#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 0.00 0.25 0.00 0.00 -1.26 -3.16 105.19 101.02 2kc0 n GLY 15 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 0.00 -0.81 0.99 -0.00 -1.97 -2.03 115.31 111.50 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 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 40.66 40.54 2kc0 h LEU 16 CO 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 178.44 178.71 2kc0 h ALA 17 N 2.01 1.16 -0.06 0.17 0.00 -1.80 -2.16 119.26 118.58 2kc0 h ALA 17 Ca 0.00 0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2kc0 h ALA 17 Cb 0.04 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2kc0 h ALA 17 CO 0.00 -0.34 -0.40 0.22 0.00 0.00 0.00 179.25 178.73 2kc0 h ASP 18 N 0.33 0.14 0.55 0.00 3.58 -1.68 -2.10 116.42 117.22 2kc0 h ASP 18 Ca 0.48 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.87 2kc0 h ASP 18 Cb 0.86 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.87 2kc0 h ASP 18 CO -0.52 0.53 0.00 0.00 -2.88 0.00 0.00 179.24 176.37 2kc0 n ALA 19 N -2.47 2.42 -0.06 -0.78 0.00 -0.84 -1.07 120.51 117.71 2kc0 n ALA 19 Ca -0.02 -0.13 -0.14 0.00 0.00 0.00 0.00 53.44 53.15 2kc0 n ALA 19 Cb 0.46 -1.47 -0.14 0.00 0.00 0.00 0.00 19.45 18.30 2kc0 n ALA 19 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kc0 n LEU 20 N -1.29 1.60 -0.00 0.00 7.99 -0.83 -4.43 117.00 120.05 2kc0 n LEU 20 Ca 0.13 0.12 -0.20 0.00 -0.01 0.00 0.00 56.01 56.05 2kc0 n LEU 20 Cb 0.23 -0.33 -0.14 0.00 -0.11 0.00 0.00 43.42 43.08 2kc0 n LEU 20 CO 0.22 0.67 -0.18 0.71 -1.51 0.00 0.00 177.39 177.30 2kc0 h THR 21 N 0.02 1.27 -2.53 -5.08 1.35 -1.42 -3.47 112.91 103.05 2kc0 h THR 21 Ca -0.46 -2.41 -0.59 0.00 -0.55 0.00 0.00 66.41 62.39 2kc0 h THR 21 Cb 2.05 2.91 -0.15 0.00 -1.73 0.00 0.00 68.15 71.23 2kc0 h THR 21 CO 0.03 0.66 -0.77 0.00 -0.25 0.00 0.00 175.52 175.18 2kc0 s ALA 22 N -2.42 2.57 0.89 6.62 0.00 -0.23 -5.11 121.76 124.08 2kc0 s ALA 22 Ca -0.19 -1.79 -0.12 0.00 0.00 0.00 0.00 51.96 49.87 2kc0 s ALA 22 Cb 0.02 -0.24 0.12 0.00 0.00 0.00 0.00 23.12 23.02 2kc0 s ALA 22 CO 0.76 0.27 1.10 -1.25 0.00 0.00 0.00 175.76 176.64 2kc0 s PRO 23 N -3.34 1.34 0.00 0.00 0.04 -1.26 -4.41 135.00 127.37 2kc0 s PRO 23 Ca 0.27 0.63 0.00 0.00 0.04 0.00 0.00 61.00 61.94 2kc0 s PRO 23 Cb -0.05 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.66 2kc0 s PRO 23 CO 0.12 -2.13 0.00 1.28 0.04 0.00 0.00 177.00 176.31 2kc0 n LEU 24 N -3.78 1.44 -3.83 -3.56 7.99 -1.26 -4.99 117.00 109.02 2kc0 n LEU 24 Ca 0.07 0.00 -0.07 0.00 -0.01 0.00 0.00 56.01 56.00 2kc0 n LEU 24 Cb 0.56 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 43.88 2kc0 n LEU 24 CO 0.56 0.23 0.58 -0.62 -1.51 0.00 0.00 177.39 176.64 2kc0 s ASP 25 N -4.49 -0.07 -0.40 -1.43 -1.08 -1.26 -4.80 116.67 103.13 2kc0 s ASP 25 Ca 0.00 -0.87 0.08 0.00 -0.52 0.00 0.00 52.55 51.24 2kc0 s ASP 25 Cb 0.00 0.73 0.26 0.00 -1.46 0.00 0.00 42.92 42.45 2kc0 s ASP 25 CO 0.00 -1.42 0.54 1.57 0.52 0.00 0.00 175.17 176.39 2kc0 n HIS 26 N -0.54 -0.12 0.00 -5.34 -0.00 -1.26 -4.79 115.22 103.17 2kc0 n HIS 26 Ca -0.06 -3.61 0.00 0.00 -0.00 0.00 0.00 57.72 54.05 2kc0 n HIS 26 Cb 0.60 -0.37 0.00 0.00 -0.00 0.00 0.00 29.99 30.22 2kc0 n HIS 26 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 2kc0 n LYS 27 N 1.31 0.00 0.00 1.57 2.85 -1.26 -5.16 118.16 117.47 2kc0 n LYS 27 Ca 0.22 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.48 2kc0 n LYS 27 Cb 0.53 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.91 2kc0 n LYS 27 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2kc0 n ASP 28 N 0.00 0.00 -1.06 -5.58 -0.08 -1.26 -2.71 116.55 105.85 2kc0 n ASP 28 Ca 0.00 0.00 -0.04 0.00 -1.51 0.00 0.00 54.79 53.24 2kc0 n ASP 28 Cb 0.00 0.00 0.16 0.00 2.34 0.00 0.00 41.12 43.62 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 12.82 2.18 0.00 -0.67 0.00 -1.26 -5.01 118.16 126.22 2kc0 n LYS 29 Ca 0.00 -3.53 0.00 0.00 -0.00 0.00 0.00 58.31 54.78 2kc0 n LYS 29 Cb 0.00 -1.83 0.00 0.00 -0.00 0.00 0.00 35.03 33.20 2kc0 n LYS 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2kc0 n GLY 30 N -1.01 1.63 3.61 2.58 0.00 -1.10 -4.89 105.19 106.01 2kc0 n GLY 30 Ca 0.28 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 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 3.60 -0.08 0.99 0.20 -1.26 -4.84 118.68 117.29 2kc0 s LEU 31 Ca 0.00 1.76 0.16 0.00 0.69 0.00 0.00 54.13 56.74 2kc0 s LEU 31 Cb 0.00 -3.52 -0.24 0.00 -0.43 0.00 0.00 46.19 42.00 2kc0 s LEU 31 CO 0.00 -1.73 0.26 0.00 -0.29 0.00 0.00 176.35 174.58 2kc0 n GLN 32 N 8.44 0.85 -3.98 1.98 6.02 -1.26 -4.79 117.38 124.63 2kc0 n GLN 32 Ca 0.26 -0.10 -0.11 0.00 -0.01 0.00 0.00 57.00 57.04 2kc0 n GLN 32 Cb 0.45 -1.42 -0.03 0.00 1.02 0.00 0.00 30.24 30.26 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 -4.39 0.23 -0.15 1.08 1.04 -1.26 -0.27 113.70 109.97 2kc0 s SER 33 Ca -0.07 -1.13 -0.02 0.00 0.48 0.00 0.00 55.95 55.22 2kc0 s SER 33 Cb 0.09 0.67 -0.02 0.00 0.10 0.00 0.00 66.02 66.86 2kc0 s SER 33 CO 0.70 -1.30 -0.10 -0.22 0.98 0.00 0.00 173.24 173.30 2kc0 s LEU 34 N -3.09 2.85 0.18 2.42 0.20 0.12 -4.97 118.68 116.39 2kc0 s LEU 34 Ca 0.23 -0.30 -0.30 0.00 0.69 0.00 0.00 54.13 54.45 2kc0 s LEU 34 Cb -0.02 -1.67 -0.08 0.00 -0.43 0.00 0.00 46.19 44.00 2kc0 s LEU 34 CO 0.13 0.13 1.05 -0.89 -0.29 0.00 0.00 176.35 176.48 2kc0 s THR 35 N 0.59 3.96 -0.75 3.68 2.01 -1.26 -0.77 115.64 123.10 2kc0 s THR 35 Ca -0.06 1.74 -0.11 0.00 0.31 0.00 0.00 61.69 63.58 2kc0 s THR 35 Cb -0.15 -4.11 0.20 0.00 0.01 0.00 0.00 72.50 68.44 2kc0 s THR 35 CO 0.03 0.32 0.66 -0.76 -0.69 0.00 0.00 174.62 174.18 2kc0 s LEU 36 N -0.52 6.27 -0.20 4.42 1.02 -0.40 -4.77 118.68 124.50 2kc0 s LEU 36 Ca 0.47 -2.71 -0.02 0.00 0.02 0.00 0.00 54.13 51.89 2kc0 s LEU 36 Cb -0.28 -2.10 -0.12 0.00 0.02 0.00 0.00 46.19 43.71 2kc0 s LEU 36 CO 0.34 -0.52 -0.20 -0.67 0.02 0.00 0.00 176.35 175.32 2kc0 n ASP 37 N 3.86 2.18 -0.05 2.29 -0.08 -1.26 -2.02 116.55 121.47 2kc0 n ASP 37 Ca 0.11 0.00 -0.07 0.00 -1.51 0.00 0.00 54.79 53.32 2kc0 n ASP 37 Cb 0.44 -0.40 -0.05 0.00 2.34 0.00 0.00 41.12 43.45 2kc0 n ASP 37 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2kc0 n GLN 38 N -3.33 0.46 -0.19 -0.67 6.02 -1.26 -4.63 117.38 113.78 2kc0 n GLN 38 Ca -0.37 0.06 0.16 0.00 -0.01 0.00 0.00 57.00 56.84 2kc0 n GLN 38 Cb 0.85 -1.22 0.30 0.00 1.02 0.00 0.00 30.24 31.19 2kc0 n GLN 38 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2kc0 n SER 39 N -2.78 0.14 -4.09 1.08 3.41 -1.26 -4.51 113.62 105.60 2kc0 n SER 39 Ca -0.19 0.96 -0.15 0.00 -0.26 0.00 0.00 58.87 59.23 2kc0 n SER 39 Cb 0.71 -0.44 -0.12 0.00 -0.26 0.00 0.00 64.21 64.10 2kc0 n SER 39 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2kc0 s VAL 40 N -5.00 0.75 0.88 -3.33 0.11 -1.26 -5.13 120.40 107.42 2kc0 s VAL 40 Ca -0.06 -1.08 -0.11 0.00 -2.93 0.00 0.00 61.98 57.80 2kc0 s VAL 40 Cb 0.19 -0.76 0.12 0.00 -1.53 0.00 0.00 36.38 34.40 2kc0 s VAL 40 CO 0.45 -0.27 1.11 -0.13 -3.33 0.00 0.00 175.10 172.93 2kc0 s ARG 41 N -1.50 1.35 0.00 1.54 1.81 -1.26 -4.83 118.95 116.06 2kc0 s ARG 41 Ca -0.06 1.24 0.01 0.00 -1.72 0.00 0.00 55.73 55.20 2kc0 s ARG 41 Cb -0.09 -1.79 0.03 0.00 -0.45 0.00 0.00 34.95 32.65 2kc0 s ARG 41 CO 0.01 -2.30 0.48 1.63 -0.68 0.00 0.00 175.30 174.44 2kc0 n LYS 42 N -3.98 0.02 -0.06 3.54 5.02 -1.26 -3.02 118.16 118.43 2kc0 n LYS 42 Ca 0.09 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.29 2kc0 n LYS 42 Cb 0.53 -1.45 -0.05 0.00 -0.02 0.00 0.00 35.03 34.05 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 -0.95 2.25 -4.82 4.39 3.02 -1.26 -4.94 115.26 112.95 2kc0 n ASN 43 Ca 0.00 0.02 -0.36 0.00 -0.03 0.00 0.00 54.58 54.22 2kc0 n ASN 43 Cb 0.00 -0.23 -0.06 0.00 -0.61 0.00 0.00 39.78 38.88 2kc0 n ASN 43 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2kc0 s GLU 44 N -2.21 4.21 -0.21 3.52 2.02 -1.17 -5.00 118.70 119.85 2kc0 s GLU 44 Ca -0.15 0.84 -0.27 0.00 0.02 0.00 0.00 54.97 55.41 2kc0 s GLU 44 Cb 0.05 -2.81 -0.00 0.00 0.10 0.00 0.00 34.13 31.47 2kc0 s GLU 44 CO 0.23 0.36 0.92 0.21 0.02 0.00 0.00 175.26 176.99 2kc0 