#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da2 s SER 2 N 0.00 6.37 0.20 1.61 0.01 -1.26 -5.00 113.70 115.64 2da2 s SER 2 Ca 0.00 -0.08 0.07 0.00 1.31 0.00 0.00 55.95 57.25 2da2 s SER 2 Cb 0.00 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.65 2da2 s SER 2 CO 0.00 -1.51 -0.12 -0.44 0.41 0.00 0.00 173.24 171.58 2da2 s SER 3 N 3.10 2.39 0.00 2.44 0.01 -1.26 -5.01 113.70 115.38 2da2 s SER 3 Ca 0.39 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.60 2da2 s SER 3 Cb -0.08 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.04 2da2 s SER 3 CO 0.22 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2da2 n GLY 4 N -0.37 -0.02 1.71 3.44 0.00 -1.26 -5.04 105.19 103.65 2da2 n GLY 4 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2da2 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2da2 n SER 5 N -1.92 0.20 -4.37 1.61 7.64 -1.26 -5.02 113.62 110.49 2da2 n SER 5 Ca 0.00 0.37 -0.39 0.00 1.01 0.00 0.00 58.87 59.86 2da2 n SER 5 Cb 0.00 0.18 -0.08 0.00 -1.01 0.00 0.00 64.21 63.30 2da2 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2da2 n SER 6 N -3.42 -1.17 0.00 6.43 7.64 -1.26 -4.09 113.62 117.75 2da2 n SER 6 Ca 0.00 -1.20 0.00 0.00 1.01 0.00 0.00 58.87 58.68 2da2 n SER 6 Cb 0.00 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 61.68 2da2 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2da2 n GLY 7 N -1.36 0.02 3.76 0.23 0.00 -1.26 -5.12 105.19 101.47 2da2 n GLY 7 Ca 0.02 -0.17 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 2da2 n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2da2 s ARG 8 N 0.00 3.45 -0.17 1.61 1.81 -1.26 -4.97 118.95 119.42 2da2 s ARG 8 Ca 0.00 2.21 -0.19 0.00 -1.72 0.00 0.00 55.73 56.03 2da2 s ARG 8 Cb 0.00 -2.43 -0.16 0.00 -0.45 0.00 0.00 34.95 31.91 2da2 s ARG 8 CO 0.00 -0.94 0.25 0.77 -0.68 0.00 0.00 175.30 174.71 2da2 h SER 9 N 1.89 0.00 -7.05 0.23 0.02 -1.97 -3.44 113.55 103.22 2da2 h SER 9 Ca -0.51 -0.48 -0.61 0.00 -0.84 0.00 0.00 61.79 59.36 2da2 h SER 9 Cb 1.28 0.00 -0.33 0.00 0.14 0.00 0.00 62.40 63.49 2da2 h SER 9 CO 0.59 1.13 -0.89 -1.20 -1.14 0.00 0.00 176.83 175.32 2da2 n SER 10 N -4.55 -1.09 -4.70 3.07 7.64 -1.26 -4.79 113.62 107.94 2da2 n SER 10 Ca -0.19 -1.21 -0.42 0.00 1.01 0.00 0.00 58.87 58.06 2da2 n SER 10 Cb 0.48 -1.54 -0.00 0.00 -1.01 0.00 0.00 64.21 62.14 2da2 n SER 10 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2da2 n ARG 11 N -4.07 2.11 -3.94 1.43 1.74 -1.26 -4.98 116.66 107.69 2da2 n ARG 11 Ca 0.01 0.74 -0.36 0.00 -0.77 0.00 0.00 57.85 57.46 2da2 n ARG 11 Cb 0.49 -2.33 -0.07 0.00 -1.02 0.00 0.00 32.46 29.54 2da2 n ARG 11 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2da2 s THR 12 N -1.10 