.21 0.00 0.00 61.69 60.85 2kc0 s THR 111 Cb -0.15 -3.47 -0.00 0.00 -1.51 0.00 0.00 72.50 67.37 2kc0 s THR 111 CO -0.33 0.58 -0.01 -0.62 -2.21 0.00 0.00 174.62 172.03 2kc0 n GLU 112 N 1.84 0.01 -3.90 7.08 1.02 -1.25 -1.21 120.64 124.23 2kc0 n GLU 112 Ca -0.18 0.01 -0.11 0.00 -0.02 0.00 0.00 57.16 56.86 2kc0 n GLU 112 Cb 0.54 -0.28 -0.12 0.00 -0.02 0.00 0.00 31.44 31.56 2kc0 n GLU 112 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2kc0 s GLN 113 N -1.51 0.18 0.15 3.49 0.00 -1.26 -2.19 119.66 118.52 2kc0 s GLN 113 Ca -0.01 -0.22 -0.01 0.00 -0.00 0.00 0.00 55.36 55.13 2kc0 s GLN 113 Cb 0.00 0.07 -0.04 0.00 0.00 0.00 0.00 33.01 33.04 2kc0 s GLN 113 CO 0.01 -0.03 0.07 0.96 0.00 0.00 0.00 175.29 176.29 2kc0 s ILE 114 N -0.63 0.17 0.83 3.63 -4.36 -0.79 -4.57 121.20 115.48 2kc0 s ILE 114 Ca -0.07 -1.94 -0.12 0.00 -0.26 0.00 0.00 60.65 58.26 2kc0 s ILE 114 Cb -0.04 -2.17 0.09 0.00 1.25 0.00 0.00 42.46 41.59 2kc0 s ILE 114 CO -0.00 -0.36 1.17 -1.58 0.24 0.00 0.00 174.94 174.41 2kc0 s GLN 115 N -4.05 1.84 0.10 0.37 -0.44 -1.25 -0.82 119.66 115.40 2kc0 s GLN 115 Ca 0.28 0.15 0.03 0.00 -2.50 0.00 0.00 55.36 53.32 2kc0 s GLN 115 Cb 0.07 -1.93 -0.04 0.00 -1.64 0.00 0.00 33.01 29.47 2kc0 s GLN 115 CO 0.05 -1.69 -0.09 0.34 0.50 0.00 0.00 175.29 174.39 2kc0 s ASP 116 N -4.48 1.42 0.03 6.67 -1.08 0.89 -4.66 116.67 115.46 2kc0 s ASP 116 Ca 0.62 -0.86 0.24 0.00 -0.52 0.00 0.00 52.55 52.03 2kc0 s ASP 116 Cb -0.12 0.02 0.28 0.00 -1.46 0.00 0.00 42.92 41.65 2kc0 s ASP 116 CO 0.50 -0.30 1.24 -0.24 0.52 0.00 0.00 175.17 176.89 2kc0 n SER 117 N 0.40 0.61 0.29 -0.34 2.88 -1.26 -1.83 113.62 114.38 2kc0 n SER 117 Ca -0.15 -0.25 0.15 0.00 -1.33 0.00 0.00 58.87 57.29 2kc0 n SER 117 Cb 0.58 0.46 0.89 0.00 -0.75 0.00 0.00 64.21 65.39 2kc0 n SER 117 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2kc0 h GLU 118 N 0.00 0.00 0.00 -1.46 4.11 -1.97 -0.82 114.58 114.45 2kc0 h GLU 118 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2kc0 h GLU 118 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2kc0 h GLU 118 CO 0.00 0.04 -0.14 1.58 0.07 0.00 0.00 179.01 180.56 2kc0 n HIS 119 N -3.67 0.00 -4.32 2.06 -0.00 -1.26 -5.01 115.22 103.01 2kc0 n HIS 119 Ca -0.03 -0.28 -0.36 0.00 0.46 0.00 0.00 57.72 57.51 2kc0 n HIS 119 Cb 0.13 -0.05 -0.06 0.00 -0.12 0.00 0.00 29.99 29.90 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 -0.36 -1.62 0.00 0.26 2.88 -0.31 -4.68 113.62 109.79 2kc0 n SER 120 Ca 0.03 -1.14 0.00 0.00 -1.33 0.00 0.00 58.87 56.42 2kc0 n SER 120 Cb 0.53 -2.17 0.00 0.00 -0.75 0.00 0.00 64.21 61.82 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 -1.57 0.00 1.29 0.46 0.00 -0.76 -4.96 105.19 99.65 2kc0 n GLY 121 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 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 1.49 -3.71 1.61 5.02 -1.18 -4.95 118.16 116.43 2kc0 n LYS 122 Ca 0.00 -1.29 -0.12 0.00 -2.02 0.00 0.00 58.31 54.89 2kc0 n LYS 122 Cb 0.00 0.30 -0.07 0.00 -0.02 0.00 0.00 35.03 35.25 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 -2.68 0.88 -0.06 1.97 0.23 -1.26 -0.07 119.30 118.31 2kc0 s MET 123 Ca 0.02 -0.50 -0.05 0.00 -1.03 0.00 0.00 55.69 54.14 2kc0 s MET 123 Cb -0.00 0.38 0.02 0.00 -1.53 0.00 0.00 34.83 33.70 2kc0 s MET 123 CO 0.01 -0.30 0.15 0.08 -2.03 0.00 0.00 175.02 172.94 2kc0 s VAL 124 N -2.72 -0.01 -1.20 5.16 1.01 -0.01 -4.89 120.40 117.75 2kc0 s VAL 124 Ca -0.04 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 2kc0 s VAL 124 Cb -0.00 -0.22 0.21 0.00 0.00 0.00 0.00 36.38 36.37 2kc0 s VAL 124 CO -0.04 0.02 2.06 0.00 0.00 0.00 0.00 175.10 177.14 2kc0 n ALA 125 N 3.29 6.27 -2.50 5.51 0.00 -1.26 -1.88 120.51 129.94 2kc0 n ALA 125 Ca -0.16 -4.35 -0.40 0.00 0.00 0.00 0.00 53.44 48.53 2kc0 n ALA 125 Cb 0.57 -2.56 -0.02 0.00 0.00 0.00 0.00 19.45 17.45 2kc0 n ALA 125 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2kc0 s LYS 126 N -2.23 3.68 -0.45 0.00 0.00 -0.93 -4.83 119.74 114.98 2kc0 s LYS 126 Ca 0.45 -1.63 -0.05 0.00 0.00 0.00 0.00 55.97 54.75 2kc0 s LYS 126 Cb 0.17 -5.45 -0.11 0.00 0.00 0.00 0.00 37.83 32.44 2kc0 s LYS 126 CO -0.08 -2.47 2.31 -2.13 0.00 0.00 0.00 175.35 172.98 2kc0 n ARG 127 N 8.53 1.69 -3.41 1.78 0.63 -1.09 -3.94 116.66 120.85 2kc0 n ARG 127 Ca 0.44 -1.03 -0.41 0.00 -0.92 0.00 0.00 57.85 55.93 2kc0 n ARG 127 Cb 0.47 -2.11 -0.09 0.00 0.45 0.00 0.00 32.46 31.18 2kc0 n ARG 127 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 2kc0 s GLN 128 N 2.46 3.40 -0.02 -0.14 -0.44 -0.35 -4.92 119.66 119.65 2kc0 s GLN 128 Ca 0.42 -0.58 -0.03 0.00 -2.50 0.00 0.00 55.36 52.67 2kc0 s GLN 128 Cb 0.16 -3.85 -0.04 0.00 -1.64 0.00 0.00 33.01 27.63 2kc0 s GLN 128 CO -0.02 -0.60 0.16 -0.59 0.50 0.00 0.00 175.29 174.74 2kc0 s PHE 129 N 1.96 3.50 -0.09 1.67 -0.71 -1.26 -1.62 117.98 121.44 