#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 -0.46 0.29 0.00 0.00 -1.26 -3.72 105.19 100.03 2kc0 n GLY 15 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.21 2kc0 n GLY 15 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 2kc0 h LEU 16 N 0.02 0.00 -0.80 0.99 -0.00 -1.97 -2.13 115.31 111.42 2kc0 h LEU 16 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 57.88 58.07 2kc0 h LEU 16 Cb 0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 40.66 40.55 2kc0 h LEU 16 CO 0.00 0.00 0.24 0.00 -0.00 0.00 0.00 178.44 178.68 2kc0 h ALA 17 N 2.02 1.13 0.00 0.17 0.00 -1.81 -2.75 119.26 118.01 2kc0 h ALA 17 Ca 0.00 0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 2kc0 h ALA 17 Cb 0.15 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2kc0 h ALA 17 CO 0.00 -0.35 -0.17 0.22 0.00 0.00 0.00 179.25 178.94 2kc0 h ASP 18 N 0.30 0.00 -0.09 0.00 3.58 -1.71 -1.91 116.42 116.59 2kc0 h ASP 18 Ca 0.47 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.73 2kc0 h ASP 18 Cb 0.86 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.92 2kc0 h ASP 18 CO -0.54 0.17 -0.70 0.00 -2.88 0.00 0.00 179.24 175.30 2kc0 h ALA 19 N 1.83 0.21 0.00 -0.78 0.00 -1.67 -3.30 119.26 115.55 2kc0 h ALA 19 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2kc0 h ALA 19 Cb 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2kc0 h ALA 19 CO 0.02 0.53 0.00 1.28 0.00 0.00 0.00 179.25 181.08 2kc0 n LEU 20 N -4.07 0.13 -0.18 0.00 7.99 -0.73 -2.76 117.00 117.37 2kc0 n LEU 20 Ca -0.09 0.54 -0.05 0.00 -0.01 0.00 0.00 56.01 56.40 2kc0 n LEU 20 Cb 0.70 -0.53 0.05 0.00 -0.11 0.00 0.00 43.42 43.54 2kc0 n LEU 20 CO 0.50 -0.38 1.05 0.71 -1.51 0.00 0.00 177.39 177.76 2kc0 h THR 21 N 0.00 1.01 0.00 -5.08 1.35 -1.60 -3.40 112.91 105.20 2kc0 h THR 21 Ca 0.00 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 2kc0 h THR 21 Cb 0.20 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.00 2kc0 h THR 21 CO 0.00 0.11 0.00 0.00 -0.25 0.00 0.00 175.52 175.38 2kc0 n ALA 22 N -2.30 0.00 -2.37 6.62 0.00 -1.11 -5.02 120.51 116.33 2kc0 n ALA 22 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.28 2kc0 n ALA 22 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.52 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 -1.55 2.65 0.00 0.00 0.04 -1.22 -5.07 135.00 129.86 2kc0 s PRO 23 Ca 0.00 -1.39 0.00 0.00 0.04 0.00 0.00 61.00 59.65 2kc0 s PRO 23 Cb 0.00 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2kc0 s PRO 23 CO 0.00 -0.04 0.00 -0.11 0.04 0.00 0.00 177.00 176.89 2kc0 n LEU 24 N -1.47 0.00 -4.32 -3.56 7.94 -1.26 -4.49 117.00 109.84 2kc0 n LEU 24 Ca 0.01 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.73 2kc0 n LEU 24 Cb 0.60 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.46 2kc0 n LEU 24 CO 0.42 0.00 -0.20 -1.81 -1.11 0.00 0.00 177.39 174.69 2kc0 s ASP 25 N 1.89 1.43 -0.30 1.96 1.01 -1.26 -5.00 116.67 116.40 2kc0 s ASP 25 Ca 0.00 -1.55 -0.02 0.00 0.71 0.00 0.00 52.55 51.69 2kc0 s ASP 25 Cb 0.00 0.38 0.10 0.00 1.01 0.00 0.00 42.92 44.41 2kc0 s ASP 25 CO 0.00 -0.88 0.11 -2.28 0.21 0.00 0.00 175.17 172.32 2kc0 s HIS 26 N -3.64 1.18 -1.06 4.23 2.46 -1.26 -4.89 115.29 112.31 2kc0 s HIS 26 Ca 0.36 -1.40 -0.20 0.00 0.47 0.00 0.00 55.06 54.28 2kc0 s HIS 26 Cb 0.05 -1.40 0.02 0.00 -0.13 0.00 0.00 32.58 31.12 2kc0 s HIS 26 CO 0.17 -0.86 0.67 1.17 -2.47 0.00 0.00 174.74 173.43 2kc0 n LYS 27 N 5.00 -0.81 -0.07 2.88 0.00 -1.26 -4.92 118.16 118.97 2kc0 n LYS 27 Ca -0.04 0.39 -0.11 0.00 0.00 0.00 0.00 58.31 58.55 2kc0 n LYS 27 Cb 0.42 -2.67 -0.08 0.00 0.00 0.00 0.00 35.03 32.71 2kc0 n LYS 27 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2kc0 h ASP 28 N -1.66 -1.39 0.00 3.14 3.58 -1.97 -3.44 116.42 114.69 2kc0 h ASP 28 Ca -0.66 0.18 0.00 0.00 0.42 0.00 0.00 57.03 56.96 2kc0 h ASP 28 Cb 1.39 0.56 0.00 0.00 1.72 0.00 0.00 39.33 43.00 2kc0 h ASP 28 CO 0.46 -0.33 0.00 2.29 -2.88 0.00 0.00 179.24 178.78 2kc0 n LYS 29 N -4.73 0.15 0.00 0.28 2.85 -1.26 -5.16 118.16 110.29 2kc0 n LYS 29 Ca -0.03 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.23 2kc0 n LYS 29 Cb 0.27 -0.14 0.00 0.00 -0.65 0.00 0.00 35.03 34.51 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 -0.21 4.89 3.73 2.58 0.00 -1.26 -5.14 105.19 109.78 2kc0 n GLY 30 Ca 0.00 -1.25 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 2kc0 n GLY 30 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2kc0 n LEU 31 N 0.00 4.07 -0.13 0.99 0.00 -1.26 -4.79 117.00 115.88 2kc0 n LEU 31 Ca 0.00 1.17 0.00 0.00 0.00 0.00 0.00 56.01 57.18 2kc0 n LEU 31 Cb 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 43.42 41.87 2kc0 n LEU 31 CO 0.00 -0.06 0.16 0.00 0.00 0.00 0.00 177.39 177.49 2kc0 n GLN 32 N 1.61 0.00 -3.89 1.96 -0.00 -1.26 -4.83 117.38 110.97 2kc0 n GLN 32 Ca 0.07 -0.33 -0.09 0.00 -0.00 0.00 0.00 57.00 56.65 2kc0 n GLN 32 Cb 0.36 -0.27 -0.07 0.00 -0.00 0.00 0.00 30.24 30.26 2kc0 n GLN 32 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2kc0 s SER 33 N -0.14 0.08 -0.44 2.61 1.04 -1.26 -1.50 113.70 114.08 2kc0 s SER 33 Ca 0.00 -0.72 -0.17 0.00 0.48 0.00 0.00 55.95 55.54 2kc0 s SER 33 Cb 0.00 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.54 2kc0 s SER 33 CO 0.00 -0.80 0.42 -0.22 0.98 0.00 0.00 173.24 173.63 2kc0 s LEU 34 N -2.90 5.10 -0.00 2.42 1.98 -0.80 -4.83 118.68 119.65 2kc0 s LEU 34 Ca 0.10 -0.90 -0.30 0.00 -2.89 0.00 0.00 54.13 50.13 2kc0 s LEU 34 Cb 0.04 -2.30 -0.05 0.00 0.66 0.00 0.00 46.19 44.54 2kc0 s LEU 34 CO -0.07 -0.61 1.35 -0.89 -1.89 0.00 0.00 176.35 174.24 2kc0 s THR 35 N 1.99 3.81 -1.05 3.68 2.01 -1.26 -1.53 115.64 123.30 2kc0 s THR 35 Ca 0.09 1.20 -0.09 0.00 0.31 0.00 0.00 61.69 63.20 2kc0 s THR 35 Cb -0.19 -3.77 0.26 0.00 0.01 0.00 0.00 72.50 68.81 2kc0 s THR 35 CO 0.11 0.01 1.02 -0.76 -0.69 0.00 0.00 174.62 174.31 2kc0 s LEU 36 N 2.24 6.28 0.00 4.42 1.02 -1.11 -4.81 118.68 126.71 2kc0 s LEU 36 Ca 0.62 -3.51 0.17 0.00 0.02 0.00 0.00 54.13 51.43 2kc0 s LEU 36 Cb -0.30 -2.17 -0.12 0.00 0.02 0.00 0.00 46.19 43.62 2kc0 s LEU 36 CO 0.26 -0.31 0.78 -0.67 0.02 0.00 0.00 176.35 176.43 2kc0 n ASP 37 N 2.80 1.12 0.00 2.29 2.03 -1.26 -4.41 116.55 119.12 2kc0 n ASP 37 Ca 0.22 -1.06 0.00 0.00 0.52 0.00 0.00 54.79 54.47 2kc0 n ASP 37 Cb 0.40 0.81 0.00 0.00 -0.72 0.00 0.00 41.12 41.61 2kc0 n ASP 37 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2kc0 n GLN 38 N -0.93 0.08 -0.11 -0.67 7.27 -1.26 -4.86 117.38 116.90 2kc0 n GLN 38 Ca 0.05 0.00 0.24 0.00 0.07 0.00 0.00 57.00 57.36 2kc0 n GLN 38 Cb 0.30 -0.54 0.43 0.00 2.41 0.00 0.00 30.24 32.83 2kc0 n GLN 38 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2kc0 h SER 39 N 0.00 0.00 -3.71 1.69 0.87 -1.92 -3.42 113.55 107.06 2kc0 h SER 39 Ca 0.00 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.18 2kc0 h SER 39 Cb 0.09 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 61.90 2kc0 h SER 39 CO 0.00 0.00 -0.70 0.54 -0.53 0.00 0.00 176.83 176.14 2kc0 s VAL 40 N -4.40 1.27 0.37 2.23 0.11 -1.26 -5.15 120.40 113.56 2kc0 s VAL 40 Ca -0.03 -2.09 0.08 0.00 -2.93 0.00 0.00 61.98 57.02 2kc0 s VAL 40 Cb 0.13 -2.08 -0.06 0.00 -1.53 0.00 0.00 36.38 32.84 2kc0 s VAL 40 CO 0.42 -0.55 0.06 0.00 -3.33 0.00 0.00 175.10 171.70 2kc0 s ARG 41 N -3.76 2.12 0.55 1.54 1.70 -1.26 -4.90 118.95 114.93 2kc0 s ARG 41 Ca 0.22 -1.81 0.40 0.00 -0.47 0.00 0.00 55.73 54.07 2kc0 s ARG 41 Cb 0.03 -1.92 1.56 0.00 -0.57 0.00 0.00 34.95 34.06 2kc0 s ARG 41 CO 0.05 0.04 1.71 0.87 -1.08 0.00 0.00 175.30 176.90 2kc0 h LYS 42 N 1.69 0.00 -2.23 3.89 1.57 -2.00 -2.99 116.57 116.50 2kc0 h LYS 42 Ca -0.43 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.77 2kc0 h LYS 42 Cb 1.25 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 33.17 2kc0 h LYS 42 CO 0.69 0.00 -0.96 0.27 -0.57 0.00 0.00 179.45 178.89 2kc0 n ASN 43 N -4.02 0.67 -4.00 0.86 6.94 -1.26 -4.82 115.26 109.63 2kc0 n ASN 43 Ca 0.30 -2.73 -0.15 0.00 -0.02 0.00 0.00 54.58 51.98 2kc0 n ASN 43 Cb 1.45 -0.63 -0.13 0.00 -2.36 0.00 0.00 39.78 38.11 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 -0.99 