s LYS 45 N -2.14 4.25 -0.12 1.61 2.20 0.33 -4.29 119.74 121.57 2kc0 s LYS 45 Ca 0.45 1.13 -0.05 0.00 -0.36 0.00 0.00 55.97 57.15 2kc0 s LYS 45 Cb -0.16 -3.62 -0.04 0.00 -1.51 0.00 0.00 37.83 32.50 2kc0 s LYS 45 CO 0.20 -0.51 0.05 -1.17 -0.36 0.00 0.00 175.35 173.57 2kc0 s LEU 46 N 2.78 3.85 -0.16 5.43 0.20 -0.55 -0.80 118.68 129.43 2kc0 s LEU 46 Ca 0.40 0.21 -0.00 0.00 0.69 0.00 0.00 54.13 55.42 2kc0 s LEU 46 Cb -0.16 -1.92 -0.00 0.00 -0.43 0.00 0.00 46.19 43.68 2kc0 s LEU 46 CO 0.08 0.33 -0.15 -0.54 -0.29 0.00 0.00 176.35 175.79 2kc0 s LYS 47 N -0.56 3.21 0.03 1.98 1.02 0.03 -0.66 119.74 124.79 2kc0 s LYS 47 Ca 0.11 -0.74 -0.00 0.00 0.02 0.00 0.00 55.97 55.35 2kc0 s LYS 47 Cb -0.12 -2.66 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 2kc0 s LYS 47 CO 0.02 -0.03 0.16 -0.51 -0.92 0.00 0.00 175.35 174.07 2kc0 s LEU 48 N 0.93 4.19 -0.25 3.17 2.01 -0.22 -1.06 118.68 127.44 2kc0 s LEU 48 Ca -0.03 0.22 -0.19 0.00 0.01 0.00 0.00 54.13 54.13 2kc0 s LEU 48 Cb -0.15 -2.67 0.07 0.00 0.01 0.00 0.00 46.19 43.45 2kc0 s LEU 48 CO -0.02 0.21 0.65 0.00 1.01 0.00 0.00 176.35 178.20 2kc0 s ALA 49 N -1.39 -1.66 -0.24 4.21 0.00 -0.73 -0.95 121.76 121.00 2kc0 s ALA 49 Ca 0.30 2.01 -0.27 0.00 0.00 0.00 0.00 51.96 54.00 2kc0 s ALA 49 Cb -0.13 -1.18 0.13 0.00 0.00 0.00 0.00 23.12 21.94 2kc0 s ALA 49 CO 0.22 -0.33 1.05 0.00 0.00 0.00 0.00 175.76 176.70 2kc0 s ALA 50 N 0.85 -1.98 -1.43 0.00 0.00 -0.01 -0.84 121.76 118.36 2kc0 s ALA 50 Ca -0.04 1.75 -0.04 0.00 0.00 0.00 0.00 51.96 53.64 2kc0 s ALA 50 Cb -0.05 -1.19 0.03 0.00 0.00 0.00 0.00 23.12 21.91 2kc0 s ALA 50 CO -0.07 -0.25 0.58 0.94 0.00 0.00 0.00 175.76 176.95 2kc0 n GLN 51 N 1.58 -3.85 -0.98 0.00 -0.06 -1.26 -1.58 117.38 111.23 2kc0 n GLN 51 Ca -0.11 0.47 0.00 0.00 -2.00 0.00 0.00 57.00 55.35 2kc0 n GLN 51 Cb 0.57 -4.83 0.00 0.00 -4.06 0.00 0.00 30.24 21.91 2kc0 n GLN 51 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2kc0 n GLY 52 N -1.80 0.80 3.42 1.69 0.00 -1.26 -4.69 105.19 103.35 2kc0 n GLY 52 Ca -0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.17 2.40 0.14 4.61 0.00 -0.61 -5.08 121.76 120.05 2kc0 s ALA 53 Ca 0.00 -1.82 -0.20 0.00 0.00 0.00 0.00 51.96 49.94 2kc0 s ALA 53 Cb 0.00 -0.08 0.05 0.00 0.00 0.00 0.00 23.12 23.09 2kc0 s ALA 53 CO 0.00 0.11 0.50 -1.83 0.00 0.00 0.00 175.76 174.54 2kc0 s GLU 54 N -3.62 1.17 -0.00 0.00 1.03 -1.26 -0.83 118.70 115.19 2kc0 s GLU 54 Ca 0.27 -0.58 0.00 0.00 0.03 0.00 0.00 54.97 54.69 2kc0 s GLU 54 Cb -0.01 0.53 0.00 0.00 -0.80 0.00 0.00 34.13 33.85 2kc0 s GLU 54 CO 0.11 -0.49 0.00 0.21 -1.33 0.00 0.00 175.26 173.77 2kc0 s LYS 55 N -3.74 0.00 -0.10 -4.83 2.47 -0.12 -4.88 119.74 108.54 2kc0 s LYS 55 Ca 0.02 0.01 -0.18 0.00 -1.56 0.00 0.00 55.97 54.25 2kc0 s LYS 55 Cb 0.00 -0.01 -0.04 0.00 -1.46 0.00 0.00 37.83 36.32 2kc0 s LYS 55 CO -0.12 -0.01 0.47 0.95 0.16 0.00 0.00 175.35 176.80 2kc0 s THR 56 N 0.03 5.16 0.17 3.43 -4.23 -1.26 -1.05 115.64 117.89 2kc0 s THR 56 Ca -0.00 0.94 0.09 0.00 -1.18 0.00 0.00 61.69 61.54 2kc0 s THR 56 Cb -0.00 -3.81 -0.04 0.00 1.34 0.00 0.00 72.50 69.99 2kc0 s THR 56 CO -0.00 0.36 -0.13 -0.31 -0.54 0.00 0.00 174.62 174.00 2kc0 s TYR 57 N 0.40 2.57 -0.23 3.99 2.02 0.17 -4.98 117.35 121.29 2kc0 s TYR 57 Ca 0.26 -0.24 0.11 0.00 -0.37 0.00 0.00 57.07 56.82 2kc0 s TYR 57 Cb -0.15 -1.28 0.44 0.00 -0.40 0.00 0.00 41.96 40.56 2kc0 s TYR 57 CO 0.11 0.49 1.20 0.41 -1.57 0.00 0.00 175.55 176.18 2kc0 n GLY 58 N 0.23 5.25 1.48 0.71 0.00 -1.26 -1.48 105.19 110.11 2kc0 n GLY 58 Ca -0.12 -1.81 0.12 0.00 0.00 0.00 0.00 46.02 44.21 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 -0.84 -7.79 -2.68 1.61 2.85 -1.26 -4.86 115.26 102.29 2kc0 n ASN 59 Ca 0.28 1.55 -0.20 0.00 -0.11 0.00 0.00 54.58 56.10 2kc0 n ASN 59 Cb 0.83 -4.97 0.03 0.00 1.24 0.00 0.00 39.78 36.92 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 -3.83 -0.37 0.00 8.20 0.00 -0.85 -5.00 105.19 103.34 2kc0 n GLY 60 Ca -0.07 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.99 1.45 -3.70 1.61 -0.08 -1.19 -4.95 116.55 107.72 2kc0 n ASP 61 Ca -0.10 -0.87 -0.13 0.00 -1.51 0.00 0.00 54.79 52.19 2kc0 n ASP 61 Cb 0.60 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.97 2kc0 n ASP 61 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2kc0 s SER 62 N -0.81 -0.54 -0.15 1.67 1.04 -1.26 -1.28 113.70 112.36 2kc0 s SER 62 Ca 0.00 1.02 -0.25 0.00 0.48 0.00 0.00 55.95 57.20 2kc0 s SER 62 Cb 0.00 1.01 -0.02 0.00 0.10 0.00 0.00 66.02 67.11 2kc0 s SER 62 CO 0.00 -0.18 0.80 -0.22 0.98 0.00 0.00 173.24 174.62 2kc0 s LEU 63 N 0.47 4.20 0.63 2.42 0.20 0.05 -4.86 118.68 121.79 2kc0 s LEU 63 Ca -0.02 1.17 -0.10 0.00 0.69 0.00 0.00 54.13 55.87 2kc0 s LEU 63 Cb -0.04 -3.20 -0.01 0.00 -0.43 0.00 0.00 46.19 42.51 2kc0 s LEU 63 CO -0.02 -0.35 1.01 0.20 -0.29 0.00 0.00 176.35 176.90 2kc0 s ASN 64 N 1.11 5.83 0.00 3.68 0.01 -1.26 -0.70 114.94 123.61 2kc0 s ASN 64 Ca 0.38 1.15 0.00 0.00 -0.71 0.00 0.00 52.86 53.68 2kc0 s ASN 64 Cb -0.17 -2.12 0.00 0.00 0.41 0.00 0.00 41.25 39.37 2kc0 s ASN 64 CO 0.14 -1.05 0.00 1.07 -1.51 0.00 0.00 177.10 175.75 2kc0 n THR 65 N -2.77 0.00 -1.20 1.60 5.66 -1.19 -4.85 114.28 111.53 2kc0 n THR 65 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 2kc0 n THR 65 Cb 0.56 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.34 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 -0.67 2.51 0.37 1.09 0.00 0.63 -1.87 105.19 107.25 2kc0 n GLY 66 Ca 0.00 -0.19 0.14 0.00 0.00 0.00 0.00 46.02 45.98 2kc0 n GLY 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kc0 h LYS 67 N 0.00 0.37 -6.27 1.61 1.57 -1.87 -3.44 116.57 108.53 2kc0 h LYS 67 Ca 0.00 -0.02 -0.57 0.00 -1.87 0.00 0.00 60.65 58.19 2kc0 h LYS 67 Cb 0.00 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 2kc0 h LYS 67 CO 0.00 0.24 1.17 -0.51 -0.57 0.00 0.00 179.45 179.79 2kc0 s LEU 68 N -9.30 3.84 0.00 2.94 1.43 -0.78 -4.80 118.68 112.01 2kc0 s LEU 68 Ca -0.08 1.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.67 2kc0 s LEU 68 Cb 0.20 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.89 2kc0 s LEU 68 CO 0.76 -1.35 0.00 2.29 0.23 0.00 0.00 176.35 178.28 2kc0 n LYS 69 N 7.82 0.00 -2.81 1.70 2.85 -1.26 -4.92 118.16 121.54 2kc0 n LYS 69 Ca 0.20 0.00 -0.15 0.00 -1.05 0.00 0.00 58.31 57.31 2kc0 n LYS 69 Cb 0.45 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.86 2kc0 n LYS 69 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2kc0 n ASN 70 N 0.00 -4.65 -3.17 -5.58 3.02 -1.26 -4.39 115.26 99.23 2kc0 n ASN 70 Ca 0.00 -0.21 -0.17 0.00 -0.03 0.00 0.00 54.58 54.18 2kc0 n ASN 70 Cb 0.00 -3.49 0.08 0.00 -0.61 0.00 0.00 39.78 35.76 2kc0 n ASN 70 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2kc0 n ASP 71 N -1.14 -3.03 -4.21 6.41 8.00 -0.75 -5.02 116.55 116.82 2kc0 n ASP 71 Ca -0.07 -0.53 -0.12 0.00 0.71 0.00 0.00 54.79 54.78 2kc0 n ASP 71 Cb 0.58 -4.57 -0.10 0.00 -0.02 0.00 0.00 41.12 37.01 2kc0 n ASP 71 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2kc0 s LYS 72 N -5.45 1.17 -0.00 -1.24 -2.85 -0.42 -4.95 119.74 106.01 2kc0 s LYS 72 Ca 0.13 -1.61 0.01 0.00 -1.00 0.00 0.00 55.97 53.51 2kc0 s LYS 72 Cb -0.06 0.12 -0.04 0.00 -2.06 0.00 0.00 37.83 35.79 2kc0 s LYS 72 CO 0.64 -0.32 0.03 0.14 0.10 0.00 0.00 175.35 175.94 2kc0 s VAL 73 N -4.02 4.35 0.01 1.79 -7.23 -1.26 -0.40 120.40 113.65 2kc0 s VAL 73 Ca 0.34 -0.54 0.06 0.00 -1.81 0.00 0.00 61.98 60.03 2kc0 s VAL 73 Cb 0.07 -2.