#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 -0.42 0.22 0.00 0.00 -1.26 -2.62 105.19 101.10 2kc0 n GLY 15 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 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 0.32 -1.01 0.99 3.38 -1.96 -1.46 115.31 115.58 2kc0 h LEU 16 Ca 0.00 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 2kc0 h LEU 16 Cb 0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2kc0 h LEU 16 CO 0.00 0.22 -0.29 0.00 0.09 0.00 0.00 178.44 178.46 2kc0 h ALA 17 N 1.32 1.17 0.34 1.53 0.00 -1.69 -2.45 119.26 119.47 2kc0 h ALA 17 Ca 0.25 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2kc0 h ALA 17 Cb 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2kc0 h ALA 17 CO -0.20 0.54 -0.16 0.22 0.00 0.00 0.00 179.25 179.64 2kc0 h ASP 18 N 0.32 -0.38 0.00 0.00 3.58 -1.71 -3.26 116.42 114.97 2kc0 h ASP 18 Ca 0.05 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.37 2kc0 h ASP 18 Cb 0.67 0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.82 2kc0 h ASP 18 CO 0.05 -0.08 0.02 0.00 -2.88 0.00 0.00 179.24 176.35 2kc0 h ALA 19 N -0.14 1.01 0.00 -0.78 0.00 -1.08 -1.52 119.26 116.75 2kc0 h ALA 19 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2kc0 h ALA 19 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2kc0 h ALA 19 CO 0.08 -0.01 -1.40 1.28 0.00 0.00 0.00 179.25 179.19 2kc0 n LEU 20 N -2.48 0.51 0.00 0.00 7.99 -0.94 -4.07 117.00 118.01 2kc0 n LEU 20 Ca -0.02 -0.17 0.00 0.00 -0.01 0.00 0.00 56.01 55.81 2kc0 n LEU 20 Cb 0.06 -0.02 0.00 0.00 -0.11 0.00 0.00 43.42 43.35 2kc0 n LEU 20 CO 0.12 0.09 0.02 0.35 -1.51 0.00 0.00 177.39 176.47 2kc0 n THR 21 N -1.93 0.00 0.00 -5.08 -2.24 -0.57 -4.65 114.28 99.80 2kc0 n THR 21 Ca 0.00 0.50 0.00 0.00 -2.27 0.00 0.00 64.05 62.29 2kc0 n THR 21 Cb 0.45 -1.43 0.00 0.00 -2.10 0.00 0.00 70.33 67.25 2kc0 n THR 21 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2kc0 n ALA 22 N -1.89 0.31 -2.00 6.98 0.00 -1.23 -5.12 120.51 117.56 2kc0 n ALA 22 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2kc0 n ALA 22 Cb 0.00 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.57 2kc0 n ALA 22 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2kc0 s PRO 23 N -1.65 1.57 0.00 0.00 0.04 -1.26 -4.99 135.00 128.72 2kc0 s PRO 23 Ca 0.00 -1.25 0.00 0.00 0.04 0.00 0.00 61.00 59.79 2kc0 s PRO 23 Cb 0.00 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.20 2kc0 s PRO 23 CO 0.00 -1.53 0.00 -0.11 0.04 0.00 0.00 177.00 175.40 2kc0 n LEU 24 N -2.86 0.00 -4.70 -3.56 7.94 -1.26 -3.50 117.00 109.06 2kc0 n LEU 24 Ca 0.16 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.73 2kc0 n LEU 24 Cb 0.61 0.00 0.13 0.00 0.53 0.00 0.00 43.42 44.68 2kc0 n LEU 24 CO 0.41 0.00 0.77 1.51 -1.11 0.00 0.00 177.39 178.98 2kc0 s ASP 25 N -0.71 3.61 0.00 1.96 -4.77 -1.26 -4.79 116.67 110.71 2kc0 s ASP 25 Ca 0.00 2.37 0.00 0.00 -3.30 0.00 0.00 52.55 51.62 2kc0 s ASP 25 Cb 0.00 -2.59 0.00 0.00 -1.09 0.00 0.00 42.92 39.24 2kc0 s ASP 25 CO 0.00 -2.66 0.00 1.57 0.70 0.00 0.00 175.17 174.78 2kc0 n HIS 26 N -3.27 0.00 -0.01 2.11 -0.00 -1.26 -5.04 115.22 107.75 2kc0 n HIS 26 Ca 0.14 0.00 -0.22 0.00 0.46 0.00 0.00 57.72 58.10 2kc0 n HIS 26 Cb 0.50 0.00 -0.13 0.00 -0.12 0.00 0.00 29.99 30.24 2kc0 n HIS 26 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 2kc0 h LYS 27 N 0.00 0.21 -3.14 1.57 1.79 -1.94 -3.52 116.57 111.55 2kc0 h LYS 27 Ca 0.00 -0.36 0.04 0.00 -2.18 0.00 0.00 60.65 58.15 2kc0 h LYS 27 Cb 0.00 0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 2kc0 h LYS 27 CO 0.00 1.17 -0.86 -3.47 -1.08 0.00 0.00 179.45 175.21 2kc0 n ASP 28 N -3.83 -7.10 0.00 0.86 -0.08 -1.26 -5.07 116.55 100.06 2kc0 n ASP 28 Ca -0.29 1.55 0.00 0.00 -1.51 0.00 0.00 54.79 54.53 2kc0 n ASP 28 Cb 0.92 -4.17 0.00 0.00 2.34 0.00 0.00 41.12 40.22 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 -2.66 0.00 0.00 -0.67 2.85 -1.26 -5.04 118.16 111.37 2kc0 n LYS 29 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 2kc0 n LYS 29 Cb 0.44 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.82 2kc0 n LYS 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2kc0 n GLY 30 N 0.00 -1.04 3.69 2.58 0.00 -1.26 -5.13 105.19 104.02 2kc0 n GLY 30 Ca 0.00 0.41 -0.42 0.00 0.00 0.00 0.00 46.02 46.01 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 4.29 -0.00 0.99 0.20 -1.26 -4.86 118.68 118.03 2kc0 s LEU 31 Ca 0.00 1.79 0.00 0.00 0.69 0.00 0.00 54.13 56.61 2kc0 s LEU 31 Cb 0.00 -3.56 0.00 0.00 -0.43 0.00 0.00 46.19 42.20 2kc0 s LEU 31 CO 0.00 -0.54 0.59 0.00 -0.29 0.00 0.00 176.35 176.10 2kc0 n GLN 32 N 5.00 0.01 -3.94 1.98 6.02 -1.26 -4.59 117.38 120.59 2kc0 n GLN 32 Ca 0.10 -0.59 -0.09 0.00 -0.01 0.00 0.00 57.00 56.41 2kc0 n GLN 32 Cb 0.47 -0.50 -0.05 0.00 1.02 0.00 0.00 30.24 31.18 2kc0 n GLN 32 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2kc0 s SER 33 N -0.17 -0.11 0.07 1.08 1.04 -1.26 -1.39 113.70 112.95 2kc0 s SER 33 Ca 0.00 -0.83 0.03 0.00 0.48 0.00 0.00 55.95 55.63 2kc0 s SER 33 Cb 0.00 0.58 -0.03 0.00 0.10 0.00 0.00 66.02 66.66 2kc0 s SER 33 CO 0.00 -1.11 -0.09 -0.22 0.98 0.00 0.00 173.24 172.81 2kc0 s LEU 34 N -2.98 2.35 -0.07 2.42 0.20 -0.04 -4.75 118.68 115.81 2kc0 s LEU 34 Ca 0.19 -0.71 -0.04 0.00 0.69 0.00 0.00 54.13 54.26 2kc0 s LEU 34 Cb -0.01 -0.21 -0.04 0.00 -0.43 0.00 0.00 46.19 45.51 2kc0 s LEU 34 CO 0.06 -0.26 0.11 0.42 -0.29 0.00 0.00 176.35 176.39 2kc0 s THR 35 N -2.09 5.14 -0.72 3.68 -4.23 -1.26 -0.73 115.64 115.42 2kc0 s THR 35 Ca -0.01 -0.07 0.03 0.00 -1.18 0.00 0.00 61.69 60.46 2kc0 s THR 35 Cb -0.05 -3.29 0.31 0.00 1.34 0.00 0.00 72.50 70.81 2kc0 s THR 35 CO -0.01 0.50 1.09 0.18 -0.54 0.00 0.00 174.62 175.84 2kc0 n LEU 36 N 1.61 4.96 -0.81 4.79 4.32 -0.07 -4.77 117.00 127.04 2kc0 n LEU 36 Ca -0.16 -5.53 0.10 0.00 -0.02 0.00 0.00 56.01 50.40 2kc0 n LEU 36 Cb 0.54 -0.76 0.09 0.00 -1.62 0.00 0.00 43.42 41.67 2kc0 n LEU 36 CO 0.35 2.16 0.57 0.47 -1.22 0.00 0.00 177.39 179.72 2kc0 n ASP 37 N 0.24 2.69 0.00 -1.43 9.92 -1.26 -3.03 116.55 123.68 2kc0 n ASP 37 Ca 0.33 -1.84 0.00 0.00 -0.53 0.00 0.00 54.79 52.75 2kc0 n ASP 37 Cb 0.37 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.84 2kc0 n ASP 37 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 2kc0 n GLN 38 N 1.13 0.97 -0.34 -1.24 0.00 -1.26 -4.79 117.38 111.85 2kc0 n GLN 38 Ca 0.12 0.00 0.15 0.00 -0.00 0.00 0.00 57.00 57.27 2kc0 n GLN 38 Cb 0.50 -0.68 0.35 0.00 0.00 0.00 0.00 30.24 30.41 2kc0 n GLN 38 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2kc0 h SER 39 N 0.00 0.63 -4.67 1.69 4.64 -1.90 -3.44 113.55 110.50 2kc0 h SER 39 Ca 0.00 0.13 -0.28 0.00 -0.47 0.00 0.00 61.79 61.17 2kc0 h SER 39 Cb 0.35 0.03 -0.20 0.00 -0.31 0.00 0.00 62.40 62.28 2kc0 h SER 39 CO 0.00 0.13 -0.73 0.54 -0.87 0.00 0.00 176.83 175.90 2kc0 s VAL 40 N -5.82 0.66 0.99 0.95 0.11 -1.26 -5.15 120.40 110.87 2kc0 s VAL 40 Ca -0.11 -1.33 -0.15 0.00 -2.93 0.00 0.00 61.98 57.46 2kc0 s VAL 40 Cb 0.26 -0.94 0.18 0.00 -1.53 0.00 0.00 36.38 34.35 2kc0 s VAL 40 CO 0.79 -0.49 1.17 -0.13 -3.33 0.00 0.00 175.10 173.11 2kc0 s ARG 41 N -2.18 0.50 0.00 1.54 1.81 -1.26 -4.76 118.95 114.60 2kc0 s ARG 41 Ca -0.03 0.07 0.13 0.00 -1.72 0.00 0.00 55.73 54.18 2kc0 s ARG 41 Cb -0.06 -1.79 0.81 0.00 -0.45 0.00 0.00 34.95 33.46 2kc0 s ARG 41 CO -0.01 -2.58 1.24 1.63 -0.68 0.00 0.00 175.30 174.90 2kc0 n LYS 42 N -3.99 0.54 -0.00 3.54 5.02 -1.26 -3.80 118.16 118.21 2kc0 n LYS 42 Ca 0.10 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.38 2kc0 n LYS 42 Cb 0.59 -1.39 -0.01 0.00 -0.02 0.00 0.00 35.03 34.21 2kc0 n LYS 42 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2kc0 n ASN 43 N -0.89 4.66 -4.83 4.39 3.02 -1.26 -3.98 115.26 116.38 2kc0 n ASN 43 Ca 0.10 -0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.29 2kc0 n ASN 43 Cb 0.05 0.44 -0.07 0.00 -0.61 0.00 0.00 39.78 39.59 2kc0 n ASN 43 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2kc0 s GLU 44 N -2.02 3.64 -0.47 3.52 -1.05 -1.25 -4.92 118.70 116.15 2kc0 s GLU 44 Ca -0.01 -0.17 -0.19 0.00 -0.15 0.00 0.00 54.97 