#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 1.10 -0.30 3.52 4.57 -1.98 -0.90 114.58 120.59 2k2x h GLU 2 Ca 0.00 -0.28 -0.05 0.00 -1.18 0.00 0.00 59.36 57.86 2k2x h GLU 2 Cb 0.00 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.44 2k2x h GLU 2 CO 0.00 0.99 -0.01 0.00 -1.18 0.00 0.00 179.01 178.81 2k2x h VAL 4 N 0.44 1.38 -0.51 0.00 2.07 -1.72 -2.51 116.25 115.40 2k2x h VAL 4 Ca 0.10 -2.22 0.01 0.00 0.82 0.00 0.00 66.70 65.41 2k2x h VAL 4 Cb 0.32 2.61 -0.03 0.00 -1.52 0.00 0.00 31.29 32.67 2k2x h VAL 4 CO 0.01 0.66 0.33 -1.28 0.02 0.00 0.00 177.57 177.31 2k2x h SER 5 N 0.05 0.56 0.59 0.57 0.87 -0.88 -1.73 113.55 113.58 2k2x h SER 5 Ca -0.11 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2k2x h SER 5 Cb 1.53 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.36 2k2x h SER 5 CO 0.16 0.40 0.00 0.29 -0.53 0.00 0.00 176.83 177.15 2k2x n LYS 6 N -4.75 0.12 -0.14 2.24 4.76 -0.77 -4.90 118.16 114.72 2k2x n LYS 6 Ca 0.03 0.38 0.00 0.00 -2.87 0.00 0.00 58.31 55.85 2k2x n LYS 6 Cb 0.04 -1.75 0.00 0.00 -1.84 0.00 0.00 35.03 31.48 2k2x n LYS 6 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k2x n GLY 7 N -0.13 0.78 3.93 0.72 0.00 -0.65 -5.09 105.19 104.75 2k2x n GLY 7 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.12 1.71 0.51 1.61 2.99 -0.94 -4.88 117.98 116.87 2k2x s PHE 8 Ca 0.00 0.30 0.05 0.00 0.00 0.00 0.00 56.93 57.28 2k2x s PHE 8 Cb 0.00 -3.98 0.01 0.00 0.00 0.00 0.00 43.02 39.05 2k2x s PHE 8 CO 0.00 -2.50 0.27 0.20 -0.00 0.00 0.00 175.22 173.19 2k2x s GLY 9 N -4.85 2.53 -0.51 4.36 0.00 -0.97 -4.48 107.32 103.40 2k2x s GLY 9 Ca 0.72 -1.17 0.07 0.00 0.00 0.00 0.00 44.72 44.34 2k2x s GLY 9 CO 0.52 -2.00 0.58 0.00 0.00 0.00 0.00 173.10 172.20 2k2x s LEU 11 N -1.54 3.19 0.80 0.00 2.01 -1.20 -4.78 118.68 117.16 2k2x s LEU 11 Ca 0.36 1.65 -0.11 0.00 0.01 0.00 0.00 54.13 56.04 2k2x s LEU 11 Cb 0.13 -4.50 0.07 0.00 0.01 0.00 0.00 46.19 41.90 2k2x s LEU 11 CO -0.09 -1.40 1.09 -2.16 1.01 0.00 0.00 176.35 174.80 2k2x s PRO 12 N -4.90 2.04 0.59 1.29 0.04 -1.26 -3.46 135.00 129.34 2k2x s PRO 12 Ca 0.59 1.10 0.36 0.00 0.04 0.00 0.00 61.00 63.09 2k2x s PRO 12 Cb -0.14 -1.88 1.81 0.00 0.04 0.00 0.00 34.50 34.33 2k2x s PRO 12 CO 0.52 -1.77 2.17 1.96 0.04 0.00 0.00 177.00 179.91 2k2x h GLN 13 N -1.22 0.00 0.00 4.56 4.20 -1.89 -1.12 115.11 119.64 2k2x h GLN 13 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 2k2x h GLN 13 Cb 1.