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.02 2kc0 s VAL 73 CO 0.09 0.36 -0.15 -0.44 -0.31 0.00 0.00 175.10 174.66 2kc0 s SER 74 N -1.63 4.02 0.22 4.85 0.01 0.37 -4.95 113.70 116.58 2kc0 s SER 74 Ca 0.21 -0.32 -0.12 0.00 1.31 0.00 0.00 55.95 57.03 2kc0 s SER 74 Cb -0.12 -0.76 -0.07 0.00 0.21 0.00 0.00 66.02 65.28 2kc0 s SER 74 CO 0.12 0.28 0.58 0.00 0.41 0.00 0.00 173.24 174.62 2kc0 s ARG 75 N -1.29 3.90 -0.07 12.44 1.04 -1.26 -1.22 118.95 132.49 2kc0 s ARG 75 Ca 0.15 0.41 -0.13 0.00 -1.04 0.00 0.00 55.73 55.12 2kc0 s ARG 75 Cb -0.11 -2.71 0.03 0.00 -2.04 0.00 0.00 34.95 30.12 2kc0 s ARG 75 CO 0.05 0.35 0.31 -0.06 -0.04 0.00 0.00 175.30 175.91 2kc0 s PHE 76 N -1.72 -0.26 0.33 5.89 0.08 -0.63 -4.92 117.98 116.74 2kc0 s PHE 76 Ca 0.45 0.56 -0.16 0.00 0.12 0.00 0.00 56.93 57.90 2kc0 s PHE 76 Cb -0.12 0.11 -0.09 0.00 -0.57 0.00 0.00 43.02 42.34 2kc0 s PHE 76 CO 0.20 -0.28 0.75 -0.51 -0.10 0.00 0.00 175.22 175.28 2kc0 s ASP 77 N -0.59 6.79 -0.07 1.36 1.01 -0.02 -1.58 116.67 123.58 2kc0 s ASP 77 Ca -0.07 1.32 -0.03 0.00 0.71 0.00 0.00 52.55 54.48 2kc0 s ASP 77 Cb -0.04 -2.39 0.04 0.00 1.01 0.00 0.00 42.92 41.54 2kc0 s ASP 77 CO 0.02 -0.21 0.15 0.12 0.21 0.00 0.00 175.17 175.46 2kc0 s PHE 78 N -1.99 -0.17 -0.06 4.23 2.19 -0.07 -1.78 117.98 120.34 2kc0 s PHE 78 Ca 0.54 0.50 -0.02 0.00 0.33 0.00 0.00 56.93 58.28 2kc0 s PHE 78 Cb -0.10 -0.09 0.03 0.00 -1.31 0.00 0.00 43.02 41.55 2kc0 s PHE 78 CO 0.17 -0.18 0.05 0.42 1.83 0.00 0.00 175.22 177.51 2kc0 s ILE 79 N 1.25 0.03 -0.38 3.12 1.01 -0.23 -0.94 121.20 125.07 2kc0 s ILE 79 Ca -0.08 0.29 -0.03 0.00 0.00 0.00 0.00 60.65 60.83 2kc0 s ILE 79 Cb -0.12 -0.29 0.09 0.00 0.01 0.00 0.00 42.46 42.15 2kc0 s ILE 79 CO -0.06 0.16 0.15 -0.60 0.00 0.00 0.00 174.94 174.59 2kc0 s ARG 80 N 2.11 2.14 0.26 2.79 3.52 0.17 -0.79 118.95 129.15 2kc0 s ARG 80 Ca 0.05 -1.65 0.04 0.00 -0.13 0.00 0.00 55.73 54.04 2kc0 s ARG 80 Cb -0.12 -3.48 -0.06 0.00 -1.56 0.00 0.00 34.95 29.73 2kc0 s ARG 80 CO -0.04 -0.94 -0.01 1.14 -0.81 0.00 0.00 175.30 174.64 2kc0 s GLN 81 N 1.18 1.44 0.20 5.12 -2.07 0.02 -0.63 119.66 124.93 2kc0 s GLN 81 Ca 0.04 -1.74 -0.18 0.00 -1.82 0.00 0.00 55.36 51.66 2kc0 s GLN 81 Cb -0.22 -0.80 0.03 0.00 -1.09 0.00 0.00 33.01 30.93 2kc0 s GLN 81 CO -0.03 -0.07 0.54 -1.50 -1.32 0.00 0.00 175.29 172.90 2kc0 s ILE 82 N -3.29 0.02 -0.19 3.63 1.10 -0.70 -0.51 121.20 121.25 2kc0 s ILE 82 Ca 0.30 -0.74 -0.11 0.00 -0.51 0.00 0.00 60.65 59.58 2kc0 s ILE 82 Cb 0.06 -1.57 -0.05 0.00 0.15 0.00 0.00 42.46 41.05 2kc0 s ILE 82 CO 0.11 -0.10 0.19 -1.61 -2.11 0.00 0.00 174.94 171.42 2kc0 s GLU 83 N -3.87 4.20 -0.12 3.50 8.01 -1.26 -1.53 118.70 127.62 2kc0 s GLU 83 Ca 0.09 -0.11 0.03 0.00 0.01 0.00 0.00 54.97 54.99 2kc0 s GLU 83 Cb -0.01 -3.44 0.01 0.00 -4.31 0.00 0.00 34.13 26.37 2kc0 s GLU 83 CO -0.03 0.24 -0.22 0.08 0.01 0.00 0.00 175.26 175.34 2kc0 s VAL 84 N 0.53 1.99 -1.43 2.63 1.01 0.22 -4.80 120.40 120.55 2kc0 s VAL 84 Ca 0.11 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2kc0 s VAL 84 Cb -0.12 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.51 2kc0 s VAL 84 CO 0.01 0.54 0.00 -0.67 0.00 0.00 0.00 175.10 174.98 2kc0 n ASP 85 N 3.87 -3.94 0.00 3.32 -0.08 -1.26 -0.65 116.55 117.80 2kc0 n ASP 85 Ca -0.20 0.29 0.00 0.00 -1.51 0.00 0.00 54.79 53.37 2kc0 n ASP 85 Cb 0.52 -3.54 0.00 0.00 2.34 0.00 0.00 41.12 40.44 2kc0 n ASP 85 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2kc0 n GLY 86 N -0.44 0.75 3.29 0.27 0.00 -1.26 -5.08 105.19 102.72 2kc0 n GLY 86 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2kc0 n GLY 86 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kc0 s GLN 87 N -0.58 1.60 -0.06 1.61 -0.21 0.17 -5.11 119.66 117.08 2kc0 s GLN 87 Ca 0.00 -1.01 -0.15 0.00 0.02 0.00 0.00 55.36 54.22 2kc0 s GLN 87 Cb 0.00 -1.74 -0.05 0.00 1.00 0.00 0.00 33.01 32.22 2kc0 s GLN 87 CO 0.00 0.45 0.38 -0.48 -2.12 0.00 0.00 175.29 173.52 2kc0 s LEU 88 N -1.17 4.39 -0.03 2.90 0.05 -1.26 -0.61 118.68 122.95 2kc0 s LEU 88 Ca 0.10 0.81 0.03 0.00 0.05 0.00 0.00 54.13 55.11 2kc0 s LEU 88 Cb -0.09 -2.53 0.00 0.00 -2.05 0.00 0.00 46.19 41.52 2kc0 s LEU 88 CO 0.02 0.23 -0.10 -0.63 -0.55 0.00 0.00 176.35 175.31 2kc0 s ILE 89 N -0.44 0.89 -0.19 1.48 1.01 -0.58 -4.99 121.20 118.37 2kc0 s ILE 89 Ca 0.22 -0.42 -0.20 0.00 0.00 0.00 0.00 60.65 60.25 2kc0 s ILE 89 Cb -0.15 -0.78 -0.03 0.00 0.01 0.00 0.00 42.46 41.51 2kc0 s ILE 89 CO 0.10 0.27 0.58 0.28 0.00 0.00 0.00 174.94 176.18 2kc0 s THR 90 N 0.13 5.06 -0.00 2.92 -1.32 -1.26 -1.72 115.64 119.44 2kc0 s THR 90 Ca -0.03 1.09 0.11 0.00 -1.21 0.00 0.00 61.69 61.66 2kc0 s THR 90 Cb -0.09 -3.90 -0.13 0.00 -1.51 0.00 0.00 72.50 66.87 2kc0 s THR 90 CO 0.01 0.15 1.19 0.25 -2.21 0.00 0.00 174.62 174.00 2kc0 h LEU 91 N 8.02 0.00 -7.15 9.08 6.46 -1.25 -3.43 115.31 127.04 2kc0 h LEU 91 Ca -0.33 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.36 2kc0 h LEU 91 Cb 1.15 0.00 -0.23 0.00 -0.73 0.00 0.00 40.66 40.85 2kc0 h LEU 91 CO 0.76 0.82 -0.10 -0.70 -0.62 0.00 0.00 178.44 178.60 2kc0 s GLU 92 N -2.78 0.60 0.00 1.25 2.12 -1.18 -4.22 118.70 114.49 2kc0 s GLU 92 Ca 0.01 0.86 0.02 0.00 0.36 0.00 0.00 54.97 56.22 2kc0 s GLU 92 Cb 0.09 0.20 -0.01 0.00 0.26 0.00 0.00 34.13 34.68 2kc0 s GLU 92 CO 0.80 -0.11 -0.05 -1.12 -0.54 0.00 0.00 175.26 174.24 2kc0 s SER 93 N 0.81 0.58 0.00 -1.70 0.01 -1.26 -0.65 113.70 111.49 2kc0 s SER 93 Ca -0.04 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.07 2kc0 s SER 93 Cb -0.05 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2kc0 s SER 93 CO -0.06 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.21 2kc0 n GLY 94 N 2.74 1.58 3.19 3.44 0.00 -0.11 -4.21 105.19 111.81 2kc0 n GLY 94 Ca -0.14 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 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 1.30 3.05 0.16 1.61 2.02 0.07 -0.89 118.70 126.02 2kc0 s GLU 95 Ca 0.00 -0.81 -0.26 0.00 0.02 0.00 0.00 54.97 53.92 2kc0 s GLU 95 Cb 0.00 -2.77 -0.08 0.00 0.10 0.00 0.00 34.13 31.38 2kc0 s GLU 95 CO 0.00 -0.25 0.79 0.12 0.02 0.00 0.00 175.26 175.94 2kc0 s PHE 96 N 1.34 3.90 -0.13 1.61 5.36 -0.62 -0.94 117.98 128.50 2kc0 s PHE 96 Ca 0.04 1.64 0.01 0.00 -0.96 0.00 0.00 56.93 57.66 2kc0 s PHE 96 Cb -0.14 -2.78 0.02 0.00 -0.34 0.00 0.00 43.02 39.77 2kc0 s PHE 96 CO -0.09 0.49 -0.16 -0.65 -1.46 0.00 0.00 175.22 173.36 2kc0 s GLN 97 N -1.05 2.41 -0.24 10.12 -0.21 0.02 -1.61 119.66 129.10 2kc0 s GLN 97 Ca 0.36 -0.61 0.01 0.00 0.02 0.00 0.00 55.36 55.14 2kc0 s GLN 97 Cb -0.23 -2.10 0.06 0.00 1.00 0.00 0.00 33.01 31.74 2kc0 s GLN 97 CO 0.26 -0.14 -0.04 0.08 -2.12 0.00 0.00 175.29 173.33 2kc0 s VAL 98 N 1.21 1.53 0.10 1.09 1.01 -0.36 -0.91 120.40 124.07 2kc0 s VAL 98 Ca -0.01 -1.28 -0.26 0.00 0.00 0.00 0.00 61.98 60.43 2kc0 s VAL 98 Cb -0.14 -1.83 -0.06 0.00 0.00 0.00 0.00 36.38 34.35 2kc0 s VAL 98 CO -0.06 -0.15 0.82 -0.47 0.00 0.00 0.00 175.10 175.23 2kc0 s TYR 99 N 1.38 3.81 -0.24 5.22 6.14 -0.07 -0.48 117.35 133.12 2kc0 s TYR 99 Ca -0.04 1.61 0.01 0.00 0.64 0.00 0.00 57.07 59.30 2kc0 s TYR 99 Cb -0.19 -2.87 0.06 0.00 0.42 0.00 0.00 41.96 39.38 2kc0 s TYR 99 CO -0.07 0.34 -0.08 0.15 0.64 0.00 0.00 175.55 176.52 2kc0 s LYS 100 N -0.40 1.88 0.00 4.97 3.01 0.46 -2.40 119.74 127.26 2kc0 s LYS 100 Ca 0.40 -1.09 0.00 0.00 -1.01 0.00 0.00 55.97 54.27 2kc0 s LYS 100 Cb -0.22 -2.67 0.00 0.00 -1.01 0.00 0.00 37.83 33.93 2kc0 s LYS 100 CO 0.26 -0.56 0.00 0.94 0.51 0.00 0.00 175.35 176.49 2kc0 n GLN 101 N 4.59 2.49 -3.20 1.68 7.27 -0.09 -1.30 117.38 128.84 2kc0 n GLN 101 Ca -0.13 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.51 2kc0 n GLN 101 Cb 0.44 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 33.01 2kc0 n GLN 101 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2kc0 s SER 102 N 1.00 6.26 0.00 1.69 0.01 -1.26 -4.27 113.70 117.13 2kc0 s SER 102 Ca 0.00 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 56.68 2kc0 s SER 102 Cb 0.00 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.95 2kc0 s SER 102 CO 0.00 -0.73 0.00 1.41 0.41 0.00 0.00 173.24 174.33 2kc0 n HIS 103 N 6.00 0.00 -3.94 2.43 8.25 -1.26 -4.72 115.22 121.98 2kc0 n HIS 103 Ca -0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.08 2kc0 n HIS 103 Cb 0.47 -0.04 -0.05 0.00 1.12 0.00 0.00 29.99 31.49 2kc0 n HIS 103 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2kc0 s SER 104 N -0.12 6.25 -0.11 0.41 0.15 -1.26 -4.31 113.70 114.71 2kc0 s SER 104 Ca 0.00 0.30 -0.07 0.00 0.70 0.00 0.00 55.95 56.88 2kc0 s SER 104 Cb 0.00 -1.93 0.04 0.00 -1.71 0.00 0.00 66.02 62.42 2kc0 s SER 104 CO 0.00 0.25 0.27 0.00 1.20 0.00 0.00 173.24 174.96 2kc0 s ALA 105 N -1.32 -0.63 0.08 5.45 0.00 -0.32 -0.91 