54.45 2kc0 s GLU 44 Cb 0.00 -3.24 0.04 0.00 -0.44 0.00 0.00 34.13 30.49 2kc0 s GLU 44 CO 0.03 0.63 0.60 0.21 0.95 0.00 0.00 175.26 177.68 2kc0 s LYS 45 N -0.61 3.16 -0.41 -4.83 2.20 -0.05 -4.64 119.74 114.56 2kc0 s LYS 45 Ca 0.13 -0.72 -0.16 0.00 -0.36 0.00 0.00 55.97 54.86 2kc0 s LYS 45 Cb -0.12 -4.03 0.02 0.00 -1.51 0.00 0.00 37.83 32.19 2kc0 s LYS 45 CO 0.02 -1.10 0.37 -1.17 -0.36 0.00 0.00 175.35 173.12 2kc0 s LEU 46 N 2.60 4.96 -0.31 5.43 1.98 -0.38 -0.54 118.68 132.42 2kc0 s LEU 46 Ca 0.17 -0.77 -0.21 0.00 -2.89 0.00 0.00 54.13 50.43 2kc0 s LEU 46 Cb -0.17 -2.28 -0.01 0.00 0.66 0.00 0.00 46.19 44.39 2kc0 s LEU 46 CO 0.14 -0.52 0.65 -0.75 -1.89 0.00 0.00 176.35 173.98 2kc0 s LYS 47 N 1.93 3.88 -0.10 1.98 2.47 -0.37 -0.78 119.74 128.75 2kc0 s LYS 47 Ca 0.09 0.30 0.03 0.00 -1.56 0.00 0.00 55.97 54.83 2kc0 s LYS 47 Cb -0.18 -3.74 -0.01 0.00 -1.46 0.00 0.00 37.83 32.44 2kc0 s LYS 47 CO 0.12 -0.61 -0.20 -1.17 0.16 0.00 0.00 175.35 173.66 2kc0 s LEU 48 N 2.66 2.35 -0.00 5.43 1.98 -0.36 -1.44 118.68 129.30 2kc0 s LEU 48 Ca 0.26 -0.45 -0.18 0.00 -2.89 0.00 0.00 54.13 50.87 2kc0 s LEU 48 Cb -0.15 -1.48 0.03 0.00 0.66 0.00 0.00 46.19 45.25 2kc0 s LEU 48 CO 0.12 0.19 0.40 0.00 -1.89 0.00 0.00 176.35 175.17 2kc0 s ALA 49 N 0.19 -1.01 -0.11 5.97 0.00 -0.50 -0.67 121.76 125.63 2kc0 s ALA 49 Ca -0.12 0.48 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 2kc0 s ALA 49 Cb -0.16 0.14 0.10 0.00 0.00 0.00 0.00 23.12 23.20 2kc0 s ALA 49 CO 0.06 -0.34 0.83 0.00 0.00 0.00 0.00 175.76 176.32 2kc0 s ALA 50 N -1.66 -1.85 -1.49 0.00 0.00 -0.48 -2.59 121.76 113.69 2kc0 s ALA 50 Ca -0.11 1.47 -0.12 0.00 0.00 0.00 0.00 51.96 53.20 2kc0 s ALA 50 Cb -0.03 -0.38 0.07 0.00 0.00 0.00 0.00 23.12 22.78 2kc0 s ALA 50 CO 0.03 -0.34 0.90 0.94 0.00 0.00 0.00 175.76 177.29 2kc0 n GLN 51 N 0.89 -5.36 -0.11 0.00 -0.06 -1.26 -1.65 117.38 109.83 2kc0 n GLN 51 Ca -0.15 0.63 0.00 0.00 -2.00 0.00 0.00 57.00 55.48 2kc0 n GLN 51 Cb 0.57 -5.51 0.00 0.00 -4.06 0.00 0.00 30.24 21.25 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 -1.63 2.49 3.94 1.69 0.00 -1.26 -4.69 105.19 105.74 2kc0 n GLY 52 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.01 3.80 -0.04 4.61 0.00 -0.66 -5.13 121.76 121.34 2kc0 s ALA 53 Ca 0.00 -0.93 -0.24 0.00 0.00 0.00 0.00 51.96 50.79 2kc0 s ALA 53 Cb 0.00 -1.98 0.05 0.00 0.00 0.00 0.00 23.12 21.19 2kc0 s ALA 53 CO 0.00 0.25 0.52 -1.83 0.00 0.00 0.00 175.76 174.70 2kc0 s GLU 54 N -3.77 0.88 0.04 0.00 -1.05 -1.26 -1.38 118.70 112.16 2kc0 s GLU 54 Ca 0.38 0.09 0.02 0.00 -0.15 0.00 0.00 54.97 55.31 2kc0 s GLU 54 Cb -0.10 0.41 -0.02 0.00 -0.44 0.00 0.00 34.13 33.97 2kc0 s GLU 54 CO 0.31 -0.26 -0.07 0.21 0.95 0.00 0.00 175.26 176.40 2kc0 s LYS 55 N -1.18 0.50 -0.39 -4.83 2.20 0.15 -4.87 119.74 111.32 2kc0 s LYS 55 Ca -0.12 -0.73 0.03 0.00 -0.36 0.00 0.00 55.97 54.79 2kc0 s LYS 55 Cb -0.02 -0.25 0.11 0.00 -1.51 0.00 0.00 37.83 36.16 2kc0 s LYS 55 CO 0.07 0.04 0.13 0.99 -0.36 0.00 0.00 175.35 176.22 2kc0 s THR 56 N -1.36 2.55 0.23 3.43 2.01 -1.26 -1.22 115.64 120.01 2kc0 s THR 56 Ca -0.10 -2.51 -0.10 0.00 0.31 0.00 0.00 61.69 59.29 2kc0 s THR 56 Cb -0.10 -2.83 -0.07 0.00 0.01 0.00 0.00 72.50 69.51 2kc0 s THR 56 CO 0.00 -0.66 0.55 -0.31 -0.69 0.00 0.00 174.62 173.51 2kc0 s TYR 57 N 0.68 3.43 0.17 4.92 2.02 0.04 -4.93 117.35 123.68 2kc0 s TYR 57 Ca 0.12 0.88 -0.20 0.00 -0.37 0.00 0.00 57.07 57.51 2kc0 s TYR 57 Cb -0.21 -2.27 0.05 0.00 -0.40 0.00 0.00 41.96 39.13 2kc0 s TYR 57 CO -0.06 0.28 0.54 0.20 -1.57 0.00 0.00 175.55 174.94 2kc0 s GLY 58 N -2.33 -0.36 0.00 0.71 0.00 -1.26 -1.25 107.32 102.83 2kc0 s GLY 58 Ca 0.47 0.11 0.00 0.00 0.00 0.00 0.00 44.72 45.30 2kc0 s GLY 58 CO 0.21 -0.09 0.00 0.70 0.00 0.00 0.00 173.10 173.92 2kc0 n ASN 59 N -0.34 0.00 0.00 1.64 3.02 -1.26 -4.58 115.26 113.75 2kc0 n ASN 59 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 2kc0 n ASN 59 Cb 0.64 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.81 2kc0 n ASN 59 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2kc0 n GLY 60 N 0.00 3.85 0.00 7.41 0.00 -1.26 -4.15 105.19 111.04 2kc0 n GLY 60 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 0.53 -3.59 1.61 2.03 -1.17 -5.00 116.55 110.97 2kc0 n ASP 61 Ca 0.00 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.23 2kc0 n ASP 61 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 2kc0 n ASP 61 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2kc0 s SER 62 N 1.38 -0.36 -0.01 1.67 1.04 -1.26 -0.89 113.70 115.27 2kc0 s SER 62 Ca 0.00 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.26 2kc0 s SER 62 Cb 0.00 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.64 2kc0 s SER 62 CO 0.00 -0.87 -0.01 -0.22 0.98 0.00 0.00 173.24 173.12 2kc0 s LEU 63 N -2.72 1.60 0.05 2.42 0.20 0.09 -4.84 118.68 115.48 2kc0 s LEU 63 Ca 0.06 -0.03 -0.30 0.00 0.69 0.00 0.00 54.13 54.55 2kc0 s LEU 63 Cb -0.02 -0.16 -0.05 0.00 -0.43 0.00 0.00 46.19 45.54 2kc0 s LEU 63 CO -0.05 -0.03 1.07 0.20 -0.29 0.00 0.00 176.35 177.25 2kc0 s ASN 64 N 0.46 7.26 -0.37 3.68 0.01 -1.26 -0.86 114.94 123.86 2kc0 s ASN 64 Ca -0.04 1.85 0.13 0.00 -0.71 0.00 0.00 52.86 54.08 2kc0 s ASN 64 Cb -0.07 -2.58 0.39 0.00 0.41 0.00 0.00 41.25 39.40 2kc0 s ASN 64 CO -0.01 -0.32 0.99 1.07 -1.51 0.00 0.00 177.10 177.32 2kc0 n THR 65 N 3.68 0.29 -0.69 1.60 5.66 -0.49 -4.91 114.28 119.43 2kc0 n THR 65 Ca 0.07 -2.97 -0.24 0.00 -3.05 0.00 0.00 64.05 57.85 2kc0 n THR 65 Cb 0.49 0.59 0.12 0.00 -1.55 0.00 0.00 70.33 69.97 2kc0 n THR 65 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kc0 n GLY 66 N 0.01 -2.44 2.10 1.09 0.00 -0.54 -4.17 105.19 101.24 2kc0 n GLY 66 Ca 0.11 -0.58 -0.17 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.61 2.27 0.07 1.61 4.81 -1.26 -4.69 118.16 120.36 2kc0 n LYS 67 Ca 0.02 -1.32 0.11 0.00 -0.87 0.00 0.00 58.31 56.26 2kc0 n LYS 67 Cb 0.48 -2.11 -0.00 0.00 0.02 0.00 0.00 35.03 33.41 2kc0 n LYS 67 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 2kc0 n LEU 68 N 2.42 0.67 -3.88 3.14 -0.00 -1.26 -4.99 117.00 113.10 2kc0 n LEU 68 Ca 0.48 0.21 -0.09 0.00 -0.00 0.00 0.00 56.01 56.60 2kc0 n LEU 68 Cb 0.79 -0.07 -0.05 0.00 -0.00 0.00 0.00 43.42 44.10 2kc0 n LEU 68 CO 0.23 -0.10 0.22 -0.54 -0.00 0.00 0.00 177.39 177.20 2kc0 s LYS 69 N -3.33 1.46 0.00 1.47 -0.14 -1.26 -5.12 119.74 112.81 2kc0 s LYS 69 Ca -0.00 -1.07 0.00 0.00 -1.36 0.00 0.00 55.97 53.54 2kc0 s LYS 69 Cb 0.11 0.49 0.00 0.00 -1.68 0.00 0.00 37.83 36.76 2kc0 s LYS 69 CO 0.80 -0.61 0.91 0.09 -0.76 0.00 0.00 175.35 175.78 2kc0 n ASN 70 N -0.35 0.00 -2.73 2.83 3.02 -1.26 -3.77 115.26 113.00 2kc0 n ASN 70 Ca -0.06 0.91 -0.07 0.00 -0.03 0.00 0.00 54.58 55.33 2kc0 n ASN 70 Cb 0.62 -0.41 0.06 0.00 -0.61 0.00 0.00 39.78 39.44 2kc0 n ASN 70 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2kc0 n ASP 71 N -1.79 -2.43 -4.19 6.41 5.68 -1.25 -1.30 116.55 117.68 2kc0 n ASP 71 Ca 0.00 -2.91 -0.14 0.00 -0.50 0.00 0.00 54.79 51.24 2kc0 n ASP 71 Cb 0.00 1.54 -0.11 0.00 -1.14 0.00 0.00 41.12 41.42 2kc0 n ASP 71 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 2kc0 s LYS 72 N 0.51 0.89 0.12 0.11 -2.85 -0.49 -4.97 119.74 113.06 2kc0 s LYS 72 Ca 0.30 -1.23 -0.24 0.00 -1.00 0.00 0.00 55.97 53.79 2kc0 s LYS 72 Cb 0.23 -0.52 -0.07 0.00 -2.06 0.00 0.00 37.83 35.41 2kc0 s LYS 72 CO -0.19 0.07 0.74 0.14 0.10 0.00 0.00 175.35 176.21 2kc0 s VAL 73 N -2.73 4.52 0.14 1.79 -7.23 -1.26 -0.10 120.40 115.53 2kc0 s VAL 73 Ca 0.08 1.61 -0.03 0.00 -1.81 0.00 0.00 61.98 61.84 2kc0 s VAL 73 Cb -0.01 -4.10 -0.05 0.00 0.56 0.00 0.00 36.38 32.78 2kc0 s VAL 73 CO -0.00 0.48 0.34 -0.44 -0.31 0.00 0.00 175.10 175.17 2kc0 s SER 74 N -0.82 6.43 -0.11 4.85 0.01 0.13 -4.93 113.70 119.27 2kc0 s SER 74 Ca 0.36 0.46 -0.13 0.00 1.31 0.00 0.00 55.95 57.95 2kc0 s SER 74 Cb -0.22 -2.04 -0.05 0.00 0.21 0.00 0.00 66.02 63.93 2kc0 s SER 74 CO 0.24 0.05 0.30 0.00 0.41 0.00 0.00 173.24 174.24 2kc0 s ARG 75 N -2.80 4.02 0.01 12.44 3.03 -1.26 -2.00 118.95 132.39 2kc0 s ARG 75 Ca 0.39 0.14 -0.05 0.00 2.03 0.00 0.00 55.73 58.24 