0.46 -0.02 -3.83 2.12 -1.13 -4.92 118.70 110.40 2kc0 s GLU 44 Ca 0.34 -0.42 0.06 0.00 0.36 0.00 0.00 54.97 55.31 2kc0 s GLU 44 Cb 0.11 -0.35 -0.01 0.00 0.26 0.00 0.00 34.13 34.13 2kc0 s GLU 44 CO -0.13 0.08 -0.19 0.21 -0.54 0.00 0.00 175.26 174.69 2kc0 s LYS 45 N -0.72 1.60 -0.10 4.30 2.20 -0.68 -3.66 119.74 122.67 2kc0 s LYS 45 Ca -0.03 -0.69 -0.10 0.00 -0.36 0.00 0.00 55.97 54.79 2kc0 s LYS 45 Cb -0.05 -1.53 0.03 0.00 -1.51 0.00 0.00 37.83 34.76 2kc0 s LYS 45 CO 0.00 0.41 0.28 -0.48 -0.36 0.00 0.00 175.35 175.20 2kc0 s LEU 46 N -0.43 0.93 -0.16 5.43 2.34 -0.13 -0.78 118.68 125.88 2kc0 s LEU 46 Ca 0.07 0.55 -0.15 0.00 0.06 0.00 0.00 54.13 54.66 2kc0 s LEU 46 Cb -0.08 0.97 -0.04 0.00 -0.56 0.00 0.00 46.19 46.47 2kc0 s LEU 46 CO -0.01 -0.11 0.34 -0.54 -1.06 0.00 0.00 176.35 174.98 2kc0 s LYS 47 N 0.10 4.26 -0.10 1.48 1.02 -0.67 -1.20 119.74 124.63 2kc0 s LYS 47 Ca -0.00 0.17 0.04 0.00 0.02 0.00 0.00 55.97 56.19 2kc0 s LYS 47 Cb -0.02 -3.45 -0.00 0.00 -0.52 0.00 0.00 37.83 33.84 2kc0 s LYS 47 CO 0.00 0.17 -0.24 -1.17 -0.92 0.00 0.00 175.35 173.20 2kc0 s LEU 48 N 0.66 2.09 -0.18 3.17 1.98 -0.54 -0.83 118.68 125.02 2kc0 s LEU 48 Ca 0.18 -0.56 -0.24 0.00 -2.89 0.00 0.00 54.13 50.63 2kc0 s LEU 48 Cb -0.14 -1.41 0.06 0.00 0.66 0.00 0.00 46.19 45.37 2kc0 s LEU 48 CO 0.06 0.16 0.63 0.00 -1.89 0.00 0.00 176.35 175.31 2kc0 s ALA 49 N 0.31 -1.57 -0.03 5.97 0.00 -0.49 -0.25 121.76 125.70 2kc0 s ALA 49 Ca -0.18 1.60 -0.29 0.00 0.00 0.00 0.00 51.96 53.08 2kc0 s ALA 49 Cb -0.18 -0.75 0.08 0.00 0.00 0.00 0.00 23.12 22.27 2kc0 s ALA 49 CO 0.09 -0.31 0.72 0.00 0.00 0.00 0.00 175.76 176.25 2kc0 s ALA 50 N -0.10 -1.76 -1.43 0.00 0.00 -0.78 -1.12 121.76 116.57 2kc0 s ALA 50 Ca -0.03 1.20 -0.07 0.00 0.00 0.00 0.00 51.96 53.06 2kc0 s ALA 50 Cb -0.04 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.20 2kc0 s ALA 50 CO 0.03 -0.44 0.83 0.94 0.00 0.00 0.00 175.76 177.12 2kc0 n GLN 51 N 0.62 -5.14 -0.94 0.00 -0.06 -1.26 -1.74 117.38 108.87 2kc0 n GLN 51 Ca -0.17 0.60 0.00 0.00 -2.00 0.00 0.00 57.00 55.42 2kc0 n GLN 51 Cb 0.59 -5.30 0.00 0.00 -4.06 0.00 0.00 30.24 21.47 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 -1.66 0.69 3.71 1.69 0.00 -1.26 -4.60 105.19 103.76 2kc0 n GLY 52 Ca -0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.95 3.32 -0.19 4.61 0.00 -0.71 -5.08 121.76 120.77 2kc0 s ALA 53 Ca 0.00 -1.58 -0.12 0.00 0.00 0.00 0.00 51.96 50.26 2kc0 s ALA 53 Cb 0.00 -0.95 0.06 0.00 0.00 0.00 0.00 23.12 22.23 2kc0 s ALA 53 CO 0.00 0.25 0.46 -1.83 0.00 0.00 0.00 175.76 174.65 2kc0 s GLU 54 N -3.74 0.47 -0.19 0.00 -1.05 -1.26 -1.86 118.70 111.08 2kc0 s GLU 54 Ca 0.32 0.82 0.01 0.00 -0.15 0.00 0.00 54.97 55.97 2kc0 s GLU 54 Cb -0.07 0.06 0.03 0.00 -0.44 0.00 0.00 34.13 33.72 2kc0 s GLU 54 CO 0.22 -0.14 -0.14 0.21 0.95 0.00 0.00 175.26 176.36 2kc0 s LYS 55 N 1.19 2.39 -0.24 -4.83 2.47 0.65 -4.77 119.74 116.59 2kc0 s LYS 55 Ca -0.08 -0.81 -0.20 0.00 -1.56 0.00 0.00 55.97 53.33 2kc0 s LYS 55 Cb -0.07 -2.41 -0.02 0.00 -1.46 0.00 0.00 37.83 33.87 2kc0 s LYS 55 CO -0.11 -0.33 0.62 0.99 0.16 0.00 0.00 175.35 176.68 2kc0 s THR 56 N 1.37 5.00 0.29 3.43 2.01 -1.26 -1.47 115.64 125.01 2kc0 s THR 56 Ca 0.01 1.11 0.05 0.00 0.31 0.00 0.00 61.69 63.18 2kc0 s THR 56 Cb -0.15 -3.92 -0.02 0.00 0.01 0.00 0.00 72.50 68.42 2kc0 s THR 56 CO -0.10 0.05 0.27 0.00 -0.69 0.00 0.00 174.62 174.15 2kc0 n TYR 57 N 5.57 -0.78 -0.65 4.92 0.18 -0.34 -5.00 117.16 121.05 2kc0 n TYR 57 Ca -0.01 -2.36 0.00 0.00 1.88 0.00 0.00 57.90 57.41 2kc0 n TYR 57 Cb 0.49 0.29 0.00 0.00 -0.38 0.00 0.00 39.34 39.74 2kc0 n TYR 57 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2kc0 n GLY 58 N -0.54 3.81 3.71 -7.48 0.00 -1.26 -0.96 105.19 102.47 2kc0 n GLY 58 Ca 0.06 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 2kc0 n GLY 58 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2kc0 n ASN 59 N 0.00 3.84 0.00 1.61 2.85 -1.24 -3.42 115.26 118.91 2kc0 n ASN 59 Ca 0.00 1.05 0.00 0.00 -0.11 0.00 0.00 54.58 55.52 2kc0 n ASN 59 Cb 0.00 -1.54 0.00 0.00 1.24 0.00 0.00 39.78 39.48 2kc0 n ASN 59 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2kc0 n GLY 60 N 3.91 0.65 3.24 8.20 0.00 -1.26 -5.09 105.19 114.83 2kc0 n GLY 60 Ca 0.16 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 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 0.96 0.88 -3.63 1.61 2.03 -1.22 -4.98 116.55 112.19 2kc0 n ASP 61 Ca 0.00 -1.82 -0.13 0.00 0.52 0.00 0.00 54.79 53.36 2kc0 n ASP 61 Cb 0.00 -0.62 -0.07 0.00 -0.72 0.00 0.00 41.12 39.72 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 -4.56 -0.66 -0.16 1.67 1.04 -1.26 -2.75 113.70 107.03 2kc0 s SER 62 Ca 0.57 1.24 -0.29 0.00 0.48 0.00 0.00 55.95 57.95 2kc0 s SER 62 Cb -0.03 1.25 -0.04 0.00 0.10 0.00 0.00 66.02 67.30 2kc0 s SER 62 CO 0.38 -0.24 1.68 -0.22 0.98 0.00 0.00 173.24 175.83 2kc0 s LEU 63 N 0.25 4.03 -0.32 2.42 1.98 -0.58 -4.64 118.68 121.81 2kc0 s LEU 63 Ca 0.00 1.88 -0.28 0.00 -2.89 0.00 0.00 54.13 52.84 2kc0 s LEU 63 Cb -0.05 -3.53 -0.02 0.00 0.66 0.00 0.00 46.19 43.25 2kc0 s LEU 63 CO -0.01 -1.19 1.84 0.20 -1.89 0.00 0.00 176.35 175.31 2kc0 s ASN 64 N 4.21 5.84 -0.03 3.68 -0.87 -1.26 -1.90 114.94 124.62 2kc0 s ASN 64 Ca 0.75 1.35 0.11 0.00 -1.57 0.00 0.00 52.86 53.50 2kc0 s ASN 64 Cb -0.29 -2.52 0.20 0.00 -0.02 0.00 0.00 41.25 38.61 2kc0 s ASN 64 CO 0.30 -1.74 1.08 1.07 -2.57 0.00 0.00 177.10 175.24 2kc0 n THR 65 N 7.45 0.32 -0.92 1.60 5.66 -0.78 -4.94 114.28 122.67 2kc0 n THR 65 Ca 0.24 -0.75 -0.33 0.00 -3.05 0.00 0.00 64.05 60.15 2kc0 n THR 65 Cb 0.47 0.55 0.12 0.00 -1.55 0.00 0.00 70.33 69.91 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 -0.04 -1.30 3.59 1.09 0.00 -0.56 -4.31 105.19 103.66 2kc0 n GLY 66 Ca 0.05 -0.63 -0.19 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.23 -0.90 -4.36 1.61 4.81 -1.26 -4.89 118.16 110.94 2kc0 n LYS 67 Ca 0.09 0.01 -0.20 0.00 -0.87 0.00 0.00 58.31 57.35 2kc0 n LYS 67 Cb 0.52 -1.86 -0.10 0.00 0.02 0.00 0.00 35.03 33.60 2kc0 n LYS 67 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2kc0 s LEU 68 N -5.63 2.55 -0.51 3.14 1.02 -1.26 -5.10 118.68 112.89 2kc0 s LEU 68 Ca 0.04 -1.00 -0.28 0.00 0.02 0.00 0.00 54.13 52.91 2kc0 s LEU 68 Cb -0.02 -0.75 0.01 0.00 0.02 0.00 0.00 46.19 45.44 2kc0 s LEU 68 CO 0.56 -0.13 1.49 -0.54 0.02 0.00 0.00 176.35 177.76 2kc0 s LYS 69 N -3.53 3.31 0.00 1.70 -0.14 -1.26 -4.98 119.74 114.85 2kc0 s LYS 69 Ca 0.23 0.68 0.00 0.00 -1.36 0.00 0.00 55.97 55.52 2kc0 s LYS 69 Cb -0.02 -4.13 0.00 0.00 -1.68 0.00 0.00 37.83 32.00 2kc0 s LYS 69 CO 0.08 -1.91 0.00 0.09 -0.76 0.00 0.00 175.35 172.85 2kc0 n ASN 70 N 9.73 0.00 -3.63 2.83 3.02 -1.26 -4.86 115.26 121.10 2kc0 n ASN 70 Ca 0.15 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.43 2kc0 n ASN 70 Cb 0.49 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.69 2kc0 n ASN 70 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2kc0 n ASP 71 N 0.00 -5.05 -3.81 6.41 2.03 -0.48 -4.98 116.55 110.67 2kc0 n ASP 71 Ca 0.00 -0.59 -0.08 0.00 0.52 0.00 0.00 54.79 54.64 2kc0 n ASP 71 Cb 0.00 -4.05 -0.03 0.00 -0.72 0.00 0.00 41.12 36.32 2kc0 n ASP 71 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2kc0 s LYS 72 N -6.32 1.66 -0.25 -0.67 -2.85 -0.25 -4.99 119.74 106.07 2kc0 s LYS 72 Ca 0.55 -0.95 -0.12 0.00 -1.00 0.00 0.00 55.97 54.45 2kc0 s LYS 72 Cb -0.27 0.58 -0.05 0.00 -2.06 0.00 0.00 37.83 36.04 2kc0 s LYS 72 CO 0.68 -0.75 0.24 0.08 0.10 0.00 0.00 175.35 175.70 2kc0 s VAL 73 N -3.91 5.29 0.13 1.79 1.01 -1.26 -0.52 120.40 122.93 2kc0 s VAL 73 Ca 0.11 0.31 -0.23 0.00 0.00 0.00 0.00 61.98 62.18 2kc0 s VAL 73 Cb -0.04 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.69 2kc0 s VAL 73 CO 0.04 0.27 0.69 -0.44 0.00 0.00 0.00 175.10 175.66 2kc0 s SER 74 N 1.39 7.24 -0.05 3.32 0.01 0.40 -4.95 113.70 121.06 2kc0 s SER 74 Ca 0.10 1.48 -0.10 0.00 1.31 0.00 0.00 55.95 58.75 2kc0 s SER 74 Cb -0.15 -2.44 -0.05 0.00 0.21 0.00 0.00 66.02 63.59 2kc0 s SER 74 CO 0.08 0.22 0.26 0.00 0.41 0.00 0.00 173.24 174.21 2kc0 s ARG 75 N -1.19 3.63 -0.06 