2kc0 s PHE 129 Ca 0.10 0.35 -0.31 0.00 -1.04 0.00 0.00 56.93 56.03 2kc0 s PHE 129 Cb -0.17 -1.82 0.09 0.00 -1.21 0.00 0.00 43.02 39.90 2kc0 s PHE 129 CO 0.12 0.64 0.77 -0.98 -1.34 0.00 0.00 175.22 174.43 2kc0 s ARG 130 N -1.78 0.92 -0.04 1.99 1.04 -0.76 -4.83 118.95 115.48 2kc0 s ARG 130 Ca 0.25 0.24 0.00 0.00 -1.04 0.00 0.00 55.73 55.18 2kc0 s ARG 130 Cb -0.12 0.44 0.03 0.00 -2.04 0.00 0.00 34.95 33.25 2kc0 s ARG 130 CO 0.16 -0.28 0.00 -1.50 -0.04 0.00 0.00 175.30 173.64 2kc0 s ILE 131 N -1.13 0.22 0.00 4.99 -1.16 -1.26 -0.65 121.20 122.21 2kc0 s ILE 131 Ca -0.08 0.10 0.00 0.00 -0.51 0.00 0.00 60.65 60.16 2kc0 s ILE 131 Cb -0.00 -0.33 0.00 0.00 0.61 0.00 0.00 42.46 42.74 2kc0 s ILE 131 CO 0.07 0.17 0.00 0.61 -2.81 0.00 0.00 174.94 172.99 2kc0 n GLY 132 N 4.37 0.00 3.55 1.50 0.00 -0.89 -4.82 105.19 108.91 2kc0 n GLY 132 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2kc0 n GLY 132 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kc0 s ASP 133 N 0.00 6.42 -0.08 1.61 1.11 -1.21 -4.97 116.67 119.55 2kc0 s ASP 133 Ca 0.00 -0.01 0.00 0.00 0.18 0.00 0.00 52.55 52.72 2kc0 s ASP 133 Cb 0.00 -2.35 -0.03 0.00 1.07 0.00 0.00 42.92 41.61 2kc0 s ASP 133 CO 0.00 -0.75 -0.07 -0.63 1.18 0.00 0.00 175.17 174.90 2kc0 s ILE 134 N 2.95 3.69 0.02 0.77 -1.09 -1.26 -1.07 121.20 125.21 2kc0 s ILE 134 Ca 0.26 -0.48 0.01 0.00 -2.23 0.00 0.00 60.65 58.22 2kc0 s ILE 134 Cb -0.14 -2.52 -0.02 0.00 -1.58 0.00 0.00 42.46 38.21 2kc0 s ILE 134 CO 0.18 0.58 -0.05 0.00 -1.23 0.00 0.00 174.94 174.43 2kc0 s ALA 135 N -0.61 0.30 0.00 9.38 0.00 -0.20 -4.85 121.76 125.78 2kc0 s ALA 135 Ca 0.09 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.48 2kc0 s ALA 135 Cb -0.12 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.08 2kc0 s ALA 135 CO 0.02 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.12 2kc0 n GLY 136 N 1.79 0.37 3.56 0.00 0.00 -1.26 -1.29 105.19 108.36 2kc0 n GLY 136 Ca -0.22 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.00 3.26 -0.01 1.61 2.02 -0.87 -4.98 118.70 117.73 2kc0 s GLU 137 Ca 0.00 0.03 -0.30 0.00 0.02 0.00 0.00 54.97 54.72 2kc0 s GLU 137 Cb 0.00 -4.14 -0.05 0.00 0.10 0.00 0.00 34.13 30.05 2kc0 s GLU 137 CO 0.00 -2.02 1.27 -1.01 0.02 0.00 0.00 175.26 173.51 2kc0 s HIS 138 N 5.74 3.14 0.06 1.61 3.76 -1.26 -1.38 115.29 126.96 2kc0 s HIS 138 Ca 0.41 1.10 0.07 0.00 -0.15 0.00 0.00 55.06 56.49 2kc0 s HIS 138 Cb -0.08 -3.50 -0.03 0.00 1.11 0.00 0.00 32.58 30.08 2kc0 s HIS 138 CO 0.19 -1.68 -0.18 0.95 -0.85 0.00 0.00 174.74 173.17 2kc0 s THR 139 N 2.00 1.46 0.24 1.30 -4.23 -1.25 -4.90 115.64 110.27 2kc0 s THR 139 Ca 0.59 -1.25 -0.30 0.00 -1.18 0.00 0.00 61.69 59.56 2kc0 s THR 139 Cb -0.28 -1.31 -0.09 0.00 1.34 0.00 0.00 72.50 72.15 2kc0 s THR 139 CO 0.25 0.03 1.25 -0.44 -0.54 0.00 0.00 174.62 175.17 2kc0 s SER 140 N -1.43 6.97 0.24 3.99 0.01 -0.97 -4.15 113.70 118.36 2kc0 s SER 140 Ca 0.04 2.41 0.16 0.00 1.31 0.00 0.00 55.95 59.88 2kc0 s SER 140 Cb -0.09 -2.62 0.04 0.00 0.21 0.00 0.00 66.02 63.56 2kc0 s SER 140 CO 0.02 -0.43 1.31 2.19 0.41 0.00 0.00 173.24 176.74 2kc0 h PHE 141 N 4.63 0.00 0.00 2.43 -0.00 -1.89 -3.32 116.94 118.79 2kc0 h PHE 141 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.51 2kc0 h PHE 141 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.17 2kc0 h PHE 141 CO 0.60 0.45 0.00 -3.47 -0.00 0.00 0.00 178.31 175.89 2kc0 n ASP 142 N -3.12 0.12 0.00 -0.68 2.03 -1.26 -1.42 116.55 112.22 2kc0 n ASP 142 Ca -0.00 -0.62 0.00 0.00 0.52 0.00 0.00 54.79 54.69 2kc0 n ASP 142 Cb 0.73 -0.06 0.00 0.00 -0.72 0.00 0.00 41.12 41.07 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 -0.17 5.87 -4.09 -0.67 4.76 -1.25 -5.06 118.16 117.54 2kc0 n LYS 143 Ca 0.00 -0.02 -0.23 0.00 -2.87 0.00 0.00 58.31 55.19 2kc0 n LYS 143 Cb 0.03 -0.46 -0.04 0.00 -1.84 0.00 0.00 35.03 32.72 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 -1.69 3.86 0.69 -0.35 1.43 -0.51 -5.04 118.68 117.08 2kc0 s LEU 144 Ca 0.00 -0.17 -0.13 0.00 -1.03 0.00 0.00 54.13 52.80 2kc0 s LEU 144 Cb 0.00 -2.42 0.02 0.00 0.03 0.00 0.00 46.19 43.81 2kc0 s LEU 144 CO 0.00 -0.00 1.09 -2.16 0.23 0.00 0.00 176.35 175.51 2kc0 s PRO 145 N -3.59 2.70 -0.42 1.29 0.04 -1.26 -5.01 135.00 128.75 2kc0 s PRO 145 Ca 0.32 1.23 0.10 0.00 0.04 0.00 0.00 61.00 62.70 2kc0 s PRO 145 Cb -0.09 -1.95 0.40 0.00 0.04 0.00 0.00 34.50 32.91 2kc0 s PRO 145 CO 0.25 -1.31 0.97 -1.91 0.04 0.00 0.00 177.00 175.04 2kc0 n GLU 146 N -2.84 2.29 -0.14 4.56 2.13 -1.26 -4.87 120.64 120.52 2kc0 n GLU 146 Ca 0.09 -4.01 0.00 0.00 0.66 0.00 0.00 57.16 53.90 2kc0 n GLU 146 Cb 0.53 -1.85 0.00 0.00 0.27 0.00 0.00 31.44 30.38 2kc0 n GLU 146 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2kc0 n GLY 147 N -0.18 -0.99 0.00 8.31 0.00 -1.26 -4.50 105.19 106.57 2kc0 n GLY 147 