121.76 124.10 2kc0 s ALA 105 Ca 0.27 0.95 0.04 0.00 0.00 0.00 0.00 51.96 53.23 2kc0 s ALA 105 Cb -0.13 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 2kc0 s ALA 105 CO 0.19 -0.18 -0.11 -0.48 0.00 0.00 0.00 175.76 175.18 2kc0 s LEU 106 N 0.88 2.32 0.17 0.00 0.05 -1.01 -1.96 118.68 119.13 2kc0 s LEU 106 Ca -0.06 -0.68 0.08 0.00 0.05 0.00 0.00 54.13 53.52 2kc0 s LEU 106 Cb -0.07 -0.37 -0.04 0.00 -2.05 0.00 0.00 46.19 43.65 2kc0 s LEU 106 CO -0.06 -0.17 -0.04 0.28 -0.55 0.00 0.00 176.35 175.81 2kc0 s THR 107 N -1.74 3.52 0.08 5.48 -1.32 -0.71 -0.89 115.64 120.06 2kc0 s THR 107 Ca -0.01 -1.48 -0.01 0.00 -1.21 0.00 0.00 61.69 58.99 2kc0 s THR 107 Cb -0.07 -2.75 -0.04 0.00 -1.51 0.00 0.00 72.50 68.13 2kc0 s THR 107 CO 0.01 -0.08 -0.01 0.00 -2.21 0.00 0.00 174.62 172.33 2kc0 s ALA 108 N -1.66 0.67 0.05 11.08 0.00 -0.09 -1.12 121.76 130.69 2kc0 s ALA 108 Ca 0.26 -1.30 0.07 0.00 0.00 0.00 0.00 51.96 50.99 2kc0 s ALA 108 Cb -0.09 0.42 -0.03 0.00 0.00 0.00 0.00 23.12 23.41 2kc0 s ALA 108 CO 0.17 -0.38 -0.17 -0.06 0.00 0.00 0.00 175.76 175.31 2kc0 s PHE 109 N -3.92 2.58 -0.31 0.00 0.40 0.17 -0.80 117.98 116.11 2kc0 s PHE 109 Ca 0.12 -0.24 -0.02 0.00 -0.60 0.00 0.00 56.93 56.19 2kc0 s PHE 109 Cb 0.08 -1.46 0.11 0.00 0.51 0.00 0.00 43.02 42.26 2kc0 s PHE 109 CO -0.06 0.29 0.14 -1.14 0.70 0.00 0.00 175.22 175.14 2kc0 s GLN 110 N -1.56 0.41 -0.14 0.44 0.74 -0.12 -2.21 119.66 117.22 2kc0 s GLN 110 Ca 0.15 -0.85 -0.09 0.00 0.05 0.00 0.00 55.36 54.63 2kc0 s GLN 110 Cb -0.11 -1.42 -0.04 0.00 1.10 0.00 0.00 33.01 32.54 2kc0 s GLN 110 CO 0.06 -1.05 0.16 -0.08 -0.55 0.00 0.00 175.29 173.84 2kc0 s THR 111 N 1.75 5.43 0.00 -0.34 -1.32 -0.30 -0.75 115.64 120.10 2kc0 s THR 111 Ca 0.11 0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.86 2kc0 s THR 111 Cb -0.18 -3.46 0.00 0.00 -1.51 0.00 0.00 72.50 67.35 2kc0 s THR 111 CO -0.26 0.54 0.00 -0.62 -2.21 0.00 0.00 174.62 172.07 2kc0 n GLU 112 N 2.58 0.00 -3.69 7.08 1.02 -1.26 -0.95 120.64 125.42 2kc0 n GLU 112 Ca -0.18 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.79 2kc0 n GLU 112 Cb 0.54 -0.67 -0.16 0.00 -0.02 0.00 0.00 31.44 31.13 2kc0 n GLU 112 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2kc0 s GLN 113 N -1.78 0.00 0.18 3.49 -2.07 -1.26 -1.84 119.66 116.38 2kc0 s GLN 113 Ca 0.00 0.46 -0.11 0.00 -1.82 0.00 0.00 55.36 53.89 2kc0 s GLN 113 Cb 0.00 -0.33 -0.00 0.00 -1.09 0.00 0.00 33.01 31.59 2kc0 s GLN 113 CO 0.00 -0.29 0.34 0.96 -1.32 0.00 0.00 175.29 174.99 2kc0 s ILE 114 N 2.02 0.05 0.46 3.63 -0.00 -0.83 -4.12 121.20 122.41 2kc0 s ILE 114 Ca 0.01 -1.28 -0.03 0.00 -0.00 0.00 0.00 60.65 59.35 2kc0 s ILE 114 Cb -0.12 -1.82 0.10 0.00 -0.00 0.00 0.00 42.46 40.61 2kc0 s ILE 114 CO -0.05 -0.24 0.63 0.00 -0.00 0.00 0.00 174.94 175.29 2kc0 n GLN 115 N -0.25 -0.13 -4.04 0.37 10.64 -1.26 -1.08 117.38 121.63 2kc0 n GLN 115 Ca -0.07 -1.41 -0.34 0.00 -1.83 0.00 0.00 57.00 53.35 2kc0 n GLN 115 Cb 0.63 -0.52 -0.15 0.00 -0.86 0.00 0.00 30.24 29.34 2kc0 n GLN 115 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 2kc0 s ASP 116 N -3.47 3.66 0.00 2.61 2.15 -1.26 -4.80 116.67 115.56 2kc0 s ASP 116 Ca 0.39 -0.67 -0.02 0.00 0.43 0.00 0.00 52.55 52.69 2kc0 s ASP 116 Cb -0.02 -1.57 -0.09 0.00 -0.30 0.00 0.00 42.92 40.94 2kc0 s ASP 116 CO 0.27 -0.04 1.91 -0.24 -0.17 0.00 0.00 175.17 176.90 2kc0 n SER 117 N 4.66 3.40 0.00 -0.34 2.88 -1.26 -3.30 113.62 119.66 2kc0 n SER 117 Ca -0.19 -2.02 0.00 0.00 -1.33 0.00 0.00 58.87 55.33 2kc0 n SER 117 Cb 0.49 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 63.13 2kc0 n SER 117 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2kc0 n GLU 118 N 2.19 0.00 0.00 -1.46 1.02 -1.26 -4.93 120.64 116.20 2kc0 n GLU 118 Ca 0.14 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.35 2kc0 n GLU 118 Cb 0.46 -0.31 0.04 0.00 -0.02 0.00 0.00 31.44 31.60 2kc0 n GLU 118 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2kc0 n HIS 119 N -2.24 0.00 0.00 -0.32 -0.00 -1.21 -5.01 115.22 106.44 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 0.11 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.98 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 0.49 0.00 -0.07 0.26 7.64 -1.24 -4.54 113.62 116.16 2kc0 n SER 120 Ca 0.07 0.00 0.05 0.00 1.01 0.00 0.00 58.87 60.00 2kc0 n SER 120 Cb 0.33 -1.14 0.06 0.00 -1.01 0.00 0.00 64.21 62.45 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 -1.74 3.29 3.95 0.23 0.00 -1.26 -5.00 105.19 104.66 2kc0 n GLY 121 Ca 0.00 -0.51 -0.28 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.71 1.08 -0.16 1.61 -0.14 -1.26 -5.03 119.74 114.13 2kc0 s LYS 122 Ca 0.14 -0.60 -0.29 0.00 -1.36 0.00 0.00 55.97 53.87 2kc0 s LYS 122 Cb 0.13 -2.01 0.10 0.00 -1.68 0.00 0.00 37.83 34.36 2kc0 s LYS 122 CO 0.01 -2.03 0.85 0.00 -0.76 0.00 0.00 175.35 173.43 2kc0 s MET 123 N -5.62 0.77 0.11 1.68 0.23 -1.26 -4.24 119.30 110.97 2kc0 s MET 123 Ca 0.70 0.39 -0.07 0.00 -1.03 0.00 0.00 55.69 55.68 2kc0 s MET 123 Cb -0.05 0.37 -0.01 0.00 -1.53 0.00 0.00 34.83 33.61 2kc0 s MET 123 CO 0.50 -0.20 0.17 0.14 -2.03 0.00 0.00 175.02 173.60 2kc0 s VAL 124 N -0.69 0.13 -0.08 5.16 -7.23 -0.24 -4.94 120.40 112.51 2kc0 s VAL 124 Ca -0.04 -1.40 0.00 0.00 -1.81 0.00 0.00 61.98 58.74 2kc0 s VAL 124 Cb -0.02 -1.58 0.02 0.00 0.56 0.00 0.00 36.38 35.36 2kc0 s VAL 124 CO 0.03 -0.57 -0.07 0.00 -0.31 0.00 0.00 175.10 174.18 2kc0 s ALA 125 N -3.92 1.03 -0.07 1.32 0.00 -1.26 -1.97 121.76 116.88 2kc0 s ALA 125 Ca 0.11 -0.31 -0.03 0.00 0.00 0.00 0.00 51.96 51.73 2kc0 s ALA 125 Cb 0.05 -0.66 0.04 0.00 0.00 0.00 0.00 23.12 22.55 2kc0 s ALA 125 CO -0.06 -0.18 0.10 0.15 0.00 0.00 0.00 175.76 175.76 2kc0 s LYS 126 N 1.27 -0.02 -1.33 0.00 3.01 -0.77 -5.01 119.74 116.90 2kc0 s LYS 126 Ca -0.04 0.38 -0.16 0.00 -1.01 0.00 0.00 55.97 55.13 2kc0 s LYS 126 Cb -0.14 -0.61 0.01 0.00 -1.01 0.00 0.00 37.83 36.08 2kc0 s LYS 126 CO -0.02 -0.37 2.09 0.54 0.51 0.00 0.00 175.35 178.10 2kc0 n ARG 127 N 5.31 2.68 -3.08 1.68 1.74 -1.26 -4.18 116.66 119.55 2kc0 n ARG 127 Ca -0.04 -2.61 -0.42 0.00 -0.77 0.00 0.00 57.85 54.01 2kc0 n ARG 127 Cb 0.50 -3.29 -0.06 0.00 -1.02 0.00 0.00 32.46 28.59 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 3.74 3.81 -0.00 5.56 0.74 -0.13 -4.95 119.66 128.42 2kc0 s GLN 128 Ca 0.50 0.24 -0.16 0.00 0.05 0.00 0.00 55.36 56.00 2kc0 s GLN 128 Cb 0.12 -3.77 -0.06 0.00 1.10 0.00 0.00 33.01 30.40 2kc0 s GLN 128 CO -0.02 -0.68 0.45 0.12 -0.55 0.00 0.00 175.29 174.61 2kc0 s PHE 129 N 2.74 3.71 0.05 1.67 2.19 -1.26 -1.15 117.98 125.93 2kc0 s PHE 129 Ca 0.26 1.04 -0.00 0.00 0.33 0.00 0.00 56.93 58.56 2kc0 s PHE 129 Cb -0.14 -2.37 -0.03 0.00 -1.31 0.00 0.00 43.02 39.16 2kc0 s PHE 129 CO 0.14 0.57 -0.04 1.03 1.83 0.00 0.00 175.22 178.74 2kc0 s ARG 130 N -0.84 0.57 0.69 10.12 1.81 -0.94 -4.65 118.95 125.72 2kc0 s ARG 130 Ca 0.25 -1.07 -0.11 0.00 -1.72 0.00 0.00 55.73 53.08 2kc0 s ARG 130 Cb -0.17 0.09 0.01 0.00 -0.45 0.00 0.00 34.95 34.42 2kc0 s ARG 130 CO 0.14 -0.07 1.08 -1.50 -0.68 0.00 0.00 175.30 174.27 2kc0 s ILE 131 N -3.15 3.73 0.00 1.52 1.10 -1.26 -0.65 121.20 122.49 2kc0 s ILE 131 Ca 0.01 0.56 0.00 0.00 -0.51 0.00 0.00 60.65 60.72 2kc0 s ILE 131 Cb 0.02 -3.53 0.00 0.00 0.15 0.00 0.00 42.46 39.11 2kc0 s ILE 131 CO -0.06 -0.74 0.00 0.61 -2.11 0.00 0.00 174.94 172.64 2kc0 n GLY 132 N -2.83 5.78 3.77 1.50 0.00 -0.27 -4.67 105.19 108.46 2kc0 n GLY 132 Ca 0.07 -1.