#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2x h GLU 2 N 0.00 0.48 -0.49 3.52 4.57 -1.61 -3.10 114.58 117.95 2k2x h GLU 2 Ca 0.00 -0.12 -0.06 0.00 -1.18 0.00 0.00 59.36 58.00 2k2x h GLU 2 Cb 0.00 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 2k2x h GLU 2 CO 0.00 0.56 0.07 0.00 -1.18 0.00 0.00 179.01 178.45 2k2x h VAL 4 N 0.74 1.24 -0.73 0.00 2.07 -1.79 -1.79 116.25 115.99 2k2x h VAL 4 Ca 0.16 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.80 2k2x h VAL 4 Cb 0.35 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2k2x h VAL 4 CO 0.01 0.26 0.28 -1.28 0.02 0.00 0.00 177.57 176.86 2k2x h SER 5 N 0.24 1.01 0.61 0.57 0.87 -1.36 -2.87 113.55 112.62 2k2x h SER 5 Ca 0.08 -0.18 -0.08 0.00 -1.23 0.00 0.00 61.79 60.38 2k2x h SER 5 Cb 0.37 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 2k2x h SER 5 CO 0.01 0.92 -0.39 0.11 -0.53 0.00 0.00 176.83 176.95 2k2x h LYS 6 N 1.05 0.00 -0.05 2.24 1.79 -1.22 -3.48 116.57 116.90 2k2x h LYS 6 Ca 0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 2k2x h LYS 6 Cb 0.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 2k2x h LYS 6 CO -0.02 0.39 0.00 0.41 -1.08 0.00 0.00 179.45 179.15 2k2x n GLY 7 N -0.08 0.91 3.69 3.86 0.00 -1.00 -5.10 105.19 107.48 2k2x n GLY 7 Ca -0.01 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 2k2x n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k2x s PHE 8 N -1.88 2.08 0.50 1.61 0.40 -0.71 -4.86 117.98 115.12 2k2x s PHE 8 Ca 0.00 -0.88 0.06 0.00 -0.60 0.00 0.00 56.93 55.51 2k2x s PHE 8 Cb 0.00 -1.63 0.03 0.00 0.51 0.00 0.00 43.02 41.93 2k2x s PHE 8 CO 0.00 0.27 0.69 0.20 0.70 0.00 0.00 175.22 177.07 2k2x s GLY 9 N -3.79 1.87 -0.28 4.36 0.00 -1.01 -4.50 107.32 103.98 2k2x s GLY 9 Ca 0.18 -1.63 0.12 0.00 0.00 0.00 0.00 44.72 43.39 2k2x s GLY 9 CO 0.09 -1.36 1.16 0.00 0.00 0.00 0.00 173.10 173.00 2k2x n LEU 11 N -0.67 3.47 -4.77 0.00 7.99 -1.25 -4.62 117.00 117.16 2k2x n LEU 11 Ca 0.31 0.64 -0.33 0.00 -0.01 0.00 0.00 56.01 56.63 2k2x n LEU 11 Cb 0.91 -1.41 0.06 0.00 -0.11 0.00 0.00 43.42 42.87 2k2x n LEU 11 CO 0.29 -2.06 0.73 -2.16 -1.51 0.00 0.00 177.39 172.68 2k2x s PRO 12 N -3.46 2.66 0.61 3.23 0.04 -1.26 -3.65 135.00 133.17 2k2x s PRO 12 Ca 0.73 1.36 0.39 0.00 0.04 0.00 0.00 61.00 63.52 2k2x s PRO 12 Cb -0.33 -1.93 1.93 0.00 0.04 0.00 0.00 34.50 34.21 2k2x s PRO 12 CO 0.51 -1.35 2.20 1.96 0.04 0.00 0.00 177.00 180.35 2k2x h GLN 13 N -0.22 0.00 0.00 4.56 4.20 -1.88 -1.86 115.11 119.91 2k2x h GLN 13 Ca -0.46 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.25 2k2x h GLN 13 Cb 1.