5.31 -0.08 0.55 2.01 -1.26 -5.10 115.64 115.96 2da2 s THR 12 Ca 0.56 0.14 0.05 0.00 0.31 0.00 0.00 61.69 62.74 2da2 s THR 12 Cb -0.56 -3.32 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 2da2 s THR 12 CO 0.62 0.59 -0.24 -0.13 -0.69 0.00 0.00 174.62 174.77 2da2 s ARG 13 N -0.81 2.84 0.16 4.92 0.52 -1.26 -5.13 118.95 120.19 2da2 s ARG 13 Ca 0.14 -0.88 0.06 0.00 -0.52 0.00 0.00 55.73 54.53 2da2 s ARG 13 Cb -0.12 -2.26 -0.04 0.00 0.52 0.00 0.00 34.95 33.06 2da2 s ARG 13 CO 0.03 0.28 0.03 -0.06 0.02 0.00 0.00 175.30 175.60 2da2 s PHE 14 N 0.10 2.93 0.22 -0.53 0.40 -1.26 -5.12 117.98 114.72 2da2 s PHE 14 Ca -0.11 -0.10 0.07 0.00 -0.60 0.00 0.00 56.93 56.19 2da2 s PHE 14 Cb -0.16 -1.43 -0.04 0.00 0.51 0.00 0.00 43.02 41.91 2da2 s PHE 14 CO 0.06 0.51 0.12 -0.08 0.70 0.00 0.00 175.22 176.54 2da2 s THR 15 N -1.68 4.19 0.21 0.64 -1.32 -1.26 -4.80 115.64 111.62 2da2 s THR 15 Ca 0.28 -1.41 0.01 0.00 -1.21 0.00 0.00 61.69 59.36 2da2 s THR 15 Cb -0.10 -3.21 0.29 0.00 -1.51 0.00 0.00 72.50 67.97 2da2 s THR 15 CO 0.20 -0.26 1.07 0.47 -2.21 0.00 0.00 174.62 173.89 2da2 n ASP 16 N -0.77 -0.09 -0.04 8.08 8.00 -1.26 0.18 116.55 130.65 2da2 n ASP 16 Ca -0.08 1.16 -0.08 0.00 0.71 0.00 0.00 54.79 56.50 2da2 n ASP 16 Cb 0.57 -0.42 -0.03 0.00 -0.02 0.00 0.00 41.12 41.22 2da2 n ASP 16 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2da2 h TYR 17 N 0.00 -0.10 0.09 1.24 3.20 -1.99 0.34 116.97 119.75 2da2 h TYR 17 Ca 0.41 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.29 2da2 h TYR 17 Cb 0.84 0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.18 2da2 h TYR 17 CO -0.36 -0.08 -0.04 1.96 -1.64 0.00 0.00 178.16 178.00 2da2 h GLN 18 N 0.01 -0.11 -0.56 1.82 4.20 0.16 -3.04 115.11 117.58 2da2 h GLN 18 Ca 0.10 0.01 0.15 0.00 0.06 0.00 0.00 58.65 58.97 2da2 h GLN 18 Cb 0.15 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 2da2 h GLN 18 CO -0.21 0.38 0.40 -0.07 -0.67 0.00 0.00 178.83 178.66 2da2 h LEU 19 N -0.69 0.04 -0.29 1.46 3.38 -0.25 0.10 115.31 119.06 2da2 h LEU 19 Ca -0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2da2 h LEU 19 Cb 0.54 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2da2 h LEU 19 CO 0.02 0.02 -0.04 -0.09 0.09 0.00 0.00 178.44 178.44 2da2 h ARG 20 N 0.04 0.55 -0.13 1.13 9.65 -0.28 0.90 114.38 126.24 2da2 h ARG 20 Ca 0.27 -0.20 -0.16 0.00 -1.10 0.00 0.00 59.98 58.79 2da2 h ARG 20 Cb 1.01 -0.04 0.01 0.00 -1.39 0.00 0.00 29.97 29.56 2da2 h ARG 20 CO -0.01 0.73 -0.54 0.28 2.80 0.00 0.00 179.97 183.23 2da2 h VAL 21 N 0.32 1.34 -0.30 0.20 2.07 -1.04 0.38 116.25 119.23 2da2 h VAL 21 Ca 0.08 -1.82 -0.03 0.00 0.82 0.00 0.00 66.70 65.75 2da2 h VAL 21 Cb 0.51 2.