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 0.00 1.67 3.22 -0.02 0.00 -1.26 -4.84 105.19 103.95 2kc0 n GLY 148 Ca 0.00 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 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 3.08 1.01 -0.09 1.61 3.03 -1.26 -0.44 118.95 125.89 2kc0 s ARG 149 Ca 0.00 -1.45 -0.04 0.00 2.03 0.00 0.00 55.73 56.27 2kc0 s ARG 149 Cb 0.00 -0.30 0.04 0.00 -1.03 0.00 0.00 34.95 33.66 2kc0 s ARG 149 CO 0.00 -0.06 0.19 0.00 -1.13 0.00 0.00 175.30 174.30 2kc0 s ALA 150 N -3.59 -0.37 0.45 7.88 0.00 -0.43 -4.92 121.76 120.78 2kc0 s ALA 150 Ca 0.19 0.79 -0.20 0.00 0.00 0.00 0.00 51.96 52.73 2kc0 s ALA 150 Cb 0.05 -0.61 -0.10 0.00 0.00 0.00 0.00 23.12 22.46 2kc0 s ALA 150 CO 0.00 -0.27 0.97 0.99 0.00 0.00 0.00 175.76 177.46 2kc0 s THR 151 N 1.46 4.31 0.04 0.00 2.01 -1.26 -1.66 115.64 120.55 2kc0 s THR 151 Ca -0.07 1.40 -0.05 0.00 0.31 0.00 0.00 61.69 63.28 2kc0 s THR 151 Cb -0.11 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.79 2kc0 s THR 151 CO -0.07 -0.35 0.07 -0.31 -0.69 0.00 0.00 174.62 173.27 2kc0 s TYR 152 N -2.20 0.26 -0.06 4.92 1.51 0.02 -4.81 117.35 116.99 2kc0 s TYR 152 Ca 0.62 -0.63 0.01 0.00 -1.01 0.00 0.00 57.07 56.07 2kc0 s TYR 152 Cb -0.10 -0.18 0.02 0.00 -0.11 0.00 0.00 41.96 41.58 2kc0 s TYR 152 CO 0.16 -0.38 -0.07 0.50 -1.11 0.00 0.00 175.55 174.65 2kc0 s ARG 153 N -2.94 1.16 0.19 -0.62 3.00 -1.26 -2.60 118.95 115.88 2kc0 s ARG 153 Ca -0.02 -0.21 -0.01 0.00 -1.00 0.00 0.00 55.73 54.49 2kc0 s ARG 153 Cb 0.01 -1.10 -0.04 0.00 0.00 0.00 0.00 34.95 33.82 2kc0 s ARG 153 CO -0.06 -0.07 0.12 0.20 0.00 0.00 0.00 175.30 175.48 2kc0 s GLY 154 N 0.95 1.34 -0.13 8.12 0.00 -0.81 -4.04 107.32 112.75 2kc0 s GLY 154 Ca -0.10 -1.64 -0.10 0.00 0.00 0.00 0.00 44.72 42.88 2kc0 s GLY 154 CO 0.00 -1.39 0.20 -1.59 0.00 0.00 0.00 173.10 170.33 2kc0 s THR 155 N -4.13 5.38 -0.24 0.90 2.01 -0.32 -2.70 115.64 116.53 2kc0 s THR 155 Ca 0.36 0.35 -0.03 0.00 0.31 0.00 0.00 61.69 62.68 2kc0 s THR 155 Cb 0.07 -3.50 0.02 0.00 0.01 0.00 0.00 72.50 69.10 2kc0 s THR 155 CO 0.10 0.53 -0.05 0.00 -0.69 0.00 0.00 174.62 174.51 2kc0 s ALA 156 N -0.47 2.74 -0.25 7.40 0.00 -1.26 -2.76 121.76 127.17 2kc0 s ALA 156 Ca 0.15 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2kc0 s ALA 156 Cb -0.13 -1.70 0.07 0.00 0.00 0.00 0.00 23.12 21.36 2kc0 s ALA 156 CO 0.04 -0.70 -0.02 -0.59 0.00 0.00 0.00 175.76 174.49 2kc0 s PHE 157 N 1.38 2.30 0.08 0.00 -0.71 -0.77 -4.08 117.98 116.18 2kc0 s PHE 157 Ca 0.02 -1.76 0.09 0.00 -1.04 0.00 0.00 56.93 54.24 2kc0 s PHE 157 Cb -0.16 -1.64 -0.03 0.00 -1.21 0.00 0.00 43.02 39.98 2kc0 s PHE 157 CO -0.04 -0.78 -0.25 0.20 -1.34 0.00 0.00 175.22 173.01 2kc0 s GLY 158 N 1.42 1.40 0.00 1.99 0.00 -1.26 -0.77 107.32 110.10 2kc0 s GLY 158 Ca -0.03 -1.31 -0.02 0.00 0.00 0.00 0.00 44.72 43.37 2kc0 s GLY 158 CO -0.08 -1.25 2.28 1.44 0.00 0.00 0.00 173.10 175.49 2kc0 n SER 159 N 1.37 4.53 0.17 1.64 7.64 -1.26 -1.68 113.62 126.04 2kc0 n SER 159 Ca -0.18 -2.26 0.00 0.00 1.01 0.00 0.00 58.87 57.45 2kc0 n SER 159 Cb 0.53 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.67 2kc0 n SER 159 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2kc0 n ASP 160 N 1.96 -1.86 0.04 6.43 2.03 -1.26 -4.96 116.55 118.93 2kc0 n ASP 160 Ca 0.14 0.64 -0.22 0.00 0.52 0.00 0.00 54.79 55.87 2kc0 n ASP 160 Cb 0.57 1.86 -0.14 0.00 -0.72 0.00 0.00 41.12 42.69 2kc0 n ASP 160 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2kc0 h ASP 161 N 0.00 0.49 0.00 1.67 5.19 -1.97 -3.48 116.42 118.32 2kc0 h ASP 161 Ca 0.00 -0.91 0.00 0.00 -0.62 0.00 0.00 57.03 55.50 2kc0 h ASP 161 Cb 0.00 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.35 2kc0 h ASP 161 CO 0.00 1.74 0.00 0.00 -3.12 0.00 0.00 179.24 177.86 2kc0 n ALA 162 N -2.93 0.00 -1.73 3.45 0.00 -0.68 -4.39 120.51 114.22 2kc0 n ALA 162 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2kc0 n ALA 162 Cb 1.00 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.64 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 -1.56 0.55 3.57 0.00 0.00 -1.26 -4.82 105.19 101.67 2kc0 n GLY 163 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2kc0 n GLY 163 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kc0 s GLY 164 N 0.00 1.62 0.66 -0.02 0.00 -1.26 -4.97 107.32 103.35 2kc0 s GLY 164 Ca 0.00 -2.85 -0.13 0.00 0.00 0.00 0.00 44.72 41.74 2kc0 s GLY 164 CO 0.00 2.70 1.06 0.54 0.00 0.00 0.00 173.10 177.41 2kc0 s LYS 165 N 4.23 3.00 0.06 2.90 1.02 -1.26 -4.40 119.74 125.29 2kc0 s LYS 165 Ca 0.53 1.10 0.07 0.00 0.02 0.00 0.00 55.97 57.69 2kc0 s LYS 165 Cb 0.03 -1.