#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 -0.48 0.22 0.00 0.00 -1.26 -2.81 105.19 100.86 2kc0 n GLY 15 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 0.28 -0.71 0.99 3.38 -1.94 -2.09 115.31 115.21 2kc0 h LEU 16 Ca 0.00 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 2kc0 h LEU 16 Cb 0.04 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2kc0 h LEU 16 CO 0.00 0.18 0.30 0.00 0.09 0.00 0.00 178.44 179.01 2kc0 h ALA 17 N 1.36 0.92 -0.33 1.53 0.00 -1.70 -2.49 119.26 118.55 2kc0 h ALA 17 Ca 0.28 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2kc0 h ALA 17 Cb 0.29 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2kc0 h ALA 17 CO -0.25 0.52 -0.02 0.22 0.00 0.00 0.00 179.25 179.72 2kc0 h ASP 18 N 1.01 0.48 0.76 0.00 3.58 -1.71 -2.33 116.42 118.21 2kc0 h ASP 18 Ca 0.24 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.59 2kc0 h ASP 18 Cb 0.18 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.10 2kc0 h ASP 18 CO -0.02 0.57 0.00 0.00 -2.88 0.00 0.00 179.24 176.90 2kc0 n ALA 19 N -2.48 1.67 -0.04 -0.78 0.00 -0.81 -0.23 120.51 117.84 2kc0 n ALA 19 Ca 0.01 0.09 -0.16 0.00 0.00 0.00 0.00 53.44 53.39 2kc0 n ALA 19 Cb 0.25 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.17 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 -2.29 1.92 0.08 0.00 4.77 -0.93 -3.95 117.00 116.61 2kc0 n LEU 20 Ca 0.02 0.18 -0.14 0.00 -0.03 0.00 0.00 56.01 56.04 2kc0 n LEU 20 Cb 0.24 -0.55 -0.14 0.00 -2.33 0.00 0.00 43.42 40.64 2kc0 n LEU 20 CO 0.20 0.70 -0.08 0.71 -1.33 0.00 0.00 177.39 177.59 2kc0 h THR 21 N 0.03 1.45 -6.27 -5.08 1.35 -1.27 -3.49 112.91 99.64 2kc0 h THR 21 Ca -0.43 -3.07 -0.45 0.00 -0.55 0.00 0.00 66.41 61.91 2kc0 h THR 21 Cb 2.03 2.87 0.05 0.00 -1.73 0.00 0.00 68.15 71.38 2kc0 h THR 21 CO 0.05 0.88 -0.92 0.00 -0.25 0.00 0.00 175.52 175.28 2kc0 n ALA 22 N -2.52 -2.38 0.24 6.62 0.00 0.68 -4.93 120.51 118.21 2kc0 n ALA 22 Ca -0.09 -0.24 0.11 0.00 0.00 0.00 0.00 53.44 53.23 2kc0 n ALA 22 Cb 1.01 -3.35 0.56 0.00 0.00 0.00 0.00 19.45 17.68 2kc0 n ALA 22 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2kc0 h PRO 23 N -1.88 0.00 -7.40 0.00 0.13 -1.96 -3.45 132.00 117.44 2kc0 h PRO 23 Ca -0.65 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.04 2kc0 h PRO 23 Cb 1.36 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.66 2kc0 h PRO 23 CO 0.52 0.19 0.19 -0.48 -0.23 0.00 0.00 178.00 178.19 2kc0 s LEU 24 N -6.93 1.41 -1.11 1.56 0.05 -1.26 -4.92 118.68 107.48 2kc0 s LEU 24 Ca -0.01 0.98 -0.24 0.00 0.05 0.00 0.00 54.13 54.91 2kc0 s LEU 24 Cb 0.11 -3.05 -0.10 0.00 -2.05 0.00 0.00 46.19 41.11 2kc0 s LEU 24 CO 0.61 -3.34 1.97 -1.81 -0.55 0.00 0.00 176.35 173.24 2kc0 s ASP 25 N -3.68 4.84 -1.12 1.48 1.01 -1.26 -4.86 116.67 113.07 2kc0 s ASP 25 Ca 0.67 -1.35 -0.10 0.00 0.71 0.00 0.00 52.55 52.48 2kc0 s ASP 25 Cb -0.16 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.12 2kc0 s ASP 25 CO 0.57 -3.23 2.30 0.00 0.21 0.00 0.00 175.17 175.01 2kc0 n HIS 26 N 15.04 1.95 -0.04 4.23 1.44 -1.26 -3.33 115.22 133.25 2kc0 n HIS 26 Ca 0.44 -2.33 0.00 0.00 -2.01 0.00 0.00 57.72 53.82 2kc0 n HIS 26 Cb 0.47 -1.98 0.00 0.00 0.12 0.00 0.00 29.99 28.60 2kc0 n HIS 26 CO 0.00 0.00 0.00 0.36 -2.81 0.00 0.00 176.34 173.89 2kc0 n LYS 27 N 4.75 0.57 -0.81 -1.40 2.85 -1.26 -5.18 118.16 117.68 2kc0 n LYS 27 Ca 0.55 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 57.48 2kc0 n LYS 27 Cb 0.23 -0.05 0.15 0.00 -0.65 0.00 0.00 35.03 34.71 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 0.00 -0.03 0.18 -5.58 2.03 -1.21 -4.98 116.55 106.96 2kc0 n ASP 28 Ca 0.00 0.45 0.05 0.00 0.52 0.00 0.00 54.79 55.80 2kc0 n ASP 28 Cb 0.00 -1.42 0.27 0.00 -0.72 0.00 0.00 41.12 39.25 2kc0 n ASP 28 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 2kc0 h LYS 29 N -1.56 0.00 -7.38 -0.67 2.10 -2.03 -3.45 116.57 103.58 2kc0 h LYS 29 Ca -0.44 0.00 -0.46 0.00 -2.00 0.00 0.00 60.65 57.75 2kc0 h LYS 29 Cb 1.28 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.70 2kc0 h LYS 29 CO 0.41 0.41 0.27 0.20 -2.00 0.00 0.00 179.45 178.74 2kc0 s GLY 30 N -4.38 1.68 -0.16 0.07 0.00 -1.26 -4.99 107.32 98.28 2kc0 s GLY 30 Ca 0.01 -0.95 -0.29 0.00 0.00 0.00 0.00 44.72 43.49 2kc0 s GLY 30 CO 0.70 -0.49 1.97 -2.27 0.00 0.00 0.00 173.10 173.01 2kc0 s LEU 31 N -5.34 3.81 0.00 0.66 0.20 -1.26 -4.82 118.68 111.93 2kc0 s LEU 31 Ca 0.62 1.98 0.00 0.00 0.69 0.00 0.00 54.13 57.42 2kc0 s LEU 31 Cb -0.10 -3.52 0.00 0.00 -0.43 0.00 0.00 46.19 42.14 2kc0 s LEU 31 CO 0.46 -1.54 0.30 0.00 -0.29 0.00 0.00 176.35 175.29 2kc0 n GLN 32 N 8.15 -0.25 -3.48 1.98 -0.00 -1.26 -4.08 117.38 118.44 2kc0 n GLN 32 Ca 0.24 -0.33 -0.06 0.00 -0.00 0.00 0.00 57.00 56.84 2kc0 n GLN 32 Cb 0.44 -0.74 0.02 0.00 -0.00 0.00 0.00 30.24 29.96 2kc0 n GLN 32 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2kc0 n SER 33 N -0.03 -1.89 -3.79 2.61 3.41 -1.26 -0.20 113.62 112.47 2kc0 n SER 33 Ca 0.00 -2.23 -0.20 0.00 -0.26 0.00 0.00 58.87 56.18 2kc0 n SER 33 Cb 0.16 3.13 -0.17 0.00 -0.26 0.00 0.00 64.21 67.07 2kc0 n SER 33 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2kc0 s LEU 34 N 0.00 0.86 -0.10 1.04 1.98 -0.21 -4.86 118.68 117.39 2kc0 s LEU 34 Ca 0.16 -0.04 -0.13 0.00 -2.89 0.00 0.00 54.13 51.22 2kc0 s LEU 34 Cb -0.04 -0.30 -0.05 0.00 0.66 0.00 0.00 46.19 46.46 2kc0 s LEU 34 CO 0.09 -0.14 0.32 -0.89 -1.89 0.00 0.00 176.35 173.83 2kc0 s THR 35 N 1.46 5.24 -0.33 3.68 2.01 -1.26 -1.24 115.64 125.20 2kc0 s THR 35 Ca -0.03 0.62 0.07 0.00 0.31 0.00 0.00 61.69 62.66 2kc0 s THR 35 Cb -0.13 -3.64 0.54 0.00 0.01 0.00 0.00 72.50 69.29 2kc0 s THR 35 CO -0.03 0.48 1.57 0.18 -0.69 0.00 0.00 174.62 176.14 2kc0 n LEU 36 N 2.76 4.76 -0.33 4.42 4.32 -1.08 -4.57 117.00 127.29 2kc0 n LEU 36 Ca -0.13 -3.77 0.21 0.00 -0.02 0.00 0.00 56.01 52.29 2kc0 n LEU 36 Cb 0.52 -0.69 0.42 0.00 -1.62 0.00 0.00 43.42 42.06 2kc0 n LEU 36 CO 0.38 1.23 1.08 0.44 -1.22 0.00 0.00 177.39 179.30 2kc0 h ASP 37 N 1.01 0.41 1.26 -1.43 5.19 -1.90 -1.01 116.42 119.95 2kc0 h ASP 37 Ca 0.32 0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.92 2kc0 h ASP 37 Cb 1.94 0.16 0.00 0.00 0.18 0.00 0.00 39.33 41.61 2kc0 h ASP 37 CO 0.57 -0.11 -0.29 0.06 -3.12 0.00 0.00 179.24 176.34 2kc0 h GLN 38 N 0.33 0.00 0.00 3.56 -0.00 -1.98 -3.40 115.11 113.62 2kc0 h GLN 38 Ca 0.68 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 59.25 2kc0 h GLN 38 Cb 1.49 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.96 2kc0 h GLN 38 CO -0.60 0.00 -0.49 1.03 -0.00 0.00 0.00 178.83 178.76 2kc0 h SER 39 N 0.00 0.00 -4.29 0.06 0.87 -1.55 -3.49 113.55 105.15 2kc0 h SER 39 Ca 0.00 -0.54 -0.47 0.00 -1.23 0.00 0.00 61.79 59.55 2kc0 h SER 39 Cb 0.77 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 62.48 2kc0 h SER 39 CO 0.00 1.06 -0.80 0.54 -0.53 0.00 0.00 176.83 177.09 2kc0 s VAL 40 N -2.17 1.17 0.71 2.23 0.11 -1.22 -5.16 120.40 116.08 2kc0 s VAL 40 Ca -0.19 -0.94 -0.11 0.00 -2.93 0.00 0.00 61.98 57.81 2kc0 s VAL 40 Cb 0.01 -1.04 0.02 0.00 -1.53 0.00 0.00 36.38 33.84 2kc0 s VAL 40 CO 0.49 0.09 1.10 -0.13 -3.33 0.00 0.00 175.10 173.31 2kc0 s ARG 41 N -0.98 2.80 0.00 1.54 1.81 -1.26 -4.67 118.95 118.19 2kc0 s ARG 41 Ca 0.03 0.47 0.04 0.00 -1.72 0.00 0.00 55.73 54.55 2kc0 s ARG 41 Cb -0.07 -2.01 0.24 0.00 -0.45 0.00 0.00 34.95 32.65 2kc0 s ARG 41 CO 0.01 -1.08 0.65 1.63 -0.68 0.00 0.00 175.30 175.83 2kc0 n LYS 42 N -3.04 0.16 0.00 3.54 5.02 -1.25 -1.68 118.16 120.91 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 0.57 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 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 -0.90 1.36 -4.74 4.39 6.94 -1.26 -4.80 115.26 116.24 2kc0 n ASN 43 Ca 0.03 -0.05 -0.40 0.00 -0.02 0.00 0.00 54.58 54.15 2kc0 n ASN 43 Cb 0.01 0.37 -0.05 0.00 -2.36 0.00 0.00 39.78 37.75 2kc0 n ASN 43 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2kc0 s GLU 44 N -0.64 4.45 0.22 -3.83 2.12 -0.68 -4.86 118.70 115.49 2kc0 s GLU 44 Ca 0.00 0.97 