12.44 3.03 -1.26 -1.63 118.95 133.91 2kc0 s ARG 75 Ca 0.34 0.07 -0.04 0.00 2.03 0.00 0.00 55.73 58.12 2kc0 s ARG 75 Cb -0.21 -3.18 0.02 0.00 -1.03 0.00 0.00 34.95 30.55 2kc0 s ARG 75 CO 0.23 0.72 0.15 -0.06 -1.13 0.00 0.00 175.30 175.21 2kc0 s PHE 76 N -1.10 -0.16 0.39 5.89 0.08 -0.92 -4.88 117.98 117.28 2kc0 s PHE 76 Ca 0.20 0.42 -0.23 0.00 0.12 0.00 0.00 56.93 57.45 2kc0 s PHE 76 Cb -0.14 0.02 -0.11 0.00 -0.57 0.00 0.00 43.02 42.22 2kc0 s PHE 76 CO 0.10 -0.10 0.94 0.34 -0.10 0.00 0.00 175.22 176.39 2kc0 s ASP 77 N 0.39 7.07 -0.08 1.36 -1.08 -0.27 -1.14 116.67 122.91 2kc0 s ASP 77 Ca -0.03 1.73 -0.04 0.00 -0.52 0.00 0.00 52.55 53.69 2kc0 s ASP 77 Cb -0.04 -2.55 0.03 0.00 -1.46 0.00 0.00 42.92 38.91 2kc0 s ASP 77 CO -0.02 -0.26 0.18 0.12 0.52 0.00 0.00 175.17 175.72 2kc0 s PHE 78 N -1.99 -0.22 -0.05 -5.34 2.19 -0.58 -1.40 117.98 110.59 2kc0 s PHE 78 Ca 0.58 0.57 -0.02 0.00 0.33 0.00 0.00 56.93 58.39 2kc0 s PHE 78 Cb -0.12 -0.00 0.03 0.00 -1.31 0.00 0.00 43.02 41.62 2kc0 s PHE 78 CO 0.17 -0.17 0.04 0.42 1.83 0.00 0.00 175.22 177.51 2kc0 s ILE 79 N 0.89 0.04 -0.22 3.12 1.01 -0.01 -1.34 121.20 124.69 2kc0 s ILE 79 Ca -0.07 0.32 -0.05 0.00 0.00 0.00 0.00 60.65 60.86 2kc0 s ILE 79 Cb -0.08 -0.26 -0.02 0.00 0.01 0.00 0.00 42.46 42.11 2kc0 s ILE 79 CO -0.05 0.20 -0.00 -0.60 0.00 0.00 0.00 174.94 174.48 2kc0 s ARG 80 N 2.01 3.54 0.01 2.79 3.52 -0.69 -1.67 118.95 128.47 2kc0 s ARG 80 Ca 0.04 -0.55 -0.04 0.00 -0.13 0.00 0.00 55.73 55.05 2kc0 s ARG 80 Cb -0.12 -3.10 -0.01 0.00 -1.56 0.00 0.00 34.95 30.16 2kc0 s ARG 80 CO -0.04 -0.10 0.06 -1.14 -0.81 0.00 0.00 175.30 173.28 2kc0 s GLN 81 N 1.28 0.37 0.08 5.12 0.74 0.04 -2.00 119.66 125.30 2kc0 s GLN 81 Ca 0.04 -0.43 0.03 0.00 0.05 0.00 0.00 55.36 55.05 2kc0 s GLN 81 Cb -0.15 0.15 -0.03 0.00 1.10 0.00 0.00 33.01 34.08 2kc0 s GLN 81 CO 0.01 -0.08 -0.09 0.42 -0.55 0.00 0.00 175.29 175.00 2kc0 s ILE 82 N -1.27 0.79 -0.40 -2.34 1.01 -1.26 -1.69 121.20 116.05 2kc0 s ILE 82 Ca -0.14 -1.56 -0.28 0.00 0.00 0.00 0.00 60.65 58.67 2kc0 s ILE 82 Cb -0.08 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.14 2kc0 s ILE 82 CO 0.00 -0.58 1.67 -1.61 0.00 0.00 0.00 174.94 174.43 2kc0 s GLU 83 N -2.71 3.33 -0.57 2.79 2.02 -1.26 -4.61 118.70 117.68 2kc0 s GLU 83 Ca 0.03 1.15 -0.18 0.00 0.02 0.00 0.00 54.97 55.99 2kc0 s GLU 83 Cb -0.03 -4.16 0.11 0.00 0.10 0.00 0.00 34.13 30.15 2kc0 s GLU 83 CO -0.01 -1.87 0.62 0.08 0.02 0.00 0.00 175.26 174.10 2kc0 s VAL 84 N 6.65 4.98 -1.44 2.63 1.01 -1.09 -4.44 120.40 128.70 2kc0 s VAL 84 Ca 0.72 -1.20 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2kc0 s VAL 84 Cb -0.18 -4.42 0.00 0.00 0.00 0.00 0.00 36.38 31.78 2kc0 s VAL 84 CO 0.32 -1.01 0.00 -0.67 0.00 0.00 0.00 175.10 173.73 2kc0 n ASP 85 N 5.88 -4.17 0.00 3.32 2.03 -1.26 -0.49 116.55 121.85 2kc0 n ASP 85 Ca -0.11 0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.46 2kc0 n ASP 85 Cb 0.41 -3.68 0.00 0.00 -0.72 0.00 0.00 41.12 37.13 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 -0.54 0.51 3.90 0.27 0.00 -1.26 -5.08 105.19 102.99 2kc0 n GLY 86 Ca -0.16 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.14 3.47 -0.84 1.61 -0.21 0.35 -5.06 119.66 117.84 2kc0 s GLN 87 Ca 0.00 -0.28 0.01 0.00 0.02 0.00 0.00 55.36 55.12 2kc0 s GLN 87 Cb 0.00 -3.08 0.31 0.00 1.00 0.00 0.00 33.01 31.24 2kc0 s GLN 87 CO 0.00 0.65 1.31 1.28 -2.12 0.00 0.00 175.29 176.42 2kc0 n LEU 88 N 0.87 5.70 -4.78 2.90 4.32 -1.26 -2.67 117.00 122.08 2kc0 n LEU 88 Ca -0.10 -5.45 -0.39 0.00 -0.02 0.00 0.00 56.01 50.04 2kc0 n LEU 88 Cb 0.52 -0.92 -0.06 0.00 -1.62 0.00 0.00 43.42 41.34 2kc0 n LEU 88 CO 0.44 2.07 0.38 -0.63 -1.22 0.00 0.00 177.39 178.43 2kc0 s ILE 89 N -3.75 4.65 -0.11 -0.08 1.01 -1.26 -5.09 121.20 116.57 2kc0 s ILE 89 Ca 0.41 1.46 -0.06 0.00 0.00 0.00 0.00 60.65 62.45 2kc0 s ILE 89 Cb 0.18 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 2kc0 s ILE 89 CO -0.06 0.48 0.12 0.42 0.00 0.00 0.00 174.94 175.90 2kc0 s THR 90 N -0.74 5.34 0.00 2.92 -4.23 -1.26 -4.34 115.64 113.33 2kc0 s THR 90 Ca 0.33 0.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.98 2kc0 s THR 90 Cb -0.21 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.31 2kc0 s THR 90 CO 0.22 0.61 0.00 0.18 -0.54 0.00 0.00 174.62 175.09 2kc0 n LEU 91 N 1.98 0.00 -3.73 4.79 4.77 -0.85 -4.66 117.00 119.30 2kc0 n LEU 91 Ca -0.20 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.62 2kc0 n LEU 91 Cb 0.55 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.47 2kc0 n LEU 91 CO 0.31 0.00 -0.34 -1.61 -1.33 0.00 0.00 177.39 174.42 2kc0 s GLU 92 N -1.36 -0.05 -0.06 3.23 2.02 -1.26 -3.92 118.70 117.30 2kc0 s GLU 92 Ca 0.00 0.27 -0.10 0.00 0.02 0.00 0.00 54.97 55.16 2kc0 s GLU 92 Cb 0.00 -0.33 0.02 0.00 0.10 0.00 0.00 34.13 33.92 2kc0 s GLU 92 CO 0.00 -0.23 0.24 -1.12 0.02 0.00 0.00 175.26 174.18 2kc0 s SER 93 N 1.48 -0.20 0.00 -0.19 0.01 -1.26 -1.70 113.70 111.84 2kc0 s SER 93 Ca -0.04 0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2kc0 s SER 93 Cb -0.13 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.53 2kc0 s SER 93 CO -0.03 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.02 2kc0 n GLY 94 N 2.34 -0.57 3.52 3.44 0.00 -0.45 -4.46 105.19 109.01 2kc0 n GLY 94 Ca -0.16 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.06 3.31 -0.52 1.61 2.02 0.70 -1.53 118.70 123.23 2kc0 s GLU 95 Ca 0.00 -0.30 -0.28 0.00 0.02 0.00 0.00 54.97 54.40 2kc0 s GLU 95 Cb 0.00 -4.07 0.02 0.00 0.10 0.00 0.00 34.13 30.18 2kc0 s GLU 95 CO 0.00 -1.54 1.31 0.12 0.02 0.00 0.00 175.26 175.17 2kc0 s PHE 96 N 4.03 2.47 -0.39 1.61 5.36 -0.29 -0.86 117.98 129.92 2kc0 s PHE 96 Ca 0.30 0.54 -0.12 0.00 -0.96 0.00 0.00 56.93 56.69 2kc0 s PHE 96 Cb -0.13 -4.42 0.03 0.00 -0.34 0.00 0.00 43.02 38.16 2kc0 s PHE 96 CO 0.18 -1.77 0.24 -1.14 -1.46 0.00 0.00 175.22 171.27 2kc0 s GLN 97 N 5.08 2.85 -0.30 10.12 -0.44 -0.30 -2.16 119.66 134.52 2kc0 s GLN 97 Ca 0.51 -1.09 0.01 0.00 -2.50 0.00 0.00 55.36 52.29 2kc0 s GLN 97 Cb -0.10 -3.81 0.06 0.00 -1.64 0.00 0.00 33.01 27.53 2kc0 s GLN 97 CO 0.28 -0.73 -0.02 0.08 0.50 0.00 0.00 175.29 175.39 2kc0 s VAL 98 N 1.58 2.62 0.22 1.34 1.01 -0.65 -1.68 120.40 124.84 2kc0 s VAL 98 Ca 0.03 -1.63 -0.30 0.00 0.00 0.00 0.00 61.98 60.08 2kc0 s VAL 98 Cb -0.19 -2.58 -0.08 0.00 0.00 0.00 0.00 36.38 33.52 2kc0 s VAL 98 CO 0.07 -0.17 0.98 -0.47 0.00 0.00 0.00 175.10 175.52 2kc0 s TYR 99 N 1.15 3.86 -0.15 5.22 6.14 -0.21 -0.45 117.35 132.91 2kc0 s TYR 99 Ca -0.04 1.84 0.02 0.00 0.64 0.00 0.00 57.07 59.53 2kc0 s TYR 99 Cb -0.20 -3.06 0.01 0.00 0.42 0.00 0.00 41.96 39.13 2kc0 s TYR 99 CO -0.04 0.17 -0.21 0.15 0.64 0.00 0.00 175.55 176.26 2kc0 s LYS 100 N -0.93 3.02 0.06 4.97 3.01 0.32 -2.42 119.74 127.76 2kc0 s LYS 100 Ca 0.43 -0.84 -0.00 0.00 -1.01 0.00 0.00 55.97 54.55 2kc0 s LYS 100 Cb -0.27 -2.48 0.00 0.00 -1.01 0.00 0.00 37.83 34.07 2kc0 s LYS 100 CO 0.33 -0.07 0.08 0.00 0.51 0.00 0.00 175.35 176.20 2kc0 n GLN 101 N 4.23 0.11 0.00 1.68 0.00 -0.42 -1.09 117.38 121.90 2kc0 n GLN 101 Ca -0.20 -0.44 0.00 0.00 0.00 0.00 0.00 57.00 56.36 2kc0 n GLN 101 Cb 0.51 0.42 0.00 0.00 0.00 0.00 0.00 30.24 31.17 2kc0 n GLN 101 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2kc0 n SER 102 N -2.03 0.00 -1.18 2.61 7.64 -1.26 -2.72 113.62 116.68 2kc0 n SER 102 Ca 0.00 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.89 2kc0 n SER 102 Cb 0.09 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.29 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 -0.96 0.00 -3.87 1.43 8.25 -1.26 -5.09 115.22 113.72 2kc0 n HIS 103 Ca 0.00 -0.39 -0.09 0.00 -0.26 0.00 0.00 57.72 56.98 2kc0 n HIS 103 Cb 0.00 0.01 -0.08 0.00 1.12 0.00 0.00 29.99 31.04 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 -1.53 0.11 -0.02 0.41 0.01 -1.10 -4.40 113.70 107.18 2kc0 s SER 104 Ca 0.20 -0.56 -0.30 0.00 1.31 0.00 0.00 55.95 56.61 2kc0 s SER 104 Cb 0.23 0.31 0.07 0.00 0.21 0.00 0.00 66.02 66.84 2kc0 s SER 104 CO -0.10 -0.65 0.68 0.00 0.41 0.00 0.00 173.24 173.59 2kc0 s ALA 105 N -3.32 -1.75 0.01 1.44 