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.32 2kc0 s LYS 165 CO 0.05 -1.06 -0.20 -0.48 -0.92 0.00 0.00 175.35 172.75 2kc0 s LEU 166 N -5.15 2.22 -0.36 3.17 -0.00 -1.10 -1.98 118.68 115.48 2kc0 s LEU 166 Ca 0.61 -0.57 -0.06 0.00 -0.00 0.00 0.00 54.13 54.10 2kc0 s LEU 166 Cb -0.15 -0.89 0.06 0.00 -0.00 0.00 0.00 46.19 45.20 2kc0 s LEU 166 CO 0.47 0.10 0.15 -0.89 -0.00 0.00 0.00 176.35 176.18 2kc0 s THR 167 N -0.94 3.80 -0.01 5.48 2.01 -0.16 -1.92 115.64 123.90 2kc0 s THR 167 Ca 0.06 -1.30 -0.01 0.00 0.31 0.00 0.00 61.69 60.75 2kc0 s THR 167 Cb -0.09 -3.24 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 2kc0 s THR 167 CO 0.03 -0.30 0.11 -0.47 -0.69 0.00 0.00 174.62 173.29 2kc0 s TYR 168 N 1.38 3.36 -0.06 4.92 6.14 -1.07 -1.57 117.35 130.46 2kc0 s TYR 168 Ca 0.00 0.25 -0.07 0.00 0.64 0.00 0.00 57.07 57.90 2kc0 s TYR 168 Cb -0.21 -1.77 0.02 0.00 0.42 0.00 0.00 41.96 40.42 2kc0 s TYR 168 CO 0.02 0.58 0.18 -0.08 0.64 0.00 0.00 175.55 176.89 2kc0 s THR 169 N -1.23 0.01 0.01 4.34 -1.32 -0.29 -0.80 115.64 116.37 2kc0 s THR 169 Ca 0.24 -0.12 0.02 0.00 -1.21 0.00 0.00 61.69 60.62 2kc0 s THR 169 Cb -0.12 -0.29 -0.04 0.00 -1.51 0.00 0.00 72.50 70.54 2kc0 s THR 169 CO 0.15 -0.07 -0.02 -0.51 -2.21 0.00 0.00 174.62 171.97 2kc0 s ILE 170 N -0.17 4.01 -0.64 5.08 2.07 -0.66 -1.20 121.20 129.68 2kc0 s ILE 170 Ca -0.03 -0.69 -0.03 0.00 -1.41 0.00 0.00 60.65 58.50 2kc0 s ILE 170 Cb -0.02 -2.79 0.16 0.00 0.13 0.00 0.00 42.46 39.94 2kc0 s ILE 170 CO 0.01 0.35 0.45 -1.81 -1.91 0.00 0.00 174.94 172.03 2kc0 s ASP 171 N -1.60 5.24 0.55 4.50 1.01 -0.42 -1.31 116.67 124.63 2kc0 s ASP 171 Ca 0.19 -2.90 0.22 0.00 0.71 0.00 0.00 52.55 50.78 2kc0 s ASP 171 Cb -0.11 -1.86 1.45 0.00 1.01 0.00 0.00 42.92 43.41 2kc0 s ASP 171 CO 0.10 -0.36 2.12 -0.26 0.21 0.00 0.00 175.17 176.98 2kc0 h PHE 172 N 6.97 0.00 0.00 4.23 0.04 -1.04 0.26 116.94 127.41 2kc0 h PHE 172 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2kc0 h PHE 172 Cb 0.95 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.10 2kc0 h PHE 172 CO 0.72 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 178.43 2kc0 n ALA 173 N -2.49 1.29 -0.32 2.45 0.00 -0.69 -2.58 120.51 118.16 2kc0 n ALA 173 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2kc0 n ALA 173 Cb 0.25 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.46 2kc0 n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kc0 n ALA 174 N -1.66 1.44 -4.13 0.00 0.00 -0.32 -4.95 120.51 110.90 2kc0 n ALA 174 Ca 0.01 -0.24 -0.33 0.00 0.00 0.00 0.00 53.44 52.87 2kc0 n ALA 174 Cb 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.53 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 -0.12 -3.51 -4.96 0.00 5.02 0.78 -5.00 118.16 110.37 2kc0 n LYS 175 Ca 0.00 0.41 -0.32 0.00 -2.02 0.00 0.00 58.31 56.37 2kc0 n LYS 175 Cb 0.08 -5.03 -0.14 0.00 -0.02 0.00 0.00 35.03 29.92 2kc0 n LYS 175 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2kc0 s GLN 176 N -6.82 2.67 -0.29 1.97 -0.21 -1.02 -4.02 119.66 111.94 2kc0 s GLN 176 Ca 0.57 -0.75 -0.07 0.00 0.02 0.00 0.00 55.36 55.14 2kc0 s GLN 176 Cb -0.31 -2.37 0.01 0.00 1.00 0.00 0.00 33.01 31.34 2kc0 s GLN 176 CO 0.91 0.49 0.07 0.20 -2.12 0.00 0.00 175.29 174.84 2kc0 s GLY 177 N -0.39 1.77 0.46 3.09 0.00 0.25 -1.30 107.32 111.19 2kc0 s GLY 177 Ca 0.04 -1.41 0.03 0.00 0.00 0.00 0.00 44.72 43.38 2kc0 s GLY 177 CO 0.02 0.62 0.03 0.21 0.00 0.00 0.00 173.10 173.99 2kc0 s ASN 178 N 1.50 3.69 0.00 1.64 3.84 -0.34 -1.46 114.94 123.81 2kc0 s ASN 178 Ca 0.03 -1.58 0.00 0.00 0.21 0.00 0.00 52.86 51.52 2kc0 s ASN 178 Cb -0.17 0.29 0.00 0.00 -0.55 0.00 0.00 41.25 40.82 2kc0 s ASN 178 CO 0.02 -0.77 0.00 0.61 -2.79 0.00 0.00 177.10 174.17 2kc0 n GLY 179 N -1.09 1.14 3.58 1.21 0.00 -1.26 -1.13 105.19 107.63 2kc0 n GLY 179 Ca -0.13 -0.74 -0.06 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.38 0.45 0.07 1.61 -2.85 -0.61 -3.35 119.74 114.69 2kc0 s LYS 180 Ca 0.00 -0.08 -0.22 0.00 -1.00 0.00 0.00 55.97 54.67 2kc0 s LYS 180 Cb 0.00 0.21 -0.06 0.00 -2.06 0.00 0.00 37.83 35.92 2kc0 s LYS 180 CO 0.00 -0.18 0.66 0.42 0.10 0.00 0.00 175.35 176.35 2kc0 s ILE 181 N -2.08 4.70 -0.27 3.79 -1.09 -0.47 -0.99 121.20 124.78 2kc0 s ILE 181 Ca 0.06 1.42 -0.01 0.00 -2.23 0.00 0.00 60.65 59.89 2kc0 s ILE 181 Cb -0.01 -4.00 0.16 0.00 -1.58 0.00 0.00 42.46 37.03 2kc0 s ILE 181 CO -0.05 0.48 0.49 -0.70 -1.23 0.00 0.00 174.94 173.93 2kc0 s GLU 182 N -0.67 0.46 0.00 2.79 2.12 -0.84 -4.15 118.70 118.42 2kc0 s GLU 182 Ca 0.33 0.69 0.00 0.00 0.36 0.00 0.00 54.97 56.35 2kc0 s GLU 182 Cb -0.20 0.02 0.00 0.00 0.26 0.00 0.00 34.13 34.21 2kc0 s GLU 182 CO 0.21 -0.70 0.00 1.58 -0.54 0.00 0.00 175.26 175.81 2kc0 n HIS 183 N 5.39 0.00 -1.95 5.30 -0.00 -1.26 -4.56 115.22 118.14 2kc0 n HIS 183 Ca -0.01 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.86 2kc0 n HIS 183 Cb 0.51 0.00 0.01 0.00 -0.12 0.00 0.00 29.99 30.39 2kc0 n HIS 183 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 2kc0 s LEU 184 N -0.02 