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 2da2 h VAL 21 CO 0.02 0.56 0.09 -0.07 0.02 0.00 0.00 177.57 178.19 2da2 h LEU 22 N 0.22 0.44 -0.49 2.57 3.38 -0.88 -1.00 115.31 119.55 2da2 h LEU 22 Ca -0.03 -0.21 -0.17 0.00 0.09 0.00 0.00 57.88 57.56 2da2 h LEU 22 Cb 1.17 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2da2 h LEU 22 CO 0.11 0.54 -0.62 -0.61 0.09 0.00 0.00 178.44 177.95 2da2 h GLN 23 N 0.32 0.47 -0.70 1.13 -0.00 -0.88 -2.29 115.11 113.16 2da2 h GLN 23 Ca 0.10 -0.33 -0.06 0.00 -0.00 0.00 0.00 58.65 58.35 2da2 h GLN 23 Cb 0.26 0.05 -0.03 0.00 0.00 0.00 0.00 27.48 27.76 2da2 h GLN 23 CO -0.00 0.94 0.20 0.22 0.00 0.00 0.00 178.83 180.19 2da2 h ASP 24 N 0.35 1.04 0.81 -0.69 3.58 -0.77 -0.71 116.42 120.02 2da2 h ASP 24 Ca -0.01 -0.22 -0.12 0.00 0.42 0.00 0.00 57.03 57.10 2da2 h ASP 24 Cb 1.17 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.93 2da2 h ASP 24 CO 0.11 0.99 -0.57 0.15 -2.88 0.00 0.00 179.24 177.04 2da2 h PHE 25 N 1.05 0.00 -0.04 0.28 3.04 -1.15 -3.20 116.94 116.92 2da2 h PHE 25 Ca 0.22 0.00 -0.05 0.00 3.98 0.00 0.00 57.97 62.12 2da2 h PHE 25 Cb 0.33 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.85 2da2 h PHE 25 CO 0.03 0.57 -0.18 0.35 -2.02 0.00 0.00 178.31 177.07 2da2 h PHE 26 N 0.00 0.25 -0.72 0.41 3.04 -1.03 0.45 116.94 119.34 2da2 h PHE 26 Ca -0.01 -0.11 0.19 0.00 3.98 0.00 0.00 57.97 62.02 2da2 h PHE 26 Cb 1.13 -0.04 -0.04 0.00 2.56 0.00 0.00 35.95 39.57 2da2 h PHE 26 CO 0.00 0.81 0.50 0.22 -2.02 0.00 0.00 178.31 177.83 2da2 h ASP 27 N -0.38 0.11 0.07 0.41 3.58 -1.18 -2.24 116.42 116.79 2da2 h ASP 27 Ca -0.01 0.01 -0.37 0.00 0.42 0.00 0.00 57.03 57.08 2da2 h ASP 27 Cb 0.83 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.83 2da2 h ASP 27 CO 0.04 0.05 -2.12 0.00 -2.88 0.00 0.00 179.24 174.33 2da2 n ALA 28 N -2.63 1.07 -3.70 -0.78 0.00 -1.20 -4.96 120.51 108.32 2da2 n ALA 28 Ca 0.14 -0.77 -0.11 0.00 0.00 0.00 0.00 53.44 52.70 2da2 n ALA 28 Cb 0.71 -0.44 -0.12 0.00 0.00 0.00 0.00 19.45 19.60 2da2 n ALA 28 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2da2 s ASN 29 N -6.89 -0.27 -0.01 0.00 2.47 0.16 -5.02 114.94 105.38 2da2 s ASN 29 Ca -0.28 0.74 0.02 0.00 0.42 0.00 0.00 52.86 53.76 2da2 s ASN 29 Cb 0.08 0.71 0.03 0.00 -1.45 0.00 0.00 41.25 40.62 2da2 s ASN 29 CO 0.69 -0.20 1.00 0.00 -3.72 0.00 0.00 177.10 174.87 2da2 n ALA 30 N 4.56 2.00 -2.60 1.71 0.00 -1.23 -3.26 120.51 121.68 2da2 n ALA 30 Ca -0.20 -1.15 -0.08 0.00 0.00 0.00 0.00 53.44 52.01 2da2 n ALA 30 Cb 0.53 -0.04 0.04 0.00 0.00 0.00 0.00 19.45 19.98 2da2 n ALA 30 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2da2 n TYR 31 N -0.58 1.71 -1.24 0.00 4.02 -1.26 -4.90 117.16 114.91 2da2 n TYR 31 Ca 0.02 -2.30 -0.31 0.00 -0.01 0.00 0.00 57.90 55.30 2da2 n TYR 31 Cb 0.30 -0.27 0.11 0.00 -0.02 0.00 0.00 39.34 39.46 2da2 n TYR 31 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2da2 s PRO 32 N -3.65 1.93 0.50 -0.72 0.04 -1.26 -5.06 135.00 126.77 2da2 s PRO 32 Ca 0.34 1.05 0.05 0.00 0.04 0.00 0.00 61.00 62.48 2da2 s PRO 32 Cb 0.36 -1.87 0.03 0.00 0.04 0.00 0.00 34.50 33.06 2da2 s PRO 32 CO -0.02 -1.84 0.69 0.15 0.04 0.00 0.00 177.00 176.02 2da2 s LYS 33 N -4.92 2.63 0.18 4.56 1.02 -1.26 -4.85 119.74 117.11 2da2 s LYS 33 Ca 0.62 -1.05 -0.24 0.00 0.02 0.00 0.00 55.97 55.32 2da2 s LYS 33 Cb -0.17 -2.62 0.07 0.00 -0.52 0.00 0.00 37.83 34.59 2da2 s LYS 33 CO 0.56 -0.54 1.57 -0.44 -0.92 0.00 0.00 175.35 175.58 2da2 h ASP 34 N 0.32 -1.50 -0.85 2.83 5.19 -1.98 0.16 116.42 120.60 2da2 h ASP 34 Ca -0.40 0.26 0.19 0.00 -0.62 0.00 0.00 57.03 56.46 2da2 h ASP 34 Cb 1.29 0.70 -0.16 0.00 0.18 0.00 0.00 39.33 41.34 2da2 h ASP 34 CO 0.48 -0.32 -0.08 -0.78 -3.12 0.00 0.00 179.24 175.42 2da2 h ASP 35 N -0.17 -0.57 0.07 6.45 3.58 -2.00 0.47 116.42 124.25 2da2 h ASP 35 Ca 0.21 0.24 -0.00 0.00 0.42 0.00 0.00 57.03 57.90 2da2 h ASP 35 Cb 0.56 0.46 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2da2 h ASP 35 CO -0.75 -0.26 -0.03 -0.33 -2.88 0.00 0.00 179.24 174.98 2da2 h GLU 36 N 0.04 -0.09 -0.96 0.28 4.39 -1.16 -2.85 114.58 114.23 2da2 h GLU 36 Ca 0.45 0.01 0.28 0.00 0.34 0.00 0.00 59.36 60.44 2da2 h GLU 36 Cb 0.79 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.43 2da2 h GLU 36 CO -0.82 0.22 0.69 0.74 -1.16 0.00 0.00 179.01 178.68 2da2 h PHE 37 N -0.41 0.02 -0.46 4.33 0.04 0.94 0.15 116.94 121.56 2da2 h PHE 37 Ca -0.01 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.72 2da2 h PHE 37 Cb 0.35 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 2da2 h PHE 37 CO 0.03 0.00 0.12 0.93 -0.60 0.00 0.00 178.31 178.79 2da2 h GLU 38 N 0.02 0.72 -0.83 1.51 5.08 -0.75 -1.96 114.58 118.36 2da2 h GLU 38 Ca 0.46 -0.17 0.16 0.00 -1.00 0.00 0.00 59.36 58.81 2da2 h GLU 38 Cb 1.81 -0.10 -0.10 0.00 0.50 0.00 0.00 28.75 30.86 2da2 h GLU 38 CO -0.01 0.71 0.38 1.96 -1.00 0.00 0.00 179.01 181.05 2da2 h GLN 39 N 0.61 0.49 -0.11 2.33 1.08 -0.71 0.11 115.11 118.92 2da2 h GLN 39 Ca 0.14 -0.03 -0.07 0.00 -1.45 0.00 0.00 58.65 57.25 2da2 h GLN 39 Cb 0.31 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2da2 h GLN 39 CO -0.00 0.32 -0.19 -0.07 -0.95 0.00 0.00 178.83 177.94 2da2 h LEU 40 N 0.51 0.35 -1.58 1.46 3.38 -1.51 -1.26 115.31 116.66 2da2 h LEU 40 Ca 0.47 -0.55 0.09 0.00 0.09 0.00 0.00 57.88 57.98 2da2 h LEU 40 Cb 0.76 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 2da2 h LEU 40 CO -0.42 0.83 0.41 0.77 0.09 0.00 0.00 