2kc0 s ARG 75 Cb -0.12 -3.33 -0.01 0.00 -1.03 0.00 0.00 34.95 30.46 2kc0 s ARG 75 CO 0.27 0.45 0.08 -0.06 -1.13 0.00 0.00 175.30 174.91 2kc0 s PHE 76 N -0.20 0.12 0.03 5.89 0.08 -0.81 -4.94 117.98 118.15 2kc0 s PHE 76 Ca 0.18 -0.29 0.08 0.00 0.12 0.00 0.00 56.93 57.02 2kc0 s PHE 76 Cb -0.14 -0.10 -0.03 0.00 -0.57 0.00 0.00 43.02 42.19 2kc0 s PHE 76 CO 0.06 -0.27 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.17 2kc0 s ASP 77 N -1.50 2.77 0.07 1.36 1.11 -1.07 -2.16 116.67 117.25 2kc0 s ASP 77 Ca -0.14 -0.53 -0.06 0.00 0.18 0.00 0.00 52.55 52.00 2kc0 s ASP 77 Cb -0.07 -0.25 -0.02 0.00 1.07 0.00 0.00 42.92 43.65 2kc0 s ASP 77 CO 0.00 0.22 0.11 0.72 1.18 0.00 0.00 175.17 177.40 2kc0 s PHE 78 N -0.75 0.28 0.07 4.23 -0.12 -0.65 -1.41 117.98 119.63 2kc0 s PHE 78 Ca 0.09 -0.75 0.02 0.00 -0.05 0.00 0.00 56.93 56.25 2kc0 s PHE 78 Cb -0.09 -0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.09 2kc0 s PHE 78 CO 0.01 -0.48 -0.08 0.96 -0.05 0.00 0.00 175.22 175.58 2kc0 s ILE 79 N -3.83 0.69 -0.26 -4.49 -4.36 -0.52 -1.27 121.20 107.16 2kc0 s ILE 79 Ca 0.05 -1.49 -0.04 0.00 -0.26 0.00 0.00 60.65 58.91 2kc0 s ILE 79 Cb 0.06 -1.14 0.01 0.00 1.25 0.00 0.00 42.46 42.64 2kc0 s ILE 79 CO -0.10 -0.58 -0.00 -0.13 0.24 0.00 0.00 174.94 174.37 2kc0 s ARG 80 N -2.60 3.00 -0.14 0.37 0.52 -0.74 -1.23 118.95 118.13 2kc0 s ARG 80 Ca 0.01 -0.89 -0.11 0.00 -0.52 0.00 0.00 55.73 54.23 2kc0 s ARG 80 Cb -0.03 -3.15 -0.05 0.00 0.52 0.00 0.00 34.95 32.24 2kc0 s ARG 80 CO -0.01 -0.39 0.21 -1.14 0.02 0.00 0.00 175.30 173.98 2kc0 s GLN 81 N 1.41 3.93 -0.17 3.54 -0.44 0.29 -4.27 119.66 123.96 2kc0 s GLN 81 Ca 0.02 -0.04 -0.23 0.00 -2.50 0.00 0.00 55.36 52.60 2kc0 s GLN 81 Cb -0.17 -3.32 0.06 0.00 -1.64 0.00 0.00 33.01 27.94 2kc0 s GLN 81 CO -0.01 0.49 0.61 -1.50 0.50 0.00 0.00 175.29 175.37 2kc0 s ILE 82 N -0.23 0.00 -0.13 -2.34 2.07 -1.19 -0.87 121.20 118.51 2kc0 s ILE 82 Ca 0.14 -0.04 -0.05 0.00 -1.41 0.00 0.00 60.65 59.29 2kc0 s ILE 82 Cb -0.12 -0.88 -0.15 0.00 0.13 0.00 0.00 42.46 41.44 2kc0 s ILE 82 CO 0.03 -0.02 3.26 1.21 -1.91 0.00 0.00 174.94 177.51 2kc0 n GLU 83 N 2.16 2.05 -1.67 3.50 2.13 -1.26 -3.85 120.64 123.69 2kc0 n GLU 83 Ca -0.16 -1.33 -0.46 0.00 0.66 0.00 0.00 57.16 55.87 2kc0 n GLU 83 Cb 0.56 -1.97 -0.04 0.00 0.27 0.00 0.00 31.44 30.26 2kc0 n GLU 83 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 2kc0 n VAL 84 N 1.93 0.14 -0.84 6.31 0.24 -1.03 -1.96 118.33 123.12 2kc0 n VAL 84 Ca 0.42 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.69 2kc0 n VAL 84 Cb 0.78 -1.64 0.00 0.00 -1.47 0.00 0.00 33.84 31.52 2kc0 n VAL 84 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2kc0 n ASP 85 N 4.19 -4.93 0.00 -1.34 2.03 -1.26 -0.83 116.55 114.40 2kc0 n ASP 85 Ca 0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.49 2kc0 n ASP 85 Cb 0.29 -3.03 0.00 0.00 -0.72 0.00 0.00 41.12 37.67 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 0.77 0.83 3.27 0.27 0.00 -0.83 -5.11 105.19 104.40 2kc0 n GLY 86 Ca 0.00 -0.63 -0.18 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.61 1.11 -0.57 1.61 -1.52 -0.01 -5.13 119.66 112.55 2kc0 s GLN 87 Ca 0.00 -1.35 -0.07 0.00 -1.95 0.00 0.00 55.36 51.99 2kc0 s GLN 87 Cb 0.00 -0.96 0.15 0.00 -0.22 0.00 0.00 33.01 31.98 2kc0 s GLN 87 CO 0.00 0.17 0.42 -0.51 -0.25 0.00 0.00 175.29 175.13 2kc0 s LEU 88 N -2.73 5.66 -0.14 2.90 1.02 -1.26 -2.48 118.68 121.65 2kc0 s LEU 88 Ca 0.13 -2.36 -0.02 0.00 0.02 0.00 0.00 54.13 51.90 2kc0 s LEU 88 Cb -0.03 -1.97 -0.02 0.00 0.02 0.00 0.00 46.19 44.19 2kc0 s LEU 88 CO 0.04 -0.55 -0.08 -0.63 0.02 0.00 0.00 176.35 175.15 2kc0 s ILE 89 N 0.68 3.51 -0.02 -0.59 1.01 -1.25 -5.00 121.20 119.54 2kc0 s ILE 89 Ca 0.12 -0.50 0.03 0.00 0.00 0.00 0.00 60.65 60.30 2kc0 s ILE 89 Cb -0.21 -2.51 0.05 0.00 0.01 0.00 0.00 42.46 39.79 2kc0 s ILE 89 CO -0.03 0.51 0.92 1.07 0.00 0.00 0.00 174.94 177.41 2kc0 n THR 90 N 3.50 0.35 -1.20 2.92 5.66 -1.26 -3.18 114.28 121.07 2kc0 n THR 90 Ca -0.18 -0.41 -0.28 0.00 -3.05 0.00 0.00 64.05 60.13 2kc0 n THR 90 Cb 0.53 0.48 0.13 0.00 -1.55 0.00 0.00 70.33 69.92 2kc0 n THR 90 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2kc0 n LEU 91 N -0.25 7.06 -4.45 1.09 4.77 -1.26 -4.22 117.00 119.74 2kc0 n LEU 91 Ca 0.03 -3.84 -0.43 0.00 -0.03 0.00 0.00 56.01 51.74 2kc0 n LEU 91 Cb 0.63 -0.90 -0.10 0.00 -2.33 0.00 0.00 43.42 40.71 2kc0 n LEU 91 CO 0.00 1.22 -0.07 -1.61 -1.33 0.00 0.00 177.39 175.60 2kc0 s GLU 92 N -3.38 2.96 -0.08 3.23 2.02 -1.26 -2.99 118.70 119.20 2kc0 s GLU 92 Ca 0.58 -1.04 0.05 0.00 0.02 0.00 0.00 54.97 54.58 2kc0 s GLU 92 Cb 0.47 -3.96 -0.01 0.00 0.10 0.00 0.00 34.13 30.73 2kc0 s GLU 92 CO 0.05 -0.75 -0.23 -1.54 0.02 0.00 0.00 175.26 172.81 2kc0 s SER 93 N 1.69 3.22 0.06 -0.19 1.04 -1.06 -1.79 113.70 116.67 2kc0 s SER 93 Ca 0.05 -0.50 -0.00 0.00 0.48 0.00 0.00 55.95 55.97 2kc0 s SER 93 Cb -0.19 -1.14 0.00 0.00 0.10 0.00 0.00 66.02 64.79 2kc0 s SER 93 CO 0.10 0.21 0.08 0.61 0.98 0.00 0.00 173.24 175.22 2kc0 n GLY 94 N 3.20 2.90 3.14 7.32 0.00 -0.39 -4.21 105.19 117.14 2kc0 n GLY 94 Ca -0.18 -1.39 -0.11 0.00 0.00 0.00 0.00 46.02 44.34 2kc0 n GLY 94 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kc0 s GLU 95 N -2.12 0.75 -0.32 1.61 -6.30 0.35 -1.64 118.70 111.02 2kc0 s GLU 95 Ca 0.05 -1.20 0.01 0.00 -2.50 0.00 0.00 54.97 51.33 2kc0 s GLU 95 Cb -0.00 -0.19 0.15 0.00 0.00 0.00 0.00 34.13 34.08 2kc0 s GLU 95 CO 0.03 -0.01 0.33 0.12 0.02 0.00 0.00 175.26 175.76 2kc0 s PHE 96 N -3.16 -0.44 -0.35 5.30 5.36 -0.92 -2.14 117.98 121.63 2kc0 s PHE 96 Ca 0.07 -0.38 -0.13 0.00 -0.96 0.00 0.00 56.93 55.53 2kc0 s PHE 96 Cb 0.02 -0.42 -0.01 0.00 -0.34 0.00 0.00 43.02 42.27 2kc0 s PHE 96 CO -0.04 -0.94 0.24 -0.65 -1.46 0.00 0.00 175.22 172.36 2kc0 s GLN 97 N 2.02 3.36 -0.34 10.12 -0.21 -1.09 -1.93 119.66 131.61 2kc0 s GLN 97 Ca 0.12 -0.73 -0.08 0.00 0.02 0.00 0.00 55.36 54.69 2kc0 s GLN 97 Cb -0.14 -3.80 0.03 0.00 1.00 0.00 0.00 33.01 30.10 2kc0 s GLN 97 CO -0.22 -0.50 0.12 0.08 -2.12 0.00 0.00 175.29 172.66 2kc0 s VAL 98 N 1.69 4.02 -0.46 1.09 1.01 -0.85 -2.58 120.40 124.33 2kc0 s VAL 98 Ca 0.06 -0.96 -0.29 0.00 0.00 0.00 0.00 61.98 60.79 2kc0 s VAL 98 Cb -0.18 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 33.01 2kc0 s VAL 98 CO 0.10 -0.13 1.24 -0.47 0.00 0.00 0.00 175.10 175.84 2kc0 s TYR 99 N 1.46 2.65 -0.52 5.22 6.14 0.15 -0.69 117.35 131.76 2kc0 s TYR 99 Ca 0.00 0.69 -0.17 0.00 0.64 0.00 0.00 57.07 58.24 2kc0 s TYR 99 Cb -0.19 -4.40 0.10 0.00 0.42 0.00 0.00 41.96 37.89 2kc0 s TYR 99 CO 0.04 -1.54 0.52 0.21 0.64 0.00 0.00 175.55 175.41 2kc0 s LYS 100 N 4.66 3.01 0.65 4.97 2.36 0.85 -2.25 119.74 133.99 2kc0 s LYS 100 Ca 0.53 -1.44 0.04 0.00 -2.55 0.00 0.00 55.97 52.55 2kc0 s LYS 100 Cb -0.09 -4.22 0.11 0.00 -1.05 0.00 0.00 37.83 32.57 2kc0 s LYS 100 CO 0.32 -1.26 0.89 -0.65 1.55 0.00 0.00 175.35 176.20 2kc0 s GLN 101 N 1.91 1.99 0.63 4.03 -0.21 -0.91 -1.39 119.66 125.71 2kc0 s GLN 101 Ca 0.06 -1.36 0.33 0.00 0.02 0.00 0.00 55.36 54.40 2kc0 s GLN 101 Cb -0.26 -2.49 1.80 0.00 1.00 0.00 0.00 33.01 33.07 2kc0 s GLN 101 CO 0.06 -1.15 2.08 1.03 -2.12 0.00 0.00 175.29 175.18 2kc0 h SER 102 N -0.18 0.00 0.00 5.90 0.87 -1.29 -3.39 113.55 115.47 2kc0 h SER 102 Ca -0.33 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 2kc0 h SER 102 Cb 1.28 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2kc0 h SER 102 CO 0.40 0.00 0.00 1.41 -0.53 0.00 0.00 176.83 178.11 2kc0 n HIS 103 N -3.33 -0.99 -1.16 2.24 8.25 -1.26 -4.86 115.22 114.12 2kc0 n HIS 103 Ca -0.00 0.17 -0.29 0.00 -0.26 0.00 0.00 57.72 57.34 2kc0 n HIS 103 Cb 0.32 0.63 0.19 0.00 1.12 0.00 0.00 29.99 32.25 2kc0 n HIS 103 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2kc0 s SER 104 N -3.97 2.33 0.01 0.41 0.01 -1.26 -4.83 113.70 106.41 2kc0 s SER 104 Ca 0.00 1.10 -0.29 0.00 1.31 0.00 0.00 55.95 58.07 2kc0 s SER 104 Cb 0.00 -1.72 0.07 0.00 0.21 0.00 0.00 66.02 64.59 2kc0 s SER 104 CO 0.00 -3.30 0.66 0.00 0.41 0.00 0.00 173.24 171.01 2kc0 s ALA 105 N -2.97 -1.72 0.04 1.44 0.00 -1.00 -2.14 