#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d85 s SER 2 N 0.00 -0.72 -0.15 1.61 0.15 -1.26 -5.08 113.70 108.25 2d85 s SER 2 Ca 0.00 1.37 -0.13 0.00 0.70 0.00 0.00 55.95 57.89 2d85 s SER 2 Cb 0.00 1.38 -0.06 0.00 -1.71 0.00 0.00 66.02 65.62 2d85 s SER 2 CO 0.00 -0.23 -0.27 -1.20 1.20 0.00 0.00 173.24 172.73 2d85 n SER 3 N 2.85 1.66 0.00 5.45 7.64 -1.26 -5.08 113.62 124.88 2d85 n SER 3 Ca -0.14 0.28 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2d85 n SER 3 Cb 0.56 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 2d85 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d85 n GLY 4 N 1.83 0.71 3.72 0.23 0.00 -1.26 -5.07 105.19 105.35 2d85 n GLY 4 Ca -0.23 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.12 2d85 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2d85 n SER 5 N 0.00 3.64 -4.39 1.61 2.88 -1.26 -4.95 113.62 111.16 2d85 n SER 5 Ca 0.00 1.13 -0.31 0.00 -1.33 0.00 0.00 58.87 58.36 2d85 n SER 5 Cb 0.00 -1.55 0.19 0.00 -0.75 0.00 0.00 64.21 62.09 2d85 n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2d85 n SER 6 N 2.49 -1.93 -4.75 -3.46 2.88 -1.26 -4.48 113.62 103.11 2d85 n SER 6 Ca 0.11 -0.01 -0.41 0.00 -1.33 0.00 0.00 58.87 57.22 2d85 n SER 6 Cb 0.35 -1.13 -0.02 0.00 -0.75 0.00 0.00 64.21 62.66 2d85 n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2d85 s GLY 7 N -2.09 2.17 0.32 0.46 0.00 0.32 -4.75 107.32 103.75 2d85 s GLY 7 Ca 0.61 1.50 -0.17 0.00 0.00 0.00 0.00 44.72 46.65 2d85 s GLY 7 CO 0.65 2.47 0.71 0.21 0.00 0.00 0.00 173.10 177.14 2d85 s ASN 8 N 0.46 -0.06 -0.01 1.64 2.47 -1.26 -5.01 114.94 113.17 2d85 s ASN 8 Ca 0.62 -0.92 0.12 0.00 0.42 0.00 0.00 52.86 53.09 2d85 s ASN 8 Cb -0.46 0.76 -0.23 0.00 -1.45 0.00 0.00 41.25 39.88 2d85 s ASN 8 CO 0.46 -1.47 0.78 0.44 -3.72 0.00 0.00 177.10 173.60 2d85 h ASP 9 N 2.03 0.00 0.04 -4.21 3.32 -2.02 -3.35 116.42 112.23 2d85 h ASP 9 Ca -0.26 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.56 2d85 h ASP 9 Cb 1.25 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.81 2d85 h ASP 9 CO 0.33 1.00 -0.89 0.44 -1.72 0.00 0.00 179.24 178.39 2d85 h ASP 10 N 0.00 0.81 -0.01 6.45 5.19 -1.99 -3.11 116.42 123.76 2d85 h ASP 10 Ca -0.23 -0.59 0.00 0.00 -0.62 0.00 0.00 57.03 55.59 2d85 h ASP 10 Cb 1.97 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 41.23 2d85 h ASP 10 CO 0.09 1.38 0.02 -0.29 -3.12 0.00 0.00 179.24 177.32 2d85 h ILE 11 N 0.41 0.38 -1.00 0.35 2.10 -1.94 -2.78 117.51 115.02 2d85 h ILE 11 Ca -0.08 0.00 0.41 0.00 1.08 0.00 0.00 64.86 66.27 2d85 h ILE 11 Cb 1.53 0.98 -0.18 0.00 -1.09 0.00 0.00 36.82 38.06 2d85 