178.44 180.12 2da2 h SER 41 N -0.12 0.43 1.02 -0.43 4.64 -0.51 0.31 113.55 118.89 2da2 h SER 41 Ca 0.01 0.01 -0.20 0.00 -0.47 0.00 0.00 61.79 61.14 2da2 h SER 41 Cb 0.77 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.75 2da2 h SER 41 CO 0.04 0.26 -1.02 0.78 -0.87 0.00 0.00 176.83 176.03 2da2 h ASN 42 N 0.48 0.00 0.16 4.97 2.35 -0.77 -0.24 115.58 122.53 2da2 h ASN 42 Ca 0.28 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.02 2da2 h ASN 42 Cb 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 2da2 h ASN 42 CO -0.08 0.88 -0.08 0.25 -1.65 0.00 0.00 177.43 176.75 2da2 h LEU 43 N 0.00 -0.18 -0.10 1.61 5.85 0.13 -3.31 115.31 119.30 2da2 h LEU 43 Ca -0.05 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.56 2da2 h LEU 43 Cb 1.72 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.80 2da2 h LEU 43 CO 0.11 0.34 -0.06 0.18 -0.34 0.00 0.00 178.44 178.66 2da2 n LEU 44 N -4.91 0.22 -2.10 2.25 4.77 0.95 -4.90 117.00 113.28 2da2 n LEU 44 Ca -0.04 0.15 -0.20 0.00 -0.03 0.00 0.00 56.01 55.89 2da2 n LEU 44 Cb 0.14 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 2da2 n LEU 44 CO 0.11 0.04 -0.24 0.59 -1.33 0.00 0.00 177.39 176.56 2da2 n ASN 45 N -1.14 -5.72 -4.80 -1.43 4.13 -0.16 -4.98 115.26 101.16 2da2 n ASN 45 Ca 0.14 0.14 -0.28 0.00 1.68 0.00 0.00 54.58 56.26 2da2 n ASN 45 Cb 0.26 -4.81 -0.06 0.00 -1.54 0.00 0.00 39.78 33.63 2da2 n ASN 45 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2da2 s LEU 46 N -5.51 3.85 0.09 3.41 1.43 -0.84 -4.97 118.68 116.14 2da2 s LEU 46 Ca 0.00 -0.06 -0.31 0.00 -1.03 0.00 0.00 54.13 52.73 2da2 s LEU 46 Cb 0.00 -2.48 -0.07 0.00 0.03 0.00 0.00 46.19 43.67 2da2 s LEU 46 CO 0.00 0.10 1.38 -2.16 0.23 0.00 0.00 176.35 175.90 2da2 s PRO 47 N -2.88 4.32 0.33 1.29 0.04 -1.26 -4.22 135.00 132.62 2da2 s PRO 47 Ca 0.31 2.03 0.12 0.00 0.04 0.00 0.00 61.00 63.50 2da2 s PRO 47 Cb -0.11 -3.32 1.02 0.00 0.04 0.00 0.00 34.50 32.14 2da2 s PRO 47 CO 0.23 -0.45 1.65 1.79 0.04 0.00 0.00 177.00 180.27 2da2 h THR 48 N 4.39 0.27 -0.94 1.26 1.35 -1.93 0.74 112.91 118.05 2da2 h THR 48 Ca -0.41 -0.09 0.20 0.00 -0.55 0.00 0.00 66.41 65.55 2da2 h THR 48 Cb 1.20 -0.02 -0.08 0.00 -1.73 0.00 0.00 68.15 67.53 2da2 h THR 48 CO 0.87 0.05 0.60 0.08 -0.25 0.00 0.00 175.52 176.87 2da2 h ARG 49 N 0.26 0.52 -0.04 4.72 -0.00 -1.99 0.46 114.38 118.31 2da2 h ARG 49 Ca 0.70 -0.03 -0.23 0.00 -0.00 0.00 0.00 59.98 60.42 2da2 h ARG 49 Cb 1.59 -0.12 0.01 0.00 -0.00 0.00 0.00 29.97 31.45 2da2 h ARG 49 CO -0.64 0.34 -0.90 0.28 -0.00 0.00 0.00 179.97 179.05 2da2 h VAL 50 N 0.53 1.34 -0.02 0.08 2.07 0.12 -2.85 116.25 117.52 2da2 h VAL 50 Ca 0.50 -2.25 -0.14 0.00 0.82 0.00 0.00 66.70 65.62 2da2 h VAL 50 Cb 