121.76 115.41 2kc0 s ALA 105 Ca 0.66 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.69 2kc0 s ALA 105 Cb -0.18 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.18 2kc0 s ALA 105 CO 0.57 -0.49 -0.04 -0.48 0.00 0.00 0.00 175.76 175.32 2kc0 s LEU 106 N -1.68 2.34 0.27 0.00 0.05 -0.95 -2.25 118.68 116.46 2kc0 s LEU 106 Ca -0.07 -0.69 0.08 0.00 0.05 0.00 0.00 54.13 53.50 2kc0 s LEU 106 Cb -0.00 0.08 -0.04 0.00 -2.05 0.00 0.00 46.19 44.18 2kc0 s LEU 106 CO 0.03 -0.39 0.10 0.28 -0.55 0.00 0.00 176.35 175.81 2kc0 s THR 107 N -2.35 3.84 0.01 5.48 -1.32 -1.24 -0.68 115.64 119.39 2kc0 s THR 107 Ca -0.06 -1.67 0.00 0.00 -1.21 0.00 0.00 61.69 58.75 2kc0 s THR 107 Cb -0.03 -3.10 -0.01 0.00 -1.51 0.00 0.00 72.50 67.85 2kc0 s THR 107 CO -0.04 -0.35 -0.02 0.00 -2.21 0.00 0.00 174.62 172.00 2kc0 s ALA 108 N -2.25 0.11 0.05 11.08 0.00 -1.06 -1.15 121.76 128.53 2kc0 s ALA 108 Ca 0.33 -0.31 -0.00 0.00 0.00 0.00 0.00 51.96 51.97 2kc0 s ALA 108 Cb -0.07 0.06 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 2kc0 s ALA 108 CO 0.22 -0.06 0.20 -0.06 0.00 0.00 0.00 175.76 176.06 2kc0 s PHE 109 N -0.71 3.50 -0.07 0.00 0.40 -0.38 -2.66 117.98 118.07 2kc0 s PHE 109 Ca -0.07 0.26 -0.08 0.00 -0.60 0.00 0.00 56.93 56.43 2kc0 s PHE 109 Cb -0.05 -1.76 0.02 0.00 0.51 0.00 0.00 43.02 41.74 2kc0 s PHE 109 CO -0.00 0.59 0.22 -1.14 0.70 0.00 0.00 175.22 175.59 2kc0 s GLN 110 N -2.41 0.31 -0.14 0.44 -0.44 -0.91 -2.29 119.66 114.23 2kc0 s GLN 110 Ca 0.33 0.20 -0.09 0.00 -2.50 0.00 0.00 55.36 53.31 2kc0 s GLN 110 Cb -0.13 0.15 0.05 0.00 -1.64 0.00 0.00 33.01 31.43 2kc0 s GLN 110 CO 0.26 -0.05 0.34 -0.08 0.50 0.00 0.00 175.29 176.26 2kc0 s THR 111 N -0.14 -0.02 0.00 -0.34 -1.32 -1.21 -0.50 115.64 112.12 2kc0 s THR 111 Ca -0.02 0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.53 2kc0 s THR 111 Cb -0.02 -0.50 0.00 0.00 -1.51 0.00 0.00 72.50 70.47 2kc0 s THR 111 CO 0.01 0.03 0.00 -0.62 -2.21 0.00 0.00 174.62 171.83 2kc0 n GLU 112 N 3.75 5.30 -3.60 7.08 1.02 -1.26 -2.10 120.64 130.84 2kc0 n GLU 112 Ca -0.20 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.70 2kc0 n GLU 112 Cb 0.55 -0.41 -0.16 0.00 -0.02 0.00 0.00 31.44 31.40 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 -0.81 0.06 -0.04 3.49 -2.07 -1.26 -4.45 119.66 114.59 2kc0 s GLN 113 Ca 0.00 0.02 -0.09 0.00 -1.82 0.00 0.00 55.36 53.46 2kc0 s GLN 113 Cb 0.00 -1.58 0.01 0.00 -1.09 0.00 0.00 33.01 30.35 2kc0 s GLN 113 CO 0.00 -0.63 0.22 -1.50 -1.32 0.00 0.00 175.29 172.06 2kc0 s ILE 114 N 2.17 0.05 0.82 3.63 2.07 -1.12 -2.56 121.20 126.26 2kc0 s ILE 114 Ca 0.03 -0.38 -0.12 0.00 -1.41 0.00 0.00 60.65 58.77 2kc0 s ILE 114 Cb -0.15 -0.44 0.08 0.00 0.13 0.00 0.00 42.46 42.08 2kc0 s ILE 114 CO -0.09 -0.21 1.14 -1.10 -1.91 0.00 0.00 174.94 172.77 2kc0 s GLN 115 N -0.81 1.92 -0.03 3.50 -0.21 -1.16 -1.54 119.66 121.34 2kc0 s GLN 115 Ca -0.09 0.32 0.05 0.00 0.02 0.00 0.00 55.36 55.65 2kc0 s GLN 115 Cb -0.05 -1.93 -0.01 0.00 1.00 0.00 0.00 33.01 32.03 2kc0 s GLN 115 CO 0.02 -1.66 -0.17 -0.51 -2.12 0.00 0.00 175.29 170.85 2kc0 s ASP 116 N -4.27 2.01 -0.02 5.90 1.01 0.31 -4.79 116.67 116.83 2kc0 s ASP 116 Ca 0.62 -0.32 0.08 0.00 0.71 0.00 0.00 52.55 53.64 2kc0 s ASP 116 Cb -0.13 -0.38 0.27 0.00 1.01 0.00 0.00 42.92 43.69 2kc0 s ASP 116 CO 0.52 0.18 1.17 -1.20 0.21 0.00 0.00 175.17 176.04 2kc0 n SER 117 N 2.90 1.79 0.02 0.27 7.64 -1.26 -2.60 113.62 122.39 2kc0 n SER 117 Ca -0.16 -2.07 -0.12 0.00 1.01 0.00 0.00 58.87 57.53 2kc0 n SER 117 Cb 0.54 -0.27 -0.09 0.00 -1.01 0.00 0.00 64.21 63.38 2kc0 n SER 117 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2kc0 h GLU 118 N 1.66 -0.13 -0.30 1.43 5.08 -1.97 -3.24 114.58 117.12 2kc0 h GLU 118 Ca 0.00 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2kc0 h GLU 118 Cb 0.52 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2kc0 h GLU 118 CO 0.04 0.37 0.01 1.58 -1.00 0.00 0.00 179.01 180.01 2kc0 n HIS 119 N -4.88 1.06 -3.71 4.33 -0.00 -1.26 -5.00 115.22 105.76 2kc0 n HIS 119 Ca -0.08 -0.94 -0.27 0.00 0.46 0.00 0.00 57.72 56.89 2kc0 n HIS 119 Cb 0.28 -0.35 0.03 0.00 -0.12 0.00 0.00 29.99 29.83 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 -0.50 -3.40 0.00 0.26 2.88 -1.22 -4.65 113.62 107.00 2kc0 n SER 120 Ca 0.23 -0.94 0.00 0.00 -1.33 0.00 0.00 58.87 56.83 2kc0 n SER 120 Cb 0.94 -3.62 0.00 0.00 -0.75 0.00 0.00 64.21 60.78 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 -1.68 0.00 3.95 0.46 0.00 -1.24 -5.07 105.19 101.61 2kc0 n GLY 121 Ca -0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 2.47 0.18 1.61 -0.14 -1.07 -4.96 119.74 117.83 2kc0 s LYS 122 Ca 0.00 -0.54 -0.23 0.00 -1.36 0.00 0.00 55.97 53.84 2kc0 s LYS 122 Cb 0.00 -2.37 0.06 0.00 -1.68 0.00 0.00 37.83 33.84 2kc0 s LYS 122 CO 0.00 -0.87 0.63 0.00 -0.76 0.00 0.00 175.35 174.34 2kc0 s MET 123 N -4.93 1.39 0.15 1.68 0.23 -1.26 -0.53 119.30 116.03 2kc0 s MET 123 Ca 0.58 -0.58 -0.25 0.00 -1.03 0.00 0.00 55.69 54.41 2kc0 s MET 123 Cb -0.10 0.59 0.06 0.00 -1.53 0.00 0.00 34.83 33.85 2kc0 s MET 123 CO 0.41 -0.61 0.93 0.54 -2.03 0.00 0.00 175.02 174.25 2kc0 s VAL 124 N -3.78 0.00 -0.75 5.16 0.11 -0.59 -4.87 120.40 115.68 2kc0 s VAL 124 Ca 0.03 -0.63 0.03 0.00 -2.93 0.00 0.00 61.98 58.47 2kc0 s VAL 124 Cb -0.02 -1.90 0.18 0.00 -1.53 0.00 0.00 36.38 33.11 2kc0 s VAL 124 CO -0.09 0.00 0.56 0.00 -3.33 0.00 0.00 175.10 172.24 2kc0 s ALA 125 N -3.34 3.91 -0.30 1.54 0.00 -1.26 -2.77 121.76 119.53 2kc0 s ALA 125 Ca 0.11 -3.79 -0.20 0.00 0.00 0.00 0.00 51.96 48.08 2kc0 s ALA 125 Cb -0.02 -2.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.71 2kc0 s ALA 125 CO 0.02 -2.11 0.63 0.15 0.00 0.00 0.00 175.76 174.45 2kc0 s LYS 126 N -1.30 3.93 -1.24 0.00 3.01 -1.26 -5.00 119.74 117.87 2kc0 s LYS 126 Ca 0.25 0.33 -0.19 0.00 -1.01 0.00 0.00 55.97 55.34 2kc0 s LYS 126 Cb -0.07 -3.72 -0.00 0.00 -1.01 0.00 0.00 37.83 33.03 2kc0 s LYS 126 CO -0.14 -0.55 1.89 0.54 0.51 0.00 0.00 175.35 177.60 2kc0 n ARG 127 N 5.86 2.52 -2.20 1.68 1.74 -1.26 -4.50 116.66 120.50 2kc0 n ARG 127 Ca -0.01 -2.80 -0.42 0.00 -0.77 0.00 0.00 57.85 53.85 2kc0 n ARG 127 Cb 0.49 -3.48 0.00 0.00 -1.02 0.00 0.00 32.46 28.45 2kc0 n ARG 127 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2kc0 n GLN 128 N 7.88 3.56 -2.82 5.56 7.27 -0.89 -4.96 117.38 132.97 2kc0 n GLN 128 Ca 0.48 -3.35 -0.42 0.00 0.07 0.00 0.00 57.00 53.79 2kc0 n GLN 128 Cb 0.45 -2.96 -0.04 0.00 2.41 0.00 0.00 30.24 30.10 2kc0 n GLN 128 CO 0.00 0.00 0.00 0.12 0.07 0.00 0.00 177.06 177.25 2kc0 s PHE 129 N 0.77 3.39 0.02 3.69 2.19 -1.26 -3.30 117.98 123.49 2kc0 s PHE 129 Ca 0.42 1.31 -0.04 0.00 0.33 0.00 0.00 56.93 58.95 2kc0 s PHE 129 Cb 0.11 -3.09 -0.01 0.00 -1.31 0.00 0.00 43.02 38.72 2kc0 s PHE 129 CO -0.02 -0.31 0.07 1.03 1.83 0.00 0.00 175.22 177.81 2kc0 s ARG 130 N 2.47 0.49 0.55 10.12 1.81 -0.97 -4.72 118.95 128.69 2kc0 s ARG 130 Ca 0.40 -0.65 -0.18 0.00 -1.72 0.00 0.00 55.73 53.58 2kc0 s ARG 130 Cb -0.16 0.19 -0.06 0.00 -0.45 0.00 0.00 34.95 34.47 2kc0 s ARG 130 CO 0.11 -0.11 1.05 -1.50 -0.68 0.00 0.00 175.30 174.17 2kc0 s ILE 131 N -2.06 3.81 0.23 1.52 1.10 -1.26 -1.25 121.20 123.29 2kc0 s ILE 131 Ca -0.10 0.97 0.01 0.00 -0.51 0.00 0.00 60.65 61.03 2kc0 s ILE 131 Cb -0.05 -3.42 0.01 0.00 0.15 0.00 0.00 42.46 39.16 2kc0 s ILE 131 CO -0.02 -0.40 0.12 0.61 -2.11 0.00 0.00 174.94 173.14 2kc0 n GLY 132 N -0.68 3.26 3.74 1.50 0.00 -0.30 -4.73 105.19 107.97 2kc0 n GLY 132 Ca 0.09 -2.24 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 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 -2.33 7.14 -0.57 1.61 1.11 -1.26 -4.72 116.67 117.64 2kc0 s ASP 133 Ca 0.09 2.22 -0.19 0.00 0.18 0.00 0.00 52.55 54.85 2kc0 s ASP 133 Cb -0.01 -2.61 0.09 0.00 1.07 0.00 0.00 42.92 41.46 2kc0 s ASP 133 CO 0.06 -0.32 0.69 -0.63 1.18 0.00 0.00 175.17 176.15 2kc0 s ILE 134 N -0.26 4.82 -0.11 0.77 -1.09 -1.26 -3.63 121.20 120.44 2kc0 s ILE 134 Ca 0.51 -0.83 -0.05 0.00 -2.23 0.00 0.00 60.65 58.04 2kc0 s ILE 134 Cb -0.32 -4.44 -0.04 0.00 -1.58 0.00 0.00 42.46 36.08 2kc0 s ILE 134 CO 