h ILE 11 CO 0.17 0.00 0.52 0.40 -1.08 0.00 0.00 178.15 178.16 2d85 h ILE 12 N 0.00 0.02 0.01 2.19 2.04 -1.67 0.59 117.51 120.69 2d85 h ILE 12 Ca 0.01 -0.01 -0.13 0.00 1.00 0.00 0.00 64.86 65.73 2d85 h ILE 12 Cb 0.05 -0.00 0.01 0.00 -0.74 0.00 0.00 36.82 36.13 2d85 h ILE 12 CO -0.00 0.00 -0.50 0.58 0.00 0.00 0.00 178.15 178.24 2d85 h VAL 13 N 0.02 1.48 -0.22 1.67 2.07 -1.74 -3.10 116.25 116.43 2d85 h VAL 13 Ca 0.83 -2.08 0.04 0.00 0.82 0.00 0.00 66.70 66.31 2d85 h VAL 13 Cb 2.18 2.72 -0.04 0.00 -1.52 0.00 0.00 31.29 34.63 2d85 h VAL 13 CO -0.77 0.59 -0.02 0.78 0.02 0.00 0.00 177.57 178.18 2d85 h ASN 14 N -0.27 -0.12 -0.56 0.57 -0.26 -0.13 -0.73 115.58 114.08 2d85 h ASN 14 Ca -0.07 0.05 0.08 0.00 -0.56 0.00 0.00 56.30 55.81 2d85 h ASN 14 Cb 1.24 0.10 -0.06 0.00 -1.06 0.00 0.00 38.32 38.54 2d85 h ASN 14 CO 0.10 -0.03 0.22 -0.25 -1.06 0.00 0.00 177.43 176.40 2d85 h TRP 15 N 0.05 0.38 0.66 1.19 7.01 -0.73 -0.81 115.95 123.70 2d85 h TRP 15 Ca 0.11 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.10 2d85 h TRP 15 Cb 0.14 -0.09 0.01 0.00 -2.10 0.00 0.00 29.16 27.12 2d85 h TRP 15 CO -0.20 0.12 -0.32 0.28 -2.79 0.00 0.00 178.44 175.54 2d85 h VAL 16 N 0.41 0.34 -0.22 2.65 2.07 -1.35 0.18 116.25 120.33 2d85 h VAL 16 Ca 0.27 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.80 2d85 h VAL 16 Cb 0.29 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 30.34 2d85 h VAL 16 CO -0.26 0.01 -0.38 0.78 0.02 0.00 0.00 177.57 177.74 2d85 h ASN 17 N -0.92 -1.20 0.54 0.57 2.35 -0.88 -1.24 115.58 114.79 2d85 h ASN 17 Ca -0.09 0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.82 2d85 h ASN 17 Cb 0.69 0.51 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 2d85 h ASN 17 CO 0.15 -0.38 -0.35 -0.33 -1.65 0.00 0.00 177.43 174.86 2d85 h GLU 18 N -0.40 -0.82 -1.10 0.81 4.39 -1.12 0.21 114.58 116.54 2d85 h GLU 18 Ca 0.11 0.06 0.38 0.00 0.34 0.00 0.00 59.36 60.24 2d85 h GLU 18 Cb 0.58 0.19 -0.15 0.00 -0.10 0.00 0.00 28.75 29.27 2d85 h GLU 18 CO -0.44 -0.55 0.66 1.15 -1.16 0.00 0.00 179.01 178.67 2d85 h THR 19 N -0.86 0.18 0.20 1.13 2.02 -0.29 0.41 112.91 115.71 2d85 h THR 19 Ca -0.06 -0.06 -0.27 0.00 0.77 0.00 0.00 66.41 66.79 2d85 h THR 19 Cb 0.71 -0.01 0.03 0.00 -1.74 0.00 0.00 68.15 67.14 2d85 h THR 19 CO 0.05 0.03 -1.21 -0.07 0.37 0.00 0.00 175.52 174.69 2d85 h LEU 20 N 0.17 0.66 -0.29 2.58 3.38 -0.71 -3.16 115.31 117.93 2d85 h LEU 20 Ca 0.79 -0.93 0.05 0.00 0.09 0.00 0.00 57.88 57.87 2d85 h LEU 20 Cb 2.10 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 42.59 2d85 h LEU 20 CO -0.58 1.58 -0.01 -0.09 0.09 0.00 0.00 178.44 