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.15 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 1.00 6.95 -0.10 1.61 1.11 -1.26 -4.76 116.67 121.22 2kc0 s ASP 133 Ca 0.00 2.53 -0.01 0.00 0.18 0.00 0.00 52.55 55.25 2kc0 s ASP 133 Cb 0.00 -2.64 -0.03 0.00 1.07 0.00 0.00 42.92 41.32 2kc0 s ASP 133 CO 0.00 -0.39 -0.07 -0.63 1.18 0.00 0.00 175.17 175.26 2kc0 s ILE 134 N -1.15 3.67 -0.01 0.77 -1.09 -1.26 -1.74 121.20 120.39 2kc0 s ILE 134 Ca 0.47 -0.47 -0.04 0.00 -2.23 0.00 0.00 60.65 58.38 2kc0 s ILE 134 Cb -0.37 -2.54 -0.00 0.00 -1.58 0.00 0.00 42.46 37.98 2kc0 s ILE 134 CO 0.48 0.56 0.08 0.00 -1.23 0.00 0.00 174.94 174.83 2kc0 s ALA 135 N -0.32 -0.19 0.00 9.38 0.00 -0.83 -4.96 121.76 124.85 2kc0 s ALA 135 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.91 2kc0 s ALA 135 Cb -0.13 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.01 2kc0 s ALA 135 CO 0.02 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.06 2kc0 n GLY 136 N 2.06 -0.59 2.99 0.00 0.00 -1.26 -1.17 105.19 107.22 2kc0 n GLY 136 Ca -0.19 -0.62 -0.28 0.00 0.00 0.00 0.00 46.02 44.93 2kc0 n GLY 136 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kc0 s GLU 137 N -0.37 1.99 -0.02 1.61 -1.05 -1.26 -4.95 118.70 114.66 2kc0 s GLU 137 Ca 0.00 -0.45 -0.27 0.00 -0.15 0.00 0.00 54.97 54.10 2kc0 s GLU 137 Cb 0.00 -1.86 -0.04 0.00 -0.44 0.00 0.00 34.13 31.80 2kc0 s GLU 137 CO 0.00 -0.20 0.84 -1.01 0.95 0.00 0.00 175.26 175.84 2kc0 s HIS 138 N 1.43 3.64 -0.25 4.83 3.76 -1.26 -1.59 115.29 125.85 2kc0 s HIS 138 Ca 0.02 1.49 -0.14 0.00 -0.15 0.00 0.00 55.06 56.28 2kc0 s HIS 138 Cb -0.13 -2.95 -0.04 0.00 1.11 0.00 0.00 32.58 30.56 2kc0 s HIS 138 CO -0.07 0.07 0.34 0.99 -0.85 0.00 0.00 174.74 175.22 2kc0 s THR 139 N 0.76 5.21 -0.30 1.30 2.01 -1.22 -4.89 115.64 118.51 2kc0 s THR 139 Ca 0.44 0.53 -0.34 0.00 0.31 0.00 0.00 61.69 62.63 2kc0 s THR 139 Cb -0.20 -3.67 -0.11 0.00 0.01 0.00 0.00 72.50 68.54 2kc0 s THR 139 CO 0.23 0.22 2.15 -1.20 -0.69 0.00 0.00 174.62 175.33 2kc0 n SER 140 N 4.93 2.46 0.11 3.53 7.64 -1.24 -4.29 113.62 126.76 2kc0 n SER 140 Ca -0.10 0.46 0.13 0.00 1.01 0.00 0.00 58.87 60.37 2kc0 n SER 140 Cb 0.51 -1.32 0.43 0.00 -1.01 0.00 0.00 64.21 62.82 2kc0 n SER 140 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 2kc0 n PHE 141 N 9.66 0.92 0.27 1.43 -1.74 -1.26 -2.38 117.46 124.36 2kc0 n PHE 141 Ca 0.37 0.29 0.03 0.00 -0.56 0.00 0.00 57.45 57.58 2kc0 n PHE 141 Cb 0.27 -0.97 0.16 0.00 1.52 0.00 0.00 39.48 40.45 2kc0 n PHE 141 CO 0.00 0.00 0.00 -3.47 -0.56 0.00 0.00 176.76 172.73 2kc0 n ASP 142 N -2.27 0.00 0.00 5.98 2.03 -1.26 -1.97 116.55 119.06 2kc0 n ASP 142 Ca 0.05 0.36 0.00 0.00 0.52 0.00 0.00 54.79 55.72 2kc0 n ASP 142 Cb 0.38 -0.40 0.00 0.00 -0.72 0.00 0.00 41.12 40.37 2kc0 n ASP 142 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2kc0 n LYS 143 N -1.40 -0.86 -2.58 -0.67 4.76 -1.00 -5.02 118.16 111.39 2kc0 n LYS 143 Ca 0.02 -0.43 -0.29 0.00 -2.87 0.00 0.00 58.31 54.74 2kc0 n LYS 143 Cb 0.07 -0.93 -0.01 0.00 -1.84 0.00 0.00 35.03 32.32 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 -0.00 3.63 0.80 -0.35 1.02 -0.83 -4.99 118.68 117.95 2kc0 s LEU 144 Ca 0.00 1.09 -0.11 0.00 0.02 0.00 0.00 54.13 55.14 2kc0 s LEU 144 Cb 0.00 -4.04 0.07 0.00 0.02 0.00 0.00 46.19 42.24 2kc0 s LEU 144 CO 0.00 -0.57 1.10 -2.16 0.02 0.00 0.00 176.35 174.74 2kc0 s PRO 145 N -4.50 2.04 -0.24 1.29 0.04 -1.26 -4.98 135.00 127.38 2kc0 s PRO 145 Ca 0.50 1.18 0.10 0.00 0.04 0.00 0.00 61.00 62.82 2kc0 s PRO 145 Cb -0.10 -1.87 0.45 0.00 0.04 0.00 0.00 34.50 33.02 2kc0 s PRO 145 CO 0.41 -1.80 1.33 -1.91 0.04 0.00 0.00 177.00 175.07 2kc0 n GLU 146 N -3.63 1.70 -3.56 4.56 2.13 -1.26 -4.88 120.64 115.70 2kc0 n GLU 146 Ca 0.09 -3.23 -0.06 0.00 0.66 0.00 0.00 57.16 54.62 2kc0 n GLU 146 Cb 0.53 -1.70 -0.02 0.00 0.27 0.00 0.00 31.44 30.52 2kc0 n GLU 146 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2kc0 s GLY 147 N -2.91 -0.36 0.00 8.31 0.00 -1.20 -3.96 107.32 107.20 2kc0 s GLY 147 Ca 0.41 1.38 0.00 0.00 0.00 0.00 0.00 44.72 46.51 2kc0 s GLY 147 CO -0.04 0.46 0.00 0.61 0.00 0.00 0.00 173.10 174.14 2kc0 n GLY 148 N -0.14 -2.60 3.04 0.20 0.00 -1.26 -4.58 105.19 99.86 2kc0 n GLY 148 Ca -0.03 -1.71 -0.10 0.00 0.00 0.00 0.00 46.02 44.17 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 -0.58 0.47 -0.01 1.61 1.70 -1.26 -1.02 118.95 119.85 2kc0 s ARG 149 Ca 0.00 -0.79 0.00 0.00 -0.47 0.00 0.00 55.73 54.47 2kc0 s ARG 149 Cb 0.00 -0.06 0.01 0.00 -0.57 0.00 0.00 34.95 34.33 2kc0 s ARG 149 CO 0.00 -0.01 -0.01 0.00 -1.08 0.00 0.00 175.30 174.20 2kc0 s ALA 150 N -1.87 0.21 0.03 7.88 0.00 -0.91 -4.97 121.76 122.14 2kc0 s ALA 150 Ca -0.09 0.06 -0.07 0.00 0.00 0.00 0.00 51.96 51.86 2kc0 s ALA 150 Cb -0.07 -0.17 -0.05 0.00 0.00 0.00 0.00 23.12 22.83 2kc0 s ALA 150 CO -0.02 -0.02 0.30 -0.08 0.00 0.00 0.00 175.76 175.95 2kc0 s THR 151 N 0.48 5.25 -0.00 0.00 -1.32 -1.26 -2.11 115.64 116.68 2kc0 s THR 151 Ca -0.04 0.21 -0.00 0.00 -1.21 0.00 0.00 61.69 60.65 2kc0 s THR 151 Cb -0.07 -3.59 0.00 0.00 -1.51 0.00 0.00 72.50 67.33 2kc0 s THR 151 CO -0.01 0.32 0.01 -0.31 -2.21 0.00 0.00 174.62 172.42 2kc0 s TYR 152 N -1.35 -0.00 -0.08 9.09 2.02 -0.10 -4.23 117.35 122.70 2kc0 s TYR 152 Ca 0.30 0.02 0.02 0.00 -0.37 0.00 0.00 57.07 57.03 2kc0 s TYR 152 Cb -0.13 -0.01 0.02 0.00 -0.40 0.00 0.00 41.96 41.43 2kc0 s TYR 152 CO 0.17 -0.01 -0.12 0.50 -1.57 0.00 0.00 175.55 174.53 2kc0 s ARG 153 N 0.05 1.76 0.29 -0.62 3.00 -0.64 -1.15 118.95 121.63 2kc0 s ARG 153 Ca -0.00 -0.41 -0.02 0.00 -1.00 0.00 0.00 55.73 54.30 2kc0 s ARG 153 Cb -0.01 -1.51 0.01 0.00 0.00 0.00 0.00 34.95 33.44 2kc0 s ARG 153 CO -0.00 -0.03 0.41 0.41 0.00 0.00 0.00 175.30 176.08 2kc0 n GLY 154 N 4.05 2.27 3.21 8.12 0.00 -0.23 -1.40 105.19 121.20 2kc0 n GLY 154 Ca -0.21 -1.57 -0.29 0.00 0.00 0.00 0.00 46.02 43.95 2kc0 n GLY 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kc0 s THR 155 N -2.74 1.80 -0.25 2.61 2.01 -0.57 -1.99 115.64 116.51 2kc0 s THR 155 Ca 0.24 -0.92 -0.09 0.00 0.31 0.00 0.00 61.69 61.23 2kc0 s THR 155 Cb -0.01 -1.54 -0.04 0.00 0.01 0.00 0.00 72.50 70.92 2kc0 s THR 155 CO 0.17 0.51 0.12 0.00 -0.69 0.00 0.00 174.62 174.73 2kc0 s ALA 156 N -0.01 3.36 -0.11 7.40 0.00 -1.06 -4.00 121.76 127.34 2kc0 s ALA 156 Ca -0.06 -1.04 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 2kc0 s ALA 156 Cb -0.13 -2.22 0.03 0.00 0.00 0.00 0.00 23.12 20.80 2kc0 s ALA 156 CO 0.04 -0.40 -0.02 -0.59 0.00 0.00 0.00 175.76 174.79 2kc0 s PHE 157 N 1.45 1.04 0.18 0.00 -0.71 -1.25 -4.19 117.98 114.49 2kc0 s PHE 157 Ca 0.06 -0.52 -0.23 0.00 -1.04 0.00 0.00 56.93 55.20 2kc0 s PHE 157 Cb -0.15 -1.00 0.07 0.00 -1.21 0.00 0.00 43.02 40.73 2kc0 s PHE 157 CO 0.06 -0.45 1.00 0.20 -1.34 0.00 0.00 175.22 174.69 2kc0 s GLY 158 N 1.85 -0.02 -0.62 1.99 0.00 -1.26 -1.37 107.32 107.88 2kc0 s GLY 158 Ca 0.03 -0.15 -0.07 0.00 0.00 0.00 0.00 44.72 44.54 2kc0 s GLY 158 CO -0.07 1.24 3.25 -1.26 0.00 0.00 0.00 173.10 176.26 2kc0 n SER 159 N -0.91 6.62 0.00 1.64 2.88 -1.26 -3.77 113.62 118.82 2kc0 n SER 159 Ca -0.05 -2.64 0.00 0.00 -1.33 0.00 0.00 58.87 54.85 2kc0 n SER 159 Cb 0.60 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.63 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 2.57 0.03 0.12 -3.46 5.75 -1.26 -4.97 116.55 115.33 2kc0 n ASP 160 Ca 0.56 0.01 0.00 0.00 -0.01 0.00 0.00 54.79 55.34 2kc0 n ASP 160 Cb 0.63 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 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 -2.89 -2.04 0.00 -1.12 2.03 -1.25 -5.03 116.55 106.25 2kc0 n ASP 161 Ca 0.00 0.47 0.00 0.00 0.52 0.00 0.00 54.79 55.78 2kc0 n ASP 161 Cb 0.35 2.11 0.00 0.00 -0.72 0.00 0.00 41.12 42.86 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 -3.03 0.00 0.07 -1.67 0.00 -1.26 -4.78 120.51 109.85 2kc0 n ALA 162 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 2kc0 n ALA 162 Cb 0.00 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 18.36 2kc0 n ALA 162 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2kc0 h GLY 163 N 0.00 0.00 -3.07 0.00 0.00 -1.96 -3.47 103.07 94.57 2kc0 h GLY 163 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 2kc0 h GLY 163 CO 0.00 0.00 0.51 -0.32 0.00 0.00 0.00 176.54 176.73 2kc0 s GLY 164 N -4.67 2.85 0.05 4.60 0.00 -1.26 -4.93 107.32 103.96 2kc0 s GLY 164 Ca 0.01 0.99 -0.02 0.00 0.00 0.00 0.00 44.72 45.69 2kc0 s GLY 164 CO 0.81 1.50 0.02 0.54 0.00 0.00 0.00 173.10 175.96 2kc0 s LYS 165 N -2.38 0.61 0.11 2.90 -0.14 -1.26 -2.57 119.74 117.01 2kc0 s LYS 165 Ca 0.58 -1.06 -0.04 0.00 -1.36 0.00 0.00 55.97 54.10 2kc0 s LYS 165 Cb -0.31 0.22 -0.03 0.00 -1.68 0.00 0.00 37.83 36.03 2kc0 s LYS 165 CO 0.39 -0.13 0.10 -0.48 -0.76 0.00 0.00 175.35 174.46 2kc0 s LEU 166 N -2.65 1.75 -0.01 3.17 -0.00 -0.84 -1.37 118.68 118.73 2kc0 s LEU 166 Ca 0.03 -1.01 0.05 0.00 -0.00 0.00 0.00 54.13 53.20 2kc0 s LEU 166 Cb 0.04 0.55 -0.03 0.00 -0.00 0.00 0.00 46.19 46.75 2kc0 s LEU 166 CO -0.08 -0.73 -0.17 -0.89 -0.00 0.00 0.00 176.35 174.48 2kc0 s THR 167 N -3.97 2.82 0.14 5.48 2.01 -0.46 -1.07 115.64 120.58 2kc0 s THR 167 Ca 0.16 -0.93 0.10 0.00 0.31 0.00 0.00 61.69 61.32 2kc0 s THR 167 Cb 0.06 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 2kc0 s THR 167 CO -0.03 0.51 -0.22 -0.31 -0.69 0.00 0.00 174.62 173.87 2kc0 s TYR 168 N -0.78 2.42 -0.01 4.92 2.02 -0.30 -1.27 117.35 124.34 2kc0 s TYR 168 Ca 0.12 -0.32 -0.11 0.00 -0.37 0.00 0.00 57.07 56.39 2kc0 s TYR 168 Cb -0.10 -1.28 0.01 0.00 -0.40 0.00 0.00 41.96 40.19 2kc0 s TYR 168 CO 0.02 0.39 0.23 -0.08 -1.57 0.00 0.00 175.55 174.54 2kc0 s THR 169 N -1.20 0.07 -0.18 -0.71 -1.32 -0.64 -0.92 115.64 110.73 2kc0 s THR 169 Ca 0.17 -0.54 -0.02 0.00 -1.21 0.00 0.00 61.69 60.09 2kc0 s THR 169 Cb -0.10 -0.52 0.05 0.00 -1.51 0.00 0.00 72.50 70.42 2kc0 s THR 169 CO 0.09 -0.30 0.00 -0.51 -2.21 0.00 0.00 174.62 171.69 2kc0 s ILE 170 N -1.26 0.76 -0.87 5.08 2.07 -0.90 -2.13 121.20 123.96 2kc0 s ILE 170 Ca -0.13 -0.60 -0.25 0.00 -1.41 0.00 0.00 60.65 58.26 2kc0 s ILE 170 Cb -0.06 -1.14 -0.00 0.00 0.13 0.00 0.00 42.46 41.39 2kc0 s ILE 170 CO 0.03 -0.08 1.69 -1.81 -1.91 0.00 0.00 174.94 172.85 2kc0 s ASP 171 N 1.76 5.72 0.53 4.50 1.01 -1.22 -2.15 116.67 126.82 2kc0 s ASP 171 Ca -0.01 -0.71 0.36 0.00 0.71 0.00 0.00 52.55 52.90 2kc0 s ASP 171 Cb -0.17 -2.56 1.88 0.00 1.01 0.00 0.00 42.92 43.08 2kc0 s ASP 171 CO -0.07 -2.18 2.09 -0.26 0.21 0.00 0.00 175.17 174.96 2kc0 h PHE 172 N 11.30 0.00 0.00 4.23 0.04 -1.34 0.31 116.94 131.47 2kc0 h PHE 172 Ca 0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.79 2kc0 h PHE 172 Cb 1.04 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.19 2kc0 h PHE 172 CO 1.19 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 178.90 2kc0 n ALA 173 N -1.98 1.67 -0.15 2.45 0.00 -1.24 -3.21 120.51 118.05 2kc0 n ALA 173 Ca -0.02 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2kc0 n ALA 173 Cb 0.09 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.16 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 -1.76 1.10 -3.79 0.00 0.00 -0.06 -4.92 120.51 111.09 2kc0 n ALA 174 Ca 0.02 -0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 2kc0 n ALA 174 Cb 0.23 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.67 2kc0 n ALA 174 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2kc0 n LYS 175 N -0.35 -3.87 -3.49 0.00 5.02 0.90 -4.94 118.16 111.42 2kc0 n LYS 175 Ca 0.00 0.47 -0.40 0.00 -2.02 0.00 0.00 58.31 56.37 2kc0 n LYS 175 Cb 0.04 -5.24 -0.10 0.00 -0.02 0.00 0.00 35.03 29.70 2kc0 n LYS 175 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2kc0 s GLN 176 N -6.47 3.73 -1.01 1.97 -1.52 -1.24 -3.69 119.66 111.43 2kc0 s GLN 176 Ca 0.59 -0.38 -0.13 0.00 -1.95 0.00 0.00 55.36 53.48 2kc0 s GLN 176 Cb -0.31 -3.74 0.21 0.00 -0.22 0.00 0.00 33.01 28.95 2kc0 s GLN 176 CO 0.72 -0.36 1.08 0.20 -0.25 0.00 0.00 175.29 176.68 2kc0 s GLY 177 N 1.72 2.65 0.61 3.09 0.00 -0.05 -3.42 107.32 111.92 2kc0 s GLY 177 Ca 0.09 -3.39 -0.03 0.00 0.00 0.00 0.00 44.72 41.39 2kc0 s GLY 177 CO 0.11 1.59 0.88 0.21 0.00 0.00 0.00 173.10 175.88 2kc0 s ASN 178 N 2.32 5.18 0.00 1.64 3.04 -0.90 -3.72 114.94 122.50 2kc0 s ASN 178 Ca 0.30 0.30 0.00 0.00 0.04 0.00 0.00 52.86 53.49 2kc0 s ASN 178 Cb -0.08 -1.13 0.00 0.00 -1.54 0.00 0.00 41.25 38.50 2kc0 s ASN 178 CO -0.07 -1.28 0.00 0.61 -3.04 0.00 0.00 177.10 173.32 2kc0 n GLY 179 N -2.58 3.32 3.58 1.21 0.00 -1.26 -1.62 105.19 107.83 2kc0 n GLY 179 Ca 0.07 -1.16 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 2kc0 n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kc0 s LYS 180 N -0.62 0.63 0.22 1.61 -2.85 -0.40 -3.59 119.74 114.75 2kc0 s LYS 180 Ca 0.00 0.18 -0.22 0.00 -1.00 0.00 0.00 55.97 54.93 2kc0 s LYS 180 Cb 0.00 0.30 -0.08 0.00 -2.06 0.00 0.00 37.83 35.98 2kc0 s LYS 180 CO 0.00 -0.19 0.77 0.42 0.10 0.00 0.00 175.35 176.45 2kc0 s ILE 181 N -1.04 4.46 -0.27 3.79 -1.09 -0.86 -1.36 121.20 124.84 2kc0 s ILE 181 Ca -0.02 1.47 -0.06 0.00 -2.23 0.00 0.00 60.65 59.81 2kc0 s ILE 181 Cb -0.01 -3.95 0.14 0.00 -1.58 0.00 0.00 42.46 37.06 2kc0 s ILE 181 CO 0.02 0.27 0.55 -0.70 -1.23 0.00 0.00 174.94 173.85 2kc0 s GLU 182 N -1.79 0.49 0.00 2.79 2.12 -0.47 -4.26 118.70 117.58 2kc0 s GLU 182 Ca 0.42 1.10 0.00 0.00 0.36 0.00 0.00 54.97 56.85 2kc0 s GLU 182 Cb -0.18 0.47 0.00 0.00 0.26 0.00 0.00 34.13 34.67 2kc0 s GLU 182 CO 0.23 -0.40 0.00 0.72 -0.54 0.00 0.00 175.26 175.27 2kc0 n HIS 183 N 5.42 0.00 -1.66 5.30 8.25 -1.26 -4.29 115.22 126.97 2kc0 n HIS 183 Ca -0.07 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.08 2kc0 n HIS 183 Cb 0.50 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.65 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 3.19 0.56 2.41 2.01 -1.26 -4.94 118.68 120.65 2kc0 s LEU 184 Ca 0.00 1.63 0.31 0.00 0.01 0.00 0.00 54.13 56.08 2kc0 s LEU 184 Cb 0.00 -4.50 1.46 0.00 0.01 0.00 0.00 46.19 43.17 2kc0 s LEU 184 CO 0.00 -1.36 1.87 0.07 1.01 0.00 0.00 176.35 177.94 2kc0 h LYS 185 N -0.52 0.00 -5.18 1.70 5.09 -2.02 -3.40 116.57 112.25 2kc0 h LYS 185 Ca -0.44 0.00 -0.40 0.00 0.09 0.00 0.00 60.65 59.90 2kc0 h LYS 185 Cb 1.21 0.00 -0.23 0.00 0.10 0.00 0.00 32.23 33.31 2kc0 h LYS 185 CO 0.57 0.00 -0.78 -1.12 -2.09 0.00 0.00 179.45 176.04 2kc0 s SER 186 N -5.38 1.50 0.17 7.07 0.01 -1.26 -5.07 113.70 110.73 2kc0 s SER 186 Ca -0.05 -0.52 -0.15 0.00 1.31 0.00 0.00 55.95 56.54 2kc0 s SER 186 Cb 0.19 -0.06 0.05 0.00 0.21 0.00 0.00 66.02 66.41 2kc0 s SER 186 CO 0.69 -0.05 1.82 1.55 0.41 0.00 0.00 173.24 177.66 2kc0 h PRO 187 N 4.64 0.60 0.00 12.44 0.13 -1.99 -2.92 132.00 144.90 2kc0 h PRO 187 Ca -0.38 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2kc0 h PRO 187 Cb 1.19 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2kc0 h PRO 187 CO 0.42 0.40 0.00 -1.91 -0.23 0.00 0.00 178.00 176.68 2kc0 n GLU 188 N -4.77 0.15 0.03 0.86 2.13 -1.26 -1.89 120.64 115.89 2kc0 n GLU 188 Ca 0.02 0.16 0.11 0.00 0.66 0.00 0.00 57.16 58.11 2kc0 n GLU 188 Cb 0.03 -1.50 -0.08 0.00 0.27 0.00 0.00 31.44 30.16 2kc0 n GLU 188 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2kc0 n LEU 189 N -1.22 0.43 -4.70 4.31 7.99 -1.10 -4.89 117.00 117.82 2kc0 n LEU 189 Ca 0.04 0.08 -0.42 0.00 -0.01 0.00 0.00 56.01 55.70 2kc0 n LEU 189 Cb 0.06 -0.04 -0.03 0.00 -0.11 0.00 0.00 43.42 43.30 2kc0 n LEU 189 CO 0.06 -0.04 0.76 0.20 -1.51 0.00 0.00 177.39 176.86 2kc0 s ASN 190 N -4.60 7.27 0.10 -1.43 0.01 -0.79 -4.59 114.94 110.91 2kc0 s ASN 190 Ca -0.03 1.67 -0.02 0.00 -0.71 0.00 0.00 52.86 53.77 2kc0 s ASN 190 Cb 0.13 -2.57 -0.05 0.00 0.41 0.00 0.00 41.25 39.18 2kc0 s ASN 190 CO 0.85 -0.37 0.29 0.68 -1.51 0.00 0.00 177.10 177.03 2kc0 s VAL 191 N 1.45 5.29 0.61 1.60 -7.23 -1.26 -4.94 120.40 115.92 2kc0 s VAL 191 Ca 0.52 -0.22 -0.16 0.00 -1.81 0.00 0.00 61.98 60.31 2kc0 s VAL 191 Cb -0.21 -3.63 -0.03 0.00 0.56 0.00 0.00 36.38 33.06 2kc0 s VAL 191 CO 0.24 0.08 1.07 -1.81 -0.31 0.00 0.00 175.10 174.37 2kc0 s ASP 192 N -2.52 5.67 -0.05 4.85 1.01 -1.26 -2.02 116.67 122.35 2kc0 s ASP 192 Ca 0.38 1.84 0.03 0.00 0.71 0.00 0.00 52.55 55.51 2kc0 s ASP 192 Cb -0.13 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 41.24 2kc0 s ASP 192 CO 0.27 -1.24 -0.12 -0.22 0.21 0.00 0.00 175.17 174.07 2kc0 s LEU 193 N -4.58 2.88 -0.68 1.23 2.96 -1.24 -4.18 118.68 115.08 2kc0 s LEU 193 Ca 0.64 -0.14 -0.27 0.00 -0.22 0.00 0.00 54.13 54.14 2kc0 s LEU 193 Cb -0.17 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 44.95 2kc0 s LEU 193 CO 0.38 0.35 1.23 0.00 -1.32 0.00 0.00 176.35 176.99 2kc0 s ALA 194 N -0.76 2.85 -0.23 5.97 0.00 -1.07 -4.53 121.76 123.99 2kc0 s ALA 194 Ca 0.12 -1.19 -0.35 0.00 0.00 0.00 0.00 51.96 50.53 2kc0 s ALA 194 Cb -0.11 -4.16 -0.12 0.00 0.00 0.00 0.00 23.12 18.73 2kc0 s ALA 194 CO 0.01 -3.04 1.99 