0.10 0.00 0.36 0.00 0.00 54.97 56.40 2kc0 s GLU 44 Cb 0.00 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 30.97 2kc0 s GLU 44 CO 0.00 0.27 -0.13 -1.59 -0.54 0.00 0.00 175.26 173.27 2kc0 s LYS 45 N 0.04 1.90 0.06 4.30 0.00 -1.11 -2.46 119.74 122.46 2kc0 s LYS 45 Ca 0.37 -1.46 -0.19 0.00 0.00 0.00 0.00 55.97 54.69 2kc0 s LYS 45 Cb -0.20 -2.00 0.04 0.00 0.00 0.00 0.00 37.83 35.67 2kc0 s LYS 45 CO 0.21 0.39 0.44 -0.48 0.00 0.00 0.00 175.35 175.91 2kc0 s LEU 46 N -3.09 0.29 -0.18 2.77 2.34 -0.41 -1.28 118.68 119.12 2kc0 s LEU 46 Ca 0.26 0.00 -0.01 0.00 0.06 0.00 0.00 54.13 54.44 2kc0 s LEU 46 Cb -0.07 1.85 0.00 0.00 -0.56 0.00 0.00 46.19 47.41 2kc0 s LEU 46 CO 0.15 -0.70 -0.13 -0.75 -1.06 0.00 0.00 176.35 173.85 2kc0 s LYS 47 N -2.64 3.19 -0.12 1.48 2.20 0.04 -1.15 119.74 122.75 2kc0 s LYS 47 Ca -0.04 -0.74 0.01 0.00 -0.36 0.00 0.00 55.97 54.85 2kc0 s LYS 47 Cb -0.00 -2.73 -0.01 0.00 -1.51 0.00 0.00 37.83 33.58 2kc0 s LYS 47 CO -0.03 -0.13 -0.17 -1.17 -0.36 0.00 0.00 175.35 173.48 2kc0 s LEU 48 N 1.19 2.47 -0.01 5.43 1.98 -0.37 -1.21 118.68 128.16 2kc0 s LEU 48 Ca 0.02 -0.42 -0.18 0.00 -2.89 0.00 0.00 54.13 50.66 2kc0 s LEU 48 Cb -0.14 -1.53 0.03 0.00 0.66 0.00 0.00 46.19 45.21 2kc0 s LEU 48 CO -0.06 0.16 0.38 0.00 -1.89 0.00 0.00 176.35 174.94 2kc0 s ALA 49 N 0.38 -0.96 -0.18 5.97 0.00 -0.10 -0.56 121.76 126.30 2kc0 s ALA 49 Ca -0.14 0.46 -0.29 0.00 0.00 0.00 0.00 51.96 52.00 2kc0 s ALA 49 Cb -0.17 0.11 0.12 0.00 0.00 0.00 0.00 23.12 23.18 2kc0 s ALA 49 CO 0.06 -0.31 0.95 0.00 0.00 0.00 0.00 175.76 176.47 2kc0 s ALA 50 N -1.53 -1.92 -1.46 0.00 0.00 -0.30 -1.89 121.76 114.67 2kc0 s ALA 50 Ca -0.12 1.65 -0.03 0.00 0.00 0.00 0.00 51.96 53.46 2kc0 s ALA 50 Cb -0.04 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.26 2kc0 s ALA 50 CO 0.04 -0.30 0.22 0.94 0.00 0.00 0.00 175.76 176.66 2kc0 n GLN 51 N 1.23 -1.71 -0.08 0.00 -0.06 -1.26 -1.79 117.38 113.70 2kc0 n GLN 51 Ca -0.12 0.21 0.00 0.00 -2.00 0.00 0.00 57.00 55.09 2kc0 n GLN 51 Cb 0.57 -3.84 0.00 0.00 -4.06 0.00 0.00 30.24 22.91 2kc0 n GLN 51 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2kc0 n GLY 52 N -2.32 0.85 3.54 1.69 0.00 -1.26 -4.54 105.19 103.15 2kc0 n GLY 52 Ca -0.30 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.39 2.87 -0.18 4.61 0.00 -0.74 -5.08 121.76 120.85 2kc0 s ALA 53 Ca 0.00 -1.53 -0.12 0.00 0.00 0.00 0.00 51.96 50.32 2kc0 s ALA 53 Cb 0.00 -0.65 0.06 0.00 0.00 0.00 0.00 23.12 22.53 2kc0 s ALA 53 CO 0.00 0.44 0.45 -1.83 0.00 0.00 0.00 175.76 174.83 2kc0 s GLU 54 N -2.86 0.46 -0.11 0.00 -1.05 -1.26 -1.15 118.70 112.73 2kc0 s GLU 54 Ca 0.25 0.81 0.01 0.00 -0.15 0.00 0.00 54.97 55.88 2kc0 s GLU 54 Cb -0.08 0.06 0.02 0.00 -0.44 0.00 0.00 34.13 33.68 2kc0 s GLU 54 CO 0.14 -0.14 -0.13 0.21 0.95 0.00 0.00 175.26 176.30 2kc0 s LYS 55 N 1.17 2.00 -0.15 -4.83 2.47 0.28 -4.99 119.74 115.69 2kc0 s LYS 55 Ca -0.08 -0.47 -0.26 0.00 -1.56 0.00 0.00 55.97 53.60 2kc0 s LYS 55 Cb -0.07 -1.79 -0.01 0.00 -1.46 0.00 0.00 37.83 34.49 2kc0 s LYS 55 CO -0.11 -0.13 0.87 0.99 0.16 0.00 0.00 175.35 177.14 2kc0 s THR 56 N 1.20 4.86 0.32 3.43 2.01 -1.26 -1.24 115.64 124.96 2kc0 s THR 56 Ca -0.03 1.73 -0.03 0.00 0.31 0.00 0.00 61.69 63.68 2kc0 s THR 56 Cb -0.14 -4.18 -0.01 0.00 0.01 0.00 0.00 72.50 68.18 2kc0 s THR 56 CO -0.04 0.03 0.43 -0.72 -0.69 0.00 0.00 174.62 173.63 2kc0 s TYR 57 N 2.05 1.05 -1.95 4.92 1.13 -0.30 -5.00 117.35 119.26 2kc0 s TYR 57 Ca 0.41 -1.27 0.00 0.00 -1.41 0.00 0.00 57.07 54.80 2kc0 s TYR 57 Cb -0.17 -0.15 0.00 0.00 -1.10 0.00 0.00 41.96 40.54 2kc0 s TYR 57 CO 0.14 -1.05 0.00 0.41 -2.51 0.00 0.00 175.55 172.54 2kc0 n GLY 58 N -0.52 -1.46 4.97 5.49 0.00 -1.26 -1.28 105.19 111.12 2kc0 n GLY 58 Ca 0.01 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2kc0 n GLY 58 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kc0 n ASN 59 N 1.17 0.00 0.00 1.61 4.13 -1.03 -4.34 115.26 116.80 2kc0 n ASN 59 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 2kc0 n ASN 59 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 2kc0 n ASN 59 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2kc0 n GLY 60 N 0.00 1.01 3.61 7.41 0.00 -1.26 -3.86 105.19 112.09 2kc0 n GLY 60 Ca 0.00 0.40 -0.11 0.00 0.00 0.00 0.00 46.02 46.31 2kc0 n GLY 60 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kc0 s ASP 61 N 0.00 0.36 -0.10 1.61 2.15 -1.26 -5.05 116.67 114.38 2kc0 s ASP 61 Ca 0.00 -1.21 0.01 0.00 0.43 0.00 0.00 52.55 51.78 2kc0 s ASP 61 Cb 0.00 0.70 0.02 0.00 -0.30 0.00 0.00 42.92 43.33 2kc0 s ASP 61 CO 0.00 -1.36 -0.12 -0.94 -0.17 0.00 0.00 175.17 172.58 2kc0 s SER 62 N -3.12 2.21 -0.50 -0.34 1.04 -1.26 -2.62 113.70 109.11 2kc0 s SER 62 Ca 0.24 -0.36 -0.26 0.00 0.48 0.00 0.00 55.95 56.05 2kc0 s SER 62 Cb -0.02 -0.95 0.03 0.00 0.10 0.00 0.00 66.02 65.18 2kc0 s SER 62 CO 0.14 -0.04 1.00 -0.22 0.98 0.00 0.00 173.24 175.11 2kc0 s LEU 63 N 1.22 3.88 0.06 2.42 2.96 -0.37 -4.84 118.68 124.01 2kc0 s LEU 63 Ca -0.03 0.07 -0.24 0.00 -0.22 0.00 0.00 54.13 53.71 2kc0 s LEU 63 Cb -0.14 -3.17 -0.06 0.00 0.50 0.00 0.00 46.19 43.32 2kc0 s LEU 63 CO -0.04 -1.19 0.72 0.20 -1.32 0.00 0.00 176.35 174.73 2kc0 s ASN 64 N 2.53 7.20 -0.32 3.68 0.01 -1.25 -1.04 114.94 125.74 2kc0 s ASN 64 Ca 0.38 1.42 0.17 0.00 -0.71 0.00 0.00 52.86 54.12 2kc0 s ASN 64 Cb -0.10 -2.45 0.45 0.00 0.41 0.00 0.00 41.25 39.57 2kc0 s ASN 64 CO 0.26 0.09 1.28 0.35 -1.51 0.00 0.00 177.10 177.56 2kc0 n THR 65 N 2.48 0.60 -1.54 1.60 -2.24 0.72 -4.44 114.28 111.47 2kc0 n THR 65 Ca -0.04 -2.05 -0.49 0.00 -2.27 0.00 0.00 64.05 59.19 2kc0 n THR 65 Cb 0.50 1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 69.74 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 -0.88 0.81 3.83 3.38 0.00 -0.73 -3.12 105.19 108.49 2kc0 n GLY 66 Ca -0.03 0.89 -0.25 0.00 0.00 0.00 0.00 46.02 46.63 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 7.83 -0.79 0.00 1.61 4.81 -1.26 -4.91 118.16 125.46 2kc0 n LYS 67 Ca 0.35 -0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.78 2kc0 n LYS 67 Cb 0.28 -2.09 0.00 0.00 0.02 0.00 0.00 35.03 33.24 2kc0 n LYS 67 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2kc0 n LEU 68 N -3.59 2.24 -3.84 3.14 -0.00 -1.18 -5.05 117.00 108.73 2kc0 n LEU 68 Ca -0.17 0.13 -0.09 0.00 -0.00 0.00 0.00 56.01 55.88 2kc0 n LEU 68 Cb 0.45 -0.08 -0.07 0.00 -0.00 0.00 0.00 43.42 43.72 2kc0 n LEU 68 CO 0.56 -0.08 -0.05 -0.54 -0.00 0.00 0.00 177.39 177.28 2kc0 s LYS 69 N -0.29 0.91 0.00 1.96 -0.14 -1.26 -5.13 119.74 115.79 2kc0 s LYS 69 Ca 0.00 -0.95 0.00 0.00 -1.36 0.00 0.00 55.97 53.66 2kc0 s LYS 69 Cb 0.00 0.36 0.00 0.00 -1.68 0.00 0.00 37.83 36.51 2kc0 s LYS 69 CO 0.00 -0.30 0.00 0.09 -0.76 0.00 0.00 175.35 174.38 2kc0 n ASN 70 N -0.10 0.00 -2.71 2.83 4.13 -1.26 -4.59 115.26 113.56 2kc0 n ASN 70 Ca -0.14 0.00 -0.06 0.00 1.68 0.00 0.00 54.58 56.05 2kc0 n ASN 70 Cb 0.63 0.00 0.06 0.00 -1.54 0.00 0.00 39.78 38.92 2kc0 n ASN 70 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2kc0 n ASP 71 N 0.00 0.70 -4.34 6.41 5.75 -1.25 -3.83 116.55 120.00 2kc0 n ASP 71 Ca 0.00 -2.48 -0.19 0.00 -0.01 0.00 0.00 54.79 52.11 2kc0 n ASP 71 Cb 0.00 -0.17 -0.10 0.00 -1.03 0.00 0.00 41.12 39.81 2kc0 n ASP 71 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2kc0 s LYS 72 N -2.49 1.30 -0.28 0.11 -2.85 -0.45 -4.85 119.74 110.23 2kc0 s LYS 72 Ca 0.25 -1.52 -0.26 0.00 -1.00 0.00 0.00 55.97 53.44 2kc0 s LYS 72 Cb 0.42 -1.17 0.00 0.00 -2.06 0.00 0.00 37.83 35.02 2kc0 s LYS 72 CO -0.01 0.21 0.90 0.14 0.10 0.00 0.00 175.35 176.69 2kc0 s VAL 73 N -2.67 4.73 0.25 1.79 -7.23 -1.26 -0.34 120.40 115.67 2kc0 s VAL 73 Ca 0.20 1.57 -0.30 0.00 -1.81 0.00 0.00 61.98 61.64 2kc0 s VAL 73 Cb -0.02 -4.22 -0.09 0.00 0.56 0.00 0.00 36.38 32.61 2kc0 s VAL 73 CO 0.07 -0.23 0.95 -0.44 -0.31 0.00 0.00 175.10 175.14 2kc0 s SER 74 N 1.46 7.61 -0.24 4.85 0.01 0.07 -4.90 113.70 122.55 2kc0 s SER 74 Ca 0.38 1.96 -0.11 0.00 1.31 0.00 0.00 55.95 59.48 2kc0 s SER 74 Cb -0.14 -2.61 -0.05 0.00 0.21 0.00 0.00 66.02 63.43 2kc0 s SER 74 CO 0.10 0.13 0.20 0.00 0.41 0.00 0.00 173.24 174.08 2kc0 s ARG 75 N -1.26 4.06 0.01 12.44 1.70 -1.26 -1.85 118.95 132.80 2kc0 s ARG 75 Ca 0.42 -0.22 0.02 0.00 -0.47 0.00 0.00 55.73 55.48 2kc0 s ARG 75 Cb -0.26 -3.56 -0.01 0.00 -0.57 0.00 0.00 34.95 30.55 2kc0 s ARG 75 CO 0.32 -0.00 -0.06 -0.06 -1.08 0.00 0.00 175.30 174.41 2kc0 s PHE 76 N 1.24 0.54 0.08 5.89 0.08 -0.97 -4.89 117.98 119.95 2kc0 s PHE 76 Ca 0.09 -0.25 0.02 0.00 0.12 0.00 0.00 56.93 56.91 2kc0 s PHE 76 Cb -0.14 -0.33 -0.04 0.00 -0.57 0.00 0.00 43.02 41.94 2kc0 s PHE 76 CO 0.06 -0.04 0.14 -0.51 -0.10 0.00 0.00 175.22 174.77 2kc0 s ASP 77 N -0.68 5.87 0.06 1.36 1.01 -0.79 -1.48 116.67 122.02 2kc0 s ASP 77 Ca -0.03 0.10 -0.11 0.00 0.71 0.00 0.00 52.55 53.22 2kc0 s ASP 77 Cb -0.05 -1.67 0.01 0.00 1.01 0.00 0.00 42.92 42.22 2kc0 s ASP 77 CO 0.00 0.16 0.25 0.72 0.21 0.00 0.00 175.17 176.52 2kc0 s PHE 78 N -1.46 0.00 0.06 4.23 -0.71 -1.03 -0.93 117.98 118.15 2kc0 s PHE 78 Ca 0.32 -0.27 0.08 0.00 -1.04 0.00 0.00 56.93 56.02 2kc0 s PHE 78 Cb -0.12 0.04 -0.03 0.00 -1.21 0.00 0.00 43.02 41.69 2kc0 s PHE 78 CO 0.25 -0.52 -0.23 0.96 -1.34 0.00 0.00 175.22 174.34 2kc0 s ILE 79 N -3.08 1.87 0.62 -4.49 -4.36 -0.35 -1.34 121.20 110.07 2kc0 s ILE 79 Ca -0.01 -1.37 -0.07 0.00 -0.26 0.00 0.00 60.65 58.94 2kc0 s ILE 79 Cb 0.01 -1.63 0.01 0.00 1.25 0.00 0.00 42.46 42.10 2kc0 s ILE 79 CO -0.07 0.20 0.95 -0.60 0.24 0.00 0.00 174.94 175.67 2kc0 s ARG 80 N -1.40 2.87 -0.28 0.37 3.52 -0.02 -0.78 118.95 123.23 2kc0 s ARG 80 Ca 0.09 0.10 -0.04 0.00 -0.13 0.00 0.00 55.73 55.75 2kc0 s ARG 80 Cb -0.09 -2.20 0.16 0.00 -1.56 0.00 0.00 34.95 31.25 2kc0 s ARG 80 CO 0.03 -0.81 0.57 -1.14 -0.81 0.00 0.00 175.30 173.13 2kc0 s GLN 81 N -5.09 0.52 0.04 5.12 0.74 -0.40 -4.31 119.66 116.27 2kc0 s GLN 81 Ca 0.55 1.04 -0.20 0.00 0.05 0.00 0.00 55.36 56.80 2kc0 s GLN 81 Cb -0.11 0.46 0.04 0.00 1.10 0.00 0.00 33.01 34.51 2kc0 s GLN 81 CO 0.47 -0.50 0.47 -1.50 -0.55 0.00 0.00 175.29 173.67 2kc0 s ILE 82 N 2.81 0.04 -0.20 -2.34 2.07 -0.65 -2.74 121.20 120.19 2kc0 s ILE 82 Ca 0.12 -0.34 -0.24 0.00 -1.41 0.00 0.00 60.65 58.78 2kc0 s ILE 82 Cb -0.14 -0.94 -0.01 0.00 0.13 0.00 0.00 42.46 41.49 2kc0 s ILE 82 CO -0.19 -0.19 0.80 -1.61 -1.91 0.00 0.00 174.94 171.84 2kc0 s GLU 83 N -2.31 4.24 -0.70 3.50 8.01 -1.26 -1.85 118.70 128.32 2kc0 s GLU 83 Ca -0.06 0.92 -0.22 0.00 0.01 0.00 0.00 54.97 55.62 2kc0 s GLU 83 Cb -0.01 -3.60 0.08 0.00 -4.31 0.00 0.00 34.13 26.29 2kc0 s GLU 83 CO -0.01 -0.39 0.98 0.08 0.01 0.00 0.00 175.26 175.94 2kc0 s VAL 84 N 2.38 4.39 -1.35 2.63 1.01 0.74 -4.36 120.40 125.84 2kc0 s VAL 84 Ca 0.35 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.73 2kc0 s VAL 84 Cb -0.16 -4.70 0.03 0.00 0.00 0.00 0.00 36.38 31.55 2kc0 s VAL 84 CO 0.10 -1.46 0.35 -0.67 0.00 0.00 0.00 175.10 173.42 2kc0 n ASP 85 N 7.52 -4.68 0.00 3.32 2.03 -1.26 -1.01 116.55 122.47 2kc0 n ASP 85 Ca 0.00 -0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.14 2kc0 n ASP 85 Cb 0.46 -3.87 0.00 0.00 -0.72 0.00 0.00 41.12 36.99 2kc0 n ASP 85 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kc0 n GLY 86 N -1.17 0.75 3.68 0.27 0.00 -1.26 -5.07 105.19 102.39 2kc0 n GLY 86 Ca -0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.67 4.16 -0.05 1.61 -0.21 -0.18 -5.00 119.66 119.31 2kc0 s GLN 87 Ca 0.00 0.04 -0.28 0.00 0.02 0.00 0.00 55.36 55.14 2kc0 s GLN 87 Cb 0.00 -3.52 -0.03 0.00 1.00 0.00 0.00 33.01 30.47 2kc0 s GLN 87 CO 0.00 0.04 0.91 -0.51 -2.12 0.00 0.00 175.29 173.61 2kc0 s LEU 88 N 1.08 4.31 -0.03 2.90 1.02 -1.26 -0.19 118.68 126.51 2kc0 s LEU 88 Ca 0.15 1.48 0.04 0.00 0.02 0.00 0.00 54.13 55.82 2kc0 s LEU 88 Cb -0.14 -3.42 -0.00 0.00 0.02 0.00 0.00 46.19 42.65 2kc0 s LEU 88 CO 0.06 -0.28 -0.15 -0.63 0.02 0.00 0.00 176.35 175.37 2kc0 s ILE 89 N 1.28 1.27 -0.31 -0.59 1.01 -0.77 -4.96 121.20 118.12 2kc0 s ILE 89 Ca 0.47 -0.64 0.18 0.00 0.00 0.00 0.00 60.65 60.66 2kc0 s ILE 89 Cb -0.19 -1.08 0.47 0.00 0.01 0.00 0.00 42.46 41.66 2kc0 s ILE 89 CO 0.22 0.37 1.08 0.41 0.00 0.00 0.00 174.94 177.02 2kc0 n THR 90 N 3.04 0.91 -1.70 2.92 -1.04 -1.26 -1.64 114.28 115.52 2kc0 n THR 90 Ca -0.17 -2.71 0.00 0.00 -2.04 0.00 0.00 64.05 59.13 2kc0 n THR 90 Cb 0.54 0.93 0.01 0.00 -1.82 0.00 0.00 70.33 69.98 2kc0 n THR 90 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2kc0 n LEU 91 N -0.39 0.14 -4.35 -4.42 -0.00 -1.26 -4.91 117.00 101.81 2kc0 n LEU 91 Ca 0.05 -0.88 -0.34 0.00 -0.00 0.00 0.00 56.01 54.85 2kc0 n LEU 91 Cb 0.82 -0.02 -0.14 0.00 -0.00 0.00 0.00 43.42 44.08 2kc0 n LEU 91 CO 0.14 0.22 -0.41 -1.61 -0.00 0.00 0.00 177.39 175.73 2kc0 s GLU 92 N -0.14 3.40 0.09 1.96 8.01 -1.26 -3.30 118.70 127.46 2kc0 s GLU 92 Ca 0.01 -0.65 0.01 0.00 0.01 0.00 0.00 54.97 54.36 2kc0 s GLU 92 Cb 0.01 -2.83 -0.04 0.00 -4.31 0.00 0.00 34.13 26.96 2kc0 s GLU 92 CO 0.00 0.01 -0.06 -1.12 0.01 0.00 0.00 175.26 174.10 2kc0 s SER 93 N 0.90 1.07 0.00 -0.19 0.01 -1.26 -0.84 113.70 113.39 2kc0 s SER 93 Ca -0.02 -1.00 0.00 0.00 1.31 0.00 0.00 55.95 56.24 2kc0 s SER 93 Cb -0.15 0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.19 2kc0 s SER 93 CO 0.00 -0.48 0.00 0.61 0.41 0.00 0.00 173.24 173.79 2kc0 n GLY 94 N -0.02 2.70 3.34 3.44 0.00 -0.45 -4.33 105.19 109.87 2kc0 n GLY 94 Ca -0.12 -0.40 -0.18 0.00 0.00 0.00 0.00 46.02 45.32 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 2.04 1.40 -0.23 1.61 2.02 -0.16 -2.45 118.70 122.94 2kc0 s GLU 95 Ca 0.00 -1.73 -0.03 0.00 0.02 0.00 0.00 54.97 53.22 2kc0 s GLU 95 Cb 0.00 -0.56 0.12 0.00 0.10 0.00 0.00 34.13 33.78 2kc0 s GLU 95 CO 0.00 -0.16 0.34 0.12 0.02 0.00 0.00 175.26 175.58 2kc0 s PHE 96 N -3.49 -0.68 -0.42 1.61 5.36 -0.55 -2.21 117.98 117.60 2kc0 s PHE 96 Ca 0.32 0.75 -0.15 0.00 -0.96 0.00 0.00 56.93 56.89 2kc0 s PHE 96 Cb 0.07 -0.05 0.02 0.00 -0.34 0.00 0.00 43.02 42.72 2kc0 s PHE 96 CO 0.11 -0.66 0.33 -1.14 -1.46 0.00 0.00 175.22 172.40 2kc0 s GLN 97 N 2.50 2.99 -0.47 10.12 0.74 -0.85 -2.28 119.66 132.40 2kc0 s GLN 97 Ca 0.10 -1.00 -0.05 0.00 0.05 0.00 0.00 55.36 54.46 2kc0 s GLN 97 Cb -0.15 -3.99 0.12 0.00 1.10 0.00 0.00 33.01 30.09 2kc0 s GLN 97 CO -0.14 -0.78 0.30 0.08 -0.55 0.00 0.00 175.29 174.20 2kc0 s VAL 98 N 1.75 3.75 -0.24 1.34 1.01 -0.77 -2.07 120.40 125.17 2kc0 s VAL 98 Ca 0.06 -2.09 -0.29 0.00 0.00 0.00 0.00 61.98 59.66 2kc0 s VAL 98 Cb -0.19 -3.50 -0.00 0.00 0.00 0.00 0.00 36.38 32.68 2kc0 s VAL 98 CO 0.10 -0.76 1.25 -0.47 0.00 0.00 0.00 175.10 175.23 2kc0 s TYR 99 N 1.03 2.83 0.12 5.22 6.14 0.26 -0.75 117.35 132.20 2kc0 s TYR 99 Ca 0.09 0.99 -0.19 0.00 0.64 0.00 0.00 57.07 58.60 2kc0 s TYR 99 Cb -0.23 -3.68 -0.07 0.00 0.42 0.00 0.00 41.96 38.39 2kc0 s TYR 99 CO -0.03 -1.55 0.62 0.15 0.64 0.00 0.00 175.55 175.38 2kc0 s LYS 100 N 3.79 4.21 0.21 4.97 -0.14 0.54 -2.44 119.74 130.90 2kc0 s LYS 100 Ca 0.54 0.76 -0.15 0.00 -1.36 0.00 0.00 55.97 55.76 2kc0 s LYS 100 Cb -0.18 -3.13 0.01 0.00 -1.68 0.00 0.00 37.83 32.85 2kc0 s LYS 100 CO 0.18 0.56 0.50 -1.14 -0.76 0.00 0.00 175.35 174.69 2kc0 s GLN 101 N -1.41 1.44 0.20 1.68 0.74 -0.57 -1.35 119.66 120.40 2kc0 s GLN 101 Ca 0.34 -1.02 -0.32 0.00 0.05 0.00 0.00 55.36 54.40 2kc0 s GLN 101 Cb -0.19 0.50 -0.13 0.00 1.10 0.00 0.00 33.01 34.29 2kc0 s GLN 101 CO 0.20 -0.60 1.60 0.43 -0.55 0.00 0.00 175.29 176.36 2kc0 n SER 102 N -0.35 3.40 -0.90 6.67 7.64 -1.25 -3.41 113.62 125.41 2kc0 n SER 102 Ca -0.07 1.09 -0.01 0.00 1.01 0.00 0.00 58.87 60.89 2kc0 n SER 102 Cb 0.62 -1.49 -0.01 0.00 -1.01 0.00 0.00 64.21 62.32 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 3.18 -0.80 -3.51 1.43 8.25 -1.26 -4.82 115.22 117.70 2kc0 n HIS 103 Ca 0.15 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.44 2kc0 n HIS 103 Cb 0.32 -1.10 -0.05 0.00 1.12 0.00 0.00 29.99 30.27 2kc0 n HIS 103 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2kc0 s SER 104 N -1.00 -0.63 -0.06 0.41 0.15 -1.22 -0.94 113.70 110.42 2kc0 s SER 