0.00 -0.45 -1.30 121.76 116.39 2kc0 s ALA 105 Ca 0.01 1.20 -0.02 0.00 0.00 0.00 0.00 51.96 53.14 2kc0 s ALA 105 Cb 0.03 0.12 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2kc0 s ALA 105 CO -0.08 -0.44 0.03 -0.48 0.00 0.00 0.00 175.76 174.79 2kc0 s LEU 106 N -1.45 2.01 0.26 0.00 0.05 -1.02 -0.91 118.68 117.64 2kc0 s LEU 106 Ca -0.08 -0.40 0.08 0.00 0.05 0.00 0.00 54.13 53.77 2kc0 s LEU 106 Cb -0.00 0.29 -0.04 0.00 -2.05 0.00 0.00 46.19 44.39 2kc0 s LEU 106 CO 0.06 -0.32 0.11 0.28 -0.55 0.00 0.00 176.35 175.92 2kc0 s THR 107 N -1.44 3.91 0.05 5.48 -1.32 -1.01 -1.05 115.64 120.26 2kc0 s THR 107 Ca -0.16 -1.65 -0.08 0.00 -1.21 0.00 0.00 61.69 58.60 2kc0 s THR 107 Cb -0.09 -3.13 -0.00 0.00 -1.51 0.00 0.00 72.50 67.77 2kc0 s THR 107 CO -0.00 -0.35 0.15 0.00 -2.21 0.00 0.00 174.62 172.21 2kc0 s ALA 108 N -2.24 -0.19 -0.08 11.08 0.00 -0.68 -0.99 121.76 128.67 2kc0 s ALA 108 Ca 0.33 -0.49 -0.03 0.00 0.00 0.00 0.00 51.96 51.76 2kc0 s ALA 108 Cb -0.07 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 2kc0 s ALA 108 CO 0.23 -0.38 0.07 -0.06 0.00 0.00 0.00 175.76 175.62 2kc0 s PHE 109 N -2.93 3.35 -0.39 0.00 0.40 -0.47 -1.15 117.98 116.79 2kc0 s PHE 109 Ca -0.02 0.32 0.03 0.00 -0.60 0.00 0.00 56.93 56.66 2kc0 s PHE 109 Cb 0.01 -1.83 0.16 0.00 0.51 0.00 0.00 43.02 41.87 2kc0 s PHE 109 CO -0.06 0.59 0.38 -0.65 0.70 0.00 0.00 175.22 176.17 2kc0 s GLN 110 N -1.15 0.72 0.09 0.44 -0.21 -0.04 -2.28 119.66 117.23 2kc0 s GLN 110 Ca 0.16 -1.20 -0.10 0.00 0.02 0.00 0.00 55.36 54.25 2kc0 s GLN 110 Cb -0.12 -0.88 -0.06 0.00 1.00 0.00 0.00 33.01 32.95 2kc0 s GLN 110 CO 0.06 -1.25 0.42 -0.08 -2.12 0.00 0.00 175.29 172.32 2kc0 s THR 111 N 1.05 5.06 -0.19 -0.19 -1.32 -0.63 -0.22 115.64 119.20 2kc0 s THR 111 Ca 0.21 0.49 0.14 0.00 -1.21 0.00 0.00 61.69 61.32 2kc0 s THR 111 Cb -0.12 -3.66 -0.21 0.00 -1.51 0.00 0.00 72.50 67.00 2kc0 s THR 111 CO -0.05 0.26 0.02 -0.62 -2.21 0.00 0.00 174.62 172.02 2kc0 n GLU 112 N 0.83 0.93 -3.63 7.08 1.02 -1.26 -1.40 120.64 124.20 2kc0 n GLU 112 Ca -0.07 0.02 -0.11 0.00 -0.02 0.00 0.00 57.16 56.97 2kc0 n GLU 112 Cb 0.52 -1.47 -0.07 0.00 -0.02 0.00 0.00 31.44 30.40 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 -2.45 0.75 0.27 3.49 1.03 -1.26 -3.48 119.66 118.01 2kc0 s GLN 113 Ca -0.13 1.01 -0.03 0.00 0.04 0.00 0.00 55.36 56.25 2kc0 s GLN 113 Cb 0.06 0.30 -0.02 0.00 0.03 0.00 0.00 33.01 33.39 2kc0 s GLN 113 CO 0.72 -0.11 0.34 0.96 -2.54 0.00 0.00 175.29 174.66 2kc0 s ILE 114 N 0.75 0.00 0.55 3.63 -0.00 -0.43 -4.66 121.20 121.04 2kc0 s ILE 114 Ca -0.03 -1.73 -0.04 0.00 -0.00 0.00 0.00 60.65 58.85 2kc0 s ILE 114 Cb -0.05 -2.47 0.12 0.00 -0.00 0.00 0.00 42.46 40.06 2kc0 s ILE 114 CO -0.06 0.00 0.75 1.67 -0.00 0.00 0.00 174.94 177.30 2kc0 n GLN 115 N -0.44 -0.25 -4.48 0.37 7.27 -1.25 -0.62 117.38 117.97 2kc0 n GLN 115 Ca 0.02 -1.65 -0.23 0.00 0.07 0.00 0.00 57.00 55.20 2kc0 n GLN 115 Cb 0.63 -0.62 -0.10 0.00 2.41 0.00 0.00 30.24 32.55 2kc0 n GLN 115 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2kc0 s ASP 116 N -3.93 3.13 -0.60 1.69 -1.08 -1.26 -4.75 116.67 109.87 2kc0 s ASP 116 Ca 0.47 -1.23 0.04 0.00 -0.52 0.00 0.00 52.55 51.31 2kc0 s ASP 116 Cb -0.02 -0.24 0.36 0.00 -1.46 0.00 0.00 42.92 41.56 2kc0 s ASP 116 CO 0.32 -0.34 1.15 -0.24 0.52 0.00 0.00 175.17 176.58 2kc0 n SER 117 N -0.70 5.04 0.14 -0.34 2.88 -1.26 -4.20 113.62 115.18 2kc0 n SER 117 Ca -0.05 -3.71 0.00 0.00 -1.33 0.00 0.00 58.87 53.78 2kc0 n SER 117 Cb 0.64 -0.63 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 2kc0 n SER 117 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2kc0 n GLU 118 N -0.31 0.00 -0.00 -1.46 0.28 -1.26 -4.85 120.64 113.03 2kc0 n GLU 118 Ca 0.36 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.36 2kc0 n GLU 118 Cb 0.45 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.32 2kc0 n GLU 118 CO 0.00 0.00 0.00 1.58 -0.16 0.00 0.00 177.13 178.55 2kc0 n HIS 119 N -3.42 0.01 -0.75 -1.84 -0.00 -1.26 -4.90 115.22 103.05 2kc0 n HIS 119 Ca 0.00 -0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2kc0 n HIS 119 Cb 0.00 -0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2kc0 n HIS 119 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 2kc0 n SER 120 N -0.48 -3.75 -2.66 0.26 7.64 -1.26 -4.54 113.62 108.83 2kc0 n SER 120 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 2kc0 n SER 120 Cb 0.00 -2.87 -0.00 0.00 -1.01 0.00 0.00 64.21 60.33 2kc0 n SER 120 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kc0 n GLY 121 N 0.14 -0.96 0.00 0.23 0.00 -1.26 -5.06 105.19 98.28 2kc0 n GLY 121 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2kc0 n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kc0 n LYS 122 N -0.36 -0.39 -3.64 1.61 4.76 -1.26 -5.01 118.16 113.87 2kc0 n LYS 122 Ca -0.26 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.11 2kc0 n LYS 122 Cb 0.65 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.78 2kc0 n LYS 122 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 2kc0 s MET 123 N -1.78 0.49 -0.07 1.97 -2.45 -1.26 -4.61 119.30 111.58 2kc0 s MET 123 Ca 0.00 0.65 -0.15 0.00 -1.25 0.00 0.00 55.69 54.95 2kc0 s MET 123 Cb 0.00 0.20 0.03 0.00 1.25 0.00 0.00 34.83 36.31 2kc0 s MET 123 CO 0.00 -0.07 0.35 0.54 1.05 0.00 0.00 175.02 176.89 2kc0 s VAL 124 N 0.61 0.03 -0.98 10.11 0.11 0.21 -4.91 120.40 125.58 2kc0 s VAL 124 Ca -0.01 -0.24 -0.04 0.00 -2.93 0.00 0.00 61.98 58.76 2kc0 s VAL 124 Cb -0.05 -0.59 0.16 0.00 -1.53 0.00 0.00 36.38 34.37 2kc0 s VAL 124 CO -0.09 -0.13 2.37 0.00 -3.33 0.00 0.00 175.10 173.92 2kc0 n ALA 125 N 1.98 6.56 -2.64 1.54 0.00 -1.26 -1.32 120.51 125.37 2kc0 n ALA 125 Ca -0.18 -3.88 -0.42 0.00 0.00 0.00 0.00 53.44 48.97 2kc0 n ALA 125 Cb 0.57 -2.42 -0.03 0.00 0.00 0.00 0.00 19.45 17.57 2kc0 n ALA 125 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2kc0 s LYS 126 N -2.15 3.23 -1.21 0.00 3.01 -1.23 -4.82 119.74 116.58 2kc0 s LYS 126 Ca 0.53 -0.31 -0.11 0.00 -1.01 0.00 0.00 55.97 55.06 2kc0 s LYS 126 Cb 0.27 -4.16 -0.06 0.00 -1.01 0.00 0.00 37.83 32.87 2kc0 s LYS 126 CO -0.17 -1.94 2.37 0.54 0.51 0.00 0.00 175.35 176.66 2kc0 n ARG 127 N 8.66 2.63 -2.56 1.68 1.74 -1.24 -4.11 116.66 123.47 2kc0 n ARG 127 Ca 0.02 -1.97 -0.41 0.00 -0.77 0.00 0.00 57.85 54.72 2kc0 n ARG 127 Cb 0.48 -2.80 -0.03 0.00 -1.02 0.00 0.00 32.46 29.10 2kc0 n ARG 127 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2kc0 s GLN 128 N 3.26 3.25 -0.04 5.56 0.74 -0.50 -4.88 119.66 127.06 2kc0 s GLN 128 Ca 0.53 -0.15 -0.00 0.00 0.05 0.00 0.00 55.36 55.79 2kc0 s GLN 128 Cb 0.14 -4.15 -0.04 0.00 1.10 0.00 0.00 33.01 30.07 2kc0 s GLN 128 CO -0.03 -2.06 0.02 -0.59 -0.55 0.00 0.00 175.29 172.08 2kc0 s PHE 129 N 5.59 3.15 0.21 1.67 -0.71 -1.26 -1.61 117.98 125.01 2kc0 s PHE 129 Ca 0.36 0.15 -0.20 0.00 -1.04 0.00 0.00 56.93 56.20 2kc0 s PHE 129 Cb -0.08 -1.73 0.04 0.00 -1.21 0.00 0.00 43.02 40.04 2kc0 s PHE 129 CO 0.17 0.48 0.60 0.50 -1.34 0.00 0.00 175.22 175.64 2kc0 s ARG 130 N -1.32 1.45 0.78 1.99 6.06 -0.97 -4.89 118.95 122.05 2kc0 s ARG 130 Ca 0.18 -0.76 -0.11 0.00 -2.50 0.00 0.00 55.73 52.54 2kc0 s ARG 130 Cb -0.12 0.57 0.06 0.00 0.06 0.00 0.00 34.95 35.52 2kc0 s ARG 130 CO 0.08 -0.64 1.09 -1.50 -2.50 0.00 0.00 175.30 171.82 2kc0 s ILE 131 N -3.84 3.32 0.00 4.11 1.10 -1.26 -1.37 121.20 123.25 2kc0 s ILE 131 Ca 0.07 0.43 0.00 0.00 -0.51 0.00 0.00 60.65 60.63 2kc0 s ILE 131 Cb -0.02 -3.11 0.00 0.00 0.15 0.00 0.00 42.46 39.47 2kc0 s ILE 131 CO -0.04 -0.56 0.00 0.61 -2.11 0.00 0.00 174.94 172.84 2kc0 n GLY 132 N -1.85 6.44 3.77 1.50 0.00 -0.16 -4.60 105.19 110.28 2kc0 n GLY 132 Ca 0.07 -1.98 -0.39 0.00 0.00 0.00 0.00 46.02 43.72 2kc0 n GLY 132 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kc0 s ASP 133 N 0.41 7.16 -0.31 1.61 1.01 -1.26 -4.76 116.67 120.54 2kc0 s ASP 133 Ca 0.00 2.14 -0.12 0.00 0.71 0.00 0.00 52.55 55.28 2kc0 s ASP 133 Cb 0.00 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 2kc0 s ASP 133 CO 0.00 -0.21 0.22 -0.63 0.21 0.00 0.00 175.17 174.76 2kc0 s ILE 134 N -1.33 5.29 0.04 0.77 -1.09 -1.26 -2.41 121.20 121.21 2kc0 s ILE 134 Ca 0.48 0.02 0.05 0.00 -2.23 0.00 0.00 60.65 58.98 2kc0 s ILE 134 Cb -0.28 -3.62 -0.03 0.00 -1.58 0.00 0.00 42.46 36.95 2kc0 s ILE 134 CO 0.35 0.13 -0.12 0.00 -1.23 0.00 0.00 174.94 174.07 2kc0 s ALA 135 N 1.76 2.84 0.00 9.38 0.00 -0.08 -5.02 121.76 130.64 2kc0 s ALA 135 Ca 0.07 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.90 2kc0 s ALA 135 Cb -0.17 -0.93 0.00 0.00 0.00 0.00 0.00 23.12 22.02 2kc0 s ALA 135 CO 0.11 0.60 0.00 0.41 0.00 0.00 0.00 175.76 176.88 2kc0 n GLY 136 N 1.41 -0.79 2.99 0.00 0.00 -1.26 -1.34 105.19 106.19 2kc0 n GLY 136 Ca -0.15 -1.29 -0.17 0.00 0.00 0.00 0.00 46.02 44.40 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 0.55 -0.02 1.61 2.02 -1.26 -5.03 118.70 114.57 2kc0 s GLU 137 Ca 0.00 -0.25 0.04 0.00 0.02 0.00 0.00 54.97 54.79 2kc0 s GLU 137 Cb 0.00 -0.53 -0.01 0.00 0.10 0.00 0.00 34.13 33.69 2kc0 s GLU 137 CO 0.00 0.15 -0.15 -3.38 0.02 0.00 0.00 175.26 171.90 2kc0 s HIS 138 N -0.17 1.34 0.19 1.61 -3.43 -1.26 -1.07 115.29 112.50 2kc0 s HIS 138 Ca 0.03 -0.28 -0.01 0.00 -0.80 0.00 0.00 55.06 54.00 2kc0 s HIS 138 Cb -0.03 -0.87 -0.04 0.00 -1.43 0.00 0.00 32.58 30.21 2kc0 s HIS 138 CO -0.00 -0.05 0.38 0.95 -2.00 0.00 0.00 174.74 174.02 2kc0 s THR 139 N -0.25 5.21 0.66 -5.38 -4.23 -1.26 -4.68 115.64 105.71 2kc0 s THR 139 Ca 0.04 -0.32 -0.13 0.00 -1.18 0.00 0.00 61.69 60.09 2kc0 s THR 139 Cb -0.07 -3.72 -0.00 0.00 1.34 0.00 0.00 72.50 70.06 2kc0 s THR 139 CO -0.00 -0.14 1.07 -0.44 -0.54 0.00 0.00 174.62 174.58 2kc0 s SER 140 N -3.05 5.33 0.26 3.99 0.01 -1.20 -4.74 113.70 114.29 2kc0 s SER 140 Ca 0.39 1.79 0.01 0.00 1.31 0.00 0.00 55.95 59.45 2kc0 s SER 140 Cb -0.11 -2.52 0.33 0.00 0.21 0.00 0.00 66.02 63.92 2kc0 s SER 140 CO 0.28 -1.48 1.66 2.19 0.41 0.00 0.00 173.24 176.31 2kc0 h PHE 141 N -0.23 0.56 0.00 2.43 -5.15 -1.90 -2.10 116.94 110.55 2kc0 h PHE 141 Ca -0.45 -0.14 0.00 0.00 -0.20 0.00 0.00 57.97 57.17 2kc0 h PHE 141 Cb 1.22 -0.13 0.00 0.00 0.22 0.00 0.00 35.95 37.27 2kc0 h PHE 141 CO 0.59 0.77 0.00 -3.47 -2.00 0.00 0.00 178.31 174.19 2kc0 n ASP 142 N -4.07 2.23 0.01 -0.68 2.03 -1.26 -2.74 116.55 112.08 2kc0 n ASP 142 Ca -0.01 -1.87 0.00 0.00 0.52 0.00 0.00 54.79 53.43 2kc0 n ASP 142 Cb 0.46 -0.47 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2kc0 n ASP 142 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2kc0 n LYS 143 N 0.38 0.00 -0.82 -0.67 5.02 -1.22 -5.11 118.16 115.74 2kc0 n LYS 143 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 2kc0 n LYS 143 Cb 0.40 0.00 0.16 0.00 -0.02 0.00 0.00 35.03 35.56 2kc0 n LYS 143 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2kc0 s LEU 144 N -5.10 2.72 0.64 -0.35 1.43 -0.79 -5.07 118.68 112.16 2kc0 s LEU 144 Ca 0.00 2.04 -0.10 0.00 -1.03 0.00 0.00 54.13 55.05 2kc0 s LEU 144 Cb 0.00 -4.45 -0.01 0.00 0.03 0.00 0.00 46.19 41.76 2kc0 s LEU 144 CO 0.00 -2.95 1.02 -2.16 0.23 0.00 0.00 176.35 172.49 2kc0 s PRO 145 N -4.70 3.15 -0.39 1.29 0.04 -1.26 -4.89 135.00 128.24 2kc0 s PRO 145 Ca 0.66 0.44 0.10 0.00 0.04 0.00 0.00 61.00 62.24 2kc0 s PRO 145 Cb -0.22 -2.11 0.44 0.00 0.04 0.00 0.00 34.50 32.65 2kc0 s PRO 145 CO 0.58 -0.76 1.06 0.39 0.04 0.00 0.00 177.00 178.31 2kc0 n GLU 146 N -2.79 2.66 -3.95 4.56 1.02 -1.26 -5.01 120.64 115.86 2kc0 n GLU 146 Ca 0.06 -4.06 -0.11 0.00 -0.02 0.00 0.00 57.16 53.02 2kc0 n GLU 146 Cb 0.56 -1.91 -0.13 0.00 -0.02 0.00 0.00 31.44 29.95 2kc0 n GLU 146 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2kc0 s GLY 147 N -3.42 0.16 0.00 0.62 0.00 -1.26 -3.62 107.32 99.80 2kc0 s GLY 147 Ca 0.41 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.81 2kc0 s GLY 147 CO -0.10 -0.35 0.00 0.61 0.00 0.00 0.00 173.10 173.26 2kc0 n GLY 148 N 2.34 -1.54 3.14 0.20 0.00 -1.26 -4.57 105.19 103.50 2kc0 n GLY 148 Ca -0.18 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.32 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 0.00 0.75 -0.08 1.61 1.70 -1.26 -1.04 118.95 120.63 2kc0 s ARG 149 Ca 0.00 -1.19 0.01 0.00 -0.47 0.00 0.00 55.73 54.07 2kc0 s ARG 149 Cb 0.00 0.26 0.02 0.00 -0.57 0.00 0.00 34.95 34.66 2kc0 s ARG 149 CO 0.00 -0.19 -0.08 0.00 -1.08 0.00 0.00 175.30 173.95 2kc0 s ALA 150 N -3.93 1.13 0.19 7.88 0.00 -0.51 -4.92 121.76 121.59 2kc0 s ALA 150 Ca 0.10 -0.38 -0.29 0.00 0.00 0.00 0.00 51.96 51.40 2kc0 s ALA 150 Cb 0.07 -0.69 -0.08 0.00 0.00 0.00 0.00 23.12 22.42 2kc0 s ALA 150 CO -0.08 -0.16 0.91 0.99 0.00 0.00 0.00 175.76 177.42 2kc0 s THR 151 N 1.21 4.26 0.03 0.00 2.01 -1.26 -2.25 115.64 119.63 2kc0 s THR 151 Ca -0.05 1.99 0.01 0.00 0.31 0.00 0.00 61.69 63.96 2kc0 s THR 151 Cb -0.14 -4.28 -0.02 0.00 0.01 0.00 0.00 72.50 68.07 2kc0 s THR 151 CO -0.02 0.45 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.00 2kc0 s TYR 152 N -0.84 0.45 -0.03 4.92 2.02 -0.11 -4.30 117.35 119.47 2kc0 s TYR 152 Ca 0.41 -0.42 0.02 0.00 -0.37 0.00 0.00 57.07 56.71 2kc0 s TYR 152 Cb -0.25 -0.28 0.01 0.00 -0.40 0.00 0.00 41.96 41.04 2kc0 s TYR 152 CO 0.30 -0.10 -0.05 0.50 -1.57 0.00 0.00 175.55 174.62 2kc0 s ARG 153 N -1.22 0.72 0.29 -0.62 3.00 -1.13 -1.48 118.95 118.51 2kc0 s ARG 153 Ca -0.10 -0.16 -0.04 0.00 -1.00 0.00 0.00 55.73 54.43 2kc0 s ARG 153 Cb -0.08 -0.72 -0.01 0.00 0.00 0.00 0.00 34.95 34.14 2kc0 s ARG 153 CO -0.00 0.01 0.40 0.20 0.00 0.00 0.00 175.30 175.91 2kc0 s GLY 154 N 0.48 1.30 -0.07 8.12 0.00 -0.30 -2.42 107.32 114.42 2kc0 s GLY 154 Ca -0.06 -1.43 0.03 0.00 0.00 0.00 0.00 44.72 43.26 2kc0 s GLY 154 CO 0.00 -1.01 -0.15 -1.59 0.00 0.00 0.00 173.10 170.35 2kc0 s THR 155 N -3.53 3.00 -0.20 0.90 2.01 -0.24 -2.06 115.64 115.52 2kc0 s THR 155 Ca 0.31 -0.73 -0.05 0.00 0.31 0.00 0.00 61.69 61.53 2kc0 s THR 155 Cb 0.01 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.30 2kc0 s THR 155 CO 0.16 0.57 0.01 0.00 -0.69 0.00 0.00 174.62 174.67 2kc0 s ALA 156 N -0.42 3.07 -0.09 7.40 0.00 -1.26 -2.77 121.76 127.70 2kc0 s ALA 156 Ca 0.05 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.06 2kc0 s ALA 156 Cb -0.12 -1.79 0.02 0.00 0.00 0.00 0.00 23.12 21.23 2kc0 s ALA 156 CO 0.02 -0.10 -0.11 -0.59 0.00 0.00 0.00 175.76 174.98 2kc0 s PHE 157 N 0.91 1.54 -0.03 0.00 -0.71 -1.09 -4.08 117.98 114.52 2kc0 s PHE 157 Ca 0.01 -0.67 -0.29 0.00 -1.04 0.00 0.00 56.93 54.95 2kc0 s PHE 157 Cb -0.14 -1.18 0.10 0.00 -1.21 0.00 0.00 43.02 40.59 2kc0 s PHE 157 CO 0.02 -0.39 0.88 0.20 -1.34 0.00 0.00 175.22 174.58 2kc0 s GLY 158 N 1.10 -0.44 -0.67 1.99 0.00 -1.26 -1.09 107.32 106.94 2kc0 s GLY 158 Ca -0.06 1.23 -0.07 0.00 0.00 0.00 0.00 44.72 45.82 2kc0 s GLY 158 CO -0.02 0.53 3.07 -1.26 0.00 0.00 0.00 173.10 175.42 2kc0 n SER 159 N 0.05 6.19 0.00 1.64 2.88 -1.26 -2.93 113.62 120.19 2kc0 n SER 159 Ca -0.10 -2.44 0.00 0.00 -1.33 0.00 0.00 58.87 54.99 2kc0 n SER 159 Cb 0.61 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.71 2kc0 n SER 159 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2kc0 n ASP 160 N 3.08 0.00 0.00 -3.46 2.03 -1.26 -5.06 116.55 111.88 2kc0 n ASP 160 Ca 0.54 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.85 2kc0 n ASP 160 Cb 0.55 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 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 -0.94 0.00 -0.26 1.67 2.03 -1.15 -4.98 116.55 112.93 2kc0 n ASP 161 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 2kc0 n ASP 161 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 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 -1.40 -0.04 0.00 -1.67 0.00 -1.19 -4.71 120.51 111.50 2kc0 n ALA 162 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2kc0 n ALA 162 Cb 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 0.43 0.38 2.92 0.00 0.00 -1.26 -4.84 105.19 102.82 2kc0 n GLY 163 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 1.26 3.62 3.81 -0.02 0.00 -1.26 -4.83 105.19 107.76 2kc0 n GLY 164 Ca 0.00 -1.46 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 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 3.94 2.82 0.16 1.61 1.02 -1.26 -4.32 119.74 123.70 2kc0 s LYS 165 Ca 0.51 1.01 -0.05 0.00 