0.00 0.00 0.00 0.00 175.76 174.72 2kc0 n ALA 195 N 8.97 0.79 -2.36 0.00 0.00 -1.26 -4.15 120.51 122.49 2kc0 n ALA 195 Ca 0.05 0.15 -0.31 0.00 0.00 0.00 0.00 53.44 53.33 2kc0 n ALA 195 Cb 0.49 -2.49 -0.15 0.00 0.00 0.00 0.00 19.45 17.30 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 5.42 2.31 0.31 0.00 0.00 -1.24 -4.96 121.76 123.59 2kc0 s ALA 196 Ca 1.00 -1.18 0.07 0.00 0.00 0.00 0.00 51.96 51.86 2kc0 s ALA 196 Cb -0.80 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.71 2kc0 s ALA 196 CO 0.53 0.54 0.35 0.16 0.00 0.00 0.00 175.76 177.33 2kc0 s ASP 197 N -0.98 5.69 0.33 0.00 -4.77 -1.26 -0.87 116.67 114.80 2kc0 s ASP 197 Ca 0.11 -0.28 -0.29 0.00 -3.30 0.00 0.00 52.55 48.80 2kc0 s ASP 197 Cb -0.10 -1.24 -0.12 0.00 -1.09 0.00 0.00 42.92 40.37 2kc0 s ASP 197 CO 0.01 -0.30 1.36 -0.38 0.70 0.00 0.00 175.17 176.57 2kc0 n ILE 198 N -1.44 1.74 -4.17 2.11 2.08 -1.24 -4.54 119.36 113.90 2kc0 n ILE 198 Ca -0.03 -0.44 -0.26 0.00 0.56 0.00 0.00 62.75 62.58 2kc0 n ILE 198 Cb 0.59 -1.65 -0.07 0.00 -0.75 0.00 0.00 39.64 37.76 2kc0 n ILE 198 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2kc0 s LYS 199 N -1.55 2.55 -1.23 0.38 1.02 -1.12 -5.05 119.74 114.74 2kc0 s LYS 199 Ca 0.58 -1.04 -0.07 0.00 0.02 0.00 0.00 55.97 55.46 2kc0 s LYS 199 Cb -0.56 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.31 2kc0 s LYS 199 CO 0.59 0.46 2.75 -0.35 -0.92 0.00 0.00 175.35 177.89 2kc0 n PRO 200 N -0.17 3.82 -1.17 -1.68 -0.04 -1.26 -4.51 135.00 129.99 2kc0 n PRO 200 Ca -0.09 -2.67 -0.34 0.00 -0.04 0.00 0.00 63.50 60.35 2kc0 n PRO 200 Cb 0.55 -2.59 -0.02 0.00 -0.04 0.00 0.00 33.50 31.40 2kc0 n PRO 200 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2kc0 n ASP 201 N 2.39 5.78 0.00 3.54 9.92 -1.26 -4.87 116.55 132.05 2kc0 n ASP 201 Ca 0.66 -2.55 0.00 0.00 -0.53 0.00 0.00 54.79 52.37 2kc0 n ASP 201 Cb 0.33 -1.36 0.00 0.00 -0.64 0.00 0.00 41.12 39.45 2kc0 n ASP 201 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2kc0 n GLY 202 N 3.86 0.51 0.00 0.44 0.00 -1.26 -3.97 105.19 104.78 2kc0 n GLY 202 Ca 0.59 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 7.50 3.20 0.00 1.61 2.85 -1.26 -4.84 118.16 127.22 2kc0 n LYS 203 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2kc0 n LYS 203 Cb 0.00 -0.55 0.00 0.00 -0.65 0.00 0.00 35.03 33.83 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 -0.66 0.01 -3.30 -1.58 -4.01 -1.26 -4.07 116.66 101.79 2kc0 n ARG 204 Ca 0.00 -0.33 -0.46 0.00 -1.04 0.00 0.00 57.85 56.02 2kc0 n ARG 204 Cb 0.00 -0.66 -0.05 0.00 -3.04 0.00 0.00 32.46 28.71 2kc0 n ARG 204 CO 0.00 0.00 0.00 -1.01 -3.04 0.00 0.00 177.63 173.58 2kc0 s HIS 205 N -0.08 3.24 -0.12 2.89 3.76 -1.25 -3.46 115.29 120.26 2kc0 s HIS 205 Ca 0.00 -1.27 -0.26 0.00 -0.15 0.00 0.00 55.06 53.37 2kc0 s HIS 205 Cb 0.00 -3.80 -0.02 0.00 1.11 0.00 0.00 32.58 29.87 2kc0 s HIS 205 CO 0.00 -1.03 0.85 0.00 -0.85 0.00 0.00 174.74 173.71 2kc0 s ALA 206 N 1.64 3.43 0.00 -1.40 0.00 -1.26 -4.42 121.76 119.75 2kc0 s ALA 206 Ca 0.03 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.20 2kc0 s ALA 206 Cb -0.30 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.59 2kc0 s ALA 206 CO 0.03 -0.50 -0.14 0.08 0.00 0.00 0.00 175.76 175.24 2kc0 s VAL 207 N 1.76 1.07 -0.13 0.00 1.01 -1.26 -2.99 120.40 119.85 2kc0 s VAL 207 Ca 0.41 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2kc0 s VAL 207 Cb -0.17 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.31 2kc0 s VAL 207 CO 0.16 0.21 -0.12 -0.63 0.00 0.00 0.00 175.10 174.72 2kc0 s ILE 208 N -0.47 1.39 -0.14 2.22 -1.09 -0.13 -2.81 121.20 120.17 2kc0 s ILE 208 Ca 0.04 -0.53 -0.00 0.00 -2.23 0.00 0.00 60.65 57.93 2kc0 s ILE 208 Cb -0.06 -1.33 0.03 0.00 -1.58 0.00 0.00 42.46 39.52 2kc0 s ILE 208 CO 0.00 0.43 -0.10 -0.44 -1.23 0.00 0.00 174.94 173.60 2kc0 s SER 209 N 1.49 2.49 0.00 3.58 0.01 -1.26 -1.62 113.70 118.39 2kc0 s SER 209 Ca 0.04 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 56.86 2kc0 s SER 209 Cb -0.13 -0.99 0.00 0.00 0.21 0.00 0.00 66.02 65.11 2kc0 s SER 209 CO -0.09 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.07 2kc0 n GLY 210 N 4.86 5.15 3.31 3.44 0.00 -0.20 -4.81 105.19 116.94 2kc0 n GLY 210 Ca -0.14 -1.31 -0.23 0.00 0.00 0.00 0.00 46.02 44.34 2kc0 n GLY 210 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kc0 s SER 211 N 1.05 2.61 -0.07 1.61 0.01 -1.26 -2.04 113.70 115.61 2kc0 s SER 211 Ca 0.00 -0.76 0.01 0.00 1.31 0.00 0.00 55.95 56.51 2kc0 s SER 211 Cb 0.00 -0.15 0.02 0.00 0.21 0.00 0.00 66.02 66.10 2kc0 s SER 211 CO 0.00 0.02 -0.09 -0.69 0.41 0.00 0.00 173.24 172.90 2kc0 s VAL 212 N -1.51 0.92 0.68 3.43 1.01 -0.96 -2.61 120.40 121.36 2kc0 s VAL 212 Ca 0.10 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.79 2kc0 s VAL 212 Cb -0.08 -0.89 0.13 0.00 0.00 0.00 0.00 36.38 35.54 2kc0 s VAL 212 CO 0.05 0.32 0.94 0.18 0.00 0.00 0.00 175.10 176.59 2kc0 n LEU 213 N 4.20 0.00 -3.65 3.92 7.99 -1.26 -1.89 117.00 126.31 2kc0 n LEU 213 Ca -0.20 -2.18 -0.00 0.00 -0.01 0.00 0.00 56.01 53.62 2kc0 n LEU 213 Cb 0.51 -0.59 -0.06 0.00 -0.11 0.00 0.00 43.42 43.17 2kc0 n LEU 213 CO 0.22 -0.92 0.84 -0.31 -1.51 0.00 0.00 177.39 175.71 2kc0 s TYR 214 N -2.93 -0.33 -1.20 -1.77 2.02 -1.26 -4.93 117.35 106.95 2kc0 s TYR 214 Ca 0.64 0.65 -0.10 0.00 -0.37 0.00 0.00 57.07 57.90 2kc0 s TYR 214 Cb -0.04 0.20 0.08 0.00 -0.40 0.00 0.00 41.96 41.80 2kc0 s TYR 214 CO 0.42 -0.16 0.43 -1.71 -1.57 0.00 0.00 175.55 172.96 2kc0 n ASN 215 N 3.38 -3.19 0.00 2.29 5.15 -1.26 -0.57 115.26 121.06 2kc0 n ASN 215 Ca -0.18 -0.37 0.00 0.00 -0.60 0.00 0.00 54.58 53.43 2kc0 n ASN 215 Cb 0.57 -2.67 0.00 0.00 -0.53 0.00 0.00 39.78 37.15 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 -3.59 -0.64 -3.15 1.20 1.13 -1.26 -4.93 117.38 106.15 2kc0 n GLN 216 Ca -0.00 0.16 0.05 0.00 -1.94 0.00 0.00 57.00 55.27 2kc0 n GLN 216 Cb 0.53 -3.94 -0.01 0.00 0.11 0.00 0.00 30.24 26.93 2kc0 n GLN 216 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2kc0 s ALA 217 N -1.79 -3.05 0.09 -1.58 0.00 0.26 -5.10 121.76 110.59 2kc0 s ALA 217 Ca 0.00 1.48 -0.27 0.00 0.00 0.00 0.00 51.96 53.17 2kc0 s ALA 217 Cb 0.00 -2.47 0.08 0.00 0.00 0.00 0.00 23.12 20.74 2kc0 s ALA 217 CO 0.00 -1.58 1.06 -2.00 0.00 0.00 0.00 175.76 173.24 2kc0 s GLU 218 N 2.91 0.92 -0.51 0.00 2.56 -1.26 -4.61 118.70 118.71 2kc0 s GLU 218 Ca 0.12 -0.50 0.06 0.00 0.00 0.00 0.00 54.97 54.65 2kc0 s GLU 218 Cb -0.10 0.32 0.23 0.00 2.00 0.00 0.00 34.13 36.57 2kc0 s GLU 218 CO -0.18 -0.42 0.56 1.17 -0.56 0.00 0.00 175.26 175.83 2kc0 n LYS 219 N -0.46 1.31 -2.71 4.30 4.81 -1.26 -4.79 118.16 119.35 2kc0 n LYS 219 Ca -0.07 -3.81 -0.19 0.00 -0.87 0.00 0.00 58.31 53.37 2kc0 n LYS 219 Cb 0.61 -1.73 0.08 0.00 0.02 0.00 0.00 35.03 34.01 2kc0 n LYS 219 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kc0 n GLY 220 N 1.54 1.53 3.01 3.14 0.00 -0.79 -4.11 105.19 109.50 2kc0 n GLY 220 Ca 0.25 -2.16 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 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 -4.51 0.55 0.02 1.61 1.04 0.41 -2.27 113.70 110.55 2kc0 s SER 221 Ca 0.59 -0.43 0.04 0.00 0.48 0.00 0.00 55.95 56.63 2kc0 s SER 221 Cb -0.04 0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.10 2kc0 s SER 221 CO 0.38 -0.18 -0.13 -0.72 0.98 0.00 0.00 173.24 173.56 2kc0 s TYR 222 N -1.12 1.17 -0.02 5.02 1.13 -0.87 -0.87 117.35 121.80 2kc0 s TYR 222 Ca -0.09 -0.30 0.01 0.00 -1.41 0.00 0.00 57.07 55.27 2kc0 s TYR 222 Cb -0.08 -0.72 0.02 0.00 -1.10 0.00 0.00 41.96 40.08 2kc0 s TYR 222 CO -0.00 0.01 -0.01 0.45 -2.51 0.00 0.00 175.55 173.49 2kc0 s SER 223 N -0.81 0.32 0.23 -0.18 0.15 0.02 -1.03 113.70 112.41 2kc0 s SER 223 Ca 0.03 -0.03 -0.13 0.00 0.70 0.00 0.00 55.95 56.53 2kc0 s SER 223 Cb -0.07 -0.13 -0.00 0.00 -1.71 0.00 0.00 66.02 64.11 2kc0 s SER 223 CO 0.01 -0.05 0.45 -1.48 1.20 0.00 0.00 173.24 173.36 2kc0 s LEU 224 N 0.59 0.41 0.24 3.45 0.05 -0.64 -0.95 118.68 121.83 2kc0 s LEU 224 Ca -0.06 -0.88 0.03 0.00 0.05 0.00 0.00 54.13 53.27 2kc0 s LEU 224 Cb -0.09 1.69 -0.05 0.00 -2.05 0.00 0.00 46.19 