104 Ca 0.00 0.57 -0.29 0.00 0.70 0.00 0.00 55.95 56.93 2kc0 s SER 104 Cb 0.00 0.54 0.10 0.00 -1.71 0.00 0.00 66.02 64.95 2kc0 s SER 104 CO 0.00 -0.66 0.84 0.00 1.20 0.00 0.00 173.24 174.63 2kc0 s ALA 105 N -1.65 -1.83 0.01 5.45 0.00 -0.30 -1.51 121.76 121.94 2kc0 s ALA 105 Ca -0.08 1.27 -0.13 0.00 0.00 0.00 0.00 51.96 53.02 2kc0 s ALA 105 Cb -0.00 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.05 2kc0 s ALA 105 CO 0.05 -0.46 0.27 -0.48 0.00 0.00 0.00 175.76 175.14 2kc0 s LEU 106 N -1.62 1.04 0.40 0.00 0.05 -1.02 -0.96 118.68 116.56 2kc0 s LEU 106 Ca -0.02 -0.10 0.08 0.00 0.05 0.00 0.00 54.13 54.13 2kc0 s LEU 106 Cb -0.01 1.15 -0.02 0.00 -2.05 0.00 0.00 46.19 45.27 2kc0 s LEU 106 CO -0.00 -0.50 0.39 0.28 -0.55 0.00 0.00 176.35 175.97 2kc0 s THR 107 N -1.86 2.96 0.13 5.48 -1.32 -1.24 -0.57 115.64 119.21 2kc0 s THR 107 Ca -0.10 -1.29 -0.20 0.00 -1.21 0.00 0.00 61.69 58.89 2kc0 s THR 107 Cb -0.04 -3.06 0.05 0.00 -1.51 0.00 0.00 72.50 67.95 2kc0 s THR 107 CO 0.01 -0.05 0.49 0.00 -2.21 0.00 0.00 174.62 172.86 2kc0 s ALA 108 N -2.41 -1.24 0.03 11.08 0.00 -0.88 -0.71 121.76 127.64 2kc0 s ALA 108 Ca 0.47 0.25 0.01 0.00 0.00 0.00 0.00 51.96 52.69 2kc0 s ALA 108 Cb -0.05 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.75 2kc0 s ALA 108 CO 0.28 -0.67 0.09 -0.06 0.00 0.00 0.00 175.76 175.41 2kc0 s PHE 109 N -3.58 3.27 -0.03 0.00 0.40 -0.63 -2.01 117.98 115.40 2kc0 s PHE 109 Ca 0.01 0.16 0.02 0.00 -0.60 0.00 0.00 56.93 56.52 2kc0 s PHE 109 Cb 0.00 -1.69 0.01 0.00 0.51 0.00 0.00 43.02 41.85 2kc0 s PHE 109 CO -0.11 0.54 -0.07 -1.14 0.70 0.00 0.00 175.22 175.15 2kc0 s GLN 110 N -2.06 0.85 -0.23 0.44 0.74 -0.94 -3.79 119.66 114.67 2kc0 s GLN 110 Ca 0.26 -0.20 -0.15 0.00 0.05 0.00 0.00 55.36 55.32 2kc0 s GLN 110 Cb -0.12 -0.81 0.07 0.00 1.10 0.00 0.00 33.01 33.24 2kc0 s GLN 110 CO 0.18 0.03 0.58 -0.08 -0.55 0.00 0.00 175.29 175.44 2kc0 s THR 111 N 0.47 -0.01 0.00 -0.34 -1.32 -1.26 -0.98 115.64 112.20 2kc0 s THR 111 Ca -0.07 0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.44 2kc0 s THR 111 Cb -0.10 -0.83 0.00 0.00 -1.51 0.00 0.00 72.50 70.05 2kc0 s THR 111 CO 0.00 0.01 0.00 -1.84 -2.21 0.00 0.00 174.62 170.59 2kc0 n GLU 112 N 3.93 0.00 -2.92 7.08 0.00 -1.26 -1.57 120.64 125.90 2kc0 n GLU 112 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 56.55 2kc0 n GLU 112 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 31.44 31.96 2kc0 n GLU 112 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.13 178.27 2kc0 s GLN 113 N 0.00 4.07 0.09 3.44 1.03 -1.26 -1.34 119.66 125.69 2kc0 s GLN 113 Ca 0.00 0.76 -0.03 0.00 0.04 0.00 0.00 55.36 56.12 2kc0 s GLN 113 Cb 0.00 -3.69 -0.03 0.00 0.03 0.00 0.00 33.01 29.32 2kc0 s GLN 113 CO 0.00 -0.61 0.07 0.96 -2.54 0.00 0.00 175.29 173.18 2kc0 s ILE 114 N 2.92 0.15 0.72 3.63 -4.36 -0.56 -4.54 121.20 119.16 2kc0 s ILE 114 Ca 0.34 -1.67 -0.11 0.00 -0.26 0.00 0.00 60.65 58.95 2kc0 s ILE 114 Cb -0.15 -1.68 0.04 0.00 1.25 0.00 0.00 42.46 41.92 2kc0 s ILE 114 CO 0.10 -0.69 1.10 -1.58 0.24 0.00 0.00 174.94 174.11 2kc0 s GLN 115 N -3.95 2.56 -0.03 0.37 -0.44 -1.21 -1.50 119.66 115.45 2kc0 s GLN 115 Ca 0.13 0.26 0.00 0.00 -2.50 0.00 0.00 55.36 53.26 2kc0 s GLN 115 Cb 0.07 -2.04 0.03 0.00 -1.64 0.00 0.00 33.01 29.43 2kc0 s GLN 115 CO -0.06 -1.18 -0.01 -0.51 0.50 0.00 0.00 175.29 174.04 2kc0 s ASP 116 N -4.43 0.61 -0.25 6.67 1.01 -0.60 -4.78 116.67 114.90 2kc0 s ASP 116 Ca 0.59 -0.05 0.00 0.00 0.71 0.00 0.00 52.55 53.80 2kc0 s ASP 116 Cb -0.11 -0.28 0.22 0.00 1.01 0.00 0.00 42.92 43.77 2kc0 s ASP 116 CO 0.50 -0.10 1.79 -1.54 0.21 0.00 0.00 175.17 176.03 2kc0 n SER 117 N 4.20 5.24 -0.09 0.27 3.41 -1.26 -2.02 113.62 123.36 2kc0 n SER 117 Ca -0.25 -2.88 -0.13 0.00 -0.26 0.00 0.00 58.87 55.36 2kc0 n SER 117 Cb 0.50 -0.91 -0.08 0.00 -0.26 0.00 0.00 64.21 63.46 2kc0 n SER 117 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2kc0 n GLU 118 N 0.23 0.46 -1.75 4.33 1.02 -1.26 -4.51 120.64 119.16 2kc0 n GLU 118 Ca 0.26 0.11 -0.18 0.00 -0.02 0.00 0.00 57.16 57.32 2kc0 n GLU 118 Cb 0.73 -1.36 0.06 0.00 -0.02 0.00 0.00 31.44 30.84 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 -3.03 2.22 -0.22 -0.32 -0.00 -1.26 -4.99 115.22 107.62 2kc0 n HIS 119 Ca -0.32 -2.08 0.00 0.00 0.46 0.00 0.00 57.72 55.77 2kc0 n HIS 119 Cb 0.84 -0.32 0.00 0.00 -0.12 0.00 0.00 29.99 30.39 2kc0 n HIS 119 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2kc0 n SER 120 N -0.79 0.00 -2.66 0.26 3.41 -1.26 -4.26 113.62 108.33 2kc0 n SER 120 Ca 0.39 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.97 2kc0 n SER 120 Cb 0.92 -1.83 0.05 0.00 -0.26 0.00 0.00 64.21 63.08 2kc0 n SER 120 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kc0 n GLY 121 N -1.82 -1.19 3.51 5.00 0.00 -1.24 -4.93 105.19 104.52 2kc0 n GLY 121 Ca 0.00 0.43 -0.29 0.00 0.00 0.00 0.00 46.02 46.16 2kc0 n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kc0 s LYS 122 N 0.03 -1.09 -0.10 1.61 1.02 -0.86 -4.84 119.74 115.51 2kc0 s LYS 122 Ca 0.11 0.49 -0.07 0.00 0.02 0.00 0.00 55.97 56.52 2kc0 s LYS 122 Cb 0.17 -1.56 0.04 0.00 -0.52 0.00 0.00 37.83 35.95 2kc0 s LYS 122 CO -0.11 -3.74 0.24 1.41 -0.92 0.00 0.00 175.35 172.23 2kc0 s MET 123 N -4.81 0.24 0.04 1.68 -2.45 -1.26 -1.55 119.30 111.18 2kc0 s MET 123 Ca 0.68 0.44 -0.12 0.00 -1.25 0.00 0.00 55.69 55.44 2kc0 s MET 123 Cb -0.19 -0.01 0.01 0.00 1.25 0.00 0.00 34.83 35.89 2kc0 s MET 123 CO 0.61 -0.11 0.27 0.14 1.05 0.00 0.00 175.02 176.98 2kc0 s VAL 124 N 0.77 0.09 -0.60 10.11 -7.23 -0.56 -4.96 120.40 118.02 2kc0 s VAL 124 Ca -0.05 -0.75 -0.02 0.00 -1.81 0.00 0.00 61.98 59.35 2kc0 s VAL 124 Cb -0.07 -0.93 0.15 0.00 0.56 0.00 0.00 36.38 36.10 2kc0 s VAL 124 CO -0.05 -0.41 0.40 0.00 -0.31 0.00 0.00 175.10 174.73 2kc0 s ALA 125 N -2.55 3.52 1.02 1.32 0.00 -1.26 -1.50 121.76 122.31 2kc0 s ALA 125 Ca -0.05 -3.24 -0.03 0.00 0.00 0.00 0.00 51.96 48.63 2kc0 s ALA 125 Cb -0.01 -2.56 0.05 0.00 0.00 0.00 0.00 23.12 20.60 2kc0 s ALA 125 CO -0.03 -2.08 0.23 1.63 0.00 0.00 0.00 175.76 175.50 2kc0 n LYS 126 N 3.44 -0.74 -2.82 0.00 4.01 -0.45 -4.91 118.16 116.69 2kc0 n LYS 126 Ca 0.07 -0.35 -0.11 0.00 -0.51 0.00 0.00 58.31 57.41 2kc0 n LYS 126 Cb 0.37 -0.27 0.05 0.00 -0.51 0.00 0.00 35.03 34.66 2kc0 n LYS 126 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 2kc0 n ARG 127 N -1.77 1.09 -2.46 1.97 1.85 -1.24 -4.29 116.66 111.79 2kc0 n ARG 127 Ca 0.03 -2.68 -0.39 0.00 -1.00 0.00 0.00 57.85 53.81 2kc0 n ARG 127 Cb 0.11 -1.03 -0.02 0.00 -1.05 0.00 0.00 32.46 30.46 2kc0 n ARG 127 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 2kc0 s GLN 128 N -1.46 3.52 -0.25 2.89 -0.44 -0.61 -4.89 119.66 118.41 2kc0 s GLN 128 Ca 0.28 -1.37 -0.14 0.00 -2.50 0.00 0.00 55.36 51.63 2kc0 s GLN 128 Cb 0.38 -5.38 -0.04 0.00 -1.64 0.00 0.00 33.01 26.33 2kc0 s GLN 128 CO -0.04 -2.54 0.35 0.12 0.50 0.00 0.00 175.29 173.68 2kc0 s PHE 129 N 5.86 3.27 0.08 1.67 2.19 -1.26 -4.12 117.98 125.67 2kc0 s PHE 129 Ca 0.54 0.41 0.02 0.00 0.33 0.00 0.00 56.93 58.23 2kc0 s PHE 129 Cb 0.01 -2.52 -0.04 0.00 -1.31 0.00 0.00 43.02 39.16 2kc0 s PHE 129 CO 0.00 -0.16 -0.07 1.03 1.83 0.00 0.00 175.22 177.86 2kc0 s ARG 130 N 1.82 0.71 0.54 10.12 1.81 -1.25 -4.79 118.95 127.91 2kc0 s ARG 130 Ca 0.15 -1.14 -0.11 0.00 -1.72 0.00 0.00 55.73 52.91 2kc0 s ARG 130 Cb -0.15 -0.19 -0.05 0.00 -0.45 0.00 0.00 34.95 34.11 2kc0 s ARG 130 CO 0.09 -0.01 0.94 -1.50 -0.68 0.00 0.00 175.30 174.14 2kc0 s ILE 131 N -2.94 4.71 0.55 1.52 1.10 -1.26 -1.61 121.20 123.27 2kc0 s ILE 131 Ca 0.04 0.80 0.08 0.00 -0.51 0.00 0.00 60.65 61.06 2kc0 s ILE 131 Cb 0.01 -3.81 0.08 0.00 0.15 0.00 0.00 42.46 38.88 2kc0 s ILE 131 CO -0.04 -0.89 0.66 0.61 -2.11 0.00 0.00 174.94 173.17 2kc0 n GLY 132 N -2.16 2.20 3.77 1.50 0.00 0.11 -4.83 105.19 105.78 2kc0 n GLY 132 Ca 0.05 -2.24 -0.35 0.00 0.00 0.00 0.00 46.02 43.47 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 -4.34 5.39 -0.11 1.61 1.11 -1.26 -4.73 116.67 114.34 2kc0 s