0.37 -1.04 0.10 0.00 -1.23 0.00 0.00 174.94 173.14 2kc0 s ALA 135 N 2.71 3.71 0.00 9.38 0.00 -0.95 -5.05 121.76 131.56 2kc0 s ALA 135 Ca 0.13 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.40 2kc0 s ALA 135 Cb -0.23 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.07 2kc0 s ALA 135 CO 0.08 0.61 0.00 0.41 0.00 0.00 0.00 175.76 176.86 2kc0 n GLY 136 N 2.01 0.46 3.51 0.00 0.00 -1.26 -2.36 105.19 107.55 2kc0 n GLY 136 Ca -0.19 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 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 3.56 0.18 1.61 2.02 -1.26 -4.99 118.70 117.82 2kc0 s GLU 137 Ca 0.00 -1.35 -0.31 0.00 0.02 0.00 0.00 54.97 53.33 2kc0 s GLU 137 Cb 0.00 -5.10 -0.10 0.00 0.10 0.00 0.00 34.13 29.03 2kc0 s GLU 137 CO 0.00 -2.01 1.52 -1.01 0.02 0.00 0.00 175.26 173.78 2kc0 s HIS 138 N 4.01 3.08 -0.02 1.61 3.76 -1.26 -0.46 115.29 126.01 2kc0 s HIS 138 Ca 0.39 0.76 0.02 0.00 -0.15 0.00 0.00 55.06 56.08 2kc0 s HIS 138 Cb -0.03 -3.87 0.00 0.00 1.11 0.00 0.00 32.58 29.79 2kc0 s HIS 138 CO -0.08 -3.12 -0.07 0.95 -0.85 0.00 0.00 174.74 171.56 2kc0 s THR 139 N 0.88 0.60 0.28 1.30 -4.23 -1.26 -4.87 115.64 108.35 2kc0 s THR 139 Ca 0.67 -0.28 -0.30 0.00 -1.18 0.00 0.00 61.69 60.60 2kc0 s THR 139 Cb -0.42 -0.53 -0.13 0.00 1.34 0.00 0.00 72.50 72.76 2kc0 s THR 139 CO 0.34 0.19 1.40 -1.20 -0.54 0.00 0.00 174.62 174.81 2kc0 n SER 140 N 3.19 2.93 0.20 3.99 7.64 -1.11 -4.08 113.62 126.38 2kc0 n SER 140 Ca -0.17 1.16 0.08 0.00 1.01 0.00 0.00 58.87 60.96 2kc0 n SER 140 Cb 0.56 -1.47 0.25 0.00 -1.01 0.00 0.00 64.21 62.54 2kc0 n SER 140 CO 0.00 0.00 0.00 2.19 -3.01 0.00 0.00 175.04 174.22 2kc0 h PHE 141 N 3.76 0.00 0.00 1.43 -0.00 -1.92 -2.98 116.94 117.23 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 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.22 2kc0 h PHE 141 CO 0.55 0.24 0.00 -0.25 -0.00 0.00 0.00 178.31 178.85 2kc0 n ASP 142 N -3.23 0.00 -0.66 -0.68 9.92 -1.26 -2.30 116.55 118.33 2kc0 n ASP 142 Ca 0.02 -0.03 0.08 0.00 -0.53 0.00 0.00 54.79 54.33 2kc0 n ASP 142 Cb 0.55 -0.19 0.08 0.00 -0.64 0.00 0.00 41.12 40.92 2kc0 n ASP 142 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2kc0 n LYS 143 N -1.19 1.35 -3.86 -1.24 4.76 -1.12 -4.97 118.16 111.88 2kc0 n LYS 143 Ca 0.06 -1.52 -0.36 0.00 -2.87 0.00 0.00 58.31 53.62 2kc0 n LYS 143 Cb 0.07 -1.31 -0.06 0.00 -1.84 0.00 0.00 35.03 31.89 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 -1.29 4.39 0.63 -0.35 1.02 -0.97 -4.99 118.68 117.11 2kc0 s LEU 144 Ca 0.20 0.47 -0.15 0.00 0.02 0.00 0.00 54.13 54.67 2kc0 s LEU 144 Cb 0.14 -2.23 -0.02 0.00 0.02 0.00 0.00 46.19 44.09 2kc0 s LEU 144 CO 0.20 0.37 1.09 -2.16 0.02 0.00 0.00 176.35 175.86 2kc0 s PRO 145 N -1.26 3.05 -0.35 1.29 0.04 -1.26 -4.96 135.00 131.55 2kc0 s PRO 145 Ca 0.19 1.30 -0.02 0.00 0.04 0.00 0.00 61.00 62.51 2kc0 s PRO 145 Cb -0.12 -1.99 0.19 0.00 0.04 0.00 0.00 34.50 32.61 2kc0 s PRO 145 CO 0.08 -1.04 2.19 -1.91 0.04 0.00 0.00 177.00 176.36 2kc0 n GLU 146 N -2.23 1.96 0.00 4.56 2.13 -1.26 -4.65 120.64 121.14 2kc0 n GLU 146 Ca 0.10 -1.78 0.00 0.00 0.66 0.00 0.00 57.16 56.14 2kc0 n GLU 146 Cb 0.52 -1.75 0.00 0.00 0.27 0.00 0.00 31.44 30.48 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 0.44 0.56 0.00 8.31 0.00 -1.26 -4.80 105.19 108.44 2kc0 n GLY 147 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 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 2.18 0.31 3.38 -0.02 0.00 -1.26 -4.76 105.19 105.02 2kc0 n GLY 148 Ca 0.00 0.23 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 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 0.75 1.41 -0.19 1.61 3.03 -1.26 -0.70 118.95 123.60 2kc0 s ARG 149 Ca 0.00 -1.65 0.00 0.00 2.03 0.00 0.00 55.73 56.11 2kc0 s ARG 149 Cb 0.00 -1.20 0.05 0.00 -1.03 0.00 0.00 34.95 32.77 2kc0 s ARG 149 CO 0.00 0.17 -0.06 0.00 -1.13 0.00 0.00 175.30 174.28 2kc0 s ALA 150 N -2.93 1.70 0.32 7.88 0.00 -0.20 -4.81 121.76 123.72 2kc0 s ALA 150 Ca 0.25 -1.04 -0.27 0.00 0.00 0.00 0.00 51.96 50.89 2kc0 s ALA 150 Cb -0.00 -1.24 -0.09 0.00 0.00 0.00 0.00 23.12 21.79 2kc0 s ALA 150 CO 0.09 -0.90 1.03 0.99 0.00 0.00 0.00 175.76 176.96 2kc0 s THR 151 N 1.53 3.80 0.03 0.00 2.01 -1.26 -2.25 115.64 119.49 2kc0 s THR 151 Ca -0.01 1.60 -0.02 0.00 0.31 0.00 0.00 61.69 63.57 2kc0 s THR 151 Cb -0.16 -3.94 -0.02 0.00 0.01 0.00 0.00 72.50 68.39 2kc0 s THR 151 CO -0.08 0.23 0.01 -0.31 -0.69 0.00 0.00 174.62 173.78 2kc0 s TYR 152 N -1.41 0.28 -0.15 4.92 2.02 -0.40 -4.58 117.35 118.01 2kc0 s TYR 152 Ca 0.49 -0.59 -0.00 0.00 -0.37 0.00 0.00 57.07 56.60 2kc0 s TYR 152 Cb -0.25 -0.21 -0.01 0.00 -0.40 0.00 0.00 41.96 41.10 2kc0 s TYR 152 CO 0.32 -0.27 -0.14 0.50 -1.57 0.00 0.00 175.55 174.40 2kc0 s ARG 153 N -2.13 3.28 0.26 -0.62 6.06 -0.56 -2.62 118.95 122.62 2kc0 s ARG 153 Ca -0.10 -0.72 0.06 0.00 -2.50 0.00 0.00 55.73 52.48 2kc0 s ARG 153 Cb -0.05 -2.66 -0.06 0.00 0.06 0.00 0.00 34.95 32.24 2kc0 s ARG 153 CO -0.03 0.05 -0.06 0.20 -2.50 0.00 0.00 175.30 172.96 2kc0 s GLY 154 N 0.75 1.73 -0.02 8.12 0.00 -0.09 -1.96 107.32 115.86 2kc0 s GLY 154 Ca -0.06 -1.85 0.07 0.00 0.00 0.00 0.00 44.72 42.89 2kc0 s GLY 154 CO 0.01 -1.80 -0.24 -1.59 0.00 0.00 0.00 173.10 169.48 2kc0 s THR 155 N -3.07 1.90 -0.15 0.90 2.01 0.07 -2.56 115.64 114.74 2kc0 s THR 155 Ca 0.28 -1.03 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 2kc0 s THR 155 Cb 0.03 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.95 2kc0 s THR 155 CO 0.11 0.54 -0.11 0.00 -0.69 0.00 0.00 174.62 174.46 2kc0 s ALA 156 N -0.57 2.68 -0.10 7.40 0.00 -1.26 -2.97 121.76 126.95 2kc0 s ALA 156 Ca 0.09 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 2kc0 s ALA 156 Cb -0.09 -1.33 0.03 0.00 0.00 0.00 0.00 23.12 21.73 2kc0 s ALA 156 CO -0.01 0.13 -0.01 -0.59 0.00 0.00 0.00 175.76 175.28 2kc0 s PHE 157 N 0.55 0.88 0.12 0.00 -0.71 -1.16 -4.34 117.98 113.32 2kc0 s PHE 157 Ca -0.07 -0.38 -0.23 0.00 -1.04 0.00 0.00 56.93 55.21 2kc0 s PHE 157 Cb -0.15 -0.92 0.06 0.00 -1.21 0.00 0.00 43.02 40.80 2kc0 s PHE 157 CO 0.03 -0.40 0.58 0.20 -1.34 0.00 0.00 175.22 174.29 2kc0 s GLY 158 N 1.90 -0.56 -1.54 1.99 0.00 -1.26 -1.29 107.32 106.56 2kc0 s GLY 158 Ca 0.04 0.54 -0.09 0.00 0.00 0.00 0.00 44.72 45.21 2kc0 s GLY 158 CO -0.06 0.21 2.79 -1.26 0.00 0.00 0.00 173.10 174.78 2kc0 n SER 159 N -0.14 8.51 0.00 1.64 2.88 -1.26 -3.28 113.62 121.96 2kc0 n SER 159 Ca -0.17 -2.74 0.00 0.00 -1.33 0.00 0.00 58.87 54.63 2kc0 n SER 159 Cb 0.63 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.59 2kc0 n SER 159 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2kc0 n ASP 160 N 3.09 0.00 0.06 -3.46 5.75 -1.26 -5.06 116.55 115.66 2kc0 n ASP 160 Ca 0.74 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.52 2kc0 n ASP 160 Cb 0.24 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 2kc0 n ASP 160 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2kc0 n ASP 161 N -0.98 -0.61 -0.25 -1.12 2.03 -1.21 -5.06 116.55 109.36 2kc0 n ASP 161 Ca 0.00 0.21 -0.03 0.00 0.52 0.00 0.00 54.79 55.49 2kc0 n ASP 161 Cb 0.00 0.75 -0.01 0.00 -0.72 0.00 0.00 41.12 41.14 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 -2.80 -0.05 0.28 -1.67 0.00 -1.23 -4.79 120.51 110.24 2kc0 n ALA 162 Ca 0.00 0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.53 2kc0 n ALA 162 Cb 0.00 -1.53 -0.05 0.00 0.00 0.00 0.00 19.45 17.87 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 0.75 0.12 2.91 0.00 0.00 -1.26 -4.81 105.19 102.90 2kc0 n GLY 163 Ca -0.03 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2kc0 n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kc0 n GLY 164 N 1.39 4.13 3.79 -0.02 0.00 -1.26 -4.88 105.19 108.34 2kc0 n GLY 164 Ca 0.01 -1.