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 2k2x h GLN 13 CO 0.53 0.01 0.00 0.43 -0.67 0.00 0.00 178.83 179.13 2k2x n SER 14 N -3.11 0.00 0.01 1.46 7.64 -1.26 -4.44 113.62 113.92 2k2x n SER 14 Ca -0.01 0.33 -0.00 0.00 1.01 0.00 0.00 58.87 60.19 2k2x n SER 14 Cb 0.18 -0.43 -0.00 0.00 -1.01 0.00 0.00 64.21 62.94 2k2x n SER 14 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2k2x n ASP 15 N -1.43 0.40 -4.76 6.43 -0.08 -0.77 -5.08 116.55 111.25 2k2x n ASP 15 Ca 0.07 0.05 -0.37 0.00 -1.51 0.00 0.00 54.79 53.04 2k2x n ASP 15 Cb 0.25 -0.16 0.02 0.00 2.34 0.00 0.00 41.12 43.57 2k2x n ASP 15 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k2x s PRO 17 N -2.95 1.35 0.00 0.00 0.04 -1.26 -4.81 135.00 127.37 2k2x s PRO 17 Ca 0.70 0.54 0.03 0.00 0.04 0.00 0.00 61.00 62.31 2k2x s PRO 17 Cb -0.32 -1.84 0.08 0.00 0.04 0.00 0.00 34.50 32.46 2k2x s PRO 17 CO 0.37 -2.11 1.07 1.04 0.04 0.00 0.00 177.00 177.41 2k2x n GLN 18 N -3.75 1.22 0.00 4.56 6.02 -1.26 -3.78 117.38 120.39 2k2x n GLN 18 Ca 0.07 -0.34 0.00 0.00 -0.01 0.00 0.00 57.00 56.72 2k2x n GLN 18 Cb 0.57 -1.07 0.00 0.00 1.02 0.00 0.00 30.24 30.76 2k2x n GLN 18 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2k2x n GLU 19 N -0.22 1.94 0.00 -1.09 0.28 -1.26 -4.62 120.64 115.66 2k2x n GLU 19 Ca 0.03 0.00 0.07 0.00 -0.16 0.00 0.00 57.16 57.10 2k2x n GLU 19 Cb 0.08 -0.96 0.35 0.00 1.43 0.00 0.00 31.44 32.33 2k2x n GLU 19 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k2x n ALA 20 N -2.15 1.76 -2.14 -1.84 0.00 -1.25 -4.80 120.51 110.09 2k2x n ALA 20 Ca 0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 2k2x n ALA 20 Cb 0.46 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 2k2x n ALA 20 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k2x s ARG 21 N -2.78 3.32 0.96 0.00 0.52 -1.26 -1.37 118.95 118.33 2k2x s ARG 21 Ca 0.11 1.10 -0.12 0.00 -0.52 0.00 0.00 55.73 56.29 2k2x s ARG 21 Cb 0.10 -4.16 0.17 0.00 0.52 0.00 0.00 34.95 31.57 2k2x s ARG 21 CO 0.25 -1.88 1.11 -0.51 0.02 0.00 0.00 175.30 174.29 2k2x s LEU 22 N 6.65 1.78 0.22 2.53 1.43 -0.58 -5.00 118.68 125.71 2k2x s LEU 22 Ca 0.70 1.07 0.24 0.00 -1.03 0.00 0.00 54.13 55.11 2k2x s LEU 22 Cb -0.18 -3.32 0.26 0.00 0.03 0.00 0.00 46.19 42.99 2k2x s LEU 22 CO 0.31 -2.86 1.32 0.77 0.23 0.00 0.00 176.35 176.12 2k2x h SER 23 N -1.71 0.00 -3.90 2.29 4.64 -1.94 -3.46 113.55 109.46 2k2x h SER 23 Ca -0.53 -0.08 -0.45 0.00 -0.47 0.00 0.00 61.79 60.27 2k2x h SER 23 Cb 1.33 0.00 0.16 0.00 -0.31 0.00 0.00 62.40 63.58 2k2x h SER 23 CO 0.60 0.04 0.22 -0.31 -0.87 0.00 0.00 176.83 176.50 2k2x s TYR 24 N -3.24 1.86 0.06 4.77 2.02 -1.26 -5.11 117.35 116.45 2k2x s TYR 24 Ca 0.04 0.81 0.04 0.00 -0.37 0.00 0.00 57.07 57.59 2k2x s TYR 24 Cb 0.10 -3.38 -0.03 0.00 -0.40 0.00 0.00 41.96 38.25 2k2x s TYR 24 CO 0.72 -2.96 -0.11 0.20 -1.57 0.00 0.00 175.55 171.83 2k2x s GLY 25 N -3.78 0.70 0.00 0.71 0.00 -1.26 -4.76 107.32 98.93 2k2x s GLY 25 Ca 0.66 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 44.50 2k2x s GLY 25 CO 0.56 -0.92 0.00 0.61 0.00 0.00 0.00 173.10 173.35 2k2x n GLY 26 N 1.40 0.00 3.36 0.20 0.00 -1.26 -1.60 105.19 107.29 2k2x n GLY 26 Ca -0.22 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.60 2k2x n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2x h SER 28 N 2.09 0.00 0.00 0.00 4.64 -1.95 -3.45 113.55 114.88 2k2x h SER 28 Ca -0.31 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 2k2x h SER 28 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2k2x h SER 28 CO 0.48 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 176.80 2k2x n THR 29 N -2.66 0.00 -3.62 2.95 -2.24 -1.26 -5.12 114.28 102.34 2k2x n THR 29 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 2k2x n THR 29 Cb 0.54 -0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.54 2k2x n THR 29 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2k2x s VAL 30 N -1.36 0.00 -0.61 2.28 0.11 -1.24 -4.84 120.40 114.74 2k2x s VAL 30 Ca 0.00 -0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.77 2k2x s VAL 30 Cb 0.00 -0.99 0.02 0.00 -1.53 0.00 0.00 36.38 33.88 2k2x s VAL 30 CO 0.00 -0.00 1.29 0.00 -3.33 0.00 0.00 175.10 173.06 2k2x s ASP 33 N 1.72 4.99 0.42 0.00 -1.08 -0.47 -2.41 116.67 119.84 2k2x s ASP 33 Ca 0.06 0.54 0.28 0.00 -0.52 0.00 0.00 52.55 52.91 2k2x s ASP 33 Cb -0.17 -2.52 0.92 0.00 -1.46 0.00 0.00 42.92 39.69 2k2x s ASP 33 CO 0.10 -2.56 1.80 -0.07 0.52 0.00 0.00 175.17 174.95 2k2x h LEU 34 N 17.53 0.00 -1.08 -1.34 3.38 -1.90 -3.21 115.31 128.70 2k2x h LEU 34 Ca -0.24 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 2k2x h LEU 34 Cb 1.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2k2x h LEU 34 CO 1.20 0.00 -0.10 -1.28 0.09 0.00 0.00 178.44 178.34 2k2x h SER 35 N 0.00 0.00 -0.01 -0.43 0.87 -1.90 -2.76 113.55 109.32 2k2x h SER 35 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2k2x h SER 35 Cb 0.66 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2k2x h SER 35 CO 0.00 0.10 -0.13 2.29 -0.53 0.00 0.00 176.83 178.56 2k2x n LYS 36 N -3.21 1.43 -0.03 2.24 2.85 -1.23 -4.63 118.16 115.58 2k2x n LYS 36 Ca 0.01 -0.88 -0.22 0.00 -1.05 0.00 0.00 58.31 56.17 2k2x n LYS 36 Cb 0.40 -1.17 -0.13 0.00 -0.65 0.00 0.00 35.03 33.48 2k2x n LYS 36 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 2k2x h LEU 37 N 1.70 0.28-10.34 -5.58 5.85 -1.52 -3.31 115.31 102.38 2k2x h LEU 37 Ca 0.00 -0.79 -0.46 0.00 0.84 0.00 0.00 57.88 57.46 2k2x h LEU 37 Cb 0.43 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 2k2x h LEU 37 CO 0.00 1.72 -0.30 0.42 -0.34 0.00 0.00 178.44 179.95 2k2x s THR 38 N -2.49 2.72 0.00 1.05 -4.23 -1.06 -4.30 115.64 107.34 2k2x s THR 38 Ca -0.24 -1.