ASP 133 Ca 0.50 2.20 -0.16 0.00 0.18 0.00 0.00 52.55 55.27 2kc0 s ASP 133 Cb -0.04 -2.58 -0.05 0.00 1.07 0.00 0.00 42.92 41.32 2kc0 s ASP 133 CO 0.32 -1.45 0.42 -0.63 1.18 0.00 0.00 175.17 175.01 2kc0 s ILE 134 N -1.85 5.19 -0.02 0.77 1.09 -1.26 -3.68 121.20 121.44 2kc0 s ILE 134 Ca 0.73 0.83 0.05 0.00 -1.10 0.00 0.00 60.65 61.16 2kc0 s ILE 134 Cb -0.25 -3.75 -0.03 0.00 -1.06 0.00 0.00 42.46 37.37 2kc0 s ILE 134 CO 0.32 0.39 -0.15 0.00 -0.10 0.00 0.00 174.94 175.40 2kc0 s ALA 135 N 0.27 2.68 -0.25 9.38 0.00 -0.14 -5.02 121.76 128.67 2kc0 s ALA 135 Ca 0.23 -1.05 -0.37 0.00 0.00 0.00 0.00 51.96 50.78 2kc0 s ALA 135 Cb -0.15 -0.91 0.15 0.00 0.00 0.00 0.00 23.12 22.21 2kc0 s ALA 135 CO 0.09 0.57 1.32 0.20 0.00 0.00 0.00 175.76 177.94 2kc0 s GLY 136 N -1.02 -0.21 -0.82 0.00 0.00 -1.26 -1.15 107.32 102.87 2kc0 s GLY 136 Ca 0.13 1.89 -0.25 0.00 0.00 0.00 0.00 44.72 46.49 2kc0 s GLY 136 CO 0.03 0.65 1.53 -0.54 0.00 0.00 0.00 173.10 174.77 2kc0 s GLU 137 N -2.07 3.11 0.04 2.90 2.02 -0.12 -4.95 118.70 119.64 2kc0 s GLU 137 Ca 0.11 -0.36 -0.34 0.00 0.02 0.00 0.00 54.97 54.40 2kc0 s GLU 137 Cb -0.01 -4.70 -0.13 0.00 0.10 0.00 0.00 34.13 29.39 2kc0 s GLU 137 CO -0.04 -2.45 1.71 0.72 0.02 0.00 0.00 175.26 175.22 2kc0 n HIS 138 N 10.52 2.26 -2.53 1.61 8.25 -1.26 -1.75 115.22 132.32 2kc0 n HIS 138 Ca 0.21 0.17 -0.43 0.00 -0.26 0.00 0.00 57.72 57.40 2kc0 n HIS 138 Cb 0.50 -2.59 -0.02 0.00 1.12 0.00 0.00 29.99 29.00 2kc0 n HIS 138 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2kc0 s THR 139 N 2.36 4.29 -0.36 1.59 -1.32 -0.89 -4.81 115.64 116.50 2kc0 s THR 139 Ca 0.86 1.45 -0.33 0.00 -1.21 0.00 0.00 61.69 62.46 2kc0 s THR 139 Cb -0.71 -4.31 -0.10 0.00 -1.51 0.00 0.00 72.50 65.87 2kc0 s THR 139 CO 0.45 -0.54 2.25 -1.20 -2.21 0.00 0.00 174.62 173.36 2kc0 n SER 140 N 7.37 2.31 -0.77 8.08 7.64 -1.15 -2.89 113.62 134.22 2kc0 n SER 140 Ca 0.13 0.26 0.12 0.00 1.01 0.00 0.00 58.87 60.40 2kc0 n SER 140 Cb 0.47 -1.34 0.31 0.00 -1.01 0.00 0.00 64.21 62.64 2kc0 n SER 140 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 2kc0 n PHE 141 N 10.90 0.14 1.66 1.43 -0.00 -0.81 -3.19 117.46 127.59 2kc0 n PHE 141 Ca 0.40 -0.07 0.14 0.00 -0.00 0.00 0.00 57.45 57.91 2kc0 n PHE 141 Cb 0.30 0.00 0.80 0.00 -0.00 0.00 0.00 39.48 40.58 2kc0 n PHE 141 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 2kc0 n ASP 142 N 0.80 0.00 0.00 -2.13 2.03 -1.16 -4.32 116.55 111.76 2kc0 n ASP 142 Ca 0.17 -0.73 0.00 0.00 0.52 0.00 0.00 54.79 54.75 2kc0 n ASP 142 Cb 0.47 -0.05 0.00 0.00 -0.72 0.00 0.00 41.12 40.81 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 -1.05 0.00 -1.02 -0.67 4.76 -1.19 -5.16 118.16 113.83 2kc0 n LYS 143 Ca 0.19 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.67 2kc0 n LYS 143 Cb 0.12 -0.03 -0.02 0.00 -1.84 0.00 0.00 35.03 33.26 2kc0 n LYS 143 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 2kc0 n LEU 144 N -1.37 -0.49 -4.84 -0.35 7.94 -1.25 -5.00 117.00 111.64 2kc0 n LEU 144 Ca 0.00 0.97 -0.29 0.00 -1.11 0.00 0.00 56.01 55.58 2kc0 n LEU 144 Cb 0.00 -2.11 0.14 0.00 0.53 0.00 0.00 43.42 41.98 2kc0 n LEU 144 CO 0.00 -0.58 0.77 -2.16 -1.11 0.00 0.00 177.39 174.31 2kc0 s PRO 145 N -4.67 1.15 0.00 1.96 0.04 -1.26 -5.04 135.00 127.19 2kc0 s PRO 145 Ca 0.00 0.05 0.00 0.00 0.04 0.00 0.00 61.00 61.09 2kc0 s PRO 145 Cb 0.00 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.68 2kc0 s PRO 145 CO 0.00 -2.14 0.25 -1.91 0.04 0.00 0.00 177.00 173.24 2kc0 n GLU 146 N -3.68 2.30 -3.21 4.56 2.13 -1.26 -4.99 120.64 116.49 2kc0 n GLU 146 Ca 0.09 -0.25 0.02 0.00 0.66 0.00 0.00 57.16 57.67 2kc0 n GLU 146 Cb 0.60 -0.73 0.01 0.00 0.27 0.00 0.00 31.44 31.58 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 0.40 0.40 3.86 8.31 0.00 -1.26 -3.87 105.19 113.03 2kc0 n GLY 147 Ca 0.00 -0.98 0.01 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.58 -2.08 3.19 -0.02 0.00 -1.26 -4.59 105.19 99.84 2kc0 n GLY 148 Ca 0.03 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.53 0.39 -0.32 1.61 1.70 -1.26 -1.43 118.95 119.11 2kc0 s ARG 149 Ca 0.00 0.29 -0.03 0.00 -0.47 0.00 0.00 55.73 55.53 2kc0 s ARG 149 Cb 0.00 0.19 0.06 0.00 -0.57 0.00 0.00 34.95 34.62 2kc0 s ARG 149 CO 0.00 -0.06 0.05 0.00 -1.08 0.00 0.00 175.30 174.21 2kc0 s ALA 150 N -0.11 2.92 -1.50 7.88 0.00 -1.14 -4.97 121.76 124.83 2kc0 s ALA 150 Ca -0.02 -1.87 -0.12 0.00 0.00 0.00 0.00 51.96 49.94 2kc0 s ALA 150 Cb -0.03 -2.08 0.00 0.00 0.00 0.00 0.00 23.12 21.02 2kc0 s ALA 150 CO 0.01 -1.36 2.48 2.41 0.00 0.00 0.00 175.76 179.30 2kc0 n THR 151 N 4.66 3.90 -1.66 0.00 -1.04 -1.26 -3.35 114.28 115.53 2kc0 n THR 151 Ca -0.11 -3.00 -0.37 0.00 -2.04 0.00 0.00 64.05 58.53 2kc0 n THR 151 Cb 0.43 -2.58 0.07 0.00 -1.82 0.00 0.00 70.33 66.44 2kc0 n THR 151 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2kc0 n TYR 152 N 4.87 1.51 -4.49 -1.42 4.01 -0.22 -4.82 117.16 116.60 2kc0 n TYR 152 Ca 0.61 0.42 -0.21 0.00 -0.16 0.00 0.00 57.90 58.56 2kc0 n TYR 152 Cb 0.32 -2.21 -0.14 0.00 -0.31 0.00 0.00 39.34 37.00 2kc0 n TYR 152 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2kc0 s ARG 153 N -3.22 1.05 0.19 -0.72 6.06 -0.58 -1.11 118.95 120.62 2kc0 s ARG 153 Ca 0.80 -0.66 -0.23 0.00 -2.50 0.00 0.00 55.73 53.15 2kc0 s ARG 153 Cb -0.39 -1.04 0.07 0.00 0.06 0.00 0.00 34.95 33.65 2kc0 s ARG 153 CO 0.43 0.27 0.98 0.20 -2.50 0.00 0.00 175.30 174.67 2kc0 s GLY 154 N -0.79 -0.03 -0.14 8.12 0.00 -1.12 -1.42 107.32 111.94 2kc0 s GLY 154 Ca 0.04 -0.16 -0.08 0.00 0.00 0.00 0.00 44.72 44.52 2kc0 s GLY 154 CO 0.01 0.96 0.14 -1.59 0.00 0.00 0.00 173.10 172.61 2kc0 s THR 155 N -2.74 5.49 -0.07 0.90 2.01 -0.68 -2.37 115.64 118.18 2kc0 s THR 155 Ca 0.16 0.21 0.01 0.00 0.31 0.00 0.00 61.69 62.38 2kc0 s THR 155 Cb -0.02 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.04 2kc0 s THR 155 CO 0.04 0.58 -0.06 0.00 -0.69 0.00 0.00 174.62 174.49 2kc0 s ALA 156 N -0.70 3.01 -0.14 7.40 0.00 -1.25 -3.02 121.76 127.07 2kc0 s ALA 156 Ca 0.13 -0.89 -0.13 0.00 0.00 0.00 0.00 51.96 51.08 2kc0 s ALA 156 Cb -0.12 -1.25 0.04 0.00 0.00 0.00 0.00 23.12 21.79 2kc0 s ALA 156 CO 0.03 0.58 0.38 -0.59 0.00 0.00 0.00 175.76 176.15 2kc0 s PHE 157 N -0.82 -0.42 0.09 0.00 -0.12 -1.14 -4.58 117.98 110.99 2kc0 s PHE 157 Ca 0.13 1.01 -0.26 0.00 -0.05 0.00 0.00 56.93 57.76 2kc0 s PHE 157 Cb -0.11 0.14 0.09 0.00 -0.63 0.00 0.00 43.02 42.51 2kc0 s PHE 157 CO 0.02 -0.20 1.14 0.20 -0.05 0.00 0.00 175.22 176.33 2kc0 s GLY 158 N 0.22 -0.09 0.00 1.99 0.00 -1.21 -1.02 107.32 107.21 2kc0 s GLY 158 Ca -0.00 0.01 0.00 0.00 0.00 0.00 0.00 44.72 44.72 2kc0 s GLY 158 CO 0.00 2.62 0.04 1.44 0.00 0.00 0.00 173.10 177.20 2kc0 n SER 159 N -0.96 0.12 0.00 1.64 7.64 -0.48 -2.57 113.62 119.01 2kc0 n SER 159 Ca -0.02 -0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2kc0 n SER 159 Cb 0.60 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.78 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 0.97 0.00 0.00 6.43 2.03 -1.26 -4.90 116.55 119.81 2kc0 n ASP 160 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2kc0 n ASP 160 Cb 0.02 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 2kc0 n ASP 160 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2kc0 n ASP 161 N -0.62 0.00 0.00 1.67 2.03 -1.06 -5.02 116.55 113.54 2kc0 n ASP 161 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2kc0 n ASP 161 Cb 0.00 0.14 0.00 0.00 -0.72 0.00 0.00 41.12 40.54 2kc0 n ASP 161 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kc0 n ALA 162 N -1.42 0.00 -0.60 -1.67 0.00 -1.25 -4.54 120.51 111.