3.24 0.63 0.27 2.01 -1.26 -4.95 118.68 118.60 2kc0 s LEU 184 Ca 0.00 1.34 0.36 0.00 0.01 0.00 0.00 54.13 55.83 2kc0 s LEU 184 Cb 0.00 -4.35 2.05 0.00 0.01 0.00 0.00 46.19 43.90 2kc0 s LEU 184 CO 0.00 -0.89 2.28 0.07 1.01 0.00 0.00 176.35 178.82 2kc0 h LYS 185 N -0.29 0.00 -3.61 1.70 5.09 -2.02 -3.43 116.57 114.00 2kc0 h LYS 185 Ca -0.44 0.00 -0.14 0.00 0.09 0.00 0.00 60.65 60.16 2kc0 h LYS 185 Cb 1.20 0.00 -0.20 0.00 0.10 0.00 0.00 32.23 33.33 2kc0 h LYS 185 CO 0.62 0.00 -0.50 -1.54 -2.09 0.00 0.00 179.45 175.94 2kc0 s SER 186 N -5.64 0.08 0.54 7.07 1.04 -1.26 -5.05 113.70 110.47 2kc0 s SER 186 Ca -0.05 -0.32 0.20 0.00 0.48 0.00 0.00 55.95 56.26 2kc0 s SER 186 Cb 0.14 0.21 1.39 0.00 0.10 0.00 0.00 66.02 67.86 2kc0 s SER 186 CO 0.48 -0.42 2.15 1.55 0.98 0.00 0.00 173.24 177.98 2kc0 h PRO 187 N 4.06 0.00 0.00 4.02 0.13 -1.94 -2.23 132.00 136.03 2kc0 h PRO 187 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2kc0 h PRO 187 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2kc0 h PRO 187 CO 0.44 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.60 2kc0 n GLU 188 N -4.38 0.01 -0.05 0.86 1.02 -1.26 -2.50 120.64 114.33 2kc0 n GLU 188 Ca -0.01 0.40 -0.02 0.00 -0.02 0.00 0.00 57.16 57.50 2kc0 n GLU 188 Cb 0.15 -1.52 -0.12 0.00 -0.02 0.00 0.00 31.44 29.94 2kc0 n GLU 188 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2kc0 n LEU 189 N -1.53 0.00 -4.79 -4.62 4.77 -0.84 -4.78 117.00 105.22 2kc0 n LEU 189 Ca 0.01 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.64 2kc0 n LEU 189 Cb 0.08 0.24 -0.06 0.00 -2.33 0.00 0.00 43.42 41.35 2kc0 n LEU 189 CO 0.06 0.24 0.68 0.20 -1.33 0.00 0.00 177.39 177.24 2kc0 s ASN 190 N -4.50 7.03 0.17 -1.43 0.01 -1.04 -4.75 114.94 110.43 2kc0 s ASN 190 Ca -0.07 1.87 0.10 0.00 -0.71 0.00 0.00 52.86 54.05 2kc0 s ASN 190 Cb 0.07 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 2kc0 s ASN 190 CO 0.64 -0.30 -0.21 0.68 -1.51 0.00 0.00 177.10 176.40 2kc0 s VAL 191 N -1.77 2.04 0.51 1.60 -7.23 -1.26 -4.80 120.40 109.49 2kc0 s VAL 191 Ca 0.56 -1.95 -0.17 0.00 -1.81 0.00 0.00 61.98 58.62 2kc0 s VAL 191 Cb -0.18 -1.95 -0.08 0.00 0.56 0.00 0.00 36.38 34.74 2kc0 s VAL 191 CO 0.22 -0.22 0.99 -1.81 -0.31 0.00 0.00 175.10 173.98 2kc0 s ASP 192 N -2.63 6.60 -0.11 4.85 1.01 -1.26 -1.37 116.67 123.76 2kc0 s ASP 192 Ca 0.17 1.58 -0.00 0.00 0.71 0.00 0.00 52.55 55.02 2kc0 s ASP 192 Cb -0.07 -2.51 -0.02 0.00 1.01 0.00 0.00 42.92 41.33 2kc0 s ASP 192 CO 0.08 -0.60 -0.09 -0.22 0.21 0.00 0.00 175.17 174.54 2kc0 s LEU 193 N -4.06 2.97 -0.30 1.23 0.20 -1.21 -3.89 118.68 113.62 2kc0 s LEU 193 Ca 0.59 -0.18 -0.29 0.00 0.69 0.00 0.00 54.13 54.94 2kc0 s LEU 193 Cb -0.10 -1.67 0.01 0.00 -0.43 0.00 0.00 46.19 44.00 2kc0 s LEU 193 CO 0.31 0.24 1.23 0.00 -0.29 0.00 0.00 176.35 177.84 2kc0 s ALA 194 N -0.11 3.42 0.13 5.97 0.00 -0.77 -4.27 121.76 126.13 2kc0 s ALA 194 Ca 0.00 0.07 -0.35 0.00 0.00 0.00 0.00 51.96 51.68 2kc0 s ALA 194 Cb -0.13 -3.74 -0.15 0.00 0.00 0.00 0.00 23.12 19.10 2kc0 s ALA 194 CO 0.03 -1.66 1.47 0.00 0.00 0.00 0.00 175.76 175.60 2kc0 n ALA 195 N 7.34 0.33 -2.22 0.00 0.00 -1.26 -4.09 120.51 120.61 2kc0 n ALA 195 Ca 0.14 0.48 -0.11 0.00 0.00 0.00 0.00 53.44 53.95 2kc0 n ALA 195 Cb 0.47 -2.23 -0.10 0.00 0.00 0.00 0.00 19.45 17.59 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 0.69 0.91 0.46 0.00 0.00 -0.54 -4.94 121.76 118.35 2kc0 s ALA 196 Ca 0.81 -1.29 0.05 0.00 0.00 0.00 0.00 51.96 51.53 2kc0 s ALA 196 Cb -0.80 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 2kc0 s ALA 196 CO 0.42 -0.23 0.14 0.16 0.00 0.00 0.00 175.76 176.26 2kc0 s ASP 197 N -2.91 4.29 0.06 0.00 -4.77 -1.26 -0.59 116.67 111.49 2kc0 s ASP 197 Ca 0.10 -1.32 -0.30 0.00 -3.30 0.00 0.00 52.55 47.73 2kc0 s ASP 197 Cb 0.04 -0.02 -0.05 0.00 -1.09 0.00 0.00 42.92 41.80 2kc0 s ASP 197 CO -0.05 -0.72 1.02 -0.63 0.70 0.00 0.00 175.17 175.50 2kc0 s ILE 198 N -2.73 4.52 0.49 2.11 -1.09 -1.26 -3.88 121.20 119.37 2kc0 s ILE 198 Ca 0.29 1.92 -0.21 0.00 -2.23 0.00 0.00 60.65 60.42 2kc0 s ILE 198 Cb 0.03 -4.23 -0.07 0.00 -1.58 0.00 0.00 42.46 36.61 2kc0 s ILE 198 CO 0.16 0.21 1.09 -0.54 -1.23 0.00 0.00 174.94 174.63 2kc0 s LYS 199 N 0.58 3.69 0.24 2.79 1.02 -0.97 -4.99 119.74 122.10 2kc0 s LYS 199 Ca 0.51 1.54 0.25 0.00 0.02 0.00 0.00 55.97 58.29 2kc0 s LYS 199 Cb -0.24 -2.18 0.91 0.00 -0.52 0.00 0.00 37.83 35.80 2kc0 s LYS 199 CO 0.29 -0.56 1.74 -0.35 -0.92 0.00 0.00 175.35 175.56 2kc0 n PRO 200 N -0.87 0.22 -0.07 -1.68 -0.04 -1.26 -4.30 135.00 127.00 2kc0 n PRO 200 Ca 0.09 0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.88 2kc0 n PRO 200 Cb 0.51 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2kc0 n PRO 200 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2kc0 n ASP 201 N -2.24 2.25 -1.82 3.54 8.00 -1.26 -4.77 116.55 120.25 2kc0 n ASP 201 Ca 0.04 -1.42 -0.01 0.00 0.71 0.00 0.00 54.79 54.11 2kc0 n ASP 201 Cb 0.31 -0.41 -0.02 0.00 -0.02 0.00 0.00 41.12 40.99 2kc0 n ASP 201 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kc0 n GLY 202 N 0.90 1.71 0.14 0.44 0.00 -1.26 -4.58 105.19 102.54 2kc0 n GLY 202 Ca 0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 46.02 45.89 2kc0 n GLY 202 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2kc0 h LYS 203 N 2.71 0.00 0.00 1.61 5.09 -1.98 -3.41 116.57 120.59 2kc0 h LYS 203 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.76 2kc0 h LYS 203 Cb 0.61 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.94 2kc0 h LYS 203 CO 0.07 0.59 0.00 0.54 -2.09 0.00 0.00 179.45 178.55 2kc0 n ARG 204 N -3.75 1.42 -4.02 0.07 5.12 -1.26 -4.99 116.66 109.25 2kc0 n ARG 204 Ca -0.01 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 55.81 2kc0 n ARG 204 Cb 0.61 -0.18 -0.07 0.00 -1.16 0.00 0.00 32.46 31.65 2kc0 n ARG 204 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2kc0 s HIS 205 N -0.35 0.53 0.37 -1.55 2.46 -1.26 -2.30 115.29 113.19 2kc0 s HIS 205 Ca 0.00 -0.87 0.04 0.00 0.47 0.00 0.00 55.06 54.70 2kc0 s HIS 205 Cb 0.00 -0.06 -0.03 0.00 -0.13 0.00 0.00 32.58 32.35 2kc0 s HIS 205 CO 0.00 -0.80 0.13 0.00 -2.47 0.00 0.00 174.74 171.60 2kc0 s ALA 206 N -4.02 2.58 -0.03 1.58 0.00 -1.26 -4.14 121.76 116.48 2kc0 s ALA 206 Ca 0.23 -1.50 -0.06 0.00 0.00 0.00 0.00 51.96 50.63 2kc0 s ALA 206 Cb 0.03 0.85 0.01 0.00 0.00 0.00 0.00 23.12 24.01 2kc0 s ALA 206 CO 0.06 -0.38 0.14 0.08 0.00 0.00 0.00 175.76 175.65 2kc0 s VAL 207 N -3.32 0.04 -0.10 0.00 1.01 -1.26 -4.51 120.40 112.25 2kc0 s VAL 207 Ca 0.29 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.95 2kc0 s VAL 207 Cb 0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2kc0 s VAL 207 CO 0.16 -0.18 -0.11 -0.63 0.00 0.00 0.00 175.10 174.34 2kc0 s ILE 208 N -0.59 3.25 -0.25 2.22 -1.09 -0.76 -2.29 121.20 121.70 2kc0 s ILE 208 Ca -0.07 -0.61 -0.02 0.00 -2.23 0.00 0.00 60.65 57.72 2kc0 s ILE 208 Cb -0.04 -2.35 0.08 0.00 -1.58 0.00 0.00 42.46 38.57 2kc0 s ILE 208 CO 0.01 0.55 0.06 -0.55 -1.23 0.00 0.00 174.94 173.77 2kc0 s SER 209 N -0.08 3.49 0.11 3.58 0.15 -1.25 -2.71 113.70 116.98 2kc0 s SER 209 Ca -0.01 -1.21 0.02 0.00 0.70 0.00 0.00 55.95 55.45 2kc0 s SER 209 Cb -0.14 -0.74 -0.01 0.00 -1.71 0.00 0.00 66.02 63.42 2kc0 s SER 209 CO 0.03 -0.35 0.08 0.61 1.20 0.00 0.00 173.24 174.81 2kc0 n GLY 210 N 4.95 3.72 3.42 9.45 0.00 -0.65 -4.64 105.19 121.44 2kc0 n GLY 210 Ca -0.06 -1.79 -0.27 0.00 0.00 0.00 0.00 46.02 43.90 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 -1.73 3.43 -0.21 1.61 0.01 -1.26 -0.67 113.70 114.89 2kc0 s SER 211 Ca 0.11 -0.85 -0.02 0.00 1.31 0.00 0.00 55.95 56.49 2kc0 s SER 211 Cb 0.01 -0.26 0.06 0.00 0.21 0.00 0.00 66.02 66.04 2kc0 s SER 211 CO 0.08 0.13 0.03 -0.69 0.41 0.00 0.00 173.24 173.19 2kc0 s VAL 212 N -1.61 0.70 -0.18 3.43 1.01 -0.45 -1.84 120.40 121.45 2kc0 s VAL 212 Ca 0.20 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.22 2kc0 s VAL 212 Cb -0.08 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 2kc0 s VAL 212 CO 0.09 -0.22 0.81 -0.22 0.00 0.00 0.00 175.10 175.56 2kc0 s LEU 213 N 1.77 4.16 -0.22 3.92 1.98 -1.25 -0.81 118.68 128.24 2kc0 s LEU 213 Ca -0.01 1.12 -0.03 0.00 -2.89 0.00 0.00 54.13 52.32 2kc0 s LEU 213 Cb -0.17 -3.19 0.00 0.00 0.66 0.00 0.00 46.19 43.49 2kc0 s LEU 213 CO -0.09 -0.39 -0.07 -0.47 -1.89 0.00 0.00 176.35 173.44 2kc0 s TYR 214 N 2.17 2.94 -1.23 5.38 5.04 0.11 -4.46 117.35 127.30 2kc0 s TYR 214 Ca 0.37 -1.14 -0.04 0.00 -2.44 0.00 0.00 57.07 53.82 2kc0 s TYR 214 Cb -0.16 -2.07 0.03 0.00 0.35 0.00 0.00 41.96 40.10 2kc0 s TYR 214 CO 0.12 -0.62 0.26 -1.71 -1.34 0.00 0.00 175.55 172.26 2kc0 n ASN 215 N 4.75 -4.21 -3.21 4.32 5.15 -1.26 -0.78 115.26 120.03 2kc0 n ASN 215 Ca -0.18 -0.09 -0.21 0.00 -0.60 0.00 0.00 54.58 53.50 2kc0 n ASN 215 Cb 0.50 -3.51 0.07 0.00 -0.53 0.00 0.00 39.78 36.32 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 -3.31 -7.00 0.00 1.20 1.13 -1.26 -4.96 117.38 103.17 2kc0 n GLN 216 Ca -0.10 0.73 0.00 0.00 -1.94 0.00 0.00 57.00 55.69 2kc0 n GLN 216 Cb 0.59 -5.47 0.00 0.00 0.11 0.00 0.00 30.24 25.47 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 -4.70 0.00 -0.86 -1.58 0.00 0.04 -5.18 120.51 108.24 2kc0 n ALA 217 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2kc0 n ALA 217 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2kc0 n ALA 217 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2kc0 n GLU 218 N 0.00 0.00 -3.15 0.00 4.71 -1.25 -0.71 120.64 120.24 2kc0 n GLU 218 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.16 57.19 2kc0 n GLU 218 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 31.44 30.43 2kc0 n