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2k2x s THR 38 Cb 0.06 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 71.02 2k2x s THR 38 CO 0.71 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.40 2k2x n GLY 39 N -1.76 -1.04 0.06 3.99 0.00 -1.26 -3.88 105.19 101.31 2k2x n GLY 39 Ca 0.06 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.35 2k2x n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2x n LYS 41 N -4.95 0.14 0.00 0.00 2.85 -1.26 -1.81 118.16 113.12 2k2x n LYS 41 Ca -0.07 0.36 0.00 0.00 -1.05 0.00 0.00 58.31 57.55 2k2x n LYS 41 Cb 0.13 -1.75 0.00 0.00 -0.65 0.00 0.00 35.03 32.76 2k2x n LYS 41 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k2x n GLY 42 N 0.07 -1.73 0.24 2.58 0.00 -0.97 -3.61 105.19 101.76 2k2x n GLY 42 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2k2x n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k2x h LYS 43 N 0.00 0.00 0.00 1.61 1.57 -1.68 -3.45 116.57 114.62 2k2x h LYS 43 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2k2x h LYS 43 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2k2x h LYS 43 CO 0.00 0.20 0.00 0.41 -0.57 0.00 0.00 179.45 179.49 2k2x n GLY 44 N -0.30 0.70 0.33 3.86 0.00 -1.13 -5.02 105.19 103.62 2k2x n GLY 44 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.04 2k2x n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k2x n GLY 45 N -1.08 -2.89 3.83 -0.02 0.00 -0.75 -4.78 105.19 99.50 2k2x n GLY 45 Ca 0.00 -1.31 -0.38 0.00 0.00 0.00 0.00 46.02 44.33 2k2x n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k2x s GLU 46 N -3.63 3.97 0.00 1.61 2.56 -1.26 -5.00 118.70 116.95 2k2x s GLU 46 Ca 0.00 0.48 0.11 0.00 0.00 0.00 0.00 54.97 55.56 2k2x s GLU 46 Cb 0.00 -3.21 0.37 0.00 2.00 0.00 0.00 34.13 33.29 2k2x s GLU 46 CO 0.00 0.68 1.28 0.00 -0.56 0.00 0.00 175.26 176.66 2k2x n ASN 48 N 0.20 -1.77 -4.72 0.00 0.23 -1.26 -4.39 115.26 103.55 2k2x n ASN 48 Ca 0.10 0.71 -0.31 0.00 -0.53 0.00 0.00 54.58 54.55 2k2x n ASN 48 Cb 0.23 -1.09 0.13 0.00 -2.08 0.00 0.00 39.78 36.97 2k2x n ASN 48 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 2k2x s PRO 49 N -1.83 1.63 0.63 -0.53 0.04 -1.23 -3.37 135.00 130.34 2k2x s PRO 49 Ca 0.65 1.38 0.41 0.00 0.04 0.00 0.00 61.00 63.48 2k2x s PRO 49 Cb -0.45 -1.81 2.13 0.00 0.04 0.00 0.00 34.50 34.41 2k2x s PRO 49 CO 0.58 -2.15 2.27 -0.07 0.04 0.00 0.00 177.00 177.67 2k2x h LEU 50 N -1.48 0.00 -0.18 -3.56 3.38 -1.81 -2.45 115.31 109.21 2k2x h LEU 50 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2k2x h LEU 50 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2k2x h LEU 50 CO 0.46 0.01 0.00 -0.78 0.09 0.00 0.00 178.44 