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.02 2k2x h GLN 13 CO 0.52 0.03 0.00 0.77 -0.67 0.00 0.00 178.83 179.48 2k2x h SER 14 N 0.00 0.00 0.00 1.46 0.02 -2.02 -3.37 113.55 109.64 2k2x h SER 14 Ca -0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2k2x h SER 14 Cb 0.26 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 2k2x h SER 14 CO 0.00 0.00 -1.17 0.47 -1.14 0.00 0.00 176.83 174.99 2k2x n ASP 15 N -2.77 1.60 -4.65 3.07 9.92 -0.92 -4.99 116.55 117.80 2k2x n ASP 15 Ca 0.01 0.02 -0.42 0.00 -0.53 0.00 0.00 54.79 53.87 2k2x n ASP 15 Cb 0.30 -0.07 -0.03 0.00 -0.64 0.00 0.00 41.12 40.68 2k2x n ASP 15 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k2x s PRO 17 N 4.22 2.22 0.17 0.00 0.04 -1.26 -4.76 135.00 135.63 2k2x s PRO 17 Ca 0.75 1.02 0.25 0.00 0.04 0.00 0.00 61.00 63.06 2k2x s PRO 17 Cb -0.33 -1.90 0.91 0.00 0.04 0.00 0.00 34.50 33.22 2k2x s PRO 17 CO 0.30 -1.63 1.75 1.04 0.04 0.00 0.00 177.00 178.51 2k2x n GLN 18 N -3.49 0.17 -0.03 4.56 6.02 -1.26 -2.25 117.38 121.09 2k2x n GLN 18 Ca 0.08 0.24 -0.16 0.00 -0.01 0.00 0.00 57.00 57.16 2k2x n GLN 18 Cb 0.54 -1.75 -0.08 0.00 1.02 0.00 0.00 30.24 29.97 2k2x n GLN 18 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 2k2x h GLU 19 N 0.00 0.59 0.00 -1.09 4.11 -2.01 -3.33 114.58 112.85 2k2x h GLU 19 Ca 0.00 -0.46 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2k2x h GLU 19 Cb 0.54 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2k2x h GLU 19 CO 0.00 1.09 0.00 0.00 0.07 0.00 0.00 179.01 180.17 2k2x n ALA 20 N -2.55 2.26 -2.15 1.06 0.00 -0.96 -4.79 120.51 113.38 2k2x n ALA 20 Ca -0.08 -0.10 -0.40 0.00 0.00 0.00 0.00 53.44 52.87 2k2x n ALA 20 Cb 0.62 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 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 -2.95 2.93 0.84 0.00 0.52 -1.22 -2.70 118.95 116.38 2k2x s ARG 21 Ca 0.15 0.65 -0.12 0.00 -0.52 0.00 0.00 55.73 55.89 2k2x s ARG 21 Cb 0.18 -4.28 0.09 0.00 0.52 0.00 0.00 34.95 31.46 2k2x s ARG 21 CO 0.49 -2.37 1.12 -0.51 0.02 0.00 0.00 175.30 174.05 2k2x s LEU 22 N 7.81 2.38 0.06 2.53 1.43 -1.26 -5.00 118.68 126.63 2k2x s LEU 22 Ca 0.64 1.13 0.25 0.00 -1.03 0.00 0.00 54.13 55.12 2k2x s LEU 22 Cb -0.13 -3.63 0.55 0.00 0.03 0.00 0.00 46.19 43.00 2k2x s LEU 22 CO 0.23 -2.16 1.46 -0.24 0.23 0.00 0.00 176.35 175.87 2k2x n SER 23 N -3.53 0.53 -4.63 2.29 2.88 -1.26 -4.73 113.62 105.17 2k2x n SER 23 Ca 0.07 0.03 -0.29 0.00 -1.33 0.00 0.00 58.87 57.35 2k2x n SER 23 Cb 0.58 0.08 0.18 0.00 -0.75 0.00 0.00 64.21 64.30 2k2x n SER 23 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2k2x s TYR 24 N -3.07 2.00 0.43 0.66 2.02 -1.26 -5.10 117.35 113.03 2k2x s TYR 24 Ca 0.09 0.93 0.03 0.00 -0.37 0.00 0.00 57.07 57.76 2k2x s TYR 24 Cb 0.16 -3.29 -0.02 0.00 -0.40 0.00 0.00 41.96 38.41 2k2x s TYR 24 CO 0.68 -3.00 0.09 0.20 -1.57 0.00 0.00 175.55 171.95 2k2x s GLY 25 N -3.49 2.71 0.00 0.71 0.00 -1.26 -4.79 107.32 101.19 2k2x s GLY 25 Ca 