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.74 1.14 0.00 0.00 0.00 -1.26 -2.89 105.19 101.44 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 -2.00 0.83 3.18 -0.02 0.00 -1.26 -5.03 105.19 100.90 2kc0 n GLY 164 Ca 0.00 -2.02 -0.09 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.33 0.86 0.15 1.61 -0.14 -1.26 -3.80 119.74 115.84 2kc0 s LYS 165 Ca 0.00 -1.21 0.07 0.00 -1.36 0.00 0.00 55.97 53.46 2kc0 s LYS 165 Cb 0.00 0.28 -0.04 0.00 -1.68 0.00 0.00 37.83 36.39 2kc0 s LYS 165 CO 0.00 -0.25 -0.15 -0.48 -0.76 0.00 0.00 175.35 173.71 2kc0 s LEU 166 N -2.95 2.46 -0.14 3.17 -0.00 -1.00 -1.14 118.68 119.07 2kc0 s LEU 166 Ca 0.13 -0.89 0.02 0.00 -0.00 0.00 0.00 54.13 53.39 2kc0 s LEU 166 Cb 0.06 -0.62 0.01 0.00 -0.00 0.00 0.00 46.19 45.64 2kc0 s LEU 166 CO -0.05 -0.14 -0.22 -0.89 -0.00 0.00 0.00 176.35 175.05 2kc0 s THR 167 N -2.44 2.08 0.17 5.48 2.01 -0.54 -2.77 115.64 119.63 2kc0 s THR 167 Ca 0.15 -0.97 0.08 0.00 0.31 0.00 0.00 61.69 61.26 2kc0 s THR 167 Cb -0.03 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.60 2kc0 s THR 167 CO 0.04 0.55 -0.18 -0.31 -0.69 0.00 0.00 174.62 174.04 2kc0 s TYR 168 N 0.86 1.79 -0.07 4.92 1.51 -0.26 -1.18 117.35 124.93 2kc0 s TYR 168 Ca -0.06 -0.48 -0.14 0.00 -1.01 0.00 0.00 57.07 55.38 2kc0 s TYR 168 Cb -0.15 -0.89 0.03 0.00 -0.11 0.00 0.00 41.96 40.84 2kc0 s TYR 168 CO -0.03 0.32 0.34 -0.08 -1.11 0.00 0.00 175.55 175.00 2kc0 s THR 169 N -2.12 0.03 -0.26 -0.71 -1.32 -0.80 -1.06 115.64 109.41 2kc0 s THR 169 Ca 0.16 -0.26 0.02 0.00 -1.21 0.00 0.00 61.69 60.40 2kc0 s THR 169 Cb -0.05 -0.58 0.07 0.00 -1.51 0.00 0.00 72.50 70.42 2kc0 s THR 169 CO 0.06 -0.14 -0.06 -0.51 -2.21 0.00 0.00 174.62 171.77 2kc0 s ILE 170 N -0.68 1.88 -1.04 5.08 2.07 -1.21 -1.29 121.20 126.01 2kc0 s ILE 170 Ca -0.08 -1.57 -0.20 0.00 -1.41 0.00 0.00 60.65 57.40 2kc0 s ILE 170 Cb -0.04 -2.12 0.10 0.00 0.13 0.00 0.00 42.46 40.52 2kc0 s ILE 170 CO 0.03 -0.16 1.36 -1.81 -1.91 0.00 0.00 174.94 172.45 2kc0 s ASP 171 N 1.21 6.66 0.30 4.50 1.11 -0.66 -2.87 116.67 126.91 2kc0 s ASP 171 Ca -0.04 -1.98 0.02 0.00 0.18 0.00 0.00 52.55 50.73 2kc0 s ASP 171 Cb -0.19 -2.49 0.59 0.00 1.07 0.00 0.00 42.92 41.90 2kc0 s ASP 171 CO -0.07 -1.21 1.86 -0.26 1.18 0.00 0.00 175.17 176.67 2kc0 h PHE 172 N 8.85 1.07 0.00 4.23 0.04 -1.51 -1.01 116.94 128.62 2kc0 h PHE 172 Ca 0.23 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 61.03 2kc0 h PHE 172 Cb 0.98 -0.34 -0.00 0.00 2.20 0.00 0.00 35.95 38.79 2kc0 h PHE 172 CO 1.24 0.45 -0.02 0.00 -0.60 0.00 0.00 178.31 179.38 2kc0 h ALA 173 N 1.54 1.15 -0.08 2.45 0.00 -1.67 -1.76 119.26 120.89 2kc0 h ALA 173 Ca 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2kc0 h ALA 173 Cb 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2kc0 h ALA 173 CO -0.23 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.04 2kc0 n ALA 174 N -2.16 2.25 -2.24 0.00 0.00 -0.57 -4.96 120.51 112.83 2kc0 n ALA 174 Ca -0.02 -0.83 -0.12 0.00 0.00 0.00 0.00 53.44 52.46 2kc0 n ALA 174 Cb 0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 19.45 19.40 2kc0 n ALA 174 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2kc0 n LYS 175 N 0.04 -2.05 -3.77 0.00 2.85 -0.49 -4.97 118.16 109.77 2kc0 n LYS 175 Ca 0.04 0.62 -0.37 0.00 -1.05 0.00 0.00 58.31 57.55 2kc0 n LYS 175 Cb 0.23 -5.15 -0.13 0.00 -0.65 0.00 0.00 35.03 29.33 2kc0 n LYS 175 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2kc0 s GLN 176 N -4.66 3.08 -0.87 -1.58 -1.52 -1.11 -2.50 119.66 110.50 2kc0 s GLN 176 Ca 0.00 -0.86 -0.12 0.00 -1.95 0.00 0.00 55.36 52.43 2kc0 s GLN 176 Cb 0.00 -3.36 0.23 0.00 -0.22 0.00 0.00 33.01 29.66 2kc0 s GLN 176 CO 0.00 -0.44 0.81 0.20 -0.25 0.00 0.00 175.29 175.61 2kc0 s GLY 177 N 1.49 2.78 0.56 3.09 0.00 -0.00 -1.66 107.32 113.58 2kc0 s GLY 177 Ca 0.02 -3.44 0.06 0.00 0.00 0.00 0.00 44.72 41.36 2kc0 s GLY 177 CO 0.02 1.26 0.77 0.21 0.00 0.00 0.00 173.10 175.37 2kc0 s ASN 178 N 1.84 5.11 0.00 1.64 3.84 -0.41 -3.56 114.94 123.40 2kc0 s ASN 178 Ca 0.21 -0.51 0.00 0.00 0.21 0.00 0.00 52.86 52.77 2kc0 s ASN 178 Cb -0.11 -0.20 0.00 0.00 -0.55 0.00 0.00 41.25 40.40 2kc0 s ASN 178 CO -0.09 -1.27 0.00 0.61 -2.79 0.00 0.00 177.10 173.56 2kc0 n GLY 179 N -2.28 2.39 0.00 1.21 0.00 -1.26 -1.90 105.19 103.35 2kc0 n GLY 179 Ca 0.12 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2kc0 n GLY 179 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2kc0 n LYS 180 N 0.00 0.00 -3.60 1.61 2.85 -0.32 -3.44 118.16 115.25 2kc0 n LYS 180 Ca 0.00 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.90 2kc0 n LYS 180 Cb 0.00 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.32 2kc0 n LYS 180 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2kc0 s ILE 181 N -2.00 5.14 -0.23 0.58 -1.09 -0.32 -1.47 121.20 121.82 2kc0 s ILE 181 Ca 0.00 0.54 -0.07 0.00 -2.23 0.00 0.00 60.65 58.89 2kc0 s ILE 181 Cb 0.00 -3.63 0.11 0.00 -1.58 0.00 0.00 42.46 37.35 2kc0 s ILE 181 CO 0.00 0.45 0.48 -0.70 -1.23 0.00 0.00 174.94 173.94 2kc0 s GLU 182 N -1.46 0.40 0.00 2.79 2.12 -0.30 -3.92 118.70 118.33 2kc0 s GLU 182 Ca 0.27 1.10 0.00 0.00 0.36 0.00 0.00 54.97 56.70 2kc0 s GLU 182 Cb -0.15 0.42 0.00 0.00 0.26 0.00 0.00 34.13 34.66 2kc0 s GLU 182 CO 0.14 -0.28 0.00 1.58 -0.54 0.00 0.00 175.26 176.16 2kc0 n HIS 183 N 5.41 0.00 -1.70 5.30 -0.00 -1.26 -4.08 115.22 118.89 2kc0 n HIS 183 Ca -0.09 0.00 -0.31 0.00 0.46 0.00 0.00 57.72 57.78 2kc0 n HIS 183 Cb 0.49 0.00 0.04 0.00 -0.12 0.00 0.00 29.99 30.40 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 0.00 3.23 0.54 0.27 2.01 -1.26 -4.95 118.68 118.53 2kc0 s LEU 184 Ca 0.00 1.67 0.27 0.00 0.01 0.00 0.00 54.13 56.08 2kc0 s LEU 184 Cb 0.00 -4.51 1.44 0.00 0.01 0.00 0.00 46.19 43.13 2kc0 s LEU 184 CO 0.00 -1.36 1.98 0.07 1.01 0.00 0.00 176.35 178.05 2kc0 h LYS 185 N -0.40 0.00 -4.78 1.70 2.10 -2.02 -3.42 116.57 109.75 2kc0 h LYS 185 Ca -0.45 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 57.89 2kc0 h LYS 185 Cb 1.21 0.00 -0.21 0.00 -0.90 0.00 0.00 32.23 32.33 2kc0 h LYS 185 CO 0.57 0.00 -0.75 -1.54 -2.00 0.00 0.00 179.45 175.73 2kc0 s SER 186 N -6.00 1.08 0.27 7.07 1.04 -1.26 -5.09 113.70 110.82 2kc0 s SER 186 Ca -0.05 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 55.82 2kc0 s SER 186 Cb 0.19 0.01 0.37 0.00 0.10 0.00 0.00 66.02 66.69 2kc0 s SER 186 CO 0.70 -0.17 1.70 1.55 0.98 0.00 0.00 173.24 178.01 2kc0 h PRO 187 N 4.43 0.53 -0.15 4.02 0.13 -2.00 -3.28 132.00 135.69 2kc0 h PRO 187 Ca -0.37 -0.20 0.00 0.00 -0.87 0.00 0.00 66.00 64.55 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 0.41 0.74 0.00 0.39 -0.23 0.00 0.00 178.00 179.30 2kc0 n GLU 188 N -4.12 1.18 -0.03 0.86 1.02 -1.26 -2.77 120.64 115.52 2kc0 n GLU 188 Ca -0.00 -0.26 0.02 0.00 -0.02 0.00 0.00 57.16 56.90 2kc0 n GLU 188 Cb 0.41 -1.10 -0.12 0.00 -0.02 0.00 0.00 31.44 30.61 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 -0.26 0.00 -4.75 -4.62 4.32 -1.24 -4.91 117.00 105.54 2kc0 n LEU 189 Ca 0.02 0.00 -0.41 0.00 -0.02 0.00 0.00 56.01 55.61 2kc0 n LEU 189 Cb 0.09 0.14 -0.04 0.00 -1.62 0.00 0.00 43.42 41.99 2kc0 n LEU 189 CO 0.02 0.14 0.87 0.20 -1.22 0.00 0.00 177.39 177.39 2kc0 s ASN 190 N -4.20 7.09 0.18 -1.43 0.01 -1.12 -4.66 114.94 110.82 2kc0 s ASN 190 Ca -0.06 2.36 0.09 0.00 -0.71 0.00 0.00 52.86 54.54 2kc0 s ASN 190 Cb 0.08 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 2kc0 s ASN 190 CO 0.64 -0.31 -0.10 0.68 -1.51 0.00 0.00 177.10 176.50 2kc0 s VAL 191 N -0.83 3.17 0.70 1.60 -7.23 -1.25 -4.88 120.40 111.68 2kc0 s VAL 191 Ca 0.48 -1.65 -0.11 0.00 -1.81 0.00 0.00 61.98 58.89 2kc0 s VAL 191 Cb -0.34 -2.57 0.01 0.00 0.56 0.00 0.00 36.38 34.04 2kc0 s VAL 191 CO 0.43 -0.10 1.07 -1.81 -0.31 0.00 0.00 175.10 174.38 2kc0 s ASP 192 N -2.79 5.45 -0.01 4.85 1.11 -1.26 -1.17 116.67 122.86 2kc0 s ASP 192 Ca 0.24 1.32 0.07 0.00 0.18 0.00 0.00 52.55 54.37 2kc0 s ASP 192 Cb -0.09 -2.19 -0.03 0.00 1.07 0.00 0.00 42.92 41.69 2kc0 s ASP 192 CO 0.15 -1.36 -0.22 -0.22 1.18 0.00 0.00 175.17 174.70 2kc0 s LEU 193 N -5.43 2.34 -0.57 1.23 2.96 -1.22 -3.58 118.68 114.40 2kc0 s LEU 193 Ca 0.58 -0.41 -0.27 0.00 -0.22 0.00 0.00 54.13 53.81 2kc0 s LEU 193 Cb -0.12 -1.42 0.03 0.00 0.50 0.00 0.00 46.19 45.19 2kc0 s LEU 193 CO 0.53 0.31 1.11 0.00 -1.32 0.00 0.00 176.35 176.98 2kc0 s ALA 194 N -0.73 3.05 -0.08 5.97 0.00 -0.75 -4.53 121.76 124.68 2kc0 s ALA 194 Ca 