0.02 0.00 0.00 55.97 57.47 2kc0 s LYS 165 Cb 0.13 -1.97 -0.03 0.00 -0.52 0.00 0.00 37.83 35.44 2kc0 s LYS 165 CO -0.01 -1.20 0.18 -0.48 -0.92 0.00 0.00 175.35 172.92 2kc0 s LEU 166 N -5.57 1.31 0.04 3.17 -0.00 -0.87 -1.18 118.68 115.58 2kc0 s LEU 166 Ca 0.59 -1.07 0.04 0.00 -0.00 0.00 0.00 54.13 53.69 2kc0 s LEU 166 Cb -0.15 0.75 -0.04 0.00 -0.00 0.00 0.00 46.19 46.75 2kc0 s LEU 166 CO 0.54 -0.83 -0.06 -0.89 -0.00 0.00 0.00 176.35 175.12 2kc0 s THR 167 N -4.02 3.68 0.10 5.48 2.01 -0.23 -1.15 115.64 121.51 2kc0 s THR 167 Ca 0.22 -0.92 0.07 0.00 0.31 0.00 0.00 61.69 61.38 2kc0 s THR 167 Cb 0.05 -2.66 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 2kc0 s THR 167 CO 0.02 0.27 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.73 2kc0 s TYR 168 N -1.11 1.64 -0.02 4.92 1.51 -0.55 -1.38 117.35 122.35 2kc0 s TYR 168 Ca 0.20 -0.44 -0.04 0.00 -1.01 0.00 0.00 57.07 55.79 2kc0 s TYR 168 Cb -0.11 -0.90 0.00 0.00 -0.11 0.00 0.00 41.96 40.85 2kc0 s TYR 168 CO 0.11 0.17 0.09 -0.08 -1.11 0.00 0.00 175.55 174.73 2kc0 s THR 169 N -1.27 0.04 -0.28 -0.71 -1.32 -0.33 -0.94 115.64 110.83 2kc0 s THR 169 Ca 0.05 -0.30 0.02 0.00 -1.21 0.00 0.00 61.69 60.25 2kc0 s THR 169 Cb -0.10 -0.23 0.08 0.00 -1.51 0.00 0.00 72.50 70.74 2kc0 s THR 169 CO 0.04 -0.16 -0.01 -0.51 -2.21 0.00 0.00 174.62 171.76 2kc0 s ILE 170 N -0.50 1.77 -0.96 5.08 2.07 -0.95 -1.64 121.20 126.07 2kc0 s ILE 170 Ca -0.06 -1.64 -0.24 0.00 -1.41 0.00 0.00 60.65 57.30 2kc0 s ILE 170 Cb -0.04 -2.12 0.01 0.00 0.13 0.00 0.00 42.46 40.44 2kc0 s ILE 170 CO 0.00 -0.31 1.64 -1.81 -1.91 0.00 0.00 174.94 172.55 2kc0 s ASP 171 N 1.23 5.95 0.35 4.50 1.01 -1.16 -1.43 116.67 127.13 2kc0 s ASP 171 Ca 0.00 -1.08 0.06 0.00 0.71 0.00 0.00 52.55 52.25 2kc0 s ASP 171 Cb -0.19 -2.56 0.73 0.00 1.01 0.00 0.00 42.92 41.91 2kc0 s ASP 171 CO -0.09 -2.01 1.93 -0.26 0.21 0.00 0.00 175.17 174.95 2kc0 h PHE 172 N 10.49 0.82 0.00 4.23 -1.00 -1.36 0.13 116.94 130.25 2kc0 h PHE 172 Ca 0.13 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.93 2kc0 h PHE 172 Cb 1.01 -0.27 0.00 0.00 3.61 0.00 0.00 35.95 40.31 2kc0 h PHE 172 CO 1.25 0.40 0.00 0.00 -1.61 0.00 0.00 178.31 178.34 2kc0 n ALA 173 N -2.44 1.65 0.38 2.45 0.00 -0.94 -1.95 120.51 119.66 2kc0 n ALA 173 Ca 0.13 0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.67 2kc0 n ALA 173 Cb 0.29 -1.35 -0.02 0.00 0.00 0.00 0.00 19.45 18.37 2kc0 n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kc0 n ALA 174 N -1.72 2.87 -3.76 0.00 0.00 -0.36 -4.98 120.51 112.55 2kc0 n ALA 174 Ca 0.02 -0.34 -0.29 0.00 0.00 0.00 0.00 53.44 52.83 2kc0 n ALA 174 Cb 0.21 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.37 2kc0 n ALA 174 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2kc0 n LYS 175 N -0.64 -4.16 -4.78 0.00 4.81 0.33 -5.00 118.16 108.72 2kc0 n LYS 175 Ca 0.03 0.51 -0.27 0.00 -0.87 0.00 0.00 58.31 57.71 2kc0 n LYS 175 Cb 0.16 -5.30 -0.17 0.00 0.02 0.00 0.00 35.03 29.74 2kc0 n LYS 175 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2kc0 s GLN 176 N -6.45 2.09 -0.46 1.64 -1.52 -1.19 -4.24 119.66 109.54 2kc0 s GLN 176 Ca 0.58 -0.56 -0.17 0.00 -1.95 0.00 0.00 55.36 53.27 2kc0 s GLN 176 Cb -0.30 -1.67 0.05 0.00 -0.22 0.00 0.00 33.01 30.87 2kc0 s GLN 176 CO 0.71 0.08 0.45 0.20 -0.25 0.00 0.00 175.29 176.49 2kc0 s GLY 177 N 0.54 1.93 0.45 3.09 0.00 0.46 -2.96 107.32 110.83 2kc0 s GLY 177 Ca -0.15 -1.81 0.06 0.00 0.00 0.00 0.00 44.72 42.82 2kc0 s GLY 177 CO 0.05 1.17 0.21 0.21 0.00 0.00 0.00 173.10 174.74 2kc0 s ASN 178 N 2.29 4.45 0.06 1.64 3.84 -0.65 -1.66 114.94 124.91 2kc0 s ASN 178 Ca 0.09 -1.17 -0.15 0.00 0.21 0.00 0.00 52.86 51.84 2kc0 s ASN 178 Cb -0.20 -0.18 0.05 0.00 -0.55 0.00 0.00 41.25 40.37 2kc0 s ASN 178 CO 0.10 -0.70 0.69 0.61 -2.79 0.00 0.00 177.10 175.01 2kc0 n GLY 179 N -1.36 0.67 3.61 1.21 0.00 -1.26 -1.18 105.19 106.87 2kc0 n GLY 179 Ca -0.03 -1.02 -0.07 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.02 0.39 0.18 1.61 -2.85 -0.48 -3.30 119.74 113.27 2kc0 s LYS 180 Ca 0.16 0.17 -0.26 0.00 -1.00 0.00 0.00 55.97 55.04 2kc0 s LYS 180 Cb -0.01 0.19 -0.08 0.00 -2.06 0.00 0.00 37.83 35.86 2kc0 s LYS 180 CO 0.02 -0.11 0.80 0.42 0.10 0.00 0.00 175.35 176.58 2kc0 s ILE 181 N -0.77 4.33 -0.27 3.79 -1.09 -0.75 -1.07 121.20 125.38 2kc0 s ILE 181 Ca 0.03 1.75 -0.03 0.00 -2.23 0.00 0.00 60.65 60.16 2kc0 s ILE 181 Cb -0.02 -4.16 0.15 0.00 -1.58 0.00 0.00 42.46 36.86 2kc0 s ILE 181 CO -0.04 0.52 0.51 -0.70 -1.23 0.00 0.00 174.94 174.00 2kc0 s GLU 182 N -1.16 0.46 0.00 2.79 2.12 -0.32 -4.33 118.70 118.25 2kc0 s GLU 182 Ca 0.36 0.89 0.00 0.00 0.36 0.00 0.00 54.97 56.59 2kc0 s GLU 182 Cb -0.23 0.20 0.00 0.00 0.26 0.00 0.00 34.13 34.35 2kc0 s GLU 182 CO 0.27 -0.54 0.00 1.58 -0.54 0.00 0.00 175.26 176.03 2kc0 n HIS 183 N 5.40 0.00 -2.20 5.30 -0.00 -1.26 -4.40 115.22 118.07 2kc0 n HIS 183 Ca -0.04 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 57.81 2kc0 n HIS 183 Cb 0.50 0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 30.37 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 3.60 0.47 0.27 2.01 -1.26 -4.95 118.68 118.82 2kc0 s LEU 184 Ca 0.00 1.83 0.22 0.00 0.01 0.00 0.00 54.13 56.20 2kc0 s LEU 184 Cb 0.00 -4.54 1.24 0.00 0.01 0.00 0.00 46.19 42.90 2kc0 s LEU 184 CO 0.00 -1.03 1.91 0.07 1.01 0.00 0.00 176.35 178.31 2kc0 h LYS 185 N 0.77 0.22 -4.60 1.70 2.10 -2.01 -3.43 116.57 111.32 2kc0 h LYS 185 Ca -0.48 -0.01 -0.31 0.00 -2.00 0.00 0.00 60.65 57.85 2kc0 h LYS 185 Cb 1.22 -0.05 -0.23 0.00 -0.90 0.00 0.00 32.23 32.27 2kc0 h LYS 185 CO 0.58 0.14 -0.75 -1.54 -2.00 0.00 0.00 179.45 175.89 2kc0 s SER 186 N -5.82 0.90 0.46 7.07 1.04 -1.26 -5.06 113.70 111.03 2kc0 s SER 186 Ca -0.07 -0.43 0.11 0.00 0.48 0.00 0.00 55.95 56.04 2kc0 s SER 186 Cb 0.21 -0.01 1.04 0.00 0.10 0.00 0.00 66.02 67.36 2kc0 s SER 186 CO 0.77 -0.11 2.09 1.55 0.98 0.00 0.00 173.24 178.51 2kc0 h PRO 187 N 4.90 0.28 0.00 4.02 0.13 -1.94 -2.09 132.00 137.30 2kc0 h PRO 187 Ca -0.34 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2kc0 h PRO 187 Cb 1.20 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2kc0 h PRO 187 CO 0.43 0.20 0.00 0.39 -0.23 0.00 0.00 178.00 178.79 2kc0 n GLU 188 N -4.49 0.15 -0.03 0.86 1.02 -1.26 -2.48 120.64 114.42 2kc0 n GLU 188 Ca 0.00 0.51 -0.17 0.00 -0.02 0.00 0.00 57.16 57.49 2kc0 n GLU 188 Cb 0.09 -1.88 -0.14 0.00 -0.02 0.00 0.00 31.44 29.49 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 -2.18 2.05 -4.77 -4.62 4.77 -0.79 -4.13 117.00 107.34 2kc0 n LEU 189 Ca 0.00 0.20 -0.40 0.00 -0.03 0.00 0.00 56.01 55.79 2kc0 n LEU 189 Cb 0.13 -0.65 -0.02 0.00 -2.33 0.00 0.00 43.42 40.54 2kc0 n LEU 189 CO 0.14 0.72 0.89 0.20 -1.33 0.00 0.00 177.39 178.01 2kc0 s ASN 190 N -6.63 6.77 0.13 -1.43 0.01 -1.03 -4.00 114.94 108.77 2kc0 s ASN 190 Ca -0.19 2.47 0.07 0.00 -0.71 0.00 0.00 52.86 54.51 2kc0 s ASN 190 Cb 0.07 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 39.06 2kc0 s ASN 190 CO 0.77 -0.51 -0.07 0.68 -1.51 0.00 0.00 177.10 176.46 2kc0 s VAL 191 N -1.25 3.47 0.43 1.60 -7.23 -1.26 -4.69 120.40 111.48 2kc0 s VAL 191 Ca 0.51 -1.34 -0.22 0.00 -1.81 0.00 0.00 61.98 59.12 2kc0 s VAL 191 Cb -0.35 -2.67 -0.10 0.00 0.56 0.00 0.00 36.38 33.82 2kc0 s VAL 191 CO 0.45 0.03 0.98 -1.81 -0.31 0.00 0.00 175.10 174.44 2kc0 s ASP 192 N -2.48 6.82 -0.15 4.85 1.01 -1.26 -1.80 116.67 123.66 2kc0 s ASP 192 Ca 0.24 1.80 -0.02 0.00 0.71 0.00 0.00 52.55 55.27 2kc0 s ASP 192 Cb -0.10 -2.55 -0.02 0.00 1.01 0.00 0.00 42.92 41.25 2kc0 s ASP 192 CO 0.15 -0.44 -0.08 -0.22 0.21 0.00 0.00 175.17 174.79 2kc0 s LEU 193 N -3.08 2.94 -0.22 1.23 0.20 -1.21 -4.10 118.68 114.45 2kc0 s LEU 193 Ca 0.62 -0.26 -0.29 0.00 0.69 0.00 0.00 54.13 54.88 2kc0 s LEU 193 Cb -0.13 -1.69 -0.01 0.00 -0.43 0.00 0.00 46.19 43.93 2kc0 s LEU 193 CO 0.17 0.14 1.30 0.00 -0.29 0.00 0.00 176.35 177.68 2kc0 s ALA 194 N 0.51 3.52 0.17 5.97 0.00 -0.40 -4.22 121.76 127.31 2kc0 s ALA 194 Ca -0.06 0.32 -0.33 0.00 0.00 0.00 0.00 51.96 51.89 2kc0 s ALA 194 Cb -0.15 -3.70 -0.15 0.00 0.00 0.00 0.00 23.12 19.12 2kc0 s ALA 