0.66 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 44.33 2k2x s GLY 25 CO 0.58 -1.93 0.00 0.61 0.00 0.00 0.00 173.10 172.35 2k2x n GLY 26 N -1.00 0.96 3.85 0.20 0.00 -1.26 -2.78 105.19 105.16 2k2x n GLY 26 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 2k2x n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k2x n SER 28 N -3.88 0.93 0.00 0.00 7.64 -1.26 -4.90 113.62 112.14 2k2x n SER 28 Ca 0.13 -0.96 0.00 0.00 1.01 0.00 0.00 58.87 59.04 2k2x n SER 28 Cb 0.60 0.51 0.00 0.00 -1.01 0.00 0.00 64.21 64.30 2k2x n SER 28 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2k2x n THR 29 N -0.39 0.00 -3.52 0.44 -2.24 -1.26 -5.13 114.28 102.19 2k2x n THR 29 Ca 0.03 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 2k2x n THR 29 Cb 0.13 -0.12 -0.04 0.00 -2.10 0.00 0.00 70.33 68.20 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 -0.82 0.00 0.70 2.28 0.11 -1.22 -4.87 120.40 116.57 2k2x s VAL 30 Ca 0.00 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 58.92 2k2x s VAL 30 Cb 0.00 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 2k2x s VAL 30 CO 0.00 0.00 1.09 0.00 -3.33 0.00 0.00 175.10 172.86 2k2x s ASP 33 N 2.65 5.41 0.30 0.00 3.84 -1.10 -2.29 116.67 125.49 2k2x s ASP 33 Ca -0.01 -0.78 -0.01 0.00 -0.00 0.00 0.00 52.55 51.75 2k2x s ASP 33 Cb -0.12 -2.56 0.46 0.00 -1.38 0.00 0.00 42.92 39.32 2k2x s ASP 33 CO -0.14 -2.49 1.94 -0.07 -0.00 0.00 0.00 175.17 174.41 2k2x h LEU 34 N 16.82 0.87 0.00 2.11 3.38 -1.93 -1.50 115.31 135.07 2k2x h LEU 34 Ca 0.10 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2k2x h LEU 34 Cb 1.01 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2k2x h LEU 34 CO 1.25 0.68 0.00 -1.54 0.09 0.00 0.00 178.44 178.92 2k2x n SER 35 N -4.38 0.00 0.00 -0.43 3.41 -1.26 -3.22 113.62 107.74 2k2x n SER 35 Ca 0.07 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 2k2x n SER 35 Cb 0.08 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 2k2x n SER 35 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2k2x n LYS 36 N -1.28 0.69 -0.02 4.33 5.02 -0.76 -4.90 118.16 121.24 2k2x n LYS 36 Ca 0.10 -0.70 -0.13 0.00 -2.02 0.00 0.00 58.31 55.56 2k2x n LYS 36 Cb 0.16 -0.75 -0.09 0.00 -0.02 0.00 0.00 35.03 34.33 2k2x n LYS 36 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2k2x h LEU 37 N 0.00 0.09 -1.50 -0.35 5.85 -1.27 -3.49 115.31 114.64 2k2x h LEU 37 Ca 0.00 -0.46 -0.14 0.00 0.84 0.00 0.00 57.88 58.12 2k2x h LEU 37 Cb 0.54 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.56 2k2x h LEU 37 CO 0.00 0.53 -0.50 0.35 -0.34 0.00 0.00 178.44 178.48 2k2x n THR 38 N -4.80 -1.47 -3.62 1.05 -2.24 -1.26 -5.00 114.28 96.93 2k2x n THR 38 Ca -0.08 