0.11 -0.98 -0.39 0.00 0.00 0.00 0.00 51.96 50.71 2kc0 s ALA 194 Cb -0.10 -3.94 -0.17 0.00 0.00 0.00 0.00 23.12 18.91 2kc0 s ALA 194 CO 0.01 -2.58 1.49 0.00 0.00 0.00 0.00 175.76 174.68 2kc0 n ALA 195 N 8.13 -0.86 -2.37 0.00 0.00 -1.26 -3.96 120.51 120.19 2kc0 n ALA 195 Ca 0.06 0.47 -0.18 0.00 0.00 0.00 0.00 53.44 53.79 2kc0 n ALA 195 Cb 0.48 -2.11 -0.10 0.00 0.00 0.00 0.00 19.45 17.72 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 1.71 1.79 0.09 0.00 0.00 -1.23 -4.97 121.76 119.15 2kc0 s ALA 196 Ca 0.91 -1.53 0.03 0.00 0.00 0.00 0.00 51.96 51.37 2kc0 s ALA 196 Cb -1.04 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.98 2kc0 s ALA 196 CO 0.56 0.06 0.08 0.16 0.00 0.00 0.00 175.76 176.62 2kc0 s ASP 197 N -3.04 5.52 0.27 0.00 -4.77 -1.26 -0.82 116.67 112.56 2kc0 s ASP 197 Ca 0.18 -0.02 -0.29 0.00 -3.30 0.00 0.00 52.55 49.11 2kc0 s ASP 197 Cb -0.01 -1.47 -0.10 0.00 -1.09 0.00 0.00 42.92 40.25 2kc0 s ASP 197 CO 0.05 0.16 1.28 -0.51 0.70 0.00 0.00 175.17 176.85 2kc0 s ILE 198 N -1.42 3.00 0.71 2.11 1.10 -1.04 -4.29 121.20 121.37 2kc0 s ILE 198 Ca 0.29 0.92 -0.14 0.00 -0.51 0.00 0.00 60.65 61.21 2kc0 s ILE 198 Cb -0.12 -3.59 0.03 0.00 0.15 0.00 0.00 42.46 38.93 2kc0 s ILE 198 CO 0.22 0.19 1.15 -0.54 -2.11 0.00 0.00 174.94 173.85 2kc0 s LYS 199 N -1.08 2.38 -0.03 3.50 -0.14 -0.49 -4.95 119.74 118.94 2kc0 s LYS 199 Ca 0.51 1.54 0.03 0.00 -1.36 0.00 0.00 55.97 56.69 2kc0 s LYS 199 Cb -0.38 -1.89 0.14 0.00 -1.68 0.00 0.00 37.83 34.03 2kc0 s LYS 199 CO 0.45 -1.60 0.85 -0.35 -0.76 0.00 0.00 175.35 173.94 2kc0 n PRO 200 N -2.73 1.60 -4.08 -1.68 -0.04 -1.26 -4.80 135.00 122.01 2kc0 n PRO 200 Ca 0.12 -0.56 -0.14 0.00 -0.04 0.00 0.00 63.50 62.88 2kc0 n PRO 200 Cb 0.51 -1.47 -0.12 0.00 -0.04 0.00 0.00 33.50 32.38 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 -0.42 0.92 0.00 3.54 1.01 -1.26 -4.87 116.67 115.59 2kc0 s ASP 201 Ca 0.10 -0.51 0.00 0.00 0.71 0.00 0.00 52.55 52.84 2kc0 s ASP 201 Cb 0.07 0.02 0.00 0.00 1.01 0.00 0.00 42.92 44.02 2kc0 s ASP 201 CO 0.04 -0.17 0.00 0.61 0.21 0.00 0.00 175.17 175.86 2kc0 n GLY 202 N 1.58 0.71 0.36 0.21 0.00 -1.26 -4.26 105.19 102.53 2kc0 n GLY 202 Ca -0.22 -0.38 0.18 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 0.00 -0.25 1.61 2.10 -1.95 0.44 116.57 118.51 2kc0 h LYS 203 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2kc0 h LYS 203 Cb 0.89 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.22 2kc0 h LYS 203 CO 0.00 0.00 0.00 2.89 -2.00 0.00 0.00 179.45 180.34 2kc0 n ARG 204 N -4.30 1.99 -2.76 0.07 -4.01 -1.26 -1.92 116.66 104.46 2kc0 n ARG 204 Ca 0.07 -1.83 -0.03 0.00 -1.04 0.00 0.00 57.85 55.03 2kc0 n ARG 204 Cb 0.51 -1.32 0.02 0.00 -3.04 0.00 0.00 32.46 28.63 2kc0 n ARG 204 CO 0.00 0.00 0.00 -1.58 -3.04 0.00 0.00 177.63 173.01 2kc0 s HIS 205 N -1.11 -1.07 0.25 2.89 5.04 0.12 -2.91 115.29 118.50 2kc0 s HIS 205 Ca 0.24 -0.30 -0.26 0.00 -1.54 0.00 0.00 55.06 53.21 2kc0 s HIS 205 Cb 0.14 0.21 -0.09 0.00 0.04 0.00 0.00 32.58 32.88 2kc0 s HIS 205 CO 0.20 -0.83 0.86 0.00 -2.34 0.00 0.00 174.74 172.63 2kc0 s ALA 206 N 1.06 3.34 0.04 1.58 0.00 -1.09 -4.49 121.76 122.20 2kc0 s ALA 206 Ca 0.26 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.68 2kc0 s ALA 206 Cb 0.05 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.06 2kc0 s ALA 206 CO -0.08 0.24 -0.00 0.08 0.00 0.00 0.00 175.76 176.00 2kc0 s VAL 207 N -1.39 4.05 -0.12 0.00 1.01 -1.26 -3.12 120.40 119.58 2kc0 s VAL 207 Ca 0.43 -0.78 -0.00 0.00 0.00 0.00 0.00 61.98 61.63 2kc0 s VAL 207 Cb -0.21 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 2kc0 s VAL 207 CO 0.26 0.27 -0.11 -0.63 0.00 0.00 0.00 175.10 174.88 2kc0 s ILE 208 N -1.18 3.27 -0.29 2.22 -1.09 -1.01 -1.39 121.20 121.72 2kc0 s ILE 208 Ca 0.22 -0.60 0.02 0.00 -2.23 0.00 0.00 60.65 58.06 2kc0 s ILE 208 Cb -0.12 -2.37 0.08 0.00 -1.58 0.00 0.00 42.46 38.48 2kc0 s ILE 208 CO 0.14 0.54 0.00 -0.44 -1.23 0.00 0.00 174.94 173.94 2kc0 s SER 209 N 0.09 4.37 0.32 3.58 0.01 -1.26 -3.37 113.70 117.44 2kc0 s SER 209 Ca -0.04 -1.69 0.07 0.00 1.31 0.00 0.00 55.95 55.60 2kc0 s SER 209 Cb -0.14 -1.39 -0.03 0.00 0.21 0.00 0.00 66.02 64.67 2kc0 s SER 209 CO 0.04 -0.31 0.27 0.61 0.41 0.00 0.00 173.24 174.26 2kc0 n GLY 210 N 4.48 2.94 3.48 3.44 0.00 -1.01 -4.70 105.19 113.82 2kc0 n GLY 210 Ca -0.04 -1.88 -0.28 0.00 0.00 0.00 0.00 46.02 43.81 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 -3.24 3.80 -0.15 1.61 0.01 -1.25 -0.82 113.70 113.66 2kc0 s SER 211 Ca 0.38 -0.68 -0.00 0.00 1.31 0.00 0.00 55.95 56.97 2kc0 s SER 211 Cb 0.02 -0.47 0.03 0.00 0.21 0.00 0.00 66.02 65.81 2kc0 s SER 211 CO 0.27 0.14 -0.09 -0.69 0.41 0.00 0.00 173.24 173.29 2kc0 s VAL 212 N -1.45 1.23 -0.17 3.43 1.01 -0.47 -1.81 120.40 122.16 2kc0 s VAL 212 Ca 0.20 -0.54 -0.18 0.00 0.00 0.00 0.00 61.98 61.46 2kc0 s VAL 212 Cb -0.09 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 2kc0 s VAL 212 CO 0.11 0.29 0.50 -0.22 0.00 0.00 0.00 175.10 175.78 2kc0 s LEU 213 N 1.61 4.19 -0.29 3.92 1.98 -1.24 -0.87 118.68 127.97 2kc0 s LEU 213 Ca 0.03 0.71 -0.01 0.00 -2.89 0.00 0.00 54.13 51.97 2kc0 s LEU 213 Cb -0.14 -2.70 0.05 0.00 0.66 0.00 0.00 46.19 44.07 2kc0 s LEU 213 CO -0.09 -0.12 -0.01 -0.47 -1.89 0.00 0.00 176.35 173.77 2kc0 s TYR 214 N 1.29 3.25 -1.55 5.38 5.04 0.16 -4.61 117.35 126.32 2kc0 s TYR 214 Ca 0.24 -1.89 -0.14 0.00 -2.44 0.00 0.00 57.07 52.84 2kc0 s TYR 214 Cb -0.15 -2.09 0.10 0.00 0.35 0.00 0.00 41.96 40.16 2kc0 s TYR 214 CO 0.10 -0.81 0.95 -1.71 -1.34 0.00 0.00 175.55 172.74 2kc0 n ASN 215 N 4.61 -4.65 -2.37 4.32 5.15 -1.26 -1.04 115.26 120.02 2kc0 n ASN 215 Ca -0.13 -0.79 -0.20 0.00 -0.60 0.00 0.00 54.58 52.86 2kc0 n ASN 215 Cb 0.43 -3.72 0.00 0.00 -0.53 0.00 0.00 39.78 35.96 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 -4.62 -2.37 -0.31 1.20 1.13 -1.26 -4.94 117.38 106.21 2kc0 n GLN 216 Ca 0.05 0.91 0.00 0.00 -1.94 0.00 0.00 57.00 56.02 2kc0 n GLN 216 Cb 0.52 -5.53 0.00 0.00 0.11 0.00 0.00 30.24 25.34 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 -2.35 0.00 -0.54 -1.58 0.00 -0.20 -5.18 120.51 110.66 2kc0 n ALA 217 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2kc0 n ALA 217 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 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 0.00 -3.26 0.00 4.07 -1.25 -0.66 120.64 119.54 2kc0 n GLU 218 Ca 0.00 0.00 -0.06 0.00 -0.06 0.00 0.00 57.16 57.04 2kc0 n GLU 218 Cb 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.34 2kc0 n GLU 218 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2kc0 s LYS 219 N 0.00 0.69 0.46 5.31 2.20 -1.26 -4.60 119.74 122.54 2kc0 s LYS 219 Ca 0.00 -0.32 0.06 0.00 -0.36 0.00 0.00 55.97 55.35 2kc0 s LYS 219 Cb 0.00 -0.20 0.08 0.00 -1.51 0.00 0.00 37.83 36.20 2kc0 s LYS 219 CO 0.00 -1.16 0.63 0.41 -0.36 0.00 0.00 175.35 174.87 2kc0 n GLY 220 N 4.58 1.71 3.02 5.54 0.00 -0.05 -3.69 105.19 116.29 2kc0 n GLY 220 Ca 0.09 -2.17 -0.09 0.00 0.00 0.00 0.00 46.02 43.85 2kc0 n GLY 220 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kc0 s SER 221 N -3.78 0.25 0.03 1.61 0.15 0.46 -1.37 113.70 111.04 2kc0 s SER 221 Ca 0.47 -0.54 0.06 0.00 0.70 0.00 0.00 55.95 56.64 2kc0 s SER 221 Cb -0.03 0.14 -0.02 0.00 -1.71 0.00 0.00 66.02 64.39 2kc0 s SER 221 CO 0.30 -0.37 -0.19 -0.72 1.20 0.00 0.00 173.24 173.46 2kc0 s TYR 222 N -1.92 1.67 -0.04 3.44 1.13 0.00 -1.18 117.35 120.45 2kc0 s TYR 222 Ca -0.12 -0.35 0.03 0.00 -1.41 0.00 0.00 57.07 55.22 2kc0 s TYR 222 Cb -0.06 -1.01 0.01 0.00 -1.10 0.00 0.00 41.96 39.79 2kc0 s TYR 222 CO -0.02 0.05 -0.11 0.45 -2.51 0.00 0.00 175.55 173.41 2kc0 s SER 223 N -0.97 1.54 0.15 -0.18 0.15 -0.17 -2.40 113.70 111.81 2kc0 s SER 223 Ca 0.06 -0.25 -0.16 0.00 0.70 0.00 0.00 55.95 56.31 2kc0 s SER 223 Cb -0.08 -0.52 0.03 0.00 -1.71 0.00 0.00 66.02 63.74 2kc0 s SER 223 CO 0.01 0.07 0.43 -1.48 1.20 0.00 0.00 173.24 173.47 2kc0 s LEU 224 N 0.33 0.34 0.28 3.45 0.05 -1.22 -1.19 118.68 120.73 2kc0 s LEU 224 Ca -0.07 -0.40 0.11 0.00 0.05 0.00 0.00 54.13 53.83 2kc0 s LEU 224 Cb -0.12 1.88 -0.05 0.00 -2.05 0.00 0.00 46.19 45.86 2kc0 s LEU 224 CO 0.02 -0.91 -0.15 -0.83 -0.55 0.00 0.00 176.35 173.93 2kc0 s GLY 225 N -2.83 1.82 -0.17 -3.48 0.00 -1.05 -2.42 107.32 99.19 2kc0 s GLY 225 Ca 0.06 -1.82 -0.16 0.00 0.00 0.00 0.00 44.72 42.80 2kc0 s GLY 225 CO -0.09 -1.90 0.41 -0.42 0.00 0.00 0.00 173.10 171.10 2kc0 s ILE 226 N -2.46 5.21 0.19 0.90 -1.09 -1.18 -3.57 121.20 119.21 2kc0 s ILE 226 Ca 0.30 0.77 0.10 0.00 -2.23 0.00 0.00 60.65 59.59 2kc0 s ILE 226 Cb -0.05 -3.74 -0.04 0.00 -1.58 0.00 0.00 42.46 37.04 2kc0 s ILE 226 CO 0.16 0.30 -0.16 -0.36 -1.23 0.00 0.00 174.94 173.65 2kc0 s PHE 227 N 0.95 2.48 0.07 3.97 0.08 -0.82 -2.09 117.98 122.61 2kc0 s PHE 227 Ca 0.21 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 56.98 2kc0 s PHE 227 Cb -0.14 -1.21 0.00 0.00 -0.57 0.00 0.00 43.02 41.09 2kc0 s PHE 227 CO 0.08 0.51 0.00 0.41 -0.10 0.00 0.00 175.22 176.12 2kc0 n GLY 228 N 0.11 -2.93 0.28 4.36 0.00 -0.71 -1.64 105.19 104.65 2kc0 n GLY 228 Ca -0.11 -1.26 0.19 0.00 0.00 0.00 0.00 46.02 44.84 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 0.01 0.00 -1.47 -0.02 0.00 -1.92 -1.79 103.07 97.87 2kc0 h GLY 229 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2kc0 h GLY 229 CO 0.00 0.00 -0.61 0.28 0.00 0.00 0.00 176.54 176.21 2kc0 n LYS 230 N -2.88 1.10 -3.37 4.80 4.01 -1.26 -4.88 118.16 115.68 2kc0 n LYS 230 Ca -0.02 -2.84 -0.19 0.00 -0.51 0.00 0.00 58.31 54.75 2kc0 n LYS 230 Cb 0.13 -1.14 0.06 0.00 -0.51 0.00 0.00 35.03 33.57 2kc0 n LYS 230 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2kc0 n ALA 231 N -0.67 -2.47 0.08 7.82 0.00 -0.67 -4.95 120.51 119.64 2kc0 n ALA 231 Ca 0.15 0.04 -0.10 0.00 0.00 0.00 0.00 53.44 53.53 2kc0 n ALA 231 Cb 0.81 -5.18 -0.11 0.00 0.00 0.00 0.00 19.45 14.97 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 -1.32 0.10 -3.66 0.00 4.15 -1.51 -3.48 115.11 109.38 2kc0 h GLN 232 Ca -0.62 -0.16 -0.07 0.00 0.77 0.00 0.00 58.65 58.56 2kc0 h GLN 232 Cb 1.32 0.06 -0.13 0.00 0.21 0.00 0.00 27.48 28.94 2kc0 h GLN 232 CO 0.46 1.06 -0.25 -1.83 -1.93 0.00 0.00 178.83 176.34 2kc0 s GLU 233 N -2.74 1.00 -0.03 1.69 1.03 -1.23 -2.26 118.70 116.16 2kc0 s GLU 233 Ca -0.01 -0.91 0.01 0.00 0.03 0.00 0.00 54.97 54.09 2kc0 s GLU 233 Cb 0.09 0.40 0.02 0.00 -0.80 0.00 0.00 34.13 33.84 2kc0 s GLU 233 CO 0.84 -0.36 -0.02 0.14 -1.33 0.00 0.00 175.26 174.53 2kc0 s VAL 234 N -3.86 0.33 0.05 1.83 -7.23 -0.37 -1.95 120.40 109.20 2kc0 s VAL 234 Ca 0.07 -0.02 -0.04 0.00 -1.81 0.00 0.00 61.98 60.18 2kc0 s VAL 234 Cb 0.03 -0.38 -0.02 0.00 0.56 0.00 0.00 36.38 36.57 2kc0 s VAL 234 CO -0.09 0.17 0.05 0.00 -0.31 0.00 0.00 175.10 174.92 2kc0 s ALA 235 N 0.85 0.17 0.00 1.32 0.00 -1.23 -1.84 121.76 121.04 2kc0 s ALA 235 Ca -0.10 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.00 2kc0 s ALA 235 Cb -0.13 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.29 2kc0 s ALA 235 CO -0.01 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.80 2kc0 n GLY 236 N 0.38 -0.73 3.42 0.00 0.00 -1.16 -2.54 105.19 104.57 2kc0 n GLY 236 Ca -0.16 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.55 0.03 1.61 0.15 -0.33 -1.32 113.70 109.29 2kc0 s SER 237 Ca 0.00 0.07 0.06 0.00 0.70 0.00 0.00 55.95 56.78 2kc0 s SER 237 Cb 0.00 0.58 -0.02 0.00 -1.71 0.00 0.00 66.02 64.87 2kc0 s SER 237 CO 0.00 -0.91 -0.17 0.00 1.20 0.00 0.00 173.24 173.36 2kc0 s ALA 238 N -3.39 1.47 0.04 5.45 0.00 0.13 -1.00 121.76 124.46 2kc0 s ALA 238 Ca -0.01 -0.89 0.07 0.00 0.00 0.00 0.00 51.96 51.14 2kc0 s ALA 238 Cb -0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 2kc0 s ALA 238 CO -0.10 0.32 -0.21 -1.21 0.00 0.00 0.00 175.76 174.57 2kc0 s GLU 239 N -0.93 1.41 -0.04 0.00 8.01 -0.33 -0.48 118.70 126.34 2kc0 s GLU 239 Ca 0.05 -0.94 0.04 0.00 0.01 0.00 0.00 54.97 54.13 2kc0 s GLU 239 Cb -0.08 -1.52 -0.00 0.00 -4.31 0.00 0.00 34.13 28.23 2kc0 s GLU 239 CO 0.01 0.39 -0.15 0.54 0.01 0.00 0.00 175.26 176.06 2kc0 s VAL 240 N -0.79 1.27 -0.70 2.63 0.11 -0.20 -0.41 120.40 122.32 2kc0 s VAL 240 Ca 0.07 -0.62 -0.15 0.00 -2.93 0.00 0.00 61.98 58.36 2kc0 s VAL 240 Cb -0.09 -1.11 0.18 0.00 -1.53 0.00 0.00 36.38 33.84 2kc0 s VAL 240 CO 0.02 0.37 0.64 -0.54 -3.33 0.00 0.00 175.10 172.26 2kc0 s LYS 241 N 0.14 3.31 0.54 1.54 1.02 -1.24 -0.97 119.74 124.08 2kc0 s LYS 241 Ca -0.05 -2.14 -0.06 0.00 0.02 0.00 0.00 55.97 53.74 2kc0 s LYS 241 Cb -0.11 -4.35 -0.02 0.00 -0.52 0.00 0.00 37.83 32.83 2kc0 s LYS 241 CO 0.02 -1.30 0.85 0.99 -0.92 0.00 0.00 175.35 174.99 2kc0 s THR 242 N 0.77 4.30 0.64 2.17 2.01 -0.36 -4.54 115.64 120.62 2kc0 s THR 242 Ca 0.12 0.13 0.35 0.00 0.31 0.00 0.00 61.69 62.60 2kc0 s THR 242 Cb -0.19 -3.67 0.38 0.00 0.01 0.00 0.00 72.50 69.03 2kc0 s THR 242 CO -0.04 -0.68 2.17 -0.37 -0.69 0.00 0.00 174.62 175.02 2kc0 h VAL 243 N 0.01 0.20 -0.20 3.82 -1.51 -2.02 0.10 116.25 116.66 2kc0 h VAL 243 Ca -0.46 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.00 2kc0 h VAL 243 Cb 1.23 0.87 -0.01 0.00 -2.13 0.00 0.00 31.29 31.25 2kc0 h VAL 243 CO 0.61 0.00 0.01 0.59 -1.23 0.00 0.00 177.57 177.55 2kc0 n ASN 244 N -3.34 2.58 0.00 4.19 3.02 -1.26 -5.04 115.26 115.41 2kc0 n ASN 244 Ca -0.01 -2.32 0.00 0.00 -0.03 0.00 0.00 54.58 52.22 2kc0 n ASN 244 Cb 0.22 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 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 0.19 -2.63 3.77 7.41 0.00 0.35 -4.92 105.19 109.36 2kc0 n GLY 245 Ca 0.10 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.63 2.73 -0.01 -0.61 1.10 -1.26 -1.22 121.20 121.31 2kc0 s ILE 246 Ca 0.00 0.71 0.02 0.00 -0.51 0.00 0.00 60.65 60.87 2kc0 s ILE 246 Cb 0.00 -3.44 -0.00 0.00 0.15 0.00 0.00 42.46 39.17 2kc0 s ILE 246 CO 0.00 0.14 -0.07 -0.13 -2.11 0.00 0.00 174.94 172.77 2kc0 s ARG 247 N -1.95 0.59 -0.09 3.50 1.81 -0.14 -4.94 118.95 117.73 2kc0 s ARG 247 Ca 0.52 -0.25 -0.02 0.00 -1.72 0.00 0.00 55.73 54.26 2kc0 s ARG 247 Cb -0.38 -0.57 -0.03 0.00 -0.45 0.00 0.00 34.95 33.51 2kc0 s ARG 247 CO 0.50 0.14 0.00 -1.01 -0.68 0.00 0.00 175.30 174.26 2kc0 s HIS 248 N -0.12 3.16 -0.04 -0.53 3.76 -1.26 -1.03 115.29 119.23 2kc0 s HIS 248 Ca 0.02 0.19 0.01 0.00 -0.15 0.00 0.00 55.06 55.14 2kc0 s HIS 248 Cb -0.03 -1.79 0.02 0.00 1.11 0.00 0.00 32.58 31.89 2kc0 s HIS 248 CO -0.00 0.47 -0.04 0.42 -0.85 0.00 0.00 174.74 174.74 2kc0 s ILE 249 N -0.87 0.50 0.19 0.60 1.01 0.37 -1.39 121.20 121.60 2kc0 s ILE 249 Ca 0.13 -0.11 -0.28 0.00 0.00 0.00 0.00 60.65 60.40 2kc0 s ILE 249 Cb -0.11 -0.52 -0.08 0.00 0.01 0.00 0.00 42.46 41.75 2kc0 s ILE 249 CO 0.02 0.21 0.86 -0.83 0.00 0.00 0.00 174.94 175.21 2kc0 s GLY 250 N 0.87 3.01 -0.12 6.18 0.00 -0.19 -0.69 107.32 116.38 2kc0 s GLY 250 Ca -0.11 0.49 -0.16 0.00 0.00 0.00 0.00 44.72 44.94 2kc0 s GLY 250 CO 0.00 1.07 0.38 1.08 0.00 0.00 0.00 173.10 175.63 2kc0 s LEU 251 N -1.04 4.28 -0.45 0.66 2.01 -0.43 -3.87 118.68 119.85 2kc0 s LEU 251 Ca 0.39 0.69 0.06 0.00 0.01 0.00 0.00 54.13 55.27 2kc0 s LEU 251 Cb -0.24 -2.53 0.19 0.00 0.01 0.00 0.00 46.19 43.61 2kc0 s LEU 251 CO 0.29 0.08 0.53 0.00 1.01 0.00 0.00 176.35 178.26 2kc0 n ALA 252 N 3.42 0.89 -2.48 4.21 0.00 -1.17 -2.99 120.51 122.40 2kc0 n ALA 252 Ca -0.10 -2.30 -0.24 0.00 0.00 0.00 0.00 53.44 50.80 2kc0 n ALA 252 Cb 0.52 -1.05 -0.12 0.00 0.00 0.00 0.00 19.45 18.79 2kc0 n ALA 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kc0 s ALA 253 N 0.27 2.04 0.22 0.00 0.00 -0.76 -1.69 121.76 121.83 2kc0 s ALA 253 Ca 0.32 -1.41 -0.18 0.00 0.00 0.00 0.00 51.96 50.70 2kc0 s ALA 253 Cb 0.05 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.94 2kc0 s ALA 253 CO -0.14 0.35 0.56 -1.59 0.00 0.00 0.00 175.76 174.93 2kc0 s LYS 254 N -2.33 1.49 0.00 0.00 0.00 -0.51 -1.23 119.74 117.16 2kc0 s LYS 254 Ca 0.12 -0.94 0.19 0.00 0.00 0.00 0.00 55.97 55.34 2kc0 s LYS 254 Cb -0.08 0.53 1.13 0.00 0.00 0.00 0.00 37.83 39.41 2kc0 s LYS 254 CO 0.06 -0.64 1.52 0.00 0.00 0.00 0.00 175.35 176.29