194 CO 0.03 -1.46 1.36 0.00 0.00 0.00 0.00 175.76 175.70 2kc0 n ALA 195 N 7.13 0.23 -2.66 0.00 0.00 -1.26 -4.06 120.51 119.88 2kc0 n ALA 195 Ca 0.15 0.46 -0.09 0.00 0.00 0.00 0.00 53.44 53.95 2kc0 n ALA 195 Cb 0.46 -2.18 -0.11 0.00 0.00 0.00 0.00 19.45 17.61 2kc0 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kc0 s ALA 196 N 0.23 0.35 0.27 0.00 0.00 -0.66 -4.92 121.76 117.03 2kc0 s ALA 196 Ca 0.75 -0.84 0.06 0.00 0.00 0.00 0.00 51.96 51.93 2kc0 s ALA 196 Cb -0.77 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 2kc0 s ALA 196 CO 0.47 -0.20 0.35 0.16 0.00 0.00 0.00 175.76 176.54 2kc0 s ASP 197 N -1.98 6.03 0.24 0.00 -4.77 -1.26 -0.40 116.67 114.51 2kc0 s ASP 197 Ca -0.07 -0.09 -0.30 0.00 -3.30 0.00 0.00 52.55 48.80 2kc0 s ASP 197 Cb -0.04 -1.57 -0.09 0.00 -1.09 0.00 0.00 42.92 40.13 2kc0 s ASP 197 CO -0.03 -0.17 0.97 0.27 0.70 0.00 0.00 175.17 176.91 2kc0 s ILE 198 N -2.07 3.99 0.11 2.11 -4.36 -1.26 -3.96 121.20 115.76 2kc0 s ILE 198 Ca 0.37 1.97 0.09 0.00 -0.26 0.00 0.00 60.65 62.82 2kc0 s ILE 198 Cb -0.09 -4.25 -0.04 0.00 1.25 0.00 0.00 42.46 39.33 2kc0 s ILE 198 CO 0.29 0.45 -0.18 -0.54 0.24 0.00 0.00 174.94 175.20 2kc0 s LYS 199 N -1.11 1.81 0.00 0.37 1.02 -0.83 -4.97 119.74 116.03 2kc0 s LYS 199 Ca 0.42 -1.16 0.00 0.00 0.02 0.00 0.00 55.97 55.25 2kc0 s LYS 199 Cb -0.27 -2.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.92 2kc0 s LYS 199 CO 0.33 0.49 0.46 -0.35 -0.92 0.00 0.00 175.35 175.36 2kc0 n PRO 200 N 0.89 0.73 -1.29 -1.68 -0.04 -1.26 -3.76 135.00 128.58 2kc0 n PRO 200 Ca -0.16 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.02 2kc0 n PRO 200 Cb 0.53 -1.31 0.17 0.00 -0.04 0.00 0.00 33.50 32.85 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 0.05 2.63 0.00 3.54 1.01 -1.26 -5.02 116.67 117.62 2kc0 s ASP 201 Ca 0.00 1.00 0.00 0.00 0.71 0.00 0.00 52.55 54.26 2kc0 s ASP 201 Cb 0.00 -1.56 0.00 0.00 1.01 0.00 0.00 42.92 42.37 2kc0 s ASP 201 CO 0.00 -3.10 0.00 0.61 0.21 0.00 0.00 175.17 172.89 2kc0 n GLY 202 N -1.50 -0.76 0.13 0.21 0.00 -1.26 -4.13 105.19 97.87 2kc0 n GLY 202 Ca 0.07 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.38 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 -0.79 0.00 0.00 1.61 2.85 -1.26 -4.85 118.16 115.72 2kc0 n LYS 203 Ca 0.00 -0.39 0.00 0.00 -1.05 0.00 0.00 58.31 56.87 2kc0 n LYS 203 Cb 0.00 -0.31 0.00 0.00 -0.65 0.00 0.00 35.03 34.07 2kc0 n LYS 203 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2kc0 n ARG 204 N 0.00 0.00 -3.88 -1.58 1.74 -1.26 -5.14 116.66 106.54 2kc0 n ARG 204 Ca 0.00 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.95 2kc0 n ARG 204 Cb 0.53 -0.50 -0.01 0.00 -1.02 0.00 0.00 32.46 31.46 2kc0 n ARG 204 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 2kc0 n HIS 205 N -1.19 -1.72 0.00 -1.55 1.44 -1.26 -3.26 115.22 107.69 2kc0 n HIS 205 Ca 0.00 -2.18 0.00 0.00 -2.01 0.00 0.00 57.72 53.53 2kc0 n HIS 205 Cb 0.00 0.66 0.00 0.00 0.12 0.00 0.00 29.99 30.77 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 -0.69 0.00 -3.29 1.59 0.00 -1.26 -4.25 120.51 112.62 2kc0 n ALA 206 Ca -0.14 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.16 2kc0 n ALA 206 Cb 0.58 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 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 0.00 0.03 -0.12 0.00 1.01 -1.25 -4.75 120.40 115.33 2kc0 s VAL 207 Ca 0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 2kc0 s VAL 207 Cb 0.00 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.38 2kc0 s VAL 207 CO 0.00 -0.15 -0.00 -0.63 0.00 0.00 0.00 175.10 174.31 2kc0 s ILE 208 N -2.41 4.23 -0.13 2.22 -1.09 -0.32 -1.97 121.20 121.73 2kc0 s ILE 208 Ca -0.06 -0.26 -0.06 0.00 -2.23 0.00 0.00 60.65 58.05 2kc0 s ILE 208 Cb -0.01 -2.82 0.06 0.00 -1.58 0.00 0.00 42.46 38.11 2kc0 s ILE 208 CO -0.01 0.55 0.29 -0.55 -1.23 0.00 0.00 174.94 173.99 2kc0 s SER 209 N -0.34 -0.17 0.00 3.58 0.15 -1.25 -1.70 113.70 113.96 2kc0 s SER 209 Ca 0.07 0.64 0.00 0.00 0.70 0.00 0.00 55.95 57.36 2kc0 s SER 209 Cb -0.12 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 2kc0 s SER 209 CO 0.02 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 174.88 2kc0 n GLY 210 N 4.56 3.96 3.62 9.45 0.00 -0.56 -4.64 105.19 121.59 2kc0 n GLY 210 Ca -0.20 -1.61 -0.26 0.00 0.00 0.00 0.00 46.02 43.95 2kc0 n GLY 210 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kc0 s SER 211 N -0.89 4.51 -0.08 1.61 0.01 -1.26 -0.90 113.70 116.70 2kc0 s SER 211 Ca 0.00 -0.51 -0.04 0.00 1.31 0.00 0.00 55.95 56.72 2kc0 s SER 211 Cb 0.00 -0.86 0.04 0.00 0.21 0.00 0.00 66.02 65.41 2kc0 s SER 211 CO 0.00 0.09 0.18 -0.69 0.41 0.00 0.00 173.24 173.23 2kc0 s VAL 212 N -1.78 -0.14 0.92 3.43 1.01 -0.96 -1.27 120.40 121.61 2kc0 s VAL 212 Ca 0.27 0.23 -0.16 0.00 0.00 0.00 0.00 61.98 62.32 2kc0 s VAL 212 Cb -0.09 -0.30 0.22 0.00 0.00 0.00 0.00 36.38 36.21 2kc0 s VAL 212 CO 0.17 0.09 1.01 0.18 0.00 0.00 0.00 175.10 176.56 2kc0 n LEU 213 N 4.60 0.00 -3.68 3.92 4.77 -1.26 -0.61 117.00 124.74 2kc0 n LEU 213 Ca -0.19 -1.09 -0.12 0.00 -0.03 0.00 0.00 56.01 54.58 2kc0 n LEU 213 Cb 0.51 -0.84 -0.12 0.00 -2.33 0.00 0.00 43.42 40.64 2kc0 n LEU 213 CO 0.12 -1.63 -0.07 -0.47 -1.33 0.00 0.00 177.39 174.01 2kc0 s TYR 214 N -3.04 -0.52 -1.58 -1.77 5.04 -0.40 -4.70 117.35 110.38 2kc0 s TYR 214 Ca 0.61 1.12 -0.15 0.00 -2.44 0.00 0.00 57.07 56.21 2kc0 s TYR 214 Cb -0.04 0.10 0.11 0.00 0.35 0.00 0.00 41.96 42.48 2kc0 s TYR 214 CO 0.45 -0.36 0.94 -1.71 -1.34 0.00 0.00 175.55 173.52 2kc0 n ASN 215 N 5.01 -4.45 -3.93 4.32 5.15 -1.26 -0.92 115.26 119.18 2kc0 n ASN 215 Ca -0.13 -0.84 -0.26 0.00 -0.60 0.00 0.00 54.58 52.75 2kc0 n ASN 215 Cb 0.51 -3.60 -0.01 0.00 -0.53 0.00 0.00 39.78 36.16 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 -4.61 -3.73 0.00 1.20 1.13 -1.26 -4.89 117.38 105.22 2kc0 n GLN 216 Ca 0.05 0.45 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 2kc0 n GLN 216 Cb 0.52 -4.77 0.00 0.00 0.11 0.00 0.00 30.24 26.09 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 -4.40 0.00 -0.93 -1.58 0.00 -0.09 -5.16 120.51 108.35 2kc0 n ALA 217 Ca -0.24 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.21 2kc0 n ALA 217 Cb 0.65 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.10 2kc0 n ALA 217 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2kc0 n GLU 218 N 0.00 -0.29 -3.41 0.00 4.71 -1.26 -1.27 120.64 119.12 2kc0 n GLU 218 Ca 0.00 0.19 0.00 0.00 -0.01 0.00 0.00 57.16 57.34 2kc0 n GLU 218 Cb 0.00 -0.35 -0.03 0.00 -1.01 0.00 0.00 31.44 30.05 2kc0 n GLU 218 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2kc0 s LYS 219 N -0.23 0.55 0.27 3.49 2.20 -1.26 -4.69 119.74 120.06 2kc0 s LYS 219 Ca 0.00 1.19 0.00 0.00 -0.36 0.00 0.00 55.97 56.80 2kc0 s LYS 219 Cb 0.00 0.64 -0.00 0.00 -1.51 0.00 0.00 37.83 36.95 2kc0 s LYS 219 CO 0.00 -0.41 0.02 0.41 -0.36 0.00 0.00 175.35 175.01 2kc0 n GLY 220 N 5.43 3.80 3.10 5.54 0.00 0.22 -2.93 105.19 120.36 2kc0 n GLY 220 Ca -0.07 -2.24 -0.07 0.00 0.00 0.00 0.00 46.02 43.64 2kc0 n GLY 220 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kc0 s SER 221 N -2.50 0.44 0.08 1.61 1.04 0.33 -2.28 113.70 112.42 2kc0 s SER 221 Ca 0.02 -0.95 0.06 0.00 0.48 0.00 0.00 55.95 55.57 2kc0 s SER 221 Cb 0.00 0.21 -0.03 0.00 0.10 0.00 0.00 66.02 66.30 2kc0 s SER 221 CO 0.02 -0.61 -0.15 -0.72 0.98 0.00 0.00 173.24 172.76 2kc0 s TYR 222 N -3.84 1.33 -0.03 5.02 1.13 -0.07 -1.35 117.35 119.54 2kc0 s TYR 222 Ca 0.06 -0.46 -0.02 0.00 -1.41 0.00 0.00 57.07 55.25 2kc0 s TYR 222 Cb 0.07 -0.74 0.02 0.00 -1.10 0.00 0.00 41.96 40.21 2kc0 s TYR 222 CO -0.10 0.09 0.07 -1.12 -2.51 0.00 0.00 175.55 171.98 2kc0 s SER 223 N -1.80 -0.04 0.30 -0.18 0.01 -0.05 -1.49 113.70 110.45 2kc0 s SER 223 Ca -0.00 0.14 -0.12 0.00 1.31 0.00 0.00 55.95 57.28 2kc0 s SER 223 Cb -0.10 0.09 0.01 0.00 0.21 0.00 0.00 66.02 66.23 2kc0 s SER 223 CO 0.03 -0.07 0.56 -1.48 0.41 0.00 0.00 173.24 172.68 2kc0 s LEU 224 N 0.53 0.37 0.15 2.44 0.05 -0.69 -0.86 118.68 120.66 2kc0 s LEU 224 Ca -0.04 -1.06 0.02 0.00 0.05 0.00 0.00 54.13 53.09 2kc0 s LEU 224 