GLU 218 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2kc0 s LYS 219 N 0.00 0.54 0.38 3.49 2.20 -1.26 -4.69 119.74 120.40 2kc0 s LYS 219 Ca 0.00 0.68 0.03 0.00 -0.36 0.00 0.00 55.97 56.32 2kc0 s LYS 219 Cb 0.00 0.34 0.03 0.00 -1.51 0.00 0.00 37.83 36.69 2kc0 s LYS 219 CO 0.00 -0.86 0.25 0.41 -0.36 0.00 0.00 175.35 174.79 2kc0 n GLY 220 N 5.41 2.94 3.17 5.54 0.00 0.01 -3.57 105.19 118.70 2kc0 n GLY 220 Ca 0.03 -2.27 -0.12 0.00 0.00 0.00 0.00 46.02 43.66 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 -3.20 -0.15 0.11 1.61 1.04 0.32 -1.34 113.70 112.08 2kc0 s SER 221 Ca 0.19 0.12 0.07 0.00 0.48 0.00 0.00 55.95 56.81 2kc0 s SER 221 Cb -0.02 0.34 -0.03 0.00 0.10 0.00 0.00 66.02 66.41 2kc0 s SER 221 CO 0.12 -0.32 -0.16 -0.72 0.98 0.00 0.00 173.24 173.13 2kc0 s TYR 222 N -0.93 1.50 -0.01 5.02 -0.85 0.15 -1.07 117.35 121.16 2kc0 s TYR 222 Ca -0.10 -0.48 0.02 0.00 -0.52 0.00 0.00 57.07 55.99 2kc0 s TYR 222 Cb -0.05 -0.81 -0.00 0.00 0.38 0.00 0.00 41.96 41.48 2kc0 s TYR 222 CO 0.02 0.16 -0.07 0.45 -1.52 0.00 0.00 175.55 174.60 2kc0 s SER 223 N -2.12 0.82 0.17 -0.18 0.15 -0.06 -1.64 113.70 110.84 2kc0 s SER 223 Ca 0.06 -0.13 -0.18 0.00 0.70 0.00 0.00 55.95 56.40 2kc0 s SER 223 Cb -0.08 -0.14 0.04 0.00 -1.71 0.00 0.00 66.02 64.13 2kc0 s SER 223 CO 0.04 0.07 0.51 -1.48 1.20 0.00 0.00 173.24 173.57 2kc0 s LEU 224 N -0.02 0.05 0.27 3.45 0.05 -1.10 -0.88 118.68 120.50 2kc0 s LEU 224 Ca 0.01 -0.37 0.11 0.00 0.05 0.00 0.00 54.13 53.93 2kc0 s LEU 224 Cb -0.04 2.15 -0.05 0.00 -2.05 0.00 0.00 46.19 46.19 2kc0 s LEU 224 CO -0.00 -1.00 -0.19 -0.83 -0.55 0.00 0.00 176.35 173.78 2kc0 s GLY 225 N -2.84 1.81 -0.12 -3.48 0.00 -0.97 -1.82 107.32 99.91 2kc0 s GLY 225 Ca 0.06 -1.84 -0.18 0.00 0.00 0.00 0.00 44.72 42.76 2kc0 s GLY 225 CO -0.06 -1.93 0.48 -0.42 0.00 0.00 0.00 173.10 171.17 2kc0 s ILE 226 N -2.59 5.18 0.16 0.90 -1.09 -1.26 -3.58 121.20 118.92 2kc0 s ILE 226 Ca 0.29 0.97 0.11 0.00 -2.23 0.00 0.00 60.65 59.78 2kc0 s ILE 226 Cb -0.04 -3.82 -0.04 0.00 -1.58 0.00 0.00 42.46 36.97 2kc0 s ILE 226 CO 0.14 0.32 -0.24 -0.36 -1.23 0.00 0.00 174.94 173.56 2kc0 s PHE 227 N 0.67 2.20 0.07 3.97 0.08 -0.64 -4.21 117.98 120.12 2kc0 s PHE 227 Ca 0.26 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 56.93 2kc0 s PHE 227 Cb -0.15 -1.14 0.00 0.00 -0.57 0.00 0.00 43.02 41.16 2kc0 s PHE 227 CO 0.10 0.39 0.00 0.41 -0.10 0.00 0.00 175.22 176.03 2kc0 n GLY 228 N 0.59 -2.29 0.15 4.36 0.00 -0.48 -1.48 105.19 106.06 2kc0 n GLY 228 Ca -0.15 -1.43 0.12 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.18 0.00 -3.58 -0.02 0.00 -1.97 -3.20 103.07 94.12 2kc0 h GLY 229 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.13 2kc0 h GLY 229 CO 0.01 0.00 -0.90 0.28 0.00 0.00 0.00 176.54 175.92 2kc0 n LYS 230 N -2.31 0.51 -3.32 4.80 5.02 -1.26 -4.88 118.16 116.72 2kc0 n LYS 230 Ca 0.01 -2.17 -0.17 0.00 -2.02 0.00 0.00 58.31 53.96 2kc0 n LYS 230 Cb 0.16 -0.29 0.05 0.00 -0.02 0.00 0.00 35.03 34.93 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 0.03 -2.51 0.08 7.82 0.00 -1.21 -4.96 120.51 119.75 2kc0 n ALA 231 Ca -0.00 0.03 -0.11 0.00 0.00 0.00 0.00 53.44 53.36 2kc0 n ALA 231 Cb 0.98 -4.79 -0.04 0.00 0.00 0.00 0.00 19.45 15.60 2kc0 n ALA 231 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2kc0 h GLN 232 N -1.02 0.30 -3.50 0.00 4.15 -1.50 -3.43 115.11 110.11 2kc0 h GLN 232 Ca -0.54 -0.34 -0.04 0.00 0.77 0.00 0.00 58.65 58.50 2kc0 h GLN 232 Cb 1.28 0.10 -0.10 0.00 0.21 0.00 0.00 27.48 28.97 2kc0 h GLN 232 CO 0.43 1.05 -0.07 -1.83 -1.93 0.00 0.00 178.83 176.48 2kc0 s GLU 233 N -3.18 1.41 0.01 1.69 1.03 -1.21 -1.34 118.70 117.11 2kc0 s GLU 233 Ca -0.04 -1.04 0.00 0.00 0.03 0.00 0.00 54.97 53.92 2kc0 s GLU 233 Cb 0.09 0.48 -0.01 0.00 -0.80 0.00 0.00 34.13 33.90 2kc0 s GLU 233 CO 0.85 -0.59 -0.02 0.14 -1.33 0.00 0.00 175.26 174.32 2kc0 s VAL 234 N -3.94 0.08 0.14 1.83 -7.23 -0.33 -1.61 120.40 109.34 2kc0 s VAL 234 Ca 0.15 -0.49 -0.13 0.00 -1.81 0.00 0.00 61.98 59.70 2kc0 s VAL 234 Cb -0.00 -0.16 0.02 0.00 0.56 0.00 0.00 36.38 36.79 2kc0 s VAL 234 CO 0.02 -0.26 0.35 0.00 -0.31 0.00 0.00 175.10 174.90 2kc0 s ALA 235 N -0.77 -0.56 0.00 1.32 0.00 -1.23 -1.66 121.76 118.86 2kc0 s ALA 235 Ca -0.08 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.48 2kc0 s ALA 235 Cb -0.05 0.71 0.00 0.00 0.00 0.00 0.00 23.12 23.78 2kc0 s ALA 235 CO -0.00 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 175.52 2kc0 n GLY 236 N -0.21 -0.72 3.24 0.00 0.00 -1.21 -2.28 105.19 104.01 2kc0 n GLY 236 Ca -0.13 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.37 2kc0 n GLY 236 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kc0 s SER 237 N -4.00 -0.32 -0.06 1.61 1.04 -0.06 -1.75 113.70 110.16 2kc0 s SER 237 Ca 0.00 0.52 0.02 0.00 0.48 0.00 0.00 