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.05 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 2.94 3.07 0.05 1.61 1.02 -1.26 -4.21 119.74 122.96 2kc0 s LYS 165 Ca 0.47 1.23 0.01 0.00 0.02 0.00 0.00 55.97 57.70 2kc0 s LYS 165 Cb 0.11 -2.00 -0.03 0.00 -0.52 0.00 0.00 37.83 35.40 2kc0 s LYS 165 CO -0.05 -1.02 -0.05 -0.48 -0.92 0.00 0.00 175.35 172.83 2kc0 s LEU 166 N -4.79 2.37 -0.09 3.17 -0.00 -1.06 -1.28 118.68 117.00 2kc0 s LEU 166 Ca 0.64 -0.76 -0.14 0.00 -0.00 0.00 0.00 54.13 53.87 2kc0 s LEU 166 Cb -0.17 -0.01 -0.05 0.00 -0.00 0.00 0.00 46.19 45.96 2kc0 s LEU 166 CO 0.41 -0.38 0.36 -0.89 -0.00 0.00 0.00 176.35 175.85 2kc0 s THR 167 N -2.54 5.20 -0.02 5.48 2.01 0.14 -0.91 115.64 125.00 2kc0 s THR 167 Ca -0.02 0.70 0.05 0.00 0.31 0.00 0.00 61.69 62.74 2kc0 s THR 167 Cb -0.02 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.80 2kc0 s THR 167 CO -0.03 0.47 -0.18 -0.47 -0.69 0.00 0.00 174.62 173.71 2kc0 s TYR 168 N -0.19 1.65 0.01 4.92 5.04 -1.08 -0.94 117.35 126.76 2kc0 s TYR 168 Ca 0.21 -0.37 -0.03 0.00 -2.44 0.00 0.00 57.07 54.44 2kc0 s TYR 168 Cb -0.15 -1.08 -0.01 0.00 0.35 0.00 0.00 41.96 41.07 2kc0 s TYR 168 CO 0.09 -0.08 0.04 -0.08 -1.34 0.00 0.00 175.55 174.18 2kc0 s THR 169 N -0.26 0.09 -0.14 4.34 -1.32 -0.63 -1.28 115.64 116.45 2kc0 s THR 169 Ca 0.03 -0.75 -0.04 0.00 -1.21 0.00 0.00 61.69 59.72 2kc0 s THR 169 Cb -0.09 -0.31 0.05 0.00 -1.51 0.00 0.00 72.50 70.65 2kc0 s THR 169 CO 0.00 -0.41 0.09 -0.51 -2.21 0.00 0.00 174.62 171.58 2kc0 s ILE 170 N -1.31 -0.11 -0.88 5.08 2.07 -0.96 -2.41 121.20 122.70 2kc0 s ILE 170 Ca -0.14 -0.02 -0.25 0.00 -1.41 0.00 0.00 60.65 58.82 2kc0 s ILE 170 Cb -0.08 -0.48 -0.09 0.00 0.13 0.00 0.00 42.46 41.94 2kc0 s ILE 170 CO 0.00 -0.17 2.11 -1.81 -1.91 0.00 0.00 174.94 173.16 2kc0 s ASP 171 N 2.16 4.65 0.60 4.50 1.01 -1.15 -1.04 116.67 127.40 2kc0 s ASP 171 Ca 0.03 -0.47 0.29 0.00 0.71 0.00 0.00 52.55 53.10 2kc0 s ASP 171 Cb -0.15 -2.56 1.40 0.00 1.01 0.00 0.00 42.92 42.62 2kc0 s ASP 171 CO -0.08 -3.21 1.80 -0.26 0.21 0.00 0.00 175.17 173.63 2kc0 h PHE 172 N 11.71 0.00 0.26 4.23 -1.00 -1.23 0.47 116.94 131.37 2kc0 h PHE 172 Ca 0.07 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.83 2kc0 h PHE 172 Cb 1.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.56 2kc0 h PHE 172 CO 1.19 0.00 -0.12 0.00 -1.61 0.00 0.00 178.31 177.77 2kc0 h ALA 173 N 1.30 -0.34 0.00 2.45 0.00 -1.62 -3.38 119.26 117.68 2kc0 h ALA 173 Ca 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2kc0 h ALA 173 Cb 1.43 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2kc0 h ALA 173 CO -0.00 -0.40 -0.59 0.00 0.00 0.00 0.00 179.25 178.25 2kc0 n ALA 174 N -2.60 3.64 -3.53 0.00 0.00 -0.72 -4.99 120.51 112.31 2kc0 n ALA 174 Ca -0.08 -0.37 -0.20 0.00 0.00 0.00 0.00 53.44 52.78 2kc0 n ALA 174 Cb 0.25 -1.08 0.08 0.00 0.00 0.00 0.00 19.45 18.71 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 -1.56 -6.89 -4.78 0.00 5.02 0.16 -4.98 118.16 105.13 2kc0 n LYS 175 Ca 0.05 0.81 -0.33 0.00 -2.02 0.00 0.00 58.31 56.82 2kc0 n LYS 175 Cb 0.35 -5.80 -0.14 0.00 -0.02 0.00 0.00 35.03 29.41 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 -5.79 3.36 -0.46 1.97 -0.21 -1.25 -2.78 119.66 114.50 2kc0 s GLN 176 Ca 0.23 -0.68 -0.13 0.00 0.02 0.00 0.00 55.36 54.79 2kc0 s GLN 176 Cb -0.10 -2.62 0.08 0.00 1.00 0.00 0.00 33.01 31.37 2kc0 s GLN 176 CO 0.74 0.23 0.36 0.20 -2.12 0.00 0.00 175.29 174.70 2kc0 s GLY 177 N 0.31 2.03 0.50 3.09 0.00 0.22 -2.92 107.32 110.55 2kc0 s GLY 177 Ca -0.10 -2.19 0.05 0.00 0.00 0.00 0.00 44.72 42.48 2kc0 s GLY 177 CO 0.06 1.05 0.22 0.21 0.00 0.00 0.00 173.10 174.63 2kc0 s ASN 178 N 2.57 4.42 0.00 1.64 3.04 -1.01 -1.38 114.94 124.22 2kc0 s ASN 178 Ca 0.04 -1.32 0.00 0.00 0.04 0.00 0.00 52.86 51.62 2kc0 s ASN 178 Cb -0.25 0.19 0.00 0.00 -1.54 0.00 0.00 41.25 39.65 2kc0 s ASN 178 CO 0.05 -0.87 0.00 0.61 -3.04 0.00 0.00 177.10 173.85 2kc0 n GLY 179 N -1.47 2.29 3.63 1.21 0.00 -1.24 -1.60 105.19 108.02 2kc0 n GLY 179 Ca -0.07 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.22 2kc0 n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kc0 s LYS 180 N 1.14 0.40 0.30 1.61 -2.85 -0.12 -3.96 119.74 116.27 2kc0 s LYS 180 Ca 0.00 0.41 -0.29 0.00 -1.00 0.00 0.00 55.97 55.10 2kc0 s LYS 180 Cb 0.00 0.20 -0.09 0.00 -2.06 0.00 0.00 37.83 35.87 2kc0 s LYS 180 CO 0.00 -0.06 1.10 0.42 0.10 0.00 0.00 175.35 176.91 2kc0 s ILE 181 N -0.01 3.49 -0.29 3.79 -1.09 -0.38 -0.68 121.20 126.02 2kc0 s ILE 181 Ca 0.04 1.45 -0.00 0.00 -2.23 0.00 0.00 60.65 59.90 2kc0 s ILE 181 Cb -0.04 -3.90 0.18 0.00 -1.58 0.00 0.00 42.46 37.12 2kc0 s ILE 181 CO -0.07 0.30 0.57 -0.70 -1.23 0.00 0.00 174.94 173.81 2kc0 s GLU 182 N -1.61 0.54 0.00 2.79 2.12 -0.40 -4.22 118.70 117.92 2kc0 s GLU 182 Ca 0.47 0.90 0.00 0.00 0.36 0.00 0.00 54.97 56.69 2kc0 s GLU 182 Cb -0.31 0.40 0.00 0.00 0.26 0.00 0.00 34.13 34.49 2kc0 s GLU 182 CO 0.39 -0.68 0.00 0.72 -0.54 0.00 0.00 175.26 175.16 2kc0 n HIS 183 N 5.42 0.00 -2.05 5.30 8.25 -1.26 -4.60 115.22 126.28 2kc0 n HIS 183 Ca -0.01 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.12 2kc0 n HIS 183 Cb 0.51 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.64 2kc0 n HIS 183 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2kc0 s LEU 184 N 0.00 3.54 0.00 2.41 2.01 -1.26 -4.94 118.68 120.44 2kc0 s LEU 184 Ca 0.00 1.93 0.10 0.00 0.01 0.00 0.00 54.13 56.18 2kc0 s LEU 184 Cb 0.00 -4.55 0.44 0.00 0.01 0.00 0.00 46.19 42.09 2kc0 s LEU 184 CO 0.00 -1.26 1.32 2.29 1.01 0.00 0.00 176.35 179.71 2kc0 n LYS 185 N -1.91 0.01 -4.22 1.70 -0.00 -1.26 -4.59 118.16 107.89 2kc0 n LYS 185 Ca 0.10 0.32 -0.17 0.00 -0.00 0.00 0.00 58.31 58.55 2kc0 n LYS 185 Cb 0.52 -1.50 -0.13 0.00 -0.00 0.00 0.00 35.03 33.92 2kc0 n LYS 185 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2kc0 s SER 186 N -2.98 1.23 0.62 -5.58 0.15 -1.26 -5.04 113.70 100.84 2kc0 s SER 186 Ca 0.05 -0.43 0.37 0.00 0.70 0.00 0.00 55.95 56.64 2kc0 s SER 186 Cb 0.07 -0.05 2.05 0.00 -1.71 0.00 0.00 66.02 66.37 2kc0 s SER 186 CO 0.18 -0.04 2.27 1.55 1.20 0.00 0.00 173.24 178.41 2kc0 h PRO 187 N 4.95 0.00 0.00 5.44 0.13 -1.92 -1.80 132.00 138.80 2kc0 h PRO 187 Ca -0.36 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.73 2kc0 h PRO 187 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2kc0 h PRO 187 CO 0.44 0.02 -0.20 0.93 -0.23 0.00 0.00 178.00 178.95 2kc0 h GLU 188 N 0.00 0.00 0.08 0.86 4.39 -1.96 -3.21 114.58 114.74 2kc0 h GLU 188 Ca -0.00 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.42 2kc0 h GLU 188 Cb 0.09 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 2kc0 h GLU 188 CO 0.00 0.20 -1.40 -0.07 -1.16 0.00 0.00 179.01 176.58 2kc0 h LEU 189 N 0.00 0.25-10.18 1.33 3.38 -1.71 -3.40 115.31 104.98 2kc0 h LEU 189 Ca -0.00 -0.33 -0.49 0.00 0.09 0.00 0.00 57.88 57.15 2kc0 h LEU 189 Cb 0.81 -0.08 0.06 0.00 0.09 0.00 0.00 40.66 41.54 2kc0 h LEU 189 CO 0.03 1.27 0.38 0.20 0.09 0.00 0.00 178.44 180.41 2kc0 s ASN 190 N -6.82 5.91 0.11 -0.43 0.01 -1.14 -4.76 114.94 107.83 2kc0 s ASN 190 Ca -0.06 1.82 0.03 0.00 -0.71 0.00 0.00 52.86 53.95 2kc0 s ASN 190 Cb 0.08 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 39.16 2kc0 s ASN 190 CO 0.84 -1.08 -0.09 0.68 -1.51 0.00 0.00 177.10 175.95 2kc0 s VAL 191 N -2.39 0.93 0.55 1.60 -7.23 -1.26 -4.91 120.40 107.68 2kc0 s VAL 191 Ca 0.64 -1.87 -0.16 0.00 -1.81 0.00 0.00 61.98 58.79 2kc0 s VAL 191 Cb -0.16 -1.61 -0.06 0.00 0.56 0.00 0.00 36.38 35.11 2kc0 s VAL 191 CO 0.34 -0.72 1.01 -0.62 -0.31 0.00 0.00 175.10 174.80 2kc0 s ASP 192 N -2.86 6.36 -0.34 4.85 2.15 -1.26 -1.25 116.67 124.32 2kc0 s ASP 192 Ca 0.11 1.60 0.03 0.00 0.43 0.00 0.00 52.55 54.72 2kc0 s ASP 192 Cb 0.01 -2.51 0.09 0.00 -0.30 0.00 0.00 42.92 40.22 2kc0 s ASP 192 CO -0.01 -0.77 0.05 -0.22 -0.17 0.00 0.00 175.17 174.05 2kc0 s LEU 193 N -4.34 4.60 -0.38 -1.34 0.20 -1.25 -4.07 118.68 112.10 2kc0 s LEU 193 Ca 0.59 -1.98 -0.41 0.00 0.69 0.00 0.00 54.13 53.02 2kc0 s LEU 193 Cb -0.11 -1.65 -0.16 0.00 -0.43 0.00 0.00 46.19 43.83 2kc0 s LEU 193 CO 0.36 -0.37 1.92 0.00 -0.29 0.00 0.00 176.35 177.97 2kc0 n ALA 194 N 4.35 0.04 -1.60 5.97 0.00 -0.84 -3.66 120.51 124.77 2kc0 n ALA 194 Ca -0.01 0.25 -0.46 0.00 0.00 0.00 0.00 53.44 53.23 2kc0 n ALA 194 Cb 0.42 -2.23 -0.04 0.00 0.00 0.00 0.00 19.45 17.60 2kc0 n ALA 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kc0 n