Cb -0.06 1.99 -0.04 0.00 -2.05 0.00 0.00 46.19 46.02 2kc0 s LEU 224 CO -0.02 -1.29 -0.02 -0.83 -0.55 0.00 0.00 176.35 173.63 2kc0 s GLY 225 N -3.07 1.06 -0.12 -3.48 0.00 -0.85 -1.18 107.32 99.68 2kc0 s GLY 225 Ca 0.22 -1.50 -0.28 0.00 0.00 0.00 0.00 44.72 43.16 2kc0 s GLY 225 CO 0.12 -1.50 0.94 -0.42 0.00 0.00 0.00 173.10 172.23 2kc0 s ILE 226 N -3.64 4.83 0.02 0.90 -1.09 -1.26 -2.73 121.20 118.22 2kc0 s ILE 226 Ca 0.20 1.89 0.01 0.00 -2.23 0.00 0.00 60.65 60.52 2kc0 s ILE 226 Cb 0.06 -4.25 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 2kc0 s ILE 226 CO 0.01 0.02 0.05 -0.36 -1.23 0.00 0.00 174.94 173.43 2kc0 s PHE 227 N 1.99 3.18 0.00 3.97 0.08 -0.36 -4.56 117.98 122.28 2kc0 s PHE 227 Ca 0.45 0.13 0.00 0.00 0.12 0.00 0.00 56.93 57.62 2kc0 s PHE 227 Cb -0.18 -1.68 0.00 0.00 -0.57 0.00 0.00 43.02 40.59 2kc0 s PHE 227 CO 0.16 0.51 0.00 0.41 -0.10 0.00 0.00 175.22 176.20 2kc0 n GLY 228 N 1.11 -2.87 0.60 4.36 0.00 -0.23 -1.29 105.19 106.86 2kc0 n GLY 228 Ca -0.13 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.69 2kc0 n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kc0 n GLY 229 N -1.08 0.63 0.56 -0.02 0.00 -1.26 -1.27 105.19 102.75 2kc0 n GLY 229 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2kc0 n GLY 229 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kc0 n LYS 230 N 0.40 0.00 -3.53 1.61 4.76 -1.26 -5.02 118.16 115.12 2kc0 n LYS 230 Ca 0.00 -0.22 -0.26 0.00 -2.87 0.00 0.00 58.31 54.97 2kc0 n LYS 230 Cb 0.12 -0.00 0.05 0.00 -1.84 0.00 0.00 35.03 33.36 2kc0 n LYS 230 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kc0 n ALA 231 N 0.01 -2.53 0.09 7.82 0.00 -0.40 -4.95 120.51 120.54 2kc0 n ALA 231 Ca -0.03 -0.11 -0.06 0.00 0.00 0.00 0.00 53.44 53.24 2kc0 n ALA 231 Cb 0.55 -4.66 0.05 0.00 0.00 0.00 0.00 19.45 15.38 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 -1.57 0.17 -3.34 0.00 5.75 -1.39 -3.48 115.11 111.24 2kc0 h GLN 232 Ca -0.64 -0.16 -0.04 0.00 -0.15 0.00 0.00 58.65 57.67 2kc0 h GLN 232 Cb 1.34 0.04 -0.05 0.00 1.07 0.00 0.00 27.48 29.87 2kc0 h GLN 232 CO 0.46 0.85 0.08 -1.83 -2.65 0.00 0.00 178.83 175.75 2kc0 s GLU 233 N -3.39 1.85 -0.04 1.69 -1.05 -1.21 -2.93 118.70 113.61 2kc0 s GLU 233 Ca -0.03 -1.29 0.04 0.00 -0.15 0.00 0.00 54.97 53.54 2kc0 s GLU 233 Cb 0.11 0.55 -0.00 0.00 -0.44 0.00 0.00 34.13 34.35 2kc0 s GLU 233 CO 0.81 -0.82 -0.15 0.14 0.95 0.00 0.00 175.26 176.19 2kc0 s VAL 234 N -3.42 1.26 0.02 1.83 -7.23 -0.17 -1.22 120.40 111.48 2kc0 s VAL 234 Ca 0.18 -0.62 -0.01 0.00 -1.81 0.00 0.00 61.98 59.72 2kc0 s VAL 234 Cb -0.03 -1.10 -0.02 0.00 0.56 0.00 0.00 36.38 35.79 2kc0 s VAL 234 CO 0.11 0.37 -0.00 0.00 -0.31 0.00 0.00 175.10 175.27 2kc0 s ALA 235 N 0.14 0.07 0.00 1.32 0.00 -1.10 -2.23 121.76 119.96 2kc0 s ALA 235 Ca -0.05 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.35 2kc0 s ALA 235 Cb -0.11 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.16 2kc0 s ALA 235 CO 0.02 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.00 2kc0 n GLY 236 N 1.44 -0.68 3.33 0.00 0.00 -1.25 -2.00 105.19 106.03 2kc0 n GLY 236 Ca -0.23 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.27 0.06 1.61 1.04 -0.04 -1.63 113.70 110.46 2kc0 s SER 237 Ca 0.00 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.30 2kc0 s SER 237 Cb 0.00 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 2kc0 s SER 237 CO 0.00 -0.78 -0.12 0.00 0.98 0.00 0.00 173.24 173.31 2kc0 s ALA 238 N -3.27 1.00 0.05 5.32 0.00 0.16 -0.87 121.76 124.15 2kc0 s ALA 238 Ca -0.00 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.13 2kc0 s ALA 238 Cb 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 2kc0 s ALA 238 CO -0.08 0.13 -0.17 -2.00 0.00 0.00 0.00 175.76 173.64 2kc0 s GLU 239 N -1.55 1.05 -0.01 0.00 -6.30 -0.46 -0.33 118.70 111.11 2kc0 s GLU 239 Ca -0.03 -0.87 0.01 0.00 -2.50 0.00 0.00 54.97 51.58 2kc0 s GLU 239 Cb -0.09 -1.12 0.00 0.00 0.00 0.00 0.00 34.13 32.92 2kc0 s GLU 239 CO 0.02 0.27 -0.05 0.54 0.02 0.00 0.00 175.26 176.06 2kc0 s VAL 240 N -0.92 0.42 -0.98 3.70 0.11 -0.08 -0.51 120.40 122.13 2kc0 s VAL 240 Ca 0.03 -0.18 -0.07 0.00 -2.93 0.00 0.00 61.98 58.84 2kc0 s VAL 240 Cb -0.09 -0.39 0.25 0.00 -1.53 0.00 0.00 36.38 34.62 2kc0 s VAL 240 CO 0.02 0.14 0.92 -0.54 -3.33 0.00 0.00 175.10 172.31 2kc0 s LYS 241 N 0.19 3.74 0.96 1.54 1.02 -1.15 -0.80 119.74 125.22 2kc0 s LYS 241 Ca -0.02 -3.10 -0.12 0.00 0.02 0.00 0.00 55.97 52.75 2kc0 s LYS 241 Cb -0.06 -4.30 0.16 0.00 -0.52 0.00 0.00 37.83 33.12 2kc0 s LYS 241 CO -0.00 -1.25 1.11 0.95 -0.92 0.00 0.00 175.35 175.24 2kc0 s THR 242 N -1.04 2.10 0.56 2.17 -4.23 0.01 -4.57 115.64 110.65 2kc0 s THR 242 Ca 0.27 0.03 0.29 0.00 -1.18 0.00 0.00 61.69 61.10 2kc0 s THR 242 Cb -0.10 -2.63 0.41 0.00 1.34 0.00 0.00 72.50 71.52 2kc0 s THR 242 CO -0.09 -0.04 1.93 0.58 -0.54 0.00 0.00 174.62 176.46 2kc0 h VAL 243 N -1.70 0.51 -0.01 2.29 2.07 -2.00 -0.62 116.25 116.79 2kc0 h VAL 243 Ca -0.53 0.00 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2kc0 h VAL 243 Cb 1.33 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2kc0 h VAL 243 CO 0.59 0.00 -0.22 0.59 0.02 0.00 0.00 177.57 178.55 2kc0 n ASN 244 N -4.03 1.15 0.00 0.57 3.02 -1.26 -5.08 115.26 109.63 2kc0 n ASN 244 Ca 0.11 -1.02 0.00 0.00 -0.03 0.00 0.00 54.58 53.64 2kc0 n ASN 244 Cb 0.71 0.12 0.00 0.00 -0.61 0.00 0.00 39.78 40.00 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 1.32 -0.46 3.79 7.41 0.00 -0.24 -5.09 105.19 111.91 2kc0 n GLY 245 Ca 0.13 -2.21 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 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 3.74 -0.07 -0.61 1.10 -1.26 -0.81 121.20 123.29 2kc0 s ILE 246 Ca 0.00 1.18 -0.03 0.00 -0.51 0.00 0.00 60.65 61.29 2kc0 s ILE 246 Cb 0.00 -3.53 0.04 0.00 0.15 0.00 0.00 42.46 39.12 2kc0 s ILE 246 CO 0.00 -0.14 0.14 -0.60 -2.11 0.00 0.00 174.94 172.23 2kc0 s ARG 247 N -2.95 0.05 0.13 3.50 3.52 0.02 -4.91 118.95 118.30 2kc0 s ARG 247 Ca 0.64 0.47 -0.12 0.00 -0.13 0.00 0.00 55.73 56.58 2kc0 s ARG 247 Cb -0.19 -0.25 -0.06 0.00 -1.56 0.00 0.00 34.95 32.89 2kc0 s ARG 247 CO 0.23 -0.25 0.49 -1.01 -0.81 0.00 0.00 175.30 173.95 2kc0 s HIS 248 N 1.82 3.58 -0.01 5.12 3.76 -1.26 -0.90 115.29 127.40 2kc0 s HIS 248 Ca -0.02 0.93 0.01 0.00 -0.15 0.00 0.00 55.06 55.83 2kc0 s HIS 248 Cb -0.12 -2.27 0.00 0.00 1.11 0.00 0.00 32.58 31.30 2kc0 s HIS 248 CO -0.06 0.45 -0.02 0.42 -0.85 0.00 0.00 174.74 174.68 2kc0 s ILE 249 N -1.47 0.19 0.21 0.60 1.01 0.55 -4.61 121.20 117.68 2kc0 s ILE 249 Ca 0.37 -0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.77 2kc0 s ILE 249 Cb -0.14 -0.18 -0.08 0.00 0.01 0.00 0.00 42.46 42.06 2kc0 s ILE 249 CO 0.19 0.07 0.67 -0.83 0.00 0.00 0.00 174.94 175.04 2kc0 s GLY 250 N 0.12 2.53 -0.05 6.18 0.00 -0.25 -0.66 107.32 115.18 2kc0 s GLY 250 Ca -0.01 0.05 -0.04 0.00 0.00 0.00 0.00 44.72 44.73 2kc0 s GLY 250 CO -0.00 0.36 0.14 1.08 0.00 0.00 0.00 173.10 174.68 2kc0 s LEU 251 N -2.12 4.25 -0.28 0.66 2.01 -0.65 -2.66 118.68 119.88 2kc0 s LEU 251 Ca 0.43 0.34 0.01 0.00 0.01 0.00 0.00 54.13 54.92 2kc0 s LEU 251 Cb -0.15 -2.34 0.16 0.00 0.01 0.00 0.00 46.19 43.87 2kc0 s LEU 251 CO 0.20 0.32 0.44 0.00 1.01 0.00 0.00 176.35 178.32 2kc0 s ALA 252 N -1.19 -1.44 -0.13 4.21 0.00 -1.11 -3.83 121.76 118.26 2kc0 s ALA 252 Ca 0.22 0.63 -0.03 0.00 0.00 0.00 0.00 51.96 52.78 2kc0 s ALA 252 Cb -0.12 -2.06 0.05 0.00 0.00 0.00 0.00 23.12 20.98 2kc0 s ALA 252 CO 0.12 -1.62 0.05 0.00 0.00 0.00 0.00 175.76 174.31 2kc0 s ALA 253 N 2.61 0.63 0.15 0.00 0.00 -0.95 -1.08 121.76 123.12 2kc0 s ALA 253 Ca 0.11 -0.30 0.11 0.00 0.00 0.00 0.00 51.96 51.88 2kc0 s ALA 253 Cb -0.13 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 22.00 2kc0 s ALA 253 CO -0.26 -0.90 -0.25 0.21 0.00 0.00 0.00 175.76 174.56 2kc0 s LYS 254 N 2.02 1.41 0.00 0.00 2.20 -1.02 -1.00 119.74 123.36 2kc0 s LYS 254 Ca 0.02 -1.39 0.19 0.00 -0.36 0.00 0.00 55.97 54.44 2kc0 s LYS 254 Cb -0.15 -1.83 1.14 0.00 -1.51 0.00 0.00 37.83 35.48 2kc0 s LYS 254 CO -0.07 0.42 1.54 0.94 -0.36 0.00 0.00 175.35 177.82