0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.68 2k2x n THR 38 Cb 0.26 -1.44 -0.02 0.00 -2.10 0.00 0.00 70.33 67.03 2k2x n THR 38 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2k2x s GLY 39 N -0.58 -0.37 0.09 3.38 0.00 -1.26 -5.07 107.32 103.51 2k2x s GLY 39 Ca 0.13 0.24 -0.15 0.00 0.00 0.00 0.00 44.72 44.95 2k2x s GLY 39 CO 0.30 0.08 1.37 0.00 0.00 0.00 0.00 173.10 174.85 2k2x n LYS 41 N -4.19 0.19 0.33 0.00 5.02 -1.26 -1.84 118.16 116.41 2k2x n LYS 41 Ca -0.05 0.49 0.22 0.00 -2.02 0.00 0.00 58.31 56.94 2k2x n LYS 41 Cb 0.54 -1.92 1.13 0.00 -0.02 0.00 0.00 35.03 34.76 2k2x n LYS 41 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2k2x h GLY 42 N 1.69 0.00 0.00 0.72 0.00 -1.84 -3.04 103.07 100.59 2k2x h GLY 42 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2k2x h GLY 42 CO 0.00 0.00 -0.78 0.28 0.00 0.00 0.00 176.54 176.04 2k2x n LYS 43 N -3.15 1.80 -1.42 4.80 4.76 -1.16 -5.05 118.16 118.75 2k2x n LYS 43 Ca -0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 2k2x n LYS 43 Cb 0.10 -0.89 0.00 0.00 -1.84 0.00 0.00 35.03 32.40 2k2x n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k2x n GLY 44 N 2.10 -0.07 3.70 0.72 0.00 -0.76 -5.07 105.19 105.81 2k2x n GLY 44 Ca 0.00 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 2k2x n GLY 44 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k2x s GLY 45 N -2.14 1.61 0.65 -0.02 0.00 -1.03 -5.02 107.32 101.38 2k2x s GLY 45 Ca 0.00 -0.05 -0.06 0.00 0.00 0.00 0.00 44.72 44.61 2k2x s GLY 45 CO 0.00 0.45 0.95 -1.83 0.00 0.00 0.00 173.10 172.67 2k2x s GLU 46 N -4.90 2.47 -0.34 2.90 1.03 -1.26 -5.03 118.70 113.58 2k2x s GLU 46 Ca 0.64 -0.23 -0.04 0.00 0.03 0.00 0.00 54.97 55.37 2k2x s GLU 46 Cb -0.19 -2.24 0.06 0.00 -0.80 0.00 0.00 34.13 30.97 2k2x s GLU 46 CO 0.57 -1.00 0.08 0.00 -1.33 0.00 0.00 175.26 173.58 2k2x s ASN 48 N 1.44 2.16 1.04 0.00 0.01 -1.26 -5.13 114.94 113.20 2k2x s ASN 48 Ca -0.01 -0.98 -0.13 0.00 -0.71 0.00 0.00 52.86 51.02 2k2x s ASN 48 Cb -0.20 -0.07 0.21 0.00 0.41 0.00 0.00 41.25 41.59 2k2x s ASN 48 CO -0.00 -0.23 1.09 -2.16 -1.51 0.00 0.00 177.10 174.29 2k2x s PRO 49 N -3.53 0.08 0.39 -0.60 0.04 -1.26 -4.07 135.00 126.04 2k2x s PRO 49 Ca 0.18 0.43 0.12 0.00 0.04 0.00 0.00 61.00 61.77 2k2x s PRO 49 Cb -0.00 -1.70 0.92 0.00 0.04 0.00 0.00 34.50 33.76 2k2x s PRO 49 CO 0.04 -2.95 1.89 -0.07 0.04 0.00 0.00 177.00 175.95 2k2x h LEU 50 N -2.05 0.54 0.00 -3.56 3.38 -1.74 -2.67 115.31 109.22 2k2x h LEU 50 Ca -0.54 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.46 2k2x h LEU 50 Cb 1.33 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2k2x h LEU 50 CO 0.55 0.27 0.00 -0.67 0.09 0.00 0.00 178.44 178.68 2k2x n ASP 51 N -4.52 