1.06 2.27 -0.02 0.00 -1.52 0.00 0.00 31.29 33.09 2da2 h VAL 50 CO -0.23 0.69 -0.65 0.40 0.02 0.00 0.00 177.57 177.79 2da2 h ILE 51 N 0.34 1.44 0.13 4.57 2.04 -0.61 -2.90 117.51 122.52 2da2 h ILE 51 Ca -0.08 -2.17 -0.01 0.00 1.00 0.00 0.00 64.86 63.61 2da2 h ILE 51 Cb 1.52 2.15 0.00 0.00 -0.74 0.00 0.00 36.82 39.76 2da2 h ILE 51 CO 0.17 0.63 -0.06 0.58 0.00 0.00 0.00 178.15 179.46 2da2 h VAL 52 N 0.06 1.04 -0.84 1.67 2.07 -0.20 -1.09 116.25 118.98 2da2 h VAL 52 Ca -0.01 -0.84 0.07 0.00 0.82 0.00 0.00 66.70 66.74 2da2 h VAL 52 Cb 1.16 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 32.43 2da2 h VAL 52 CO 0.09 0.19 0.55 0.58 0.02 0.00 0.00 177.57 179.00 2da2 h VAL 53 N -0.58 1.03 -0.23 2.57 2.07 -1.56 0.26 116.25 119.81 2da2 h VAL 53 Ca -0.02 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.09 2da2 h VAL 53 Cb 0.45 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2da2 h VAL 53 CO 0.03 0.16 -0.27 -0.25 0.02 0.00 0.00 177.57 177.26 2da2 h TRP 54 N 0.90 0.72 -0.49 1.57 7.01 -1.47 -2.68 115.95 121.51 2da2 h TRP 54 Ca 0.37 -0.23 -0.12 0.00 2.11 0.00 0.00 58.89 61.02 2da2 h TRP 54 Cb 0.27 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.16 2da2 h TRP 54 CO -0.00 0.94 -0.16 0.74 -2.79 0.00 0.00 178.44 177.17 2da2 h PHE 55 N 0.30 1.08 0.56 2.65 -1.00 -0.53 -1.84 116.94 118.17 2da2 h PHE 55 Ca 0.03 -0.24 -0.02 0.00 2.81 0.00 0.00 57.97 60.55 2da2 h PHE 55 Cb 0.84 -0.26 -0.00 0.00 3.61 0.00 0.00 35.95 40.13 2da2 h PHE 55 CO 0.08 1.04 -0.34 1.96 -1.61 0.00 0.00 178.31 179.43 2da2 h GLN 56 N 0.84 -0.83 -0.18 1.51 4.20 -0.50 -2.62 115.11 117.55 2da2 h GLN 56 Ca 0.12 0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.91 2da2 h GLN 56 Cb 0.72 0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.67 2da2 h GLN 56 CO 0.06 -0.55 0.06 -0.91 -0.67 0.00 0.00 178.83 176.81 2da2 h ASN 57 N -0.86 0.07 -1.05 1.46 2.35 -1.50 -2.19 115.58 113.86 2da2 h ASN 57 Ca -0.07 0.02 0.33 0.00 -0.55 0.00 0.00 56.30 56.03 2da2 h ASN 57 Cb 0.69 0.01 -0.14 0.00 0.05 0.00 0.00 38.32 38.93 2da2 h ASN 57 CO 0.07 0.07 0.62 0.00 -1.65 0.00 0.00 177.43 176.54 2da2 h ALA 58 N 1.11 2.10 -0.42 -0.83 0.00 -1.23 0.61 119.26 120.60 2da2 h ALA 58 Ca 0.08 0.16 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 2da2 h ALA 58 Cb 0.05 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2da2 h ALA 58 CO -0.08 -0.69 -0.20 0.00 0.00 0.00 0.00 179.25 178.27 2da2 h ARG 59 N 0.30 0.88 -0.45 0.00 3.08 -1.01 -1.70 114.38 115.48 2da2 h ARG 59 Ca 0.73 -0.39 -0.14 0.00 0.07 0.00 0.00 59.98 60.26 2da2 h ARG 59 Cb 1.79 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.80 2da2 h ARG 59 CO -0.54 1.03 -0.26 1.96 -1.07 0.00 0.00 179.97 181.09 