ALA 195 N 6.73 1.41 -2.80 0.00 0.00 -1.26 -4.17 120.51 120.42 2kc0 n ALA 195 Ca 0.37 -0.01 -0.30 0.00 0.00 0.00 0.00 53.44 53.49 2kc0 n ALA 195 Cb 0.09 -2.71 -0.06 0.00 0.00 0.00 0.00 19.45 16.76 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 6.52 3.62 0.22 0.00 0.00 -0.48 -4.91 121.76 126.73 2kc0 s ALA 196 Ca 0.99 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 51.89 2kc0 s ALA 196 Cb -0.53 -1.47 -0.05 0.00 0.00 0.00 0.00 23.12 21.06 2kc0 s ALA 196 CO 0.43 0.73 0.47 0.16 0.00 0.00 0.00 175.76 177.54 2kc0 s ASP 197 N -2.50 6.46 0.18 0.00 -4.77 -1.26 -0.61 116.67 114.18 2kc0 s ASP 197 Ca 0.30 0.63 -0.30 0.00 -3.30 0.00 0.00 52.55 49.88 2kc0 s ASP 197 Cb -0.12 -2.11 -0.08 0.00 -1.09 0.00 0.00 42.92 39.53 2kc0 s ASP 197 CO 0.23 -0.08 1.02 -0.51 0.70 0.00 0.00 175.17 176.52 2kc0 s ILE 198 N -1.89 4.08 0.09 2.11 2.07 -1.12 -3.82 121.20 122.72 2kc0 s ILE 198 Ca 0.42 1.87 -0.13 0.00 -1.41 0.00 0.00 60.65 61.39 2kc0 s ILE 198 Cb -0.11 -4.19 -0.06 0.00 0.13 0.00 0.00 42.46 38.23 2kc0 s ILE 198 CO 0.27 0.35 0.48 -0.54 -1.91 0.00 0.00 174.94 173.59 2kc0 s LYS 199 N -0.56 3.92 -0.00 3.50 -0.14 0.21 -4.98 119.74 121.69 2kc0 s LYS 199 Ca 0.46 0.40 0.01 0.00 -1.36 0.00 0.00 55.97 55.49 2kc0 s LYS 199 Cb -0.27 -3.04 0.04 0.00 -1.68 0.00 0.00 37.83 32.88 2kc0 s LYS 199 CO 0.33 0.56 0.96 -0.35 -0.76 0.00 0.00 175.35 176.09 2kc0 n PRO 200 N 1.13 1.13 -2.94 -1.68 -0.04 -1.26 -3.71 135.00 127.62 2kc0 n PRO 200 Ca -0.08 -0.17 -0.40 0.00 -0.04 0.00 0.00 63.50 62.81 2kc0 n PRO 200 Cb 0.52 -1.12 -0.05 0.00 -0.04 0.00 0.00 33.50 32.81 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 -0.85 7.27 0.00 3.54 1.01 -1.26 -4.86 116.67 121.52 2kc0 s ASP 201 Ca 0.03 1.51 0.00 0.00 0.71 0.00 0.00 52.55 54.81 2kc0 s ASP 201 Cb 0.02 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.46 2kc0 s ASP 201 CO 0.02 0.01 0.00 0.61 0.21 0.00 0.00 175.17 176.02 2kc0 n GLY 202 N 2.32 0.79 0.00 0.21 0.00 -1.26 -3.81 105.19 103.44 2kc0 n GLY 202 Ca -0.02 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.22 2kc0 n GLY 202 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2kc0 n LYS 203 N 0.61 0.00 -0.39 1.61 2.85 -1.26 -1.14 118.16 120.43 2kc0 n LYS 203 Ca 0.00 0.35 0.00 0.00 -1.05 0.00 0.00 58.31 57.61 2kc0 n LYS 203 Cb 0.00 -1.63 0.00 0.00 -0.65 0.00 0.00 35.03 32.75 2kc0 n LYS 203 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 2kc0 n ARG 204 N -1.34 0.00 0.00 -1.58 1.85 -1.26 -5.11 116.66 109.22 2kc0 n ARG 204 Ca 0.00 -0.86 0.00 0.00 -1.00 0.00 0.00 57.85 55.99 2kc0 n ARG 204 Cb 0.13 -0.48 0.00 0.00 -1.05 0.00 0.00 32.46 31.06 2kc0 n ARG 204 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 2kc0 n HIS 205 N 0.00 0.00 -3.39 2.89 1.44 -0.30 -2.74 115.22 113.12 2kc0 n HIS 205 Ca 0.00 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.68 2kc0 n HIS 205 Cb 0.65 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.76 2kc0 n HIS 205 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2kc0 n ALA 206 N -3.00 -0.38 -2.74 1.59 0.00 -1.26 -4.03 120.51 110.69 2kc0 n ALA 206 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 53.44 52.94 2kc0 n ALA 206 Cb 0.00 0.33 -0.07 0.00 0.00 0.00 0.00 19.45 19.71 2kc0 n ALA 206 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2kc0 s VAL 207 N -2.67 0.08 0.00 0.00 1.01 -1.24 -4.76 120.40 112.81 2kc0 s VAL 207 Ca 0.06 -1.28 0.08 0.00 0.00 0.00 0.00 61.98 60.84 2kc0 s VAL 207 Cb -0.01 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 2kc0 s VAL 207 CO 0.04 -0.34 -0.24 -0.63 0.00 0.00 0.00 175.10 173.93 2kc0 s ILE 208 N -3.94 1.90 -0.17 2.22 -1.09 -1.00 -0.62 121.20 118.50 2kc0 s ILE 208 Ca 0.14 -1.11 -0.04 0.00 -2.23 0.00 0.00 60.65 57.41 2kc0 s ILE 208 Cb 0.03 -1.60 0.08 0.00 -1.58 0.00 0.00 42.46 39.39 2kc0 s ILE 208 CO -0.03 0.46 0.18 -0.44 -1.23 0.00 0.00 174.94 173.88 2kc0 s SER 209 N -0.77 1.41 0.20 3.58 0.01 -1.25 -3.09 113.70 113.79 2kc0 s SER 209 Ca 0.09 -0.16 0.03 0.00 1.31 0.00 0.00 55.95 57.22 2kc0 s SER 209 Cb -0.09 0.25 -0.01 0.00 0.21 0.00 0.00 66.02 66.37 2kc0 s SER 209 CO 0.00 -0.31 0.21 0.61 0.41 0.00 0.00 173.24 174.16 2kc0 n GLY 210 N 5.31 3.09 3.59 3.44 0.00 -0.88 -4.46 105.19 115.28 2kc0 n GLY 210 Ca -0.06 -1.70 -0.25 0.00 0.00 0.00 0.00 46.02 44.01 2kc0 n GLY 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kc0 s SER 211 N -2.33 4.29 -0.09 1.61 1.04 -1.26 -1.08 113.70 115.87 2kc0 s SER 211 Ca 0.21 -0.63 -0.02 0.00 0.48 0.00 0.00 55.95 55.99 2kc0 s SER 211 Cb 0.01 -0.73 0.04 0.00 0.10 0.00 0.00 66.02 65.43 2kc0 s SER 211 CO 0.15 0.07 0.02 -0.69 0.98 0.00 0.00 173.24 173.77 2kc0 s VAL 212 N -1.95 0.29 0.84 5.02 1.01 -0.70 -1.98 120.40 122.93 2kc0 s VAL 212 Ca 0.27 0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.19 2kc0 s VAL 212 Cb -0.08 -0.55 0.10 0.00 0.00 0.00 0.00 36.38 35.85 2kc0 s VAL 212 CO 0.17 0.13 1.09 -0.22 0.00 0.00 0.00 175.10 176.27 2kc0 s LEU 213 N 2.00 2.64 -0.21 3.92 1.98 -1.26 -0.48 118.68 127.28 2kc0 s LEU 213 Ca 0.04 1.70 -0.15 0.00 -2.89 0.00 0.00 54.13 52.83 2kc0 s LEU 213 Cb -0.13 -4.24 0.06 0.00 0.66 0.00 0.00 46.19 42.54 2kc0 s LEU 213 CO -0.06 -2.42 0.53 -0.47 -1.89 0.00 0.00 176.35 172.05 2kc0 s TYR 214 N -2.89 -0.71 -1.08 5.38 5.04 -1.25 -4.79 117.35 117.05 2kc0 s TYR 214 Ca 0.63 1.55 -0.04 0.00 -2.44 0.00 0.00 57.07 56.77 2kc0 s TYR 214 Cb -0.18 0.33 0.03 0.00 0.35 0.00 0.00 41.96 42.49 2kc0 s TYR 214 CO 0.57 -0.36 0.22 -1.71 -1.34 0.00 0.00 175.55 172.92 2kc0 n ASN 215 N 3.66 -3.67 -4.22 4.32 5.15 -1.26 -0.47 115.26 118.76 2kc0 n ASN 215 Ca -0.18 -0.03 -0.35 0.00 -0.60 0.00 0.00 54.58 53.42 2kc0 n ASN 215 Cb 0.57 -3.09 -0.04 0.00 -0.53 0.00 0.00 39.78 36.68 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 -3.19 -2.69 0.04 1.20 1.13 -1.26 -4.75 117.38 107.86 2kc0 n GLN 216 Ca -0.08 0.32 0.00 0.00 -1.94 0.00 0.00 57.00 55.30 2kc0 n GLN 216 Cb 0.57 -4.80 0.00 0.00 0.11 0.00 0.00 30.24 26.12 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 -4.37 2.00 -0.97 -1.58 0.00 0.38 -5.17 120.51 110.80 2kc0 n ALA 217 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.11 2kc0 n ALA 217 Cb 0.54 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.23 2kc0 n ALA 217 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2kc0 s GLU 218 N -2.00 -1.10 -0.42 0.00 0.41 -0.59 -4.85 118.70 110.15 2kc0 s GLU 218 Ca 0.00 0.14 0.02 0.00 -0.41 0.00 0.00 54.97 54.71 2kc0 s GLU 218 Cb 0.00 -1.59 0.14 0.00 -1.78 0.00 0.00 34.13 30.90 2kc0 s GLU 218 CO 0.00 -3.67 0.26 0.15 -0.49 0.00 0.00 175.26 171.51 2kc0 s LYS 219 N -5.20 1.06 0.53 1.61 1.02 -1.26 -3.78 119.74 113.72 2kc0 s LYS 219 Ca 0.69 -1.87 -0.06 0.00 0.02 0.00 0.00 55.97 54.75 2kc0 s LYS 219 Cb -0.13 -1.94 0.11 0.00 -0.52 0.00 0.00 37.83 35.35 2kc0 s LYS 219 CO 0.57 -1.21 0.72 0.41 -0.92 0.00 0.00 175.35 174.92 2kc0 n GLY 220 N 3.52 -0.42 3.21 -3.33 0.00 0.37 -4.30 105.19 104.24 2kc0 n GLY 220 Ca 0.13 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.23 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 -3.74 0.09 0.07 1.61 1.04 -0.07 -1.72 113.70 110.98 2kc0 s SER 221 Ca 0.43 -0.61 0.02 0.00 0.48 0.00 0.00 55.95 56.27 2kc0 s SER 221 Cb -0.02 0.35 -0.03 0.00 0.10 0.00 0.00 66.02 66.42 2kc0 s SER 221 CO 0.30 -0.73 -0.07 -0.72 0.98 0.00 0.00 173.24 172.99 2kc0 s TYR 222 N -3.80 0.75 0.01 5.02 1.13 -0.24 -1.22 117.35 119.00 2kc0 s TYR 222 Ca 0.04 -0.70 0.00 0.00 -1.41 0.00 0.00 57.07 55.01 2kc0 s TYR 222 Cb 0.04 -0.45 -0.01 0.00 -1.10 0.00 0.00 41.96 40.45 2kc0 s TYR 222 CO -0.11 -0.12 -0.02 -1.54 -2.51 0.00 0.00 175.55 171.25 2kc0 s SER 223 N -2.26 0.21 0.21 -0.18 1.04 -0.01 -2.08 113.70 110.63 2kc0 s SER 223 Ca -0.00 -0.24 -0.18 0.00 0.48 0.00 0.00 55.95 56.00 2kc0 s SER 223 Cb -0.03 0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.16 2kc0 s SER 223 CO -0.02 -0.13 0.56 -1.48 0.98 0.00 0.00 173.24 173.16 2kc0 s LEU 224 N -0.70 -0.05 0.17 2.42 0.05 -1.18 -0.79 118.68 118.61 2kc0 s LEU 224 Ca -0.07 -0.47 0.07 0.00 0.05 0.00 0.00 54.13 53.71 2kc0 s LEU 224 Cb -0.05 2.28 -0.04 0.00 -2.05 0.00 