45.69 2kc0 s LEU 224 CO -0.01 -1.08 0.04 -0.83 -0.55 0.00 0.00 176.35 173.91 2kc0 s GLY 225 N -3.00 1.62 0.12 -3.48 0.00 -0.81 -0.96 107.32 100.83 2kc0 s GLY 225 Ca 0.20 -1.81 -0.28 0.00 0.00 0.00 0.00 44.72 42.83 2kc0 s GLY 225 CO 0.06 -1.64 0.89 -0.42 0.00 0.00 0.00 173.10 171.99 2kc0 s ILE 226 N -3.55 4.46 0.12 0.90 -1.09 -1.16 -2.79 121.20 118.09 2kc0 s ILE 226 Ca 0.32 1.92 0.07 0.00 -2.23 0.00 0.00 60.65 60.73 2kc0 s ILE 226 Cb 0.07 -4.25 -0.04 0.00 -1.58 0.00 0.00 42.46 36.66 2kc0 s ILE 226 CO 0.10 0.39 -0.17 -0.36 -1.23 0.00 0.00 174.94 173.67 2kc0 s PHE 227 N -0.36 1.55 0.00 3.97 0.08 -0.51 -3.74 117.98 118.97 2kc0 s PHE 227 Ca 0.42 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.99 2kc0 s PHE 227 Cb -0.23 -0.83 0.00 0.00 -0.57 0.00 0.00 43.02 41.39 2kc0 s PHE 227 CO 0.28 0.18 0.00 0.41 -0.10 0.00 0.00 175.22 175.99 2kc0 n GLY 228 N 0.78 -1.96 0.28 4.36 0.00 -0.62 -2.95 105.19 105.07 2kc0 n GLY 228 Ca -0.17 -1.87 0.17 0.00 0.00 0.00 0.00 46.02 44.15 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 0.00 -0.02 0.00 -1.98 -3.41 103.07 97.67 2kc0 h GLY 229 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2kc0 h GLY 229 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.71 2kc0 n LYS 230 N -3.17 0.00 -0.71 4.80 4.81 -1.26 -5.03 118.16 117.60 2kc0 n LYS 230 Ca -0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.40 2kc0 n LYS 230 Cb 0.27 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.28 2kc0 n LYS 230 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kc0 n ALA 231 N -1.22 2.02 0.24 3.14 0.00 -1.26 -4.88 120.51 118.54 2kc0 n ALA 231 Ca 0.00 -0.35 -0.15 0.00 0.00 0.00 0.00 53.44 52.95 2kc0 n ALA 231 Cb 0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 19.45 19.15 2kc0 n ALA 231 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2kc0 h GLN 232 N 0.00 -0.59 -3.71 0.00 7.50 -1.87 -3.46 115.11 112.99 2kc0 h GLN 232 Ca -0.29 0.04 -0.10 0.00 0.50 0.00 0.00 58.65 58.81 2kc0 h GLN 232 Cb 1.02 0.13 -0.08 0.00 0.05 0.00 0.00 27.48 28.60 2kc0 h GLN 232 CO -0.15 -0.29 -0.11 -1.83 -1.50 0.00 0.00 178.83 174.95 2kc0 s GLU 233 N -5.06 1.66 -0.06 1.46 -1.05 -1.21 -2.07 118.70 112.37 2kc0 s GLU 233 Ca -0.15 -1.36 0.03 0.00 -0.15 0.00 0.00 54.97 53.34 2kc0 s GLU 233 Cb 0.02 0.47 0.00 0.00 -0.44 0.00 0.00 34.13 34.19 2kc0 s GLU 233 CO 0.54 -0.70 -0.16 0.14 0.95 0.00 0.00 175.26 176.04 2kc0 s VAL 234 N -3.72 1.41 0.04 1.83 -7.23 -0.40 -1.42 120.40 110.90 2kc0 s VAL 234 Ca 0.24 -0.67 -0.03 0.00 -1.81 0.00 0.00 61.98 59.71 2kc0 s VAL 234 Cb -0.01 -1.24 -0.02 0.00 0.56 0.00 0.00 36.38 35.67 2kc0 s VAL 234 CO 0.11 0.41 0.04 0.00 -0.31 0.00 0.00 175.10 175.36 2kc0 s ALA 235 N 0.36 0.15 0.00 1.32 0.00 -1.12 -1.72 121.76 120.75 2kc0 s ALA 235 Ca -0.11 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.06 2kc0 s ALA 235 Cb -0.14 0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.24 2kc0 s ALA 235 CO 0.04 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2kc0 n GLY 236 N 0.59 -0.53 3.52 0.00 0.00 -1.01 -1.92 105.19 105.84 2kc0 n GLY 236 Ca -0.18 0.03 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 2kc0 n GLY 236 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2kc0 s SER 237 N -4.00 -0.64 0.13 1.61 0.15 -0.13 -1.49 113.70 109.33 2kc0 s SER 237 Ca 0.00 0.97 0.05 0.00 0.70 0.00 0.00 55.95 57.67 2kc0 s SER 237 Cb 0.00 0.92 -0.04 0.00 -1.71 0.00 0.00 66.02 65.19 2kc0 s SER 237 CO 0.00 -0.41 -0.12 0.00 1.20 0.00 0.00 173.24 173.91 2kc0 s ALA 238 N -0.44 1.42 0.10 5.45 0.00 0.10 -0.80 121.76 127.60 2kc0 s ALA 238 Ca -0.06 -1.32 0.05 0.00 0.00 0.00 0.00 51.96 50.63 2kc0 s ALA 238 Cb -0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 2kc0 s ALA 238 CO 0.05 0.03 -0.13 -2.00 0.00 0.00 0.00 175.76 173.71 2kc0 s GLU 239 N -2.96 0.93 -0.03 0.00 -6.30 -0.04 -0.78 118.70 109.53 2kc0 s GLU 239 Ca 0.10 -1.15 -0.01 0.00 -2.50 0.00 0.00 54.97 51.41 2kc0 s GLU 239 Cb -0.03 -0.81 0.02 0.00 0.00 0.00 0.00 34.13 33.32 2kc0 s GLU 239 CO 0.02 0.16 0.06 0.54 0.02 0.00 0.00 175.26 176.06 2kc0 s VAL 240 N -1.98 -0.03 -1.07 3.70 0.11 -0.81 -0.45 120.40 119.87 2kc0 s VAL 240 Ca 0.05 0.13 -0.05 0.00 -2.93 0.00 0.00 61.98 59.17 2kc0 s VAL 240 Cb -0.06 -0.12 0.29 0.00 -1.53 0.00 0.00 36.38 34.97 2kc0 s VAL 240 CO 0.02 0.05 1.28 0.29 -3.33 0.00 0.00 175.10 173.41 2kc0 n LYS 241 N 3.75 3.95 -1.30 1.54 5.02 -1.26 -0.46 118.16 129.40 2kc0 n LYS 241 Ca -0.21 -4.52 -0.29 0.00 -2.02 0.00 0.00 58.31 51.26 2kc0 n LYS 241 Cb 0.54 -2.51 0.15 0.00 -0.02 0.00 0.00 35.03 33.19 2kc0 n LYS 241 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2kc0 s THR 242 N -2.13 2.32 0.60 -0.18 2.01 -0.97 -4.82 115.64 112.47 2kc0 s THR 242 Ca 0.31 0.10 0.29 0.00 0.31 0.00 0.00 61.69 62.70 2kc0 s THR 242 Cb -0.01 -2.68 0.36 0.00 0.01 0.00 0.00 72.50 70.18 2kc0 s THR 242 CO 0.02 -0.13 1.93 -0.37 -0.69 0.00 0.00 174.62 175.38 2kc0 h VAL 243 N -1.63 0.32 -0.02 3.82 -1.51 -2.00 1.00 116.25 116.23 2kc0 h VAL 243 Ca -0.52 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 2kc0 h VAL 243 Cb 1.31 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 2kc0 h VAL 243 CO 0.58 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 177.51 2kc0 n ASN 244 N -3.59 0.73 0.00 4.19 3.02 -1.26 -5.06 115.26 113.30 2kc0 n ASN 244 Ca 0.05 -1.30 0.00 0.00 -0.03 0.00 0.00 54.58 53.30 2kc0 n ASN 244 Cb 0.56 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.72 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 1.06 -4.05 3.76 7.41 0.00 0.34 -5.05 105.19 108.66 2kc0 n GLY 245 Ca 0.20 -2.10 -0.39 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.88 2.12 0.11 -0.61 1.10 -1.26 -2.29 121.20 119.50 2kc0 s ILE 246 Ca 0.00 0.10 0.08 0.00 -0.51 0.00 0.00 60.65 60.33 2kc0 s ILE 246 Cb 0.00 -3.06 -0.04 0.00 0.15 0.00 0.00 42.46 39.52 2kc0 s ILE 246 CO 0.00 0.01 -0.20 -0.13 -2.11 0.00 0.00 174.94 172.51 2kc0 s ARG 247 N -2.62 1.13 -0.02 3.50 1.81 0.39 -4.89 118.95 118.26 2kc0 s ARG 247 Ca 0.65 -1.19 0.05 0.00 -1.72 0.00 0.00 55.73 53.52 2kc0 s ARG 247 Cb -0.42 -1.36 -0.03 0.00 -0.45 0.00 0.00 34.95 32.70 2kc0 s ARG 247 CO 0.52 0.31 -0.17 -1.01 -0.68 0.00 0.00 175.30 174.27 2kc0 s HIS 248 N -1.30 2.60 -0.02 -0.53 3.76 -1.26 -1.93 115.29 116.60 2kc0 s HIS 248 Ca 0.07 -0.23 0.03 0.00 -0.15 0.00 0.00 55.06 54.78 2kc0 s HIS 248 Cb -0.09 -1.56 0.00 0.00 1.11 0.00 0.00 32.58 32.04 2kc0 s HIS 248 CO 0.04 0.17 -0.09 0.42 -0.85 0.00 0.00 174.74 174.43 2kc0 s ILE 249 N -0.77 0.80 0.22 0.60 1.01 0.04 -4.16 121.20 118.95 2kc0 s ILE 249 Ca 0.12 -0.38 -0.28 0.00 0.00 0.00 0.00 60.65 60.11 2kc0 s ILE 249 Cb -0.10 -0.70 -0.09 0.00 0.01 0.00 0.00 42.46 41.57 2kc0 s ILE 249 CO 0.02 0.25 0.89 -0.83 0.00 0.00 0.00 174.94 175.26 2kc0 s GLY 250 N 0.10 3.04 -0.18 6.18 0.00 -0.47 -0.72 107.32 115.27 2kc0 s GLY 250 Ca -0.02 0.53 -0.14 0.00 0.00 0.00 0.00 44.72 45.10 2kc0 s GLY 250 CO 0.00 1.07 0.30 1.08 0.00 0.00 0.00 173.10 175.56 2kc0 s LEU 251 N -1.23 4.21 -0.19 0.66 2.01 -0.56 -3.95 118.68 119.63 2kc0 s LEU 251 Ca 0.40 0.46 -0.04 0.00 0.01 0.00 0.00 54.13 54.96 2kc0 s LEU 251 Cb -0.25 -2.37 0.09 0.00 0.01 0.00 0.00 46.19 43.67 2kc0 s LEU 251 CO 0.30 0.05 0.20 0.00 1.01 0.00 0.00 176.35 177.91 2kc0 s ALA 252 N 0.75 -0.18 -0.12 4.21 0.00 -1.26 -2.42 121.76 122.75 2kc0 s ALA 252 Ca 0.16 0.20 -0.04 0.00 0.00 0.00 0.00 51.96 52.28 2kc0 s ALA 252 Cb -0.13 -1.26 0.06 0.00 0.00 0.00 0.00 23.12 21.79 2kc0 s ALA 252 CO 0.05 -1.17 0.19 0.00 0.00 0.00 0.00 175.76 174.82 2kc0 s ALA 253 N 2.30 -0.22 0.12 0.00 0.00 -0.70 -1.51 121.76 121.74 2kc0 s ALA 253 Ca 0.06 0.52 0.10 0.00 0.00 0.00 0.00 51.96 52.65 2kc0 s ALA 253 Cb -0.16 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 21.96 2kc0 s ALA 253 CO -0.11 -0.74 -0.25 0.21 0.00 0.00 0.00 175.76 174.87 2kc0 s LYS 254 N 2.32 1.51 0.00 0.00 2.36 -0.50 -1.28 119.74 124.15 2kc0 s LYS 254 Ca 0.04 -1.29 0.03 0.00 -2.55 0.00 0.00 55.97 52.19 2kc0 s LYS 254 Cb -0.13 -1.95 0.20 0.00 -1.05 0.00 0.00 37.83 34.90 2kc0 s LYS 254 CO -0.08 0.46 0.68 0.00 1.55 0.00 0.00 175.35 177.97