55.95 56.97 2kc0 s SER 237 Cb 0.00 0.60 0.02 0.00 0.10 0.00 0.00 66.02 66.73 2kc0 s SER 237 CO 0.00 -0.23 -0.10 0.00 0.98 0.00 0.00 173.24 173.90 2kc0 s ALA 238 N -0.29 1.08 -0.01 5.32 0.00 0.14 -0.89 121.76 127.12 2kc0 s ALA 238 Ca -0.04 -0.30 0.08 0.00 0.00 0.00 0.00 51.96 51.69 2kc0 s ALA 238 Cb -0.03 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 2kc0 s ALA 238 CO 0.02 0.08 -0.25 -1.21 0.00 0.00 0.00 175.76 174.39 2kc0 s GLU 239 N 0.74 1.99 -0.02 0.00 8.01 -0.23 -0.57 118.70 128.61 2kc0 s GLU 239 Ca -0.14 -0.91 0.02 0.00 0.01 0.00 0.00 54.97 53.96 2kc0 s GLU 239 Cb -0.15 -1.94 0.01 0.00 -4.31 0.00 0.00 34.13 27.73 2kc0 s GLU 239 CO 0.03 0.53 -0.07 0.54 0.01 0.00 0.00 175.26 176.30 2kc0 s VAL 240 N -0.60 0.60 -0.00 2.63 0.11 -0.46 -0.52 120.40 122.15 2kc0 s VAL 240 Ca 0.10 -0.26 -0.15 0.00 -2.93 0.00 0.00 61.98 58.74 2kc0 s VAL 240 Cb -0.10 -0.54 -0.06 0.00 -1.53 0.00 0.00 36.38 34.15 2kc0 s VAL 240 CO -0.01 0.20 0.42 -0.54 -3.33 0.00 0.00 175.10 171.84 2kc0 s LYS 241 N 0.25 3.97 0.31 1.54 1.02 -1.23 -0.89 119.74 124.71 2kc0 s LYS 241 Ca -0.03 0.44 0.04 0.00 0.02 0.00 0.00 55.97 56.43 2kc0 s LYS 241 Cb -0.08 -3.24 -0.06 0.00 -0.52 0.00 0.00 37.83 33.93 2kc0 s LYS 241 CO 0.00 0.64 0.04 0.95 -0.92 0.00 0.00 175.35 176.07 2kc0 s THR 242 N -0.94 1.19 0.48 2.17 -4.23 0.35 -4.21 115.64 110.46 2kc0 s THR 242 Ca 0.24 -2.02 0.24 0.00 -1.18 0.00 0.00 61.69 58.97 2kc0 s THR 242 Cb -0.17 -2.71 0.42 0.00 1.34 0.00 0.00 72.50 71.38 2kc0 s THR 242 CO 0.13 -0.06 1.91 -0.37 -0.54 0.00 0.00 174.62 175.69 2kc0 h VAL 243 N 2.18 0.66 0.00 2.29 -1.51 -2.02 -0.88 116.25 116.97 2kc0 h VAL 243 Ca -0.40 -0.06 -0.15 0.00 -1.23 0.00 0.00 66.70 64.85 2kc0 h VAL 243 Cb 1.24 0.47 -0.02 0.00 -2.13 0.00 0.00 31.29 30.85 2kc0 h VAL 243 CO 0.69 0.03 -0.72 0.78 -1.23 0.00 0.00 177.57 177.12 2kc0 h ASN 244 N 0.18 0.00 -1.62 4.19 2.35 -2.02 -3.50 115.58 115.16 2kc0 h ASN 244 Ca 0.39 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.14 2kc0 h ASN 244 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 2kc0 h ASN 244 CO -0.07 0.72 0.00 0.61 -1.65 0.00 0.00 177.43 177.03 2kc0 n GLY 245 N 0.97 0.92 3.80 2.83 0.00 -0.34 -5.13 105.19 108.24 2kc0 n GLY 245 Ca 0.00 -1.94 -0.37 0.00 0.00 0.00 0.00 46.02 43.71 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 -2.28 4.44 -0.17 -0.61 1.10 -1.26 -0.49 121.20 121.92 2kc0 s ILE 246 Ca 0.00 1.49 0.01 0.00 -0.51 0.00 0.00 60.65 61.64 2kc0 s ILE 246 Cb 0.00 -3.94 0.01 0.00 0.15 0.00 0.00 42.46 38.68 2kc0 s ILE 246 CO 0.00 0.24 -0.18 -0.13 -2.11 0.00 0.00 174.94 172.76 2kc0 s ARG 247 N -1.87 3.08 -0.08 3.50 1.81 -0.07 -4.96 118.95 120.36 2kc0 s ARG 247 Ca 0.44 -0.80 -0.13 0.00 -1.72 0.00 0.00 55.73 53.53 2kc0 s ARG 247 Cb -0.18 -2.60 -0.05 0.00 -0.45 0.00 0.00 34.95 31.67 2kc0 s ARG 247 CO 0.22 -0.12 0.31 -1.01 -0.68 0.00 0.00 175.30 174.03 2kc0 s HIS 248 N 1.11 3.61 -0.00 -0.53 3.76 -1.26 -1.35 115.29 120.62 2kc0 s HIS 248 Ca 0.00 0.76 0.00 0.00 -0.15 0.00 0.00 55.06 55.67 2kc0 s HIS 248 Cb -0.14 -2.23 0.00 0.00 1.11 0.00 0.00 32.58 31.33 2kc0 s HIS 248 CO -0.07 0.53 0.00 0.42 -0.85 0.00 0.00 174.74 174.78 2kc0 s ILE 249 N -0.56 0.02 0.16 0.60 1.01 0.27 -4.23 121.20 118.47 2kc0 s ILE 249 Ca 0.19 0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.80 2kc0 s ILE 249 Cb -0.14 -0.05 -0.06 0.00 0.01 0.00 0.00 42.46 42.22 2kc0 s ILE 249 CO 0.08 0.02 0.42 -0.83 0.00 0.00 0.00 174.94 174.63 2kc0 s GLY 250 N 0.17 2.25 -0.01 6.18 0.00 0.05 -0.68 107.32 115.27 2kc0 s GLY 250 Ca -0.01 -0.49 0.03 0.00 0.00 0.00 0.00 44.72 44.24 2kc0 s GLY 250 CO -0.00 -0.40 -0.07 1.08 0.00 0.00 0.00 173.10 173.71 2kc0 s LEU 251 N -2.69 3.15 -0.28 0.66 2.01 -0.72 -1.85 118.68 118.96 2kc0 s LEU 251 Ca 0.43 -0.12 -0.12 0.00 0.01 0.00 0.00 54.13 54.32 2kc0 s LEU 251 Cb -0.12 -1.78 0.10 0.00 0.01 0.00 0.00 46.19 44.41 2kc0 s LEU 251 CO 0.24 0.30 0.63 0.00 1.01 0.00 0.00 176.35 178.53 2kc0 s ALA 252 N -0.95 -1.85 0.15 4.21 0.00 -1.11 -3.35 121.76 118.87 2kc0 s ALA 252 Ca 0.16 2.25 -0.12 0.00 0.00 0.00 0.00 51.96 54.24 2kc0 s ALA 252 Cb -0.11 -1.57 0.01 0.00 0.00 0.00 0.00 23.12 21.45 2kc0 s ALA 252 CO 0.06 -0.68 0.35 0.00 0.00 0.00 0.00 175.76 175.49 2kc0 s ALA 253 N 2.35 -0.45 0.03 0.00 0.00 -0.66 -1.17 121.76 121.85 2kc0 s ALA 253 Ca -0.07 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.35 2kc0 s ALA 253 Cb -0.09 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.77 2kc0 s ALA 253 CO -0.18 -0.66 0.02 0.21 0.00 0.00 0.00 175.76 175.14 2kc0 s LYS 254 N -3.89 0.49 0.00 0.00 2.20 -1.26 -1.19 119.74 116.09 2kc0 s LYS 254 Ca 0.10 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 54.91 2kc0 s LYS 254 Cb 0.02 0.18 0.00 0.00 -1.51 0.00 0.00 37.83 36.52 2kc0 s LYS 254 CO -0.05 -0.10 0.36 0.00 -0.36 0.00 0.00 175.35 175.20