2da2 h GLN 60 N 0.71 0.98 -0.17 0.04 4.20 0.23 -2.98 115.11 118.12 2da2 h GLN 60 Ca 0.09 -0.45 -0.08 0.00 0.06 0.00 0.00 58.65 58.28 2da2 h GLN 60 Cb 0.77 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 2da2 h GLN 60 CO 0.06 1.12 -0.26 0.87 -0.67 0.00 0.00 178.83 179.95 2da2 h LYS 61 N 0.82 0.31 -0.96 1.46 1.57 -0.57 -2.86 116.57 116.33 2da2 h LYS 61 Ca 0.10 -0.11 0.05 0.00 -1.87 0.00 0.00 60.65 58.82 2da2 h LYS 61 Cb 0.85 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.07 2da2 h LYS 61 CO 0.07 0.55 0.62 0.00 -0.57 0.00 0.00 179.45 180.12 2da2 h ALA 62 N 1.46 1.30 -0.98 3.86 0.00 -1.15 -3.43 119.26 120.33 2da2 h ALA 62 Ca 0.04 -0.03 -0.84 0.00 0.00 0.00 0.00 54.91 54.09 2da2 h ALA 62 Cb 0.61 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2da2 h ALA 62 CO 0.04 0.44 0.82 0.54 0.00 0.00 0.00 179.25 181.10 2da2 n ARG 63 N -4.51 0.24 -2.45 0.00 5.12 -1.08 -4.88 116.66 109.11 2da2 n ARG 63 Ca 0.14 0.09 -0.35 0.00 -1.93 0.00 0.00 57.85 55.80 2da2 n ARG 63 Cb 0.14 -1.64 -0.02 0.00 -1.16 0.00 0.00 32.46 29.78 2da2 n ARG 63 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2da2 s LYS 64 N 3.55 3.69 -0.27 5.56 1.02 -1.26 -5.05 119.74 126.98 2da2 s LYS 64 Ca 1.06 1.47 -0.02 0.00 0.02 0.00 0.00 55.97 58.50 2da2 s LYS 64 Cb -1.40 -2.11 0.16 0.00 -0.52 0.00 0.00 37.83 33.95 2da2 s LYS 64 CO 0.76 -0.54 0.49 0.45 -0.92 0.00 0.00 175.35 175.59 2da2 s SER 65 N -1.86 -0.57 0.00 2.83 0.15 -1.26 -5.15 113.70 107.84 2da2 s SER 65 Ca 0.68 0.53 0.00 0.00 0.70 0.00 0.00 55.95 57.86 2da2 s SER 65 Cb -0.20 1.64 0.00 0.00 -1.71 0.00 0.00 66.02 65.75 2da2 s SER 65 CO 0.23 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.00 2da2 n GLY 66 N 5.40 3.21 3.57 9.45 0.00 -1.26 -5.02 105.19 120.53 2da2 n GLY 66 Ca -0.02 -1.50 -0.27 0.00 0.00 0.00 0.00 46.02 44.23 2da2 n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2da2 s PRO 67 N -2.19 2.53 -0.29 1.61 0.04 -1.26 -4.83 135.00 130.61 2da2 s PRO 67 Ca 0.00 -0.54 -0.17 0.00 0.04 0.00 0.00 61.00 60.34 2da2 s PRO 67 Cb 0.00 -5.11 0.14 0.00 0.04 0.00 0.00 34.50 29.57 2da2 s PRO 67 CO 0.00 -3.56 0.98 0.45 0.04 0.00 0.00 177.00 174.91 2da2 s SER 68 N 7.61 -0.51 -0.13 6.66 0.15 -1.26 -5.09 113.70 121.14 2da2 s SER 68 Ca 0.70 0.83 -0.14 0.00 0.70 0.00 0.00 55.95 58.03 2da2 s SER 68 Cb -0.05 1.18 -0.05 0.00 -1.71 0.00 0.00 66.02 65.39 2da2 s SER 68 CO 0.03 -0.13 -0.28 -1.20 1.20 0.00 0.00 173.24 172.86 2da2 n SER 69 N 3.59 1.77 0.00 5.45 7.64 -1.26 -5.04 113.62 125.77 2da2 n SER 69 Ca -0.18 0.29 0.00 0.00 1.01 0.00 0.00 58.87 59.99 2da2 n SER 69 Cb 0.57 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2da2 n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64