178.22 2k2x h ASP 51 N 0.00 0.00 -4.26 -0.43 -0.00 -1.94 -3.47 116.42 106.32 2k2x h ASP 51 Ca -0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 57.03 56.51 2k2x h ASP 51 Cb 0.13 0.00 0.14 0.00 -0.00 0.00 0.00 39.33 39.60 2k2x h ASP 51 CO 0.00 0.00 0.33 -0.60 -0.00 0.00 0.00 179.24 178.97 2k2x s ARG 52 N -3.22 2.20 0.00 0.28 3.00 -0.92 -4.94 118.95 115.35 2k2x s ARG 52 Ca 0.08 1.35 0.16 0.00 -1.00 0.00 0.00 55.73 56.32 2k2x s ARG 52 Cb 0.08 -1.88 0.70 0.00 0.00 0.00 0.00 34.95 33.86 2k2x s ARG 52 CO 0.61 -1.71 1.50 0.94 0.00 0.00 0.00 175.30 176.64 2k2x n GLN 53 N -3.25 0.04 -1.21 5.12 -0.06 -1.26 -4.82 117.38 111.94 2k2x n GLN 53 Ca 0.10 0.21 -0.34 0.00 -2.00 0.00 0.00 57.00 54.97 2k2x n GLN 53 Cb 0.52 -1.50 0.12 0.00 -4.06 0.00 0.00 30.24 25.32 2k2x n GLN 53 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2k2x s LYS 55 N -4.00 0.40 0.00 0.00 2.20 -1.26 -5.06 119.74 112.02 2k2x s LYS 55 Ca 0.75 1.08 0.00 0.00 -0.36 0.00 0.00 55.97 57.44 2k2x s LYS 55 Cb -0.31 0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.40 2k2x s LYS 55 CO 0.49 -0.30 0.00 -1.91 -0.36 0.00 0.00 175.35 173.27 2k2x n GLU 56 N 5.40 0.00 -0.85 4.03 4.07 -1.24 -4.88 120.64 127.18 2k2x n GLU 56 Ca -0.08 0.00 -0.32 0.00 -0.06 0.00 0.00 57.16 56.70 2k2x n GLU 56 Cb 0.49 0.00 0.15 0.00 -0.06 0.00 0.00 31.44 32.03 2k2x n GLU 56 CO 0.00 0.00 0.00 1.47 -0.06 0.00 0.00 177.13 178.54 2k2x n LEU 57 N 0.00 3.65 -0.00 4.31 -0.00 -1.26 -4.80 117.00 118.90 2k2x n LEU 57 Ca 0.00 0.48 0.03 0.00 -0.00 0.00 0.00 56.01 56.52 2k2x n LEU 57 Cb 0.00 -1.48 -0.03 0.00 -0.00 0.00 0.00 43.42 41.91 2k2x n LEU 57 CO 0.00 -2.02 -0.03 0.00 -0.00 0.00 0.00 177.39 175.34 2k2x n GLN 58 N -3.79 5.05 0.28 1.47 10.64 -1.26 -3.75 117.38 126.02 2k2x n GLN 58 Ca 0.12 -0.00 -0.16 0.00 -1.83 0.00 0.00 57.00 55.13 2k2x n GLN 58 Cb 0.51 -0.77 -0.08 0.00 -0.86 0.00 0.00 30.24 29.04 2k2x n GLN 58 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k2x h ALA 59 N 0.77 -0.79 0.00 2.61 0.00 -2.01 -2.46 119.26 117.38 2k2x h ALA 59 Ca 0.00 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 2k2x h ALA 59 Cb 0.13 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2k2x h ALA 59 CO 0.00 -0.96 -1.19 0.93 0.00 0.00 0.00 179.25 178.03 2k2x h GLU 60 N -0.78 0.00 -0.20 0.00 5.08 -2.02 -3.36 114.58 113.30 2k2x h GLU 60 Ca -0.05 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2k2x h GLU 60 Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2k2x h GLU 60 CO 0.04 0.54 -0.11 1.03 -1.00 0.00 0.00 179.01 179.51 2k2x h SER 61 N 0.00 0.30 0.02 1.42 0.87 -1.79 -3.32 113.55 111.05 2k2x h SER 61 Ca -0.12 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 2k2x h SER 61 Cb 1.68 