0.00 0.10 -0.43 4.64 -1.26 -3.99 116.55 111.09 2k2x n ASP 51 Ca 0.16 -1.48 0.09 0.00 -1.38 0.00 0.00 54.79 52.18 2k2x n ASP 51 Cb 0.50 0.00 0.41 0.00 -1.04 0.00 0.00 41.12 40.99 2k2x n ASP 51 CO 0.00 0.00 0.00 -1.14 -0.82 0.00 0.00 177.20 175.24 2k2x n ARG 52 N -0.76 0.11 -0.86 -0.67 3.00 -1.01 -4.88 116.66 111.60 2k2x n ARG 52 Ca 0.12 0.50 0.00 0.00 -0.00 0.00 0.00 57.85 58.47 2k2x n ARG 52 Cb 0.06 -1.79 0.00 0.00 0.00 0.00 0.00 32.46 30.73 2k2x n ARG 52 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2k2x n GLN 53 N -2.01 -0.21 -0.61 -0.14 0.00 -1.26 -5.02 117.38 108.13 2k2x n GLN 53 Ca 0.01 0.05 -0.29 0.00 -0.00 0.00 0.00 57.00 56.76 2k2x n GLN 53 Cb 0.10 -3.41 0.22 0.00 0.00 0.00 0.00 30.24 27.16 2k2x n GLN 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2k2x s LYS 55 N -4.54 0.51 0.13 0.00 2.20 -1.26 -5.09 119.74 111.69 2k2x s LYS 55 Ca 0.68 -1.19 -0.03 0.00 -0.36 0.00 0.00 55.97 55.06 2k2x s LYS 55 Cb -0.24 -1.32 0.01 0.00 -1.51 0.00 0.00 37.83 34.77 2k2x s LYS 55 CO 0.62 -1.17 0.23 -1.91 -0.36 0.00 0.00 175.35 172.77 2k2x n GLU 56 N 4.27 0.34 -1.40 4.03 4.07 -1.26 -5.04 120.64 125.65 2k2x n GLU 56 Ca 0.08 -0.89 -0.36 0.00 -0.06 0.00 0.00 57.16 55.93 2k2x n GLU 56 Cb 0.38 0.98 0.08 0.00 -0.06 0.00 0.00 31.44 32.82 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 3.45 0.00 4.31 -0.00 -1.26 -4.84 117.00 118.66 2k2x n LEU 57 Ca -0.02 0.69 0.00 0.00 -0.00 0.00 0.00 56.01 56.68 2k2x n LEU 57 Cb 0.21 -1.40 0.00 0.00 -0.00 0.00 0.00 43.42 42.23 2k2x n LEU 57 CO 0.10 -2.05 0.17 0.00 -0.00 0.00 0.00 177.39 175.60 2k2x n GLN 58 N -1.67 -0.01 0.00 1.47 6.02 -1.26 -3.53 117.38 118.40 2k2x n GLN 58 Ca 0.13 -0.38 0.00 0.00 -0.01 0.00 0.00 57.00 56.74 2k2x n GLN 58 Cb 0.49 -0.71 0.00 0.00 1.02 0.00 0.00 30.24 31.04 2k2x n GLN 58 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k2x n ALA 59 N -0.05 0.00 0.07 -1.58 0.00 -1.26 -3.99 120.51 113.70 2k2x n ALA 59 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2k2x n ALA 59 Cb 0.21 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.87 2k2x n ALA 59 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2k2x h GLU 60 N 0.00 0.31 -0.10 0.00 5.08 -1.93 -2.99 114.58 114.95 2k2x h GLU 60 Ca 0.00 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 2k2x h GLU 60 Cb 0.00 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2k2x h GLU 60 CO 0.00 0.65 -0.04 0.77 -1.00 0.00 0.00 179.01 179.39 2k2x h SER 61 N 0.26 0.13 0.32 1.42 0.02 -1.81 -3.21 113.55 110.67 2k2x h SER 61 Ca 0.03 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2k2x h SER 61 Cb 0.80 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2k2x h SER 61 CO 0.06 0.20 0.00 0.00 -1.14 0.00 0.00 176.83 175.96 2k2x n ALA 62 N -2.51 1.44 0.23 3.77 0.00 -0.57 -3.19 120.51 119.68 2k2x n ALA 62 Ca -0.01 -0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.53 2k2x n ALA 62 Cb 0.18 -1.15 0.76 0.00 0.00 0.00 0.00 19.45 19.23 2k2x n ALA 62 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k2x h SER 63 N 0.00 0.00 1.73 0.00 0.87 -1.77 -2.94 113.55 111.44 2k2x h SER 63 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2k2x h SER 63 Cb 0.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2k2x h SER 63 CO 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.30 2k2x n GLY 65 N 1.17 1.32 2.32 0.00 0.00 -1.11 -4.99 105.19 103.90 2k2x n GLY 65 Ca 0.05 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 2k2x n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k2x n LYS 66 N 0.00 3.58 -1.74 1.61 4.76 -1.26 -4.57 118.16 120.54 2k2x n LYS 66 Ca 0.00 -2.14 -0.09 0.00 -2.87 0.00 0.00 58.31 53.21 2k2x n LYS 66 Cb 0.00 -2.77 -0.03 0.00 -1.84 0.00 0.00 35.03 30.40 2k2x n LYS 66 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k2x n GLY 67 N 3.57 0.34 3.35 0.72 0.00 -1.26 -2.52 105.19 109.39 2k2x n GLY 67 Ca 0.76 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.36 2k2x n GLY 67 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2k2x n GLN 68 N -2.06 0.15 -4.13 1.61 0.00 -1.26 -4.53 117.38 107.16 2k2x n GLN 68 Ca -0.10 0.05 -0.18 0.00 -0.00 0.00 0.00 57.00 56.77 2k2x n GLN 68 Cb 0.42 -1.14 -0.16 0.00 0.00 0.00 0.00 30.24 29.37 2k2x n GLN 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.06 175.47 2k2x s LYS 69 N -1.16 0.60 0.16 3.69 -2.85 -1.26 -1.52 119.74 117.40 2k2x s LYS 69 Ca 0.61 -0.11 -0.34 0.00 -1.00 0.00 0.00 55.97 55.13 2k2x s LYS 69 Cb -0.65 -0.63 -0.15 0.00 -2.06 0.00 0.00 37.83 34.34 2k2x s LYS 69 CO 0.61 -0.02 1.38 0.00 0.10 0.00 0.00 175.35 177.42 2k2x s VAL 72 N -0.16 2.06 0.43 0.00 1.01 -1.26 -4.95 120.40 117.52 2k2x s VAL 72 Ca 0.05 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.11 2k2x s VAL 72 Cb 0.05 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 2k2x s VAL 72 CO -0.01 0.01 0.06 0.26 0.00 0.00 0.00 175.10 175.42 2k2x s TRP 73 N -1.13 1.92 0.70 5.22 0.51 -1.26 -5.12 118.94 119.77 2k2x s TRP 73 Ca 0.54 -1.06 -0.11 0.00 -2.12 0.00 0.00 56.10 53.35 2k2x s TRP 73 Cb -0.46 -1.39 0.01 0.00 -0.81 0.00 0.00 33.47 30.82 2k2x s TRP 73 CO 0.62 0.00 1.07 -0.51 -0.51 0.00 0.00 176.95 177.62 2k2x s LEU 74 N -3.69 2.98 0.00 2.99 1.43 -1.26 -5.14 118.68 115.99 2k2x s LEU 74 Ca 0.21 1.34 0.19 0.00 -1.03 0.00 0.00 54.13 54.84 2k2x s LEU 74 Cb 0.04 -4.19 1.13 0.00 0.03 0.00 0.00 46.19 43.20 2k2x s LEU 74 CO 0.11 -1.35 1.52 1.41 0.23 0.00 0.00 176.35 178.28