0.00 46.19 46.33 2kc0 s LEU 224 CO -0.00 -1.10 -0.15 -0.83 -0.55 0.00 0.00 176.35 173.71 2kc0 s GLY 225 N -2.88 1.33 0.12 -3.48 0.00 -0.78 -2.39 107.32 99.24 2kc0 s GLY 225 Ca 0.09 -1.53 -0.24 0.00 0.00 0.00 0.00 44.72 43.04 2kc0 s GLY 225 CO -0.02 -1.61 0.73 -0.42 0.00 0.00 0.00 173.10 171.79 2kc0 s ILE 226 N -2.57 4.53 -0.04 0.90 -1.09 -1.26 -3.24 121.20 118.42 2kc0 s ILE 226 Ca 0.18 1.60 0.04 0.00 -2.23 0.00 0.00 60.65 60.23 2kc0 s ILE 226 Cb -0.03 -4.09 -0.00 0.00 -1.58 0.00 0.00 42.46 36.76 2kc0 s ILE 226 CO 0.06 0.49 -0.17 -0.36 -1.23 0.00 0.00 174.94 173.73 2kc0 s PHE 227 N -0.86 1.69 0.00 3.97 0.08 -0.99 -4.06 117.98 117.80 2kc0 s PHE 227 Ca 0.35 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.92 2kc0 s PHE 227 Cb -0.22 -1.14 0.00 0.00 -0.57 0.00 0.00 43.02 41.09 2kc0 s PHE 227 CO 0.24 -0.16 0.00 0.41 -0.10 0.00 0.00 175.22 175.61 2kc0 n GLY 228 N 3.14 0.98 0.31 4.36 0.00 0.40 -0.93 105.19 113.45 2kc0 n GLY 228 Ca -0.18 -1.79 0.18 0.00 0.00 0.00 0.00 46.02 44.23 2kc0 n GLY 228 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kc0 h GLY 229 N 0.00 0.00 -0.74 -0.02 0.00 -1.97 -2.15 103.07 98.19 2kc0 h GLY 229 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2kc0 h GLY 229 CO 0.00 0.00 -0.33 0.28 0.00 0.00 0.00 176.54 176.49 2kc0 n LYS 230 N -3.47 0.81 -2.92 4.80 5.02 -1.26 -4.96 118.16 116.18 2kc0 n LYS 230 Ca -0.03 -2.15 -0.08 0.00 -2.02 0.00 0.00 58.31 54.03 2kc0 n LYS 230 Cb 0.10 -1.07 0.01 0.00 -0.02 0.00 0.00 35.03 34.06 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 -0.77 -3.00 0.10 7.82 0.00 -0.81 -5.00 120.51 118.87 2kc0 n ALA 231 Ca 0.11 0.71 -0.19 0.00 0.00 0.00 0.00 53.44 54.07 2kc0 n ALA 231 Cb 0.72 -2.26 -0.12 0.00 0.00 0.00 0.00 19.45 17.79 2kc0 n ALA 231 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2kc0 h GLN 232 N 2.57 0.46 -2.62 0.00 1.08 -1.26 -3.49 115.11 111.85 2kc0 h GLN 232 Ca -0.07 -0.66 0.13 0.00 -1.45 0.00 0.00 58.65 56.60 2kc0 h GLN 232 Cb 0.69 0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 28.32 2kc0 h GLN 232 CO 0.15 1.29 0.54 -1.83 -0.95 0.00 0.00 178.83 178.03 2kc0 s GLU 233 N -2.88 1.46 0.03 1.46 -1.05 -1.23 -4.13 118.70 112.36 2kc0 s GLU 233 Ca -0.07 -0.94 0.01 0.00 -0.15 0.00 0.00 54.97 53.82 2kc0 s GLU 233 Cb 0.06 0.41 -0.02 0.00 -0.44 0.00 0.00 34.13 34.14 2kc0 s GLU 233 CO 0.91 -0.68 -0.05 0.14 0.95 0.00 0.00 175.26 176.53 2kc0 s VAL 234 N -2.16 0.28 0.19 1.83 -7.23 -0.41 -2.35 120.40 110.55 2kc0 s VAL 234 Ca 0.21 -0.90 -0.17 0.00 -1.81 0.00 0.00 61.98 59.31 2kc0 s VAL 234 Cb -0.03 -0.39 0.03 0.00 0.56 0.00 0.00 36.38 36.55 2kc0 s VAL 234 CO 0.06 -0.40 0.50 0.00 -0.31 0.00 0.00 175.10 174.95 2kc0 s ALA 235 N -1.30 -0.88 0.00 1.32 0.00 -1.20 -1.90 121.76 117.81 2kc0 s ALA 235 Ca -0.12 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.58 2kc0 s ALA 235 Cb -0.09 0.85 0.00 0.00 0.00 0.00 0.00 23.12 23.88 2kc0 s ALA 235 CO -0.00 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.38 2kc0 n GLY 236 N -0.33 -0.75 3.32 0.00 0.00 -1.08 -1.87 105.19 104.49 2kc0 n GLY 236 Ca -0.10 -0.29 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.33 0.05 1.61 1.04 0.03 -1.14 113.70 110.96 2kc0 s SER 237 Ca 0.00 0.32 0.05 0.00 0.48 0.00 0.00 55.95 56.80 2kc0 s SER 237 Cb 0.00 0.43 -0.02 0.00 0.10 0.00 0.00 66.02 66.52 2kc0 s SER 237 CO 0.00 -0.46 -0.15 0.00 0.98 0.00 0.00 173.24 173.62 2kc0 s ALA 238 N -1.14 1.21 -0.11 5.32 0.00 -0.03 -0.83 121.76 126.19 2kc0 s ALA 238 Ca -0.12 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 50.98 2kc0 s ALA 238 Cb -0.04 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.92 2kc0 s ALA 238 CO 0.05 0.22 -0.21 -1.21 0.00 0.00 0.00 175.76 174.61 2kc0 s GLU 239 N -1.34 2.73 -0.03 0.00 8.01 -0.36 -0.69 118.70 127.02 2kc0 s GLU 239 Ca 0.01 -0.76 0.07 0.00 0.01 0.00 0.00 54.97 54.30 2kc0 s GLU 239 Cb -0.09 -2.14 -0.02 0.00 -4.31 0.00 0.00 34.13 27.57 2kc0 s GLU 239 CO 0.02 0.08 -0.23 0.54 0.01 0.00 0.00 175.26 175.67 2kc0 s VAL 240 N 0.59 2.30 -0.17 2.63 0.11 -0.17 -0.89 120.40 124.81 2kc0 s VAL 240 Ca -0.14 -1.01 -0.05 0.00 -2.93 0.00 0.00 61.98 57.85 2kc0 s VAL 240 Cb -0.17 -1.83 -0.03 0.00 -1.53 0.00 0.00 36.38 32.82 2kc0 s VAL 240 CO 0.04 0.58 -0.00 -1.59 -3.33 0.00 0.00 175.10 170.80 2kc0 s LYS 241 N -0.59 3.77 0.29 1.54 -2.85 -1.26 -0.51 119.74 120.14 2kc0 s LYS 241 Ca 0.09 -0.46 0.04 0.00 -1.00 0.00 0.00 55.97 54.64 2kc0 s LYS 241 Cb -0.11 -3.02 -0.03 0.00 -2.06 0.00 0.00 37.83 32.61 2kc0 s LYS 241 CO -0.00 0.24 0.21 0.95 0.10 0.00 0.00 175.35 176.85 2kc0 s THR 242 N 0.39 0.09 0.45 3.79 -4.23 -0.15 -4.54 115.64 111.44 2kc0 s THR 242 Ca -0.01 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.65 2kc0 s THR 242 Cb -0.14 -2.50 0.33 0.00 1.34 0.00 0.00 72.50 71.54 2kc0 s THR 242 CO 0.02 0.00 1.99 0.58 -0.54 0.00 0.00 174.62 176.67 2kc0 h VAL 243 N 2.27 0.88 -0.12 2.29 2.07 -2.02 -0.02 116.25 121.61 2kc0 h VAL 243 Ca -0.30 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.11 2kc0 h VAL 243 Cb 1.24 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2kc0 h VAL 243 CO 0.45 0.06 0.00 0.59 0.02 0.00 0.00 177.57 178.69 2kc0 n ASN 244 N -4.46 1.11 0.00 0.57 3.02 -1.26 -5.03 115.26 109.20 2kc0 n ASN 244 Ca 0.09 -2.06 0.00 0.00 -0.03 0.00 0.00 54.58 52.58 2kc0 n ASN 244 Cb 0.38 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 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 0.48 -1.71 3.78 7.41 0.00 -0.02 -4.91 105.19 110.22 2kc0 n GLY 245 Ca 0.04 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 44.12 2kc0 n GLY 245 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kc0 s ILE 246 N 0.00 3.50 -0.03 -0.61 1.10 -1.26 -0.98 121.20 122.92 2kc0 s ILE 246 Ca 0.00 0.99 0.03 0.00 -0.51 0.00 0.00 60.65 61.16 2kc0 s ILE 246 Cb 0.00 -3.43 0.00 0.00 0.15 0.00 0.00 42.46 39.18 2kc0 s ILE 246 CO 0.00 -0.15 -0.11 -0.13 -2.11 0.00 0.00 174.94 172.44 2kc0 s ARG 247 N -3.07 1.10 -0.05 3.50 1.81 0.34 -4.95 118.95 117.63 2kc0 s ARG 247 Ca 0.67 -0.37 -0.10 0.00 -1.72 0.00 0.00 55.73 54.21 2kc0 s ARG 247 Cb -0.21 -1.01 -0.05 0.00 -0.45 0.00 0.00 34.95 33.23 2kc0 s ARG 247 CO 0.25 0.15 0.27 -1.01 -0.68 0.00 0.00 175.30 174.28 2kc0 s HIS 248 N 0.11 3.64 -0.03 -0.53 3.76 -1.26 -1.00 115.29 119.99 2kc0 s HIS 248 Ca -0.02 0.72 0.02 0.00 -0.15 0.00 0.00 55.06 55.63 2kc0 s HIS 248 Cb -0.09 -2.08 0.01 0.00 1.11 0.00 0.00 32.58 31.53 2kc0 s HIS 248 CO 0.01 0.68 -0.08 0.42 -0.85 0.00 0.00 174.74 174.91 2kc0 s ILE 249 N -1.10 0.75 0.21 0.60 1.01 0.13 -4.38 121.20 118.41 2kc0 s ILE 249 Ca 0.21 -0.32 -0.23 0.00 0.00 0.00 0.00 60.65 60.30 2kc0 s ILE 249 Cb -0.14 -0.68 -0.08 0.00 0.01 0.00 0.00 42.46 41.57 2kc0 s ILE 249 CO 0.10 0.24 0.78 -0.83 0.00 0.00 0.00 174.94 175.23 2kc0 s GLY 250 N 0.34 2.80 -0.15 6.18 0.00 -0.41 -0.85 107.32 115.23 2kc0 s GLY 250 Ca -0.05 0.31 -0.07 0.00 0.00 0.00 0.00 44.72 44.91 2kc0 s GLY 250 CO 0.01 0.76 0.10 1.08 0.00 0.00 0.00 173.10 175.05 2kc0 s LEU 251 N -1.56 4.10 -0.20 0.66 2.01 -0.29 -3.00 118.68 120.40 2kc0 s LEU 251 Ca 0.40 0.28 -0.04 0.00 0.01 0.00 0.00 54.13 54.78 2kc0 s LEU 251 Cb -0.20 -2.01 0.10 0.00 0.01 0.00 0.00 46.19 44.08 2kc0 s LEU 251 CO 0.24 0.30 0.27 0.00 1.01 0.00 0.00 176.35 178.17 2kc0 s ALA 252 N -0.36 -0.56 -0.09 4.21 0.00 -1.16 -2.62 121.76 121.18 2kc0 s ALA 252 Ca 0.10 0.59 -0.05 0.00 0.00 0.00 0.00 51.96 52.60 2kc0 s ALA 252 Cb -0.12 -1.35 0.04 0.00 0.00 0.00 0.00 23.12 21.69 2kc0 s ALA 252 CO 0.01 -1.10 0.21 0.00 0.00 0.00 0.00 175.76 174.88 2kc0 s ALA 253 N 2.41 -0.45 0.15 0.00 0.00 -0.80 -0.75 121.76 122.32 2kc0 s ALA 253 Ca 0.07 0.84 0.06 0.00 0.00 0.00 0.00 51.96 52.93 2kc0 s ALA 253 Cb -0.15 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 2kc0 s ALA 253 CO -0.12 -0.17 -0.12 0.21 0.00 0.00 0.00 175.76 175.55 2kc0 s LYS 254 N 1.09 1.12 0.00 0.00 2.20 -0.83 -1.29 119.74 122.03 2kc0 s LYS 254 Ca -0.08 -1.42 0.00 0.00 -0.36 0.00 0.00 55.97 54.11 2kc0 s LYS 254 Cb -0.10 -0.84 0.00 0.00 -1.51 0.00 0.00 37.83 35.38 2kc0 s LYS 254 CO -0.07 0.13 0.49 0.94 -0.36 0.00 0.00 175.35 176.49