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 2k2x h SER 61 CO 0.08 0.45 0.00 0.00 -0.53 0.00 0.00 176.83 176.83 2k2x n ALA 62 N -2.49 1.53 0.30 6.23 0.00 -0.93 -3.15 120.51 122.00 2k2x n ALA 62 Ca -0.00 -0.02 0.19 0.00 0.00 0.00 0.00 53.44 53.61 2k2x n ALA 62 Cb 0.27 -1.05 1.01 0.00 0.00 0.00 0.00 19.45 19.69 2k2x n ALA 62 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2k2x h SER 63 N 0.00 0.00 0.78 0.00 0.02 -1.88 -0.82 113.55 111.65 2k2x h SER 63 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k2x h SER 63 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2k2x h SER 63 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 2k2x n GLY 65 N 1.20 2.12 3.13 0.00 0.00 -0.31 -4.83 105.19 106.49 2k2x n GLY 65 Ca 0.09 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 2k2x n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k2x s LYS 66 N 0.00 0.72 -1.06 1.61 -0.14 -1.26 -4.90 119.74 114.71 2k2x s LYS 66 Ca 0.00 -0.94 -0.05 0.00 -1.36 0.00 0.00 55.97 53.61 2k2x s LYS 66 Cb 0.00 -0.53 0.01 0.00 -1.68 0.00 0.00 37.83 35.62 2k2x s LYS 66 CO 0.00 0.10 0.91 0.41 -0.76 0.00 0.00 175.35 176.02 2k2x n GLY 67 N 1.13 -0.24 3.28 -3.33 0.00 -1.26 -5.02 105.19 99.74 2k2x n GLY 67 Ca -0.20 0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.70 2k2x n GLY 67 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k2x s GLN 68 N -5.82 1.13 -0.28 1.61 0.00 -1.25 -3.53 119.66 111.52 2k2x s GLN 68 Ca 0.36 -1.41 -0.19 0.00 -0.00 0.00 0.00 55.36 54.12 2k2x s GLN 68 Cb -0.16 -0.88 0.12 0.00 0.00 0.00 0.00 33.01 32.09 2k2x s GLN 68 CO 0.58 0.15 0.90 -1.59 0.00 0.00 0.00 175.29 175.33 2k2x s LYS 69 N -3.30 0.52 0.73 9.60 -2.85 -1.22 -4.58 119.74 118.64 2k2x s LYS 69 Ca 0.15 0.81 -0.13 0.00 -1.00 0.00 0.00 55.97 55.80 2k2x s LYS 69 Cb -0.01 0.15 0.04 0.00 -2.06 0.00 0.00 37.83 35.94 2k2x s LYS 69 CO 0.03 -0.09 1.12 0.00 0.10 0.00 0.00 175.35 176.51 2k2x s VAL 72 N 0.00 2.08 0.35 0.00 1.01 -1.26 -5.01 120.40 117.57 2k2x s VAL 72 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.09 2k2x s VAL 72 Cb 0.00 -3.05 0.03 0.00 0.00 0.00 0.00 36.38 33.36 2k2x s VAL 72 CO 0.00 0.02 0.25 -2.67 0.00 0.00 0.00 175.10 172.69 2k2x n TRP 73 N 0.74 -0.84 0.00 5.22 2.14 -1.26 -4.87 117.44 118.57 2k2x n TRP 73 Ca 0.02 -1.48 0.00 0.00 2.07 0.00 0.00 57.50 58.11 2k2x n TRP 73 Cb 0.39 -0.28 0.00 0.00 -0.81 0.00 0.00 31.31 30.61 2k2x n TRP 73 CO 0.00 0.00 0.00 -0.11 2.07 0.00 0.00 177.69 179.65 2k2x n LEU 74 N 0.00 0.00 0.00 5.67 7.94 -1.26 -4.79 117.00 124.56 2k2x n LEU 74 Ca -0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 2k2x n LEU 74 Cb 0.40 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.24 2k2x n LEU 74 CO 0.23 -0.41 0.00 1.57 -1.11 0.00 0.00 177.39 177.67