179.43 2d85 h ARG 21 N -0.10 0.07 -0.33 1.13 9.65 0.30 0.28 114.38 125.37 2d85 h ARG 21 Ca -0.22 -0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.65 2d85 h ARG 21 Cb 1.92 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 30.47 2d85 h ARG 21 CO 0.21 0.05 0.15 1.05 2.80 0.00 0.00 179.97 184.22 2d85 h GLU 22 N 0.07 0.46 0.00 0.20 4.11 -0.97 -0.60 114.58 117.86 2d85 h GLU 22 Ca 0.14 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.52 2d85 h GLU 22 Cb 0.19 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2d85 h GLU 22 CO -0.25 0.37 -0.16 0.00 0.07 0.00 0.00 179.01 179.04 2d85 n ALA 23 N -2.48 2.70 -2.89 1.06 0.00 -0.49 -4.94 120.51 113.47 2d85 n ALA 23 Ca 0.02 -0.17 -0.10 0.00 0.00 0.00 0.00 53.44 53.18 2d85 n ALA 23 Cb 0.12 -1.36 0.04 0.00 0.00 0.00 0.00 19.45 18.25 2d85 n ALA 23 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2d85 n GLU 24 N -1.55 -3.64 -3.49 0.00 -0.58 0.81 -5.02 120.64 107.16 2d85 n GLU 24 Ca 0.06 0.41 -0.38 0.00 -0.42 0.00 0.00 57.16 56.84 2d85 n GLU 24 Cb 0.35 -4.17 -0.06 0.00 -0.57 0.00 0.00 31.44 26.99 2d85 n GLU 24 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2d85 s LYS 25 N -5.21 3.92 0.00 3.49 3.01 -0.26 -4.96 119.74 119.72 2d85 s LYS 25 Ca 0.16 0.41 0.11 0.00 -1.01 0.00 0.00 55.97 55.64 2d85 s LYS 25 Cb -0.07 -3.18 0.57 0.00 -1.01 0.00 0.00 37.83 34.14 2d85 s LYS 25 CO 0.36 0.66 1.38 0.43 0.51 0.00 0.00 175.35 178.69 2d85 n SER 26 N 1.66 0.24 -4.93 2.83 7.64 -1.26 -4.70 113.62 115.10 2d85 n SER 26 Ca -0.13 -1.72 -0.26 0.00 1.01 0.00 0.00 58.87 57.78 2d85 n SER 26 Cb 0.52 -0.02 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 2d85 n SER 26 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2d85 s SER 27 N -1.30 6.37 -0.15 6.43 1.04 -1.26 -5.09 113.70 119.74 2d85 s SER 27 Ca 0.16 0.44 -0.34 0.00 0.48 0.00 0.00 55.95 56.69 2d85 s SER 27 Cb 0.08 -2.02 0.13 0.00 0.10 0.00 0.00 66.02 64.31 2d85 s SER 27 CO 0.13 -0.14 1.17 -0.94 0.98 0.00 0.00 173.24 174.44 2d85 s SER 28 N -3.46 -0.16 -0.01 7.02 1.04 -1.26 -4.87 113.70 111.99 2d85 s SER 28 Ca 0.39 -0.02 0.01 0.00 0.48 0.00 0.00 55.95 56.82 2d85 s SER 28 Cb -0.10 0.18 0.01 0.00 0.10 0.00 0.00 66.02 66.21 2d85 s SER 28 CO 0.31 -0.30 -0.03 0.27 0.98 0.00 0.00 173.24 174.47 2d85 s ILE 29 N -2.53 0.32 -0.02 -1.02 -4.36 -1.26 -4.75 121.20 107.58 2d85 s ILE 29 Ca 0.09 -0.12 -0.20 0.00 -0.26 0.00 0.00 60.65 60.17 2d85 s ILE 29 Cb -0.01 -0.31 -0.31 0.00 1.25 0.00 0.00 42.46 43.09 2d85 s ILE 29 CO -0.05 0.12 0.96 -1.28 0.24 0.00 0.00 174.94 174.92 2d85 h SER 30 N 6.42 0.57 -5.00 4.36 0.87 -1.95 -3.47 113.55 115.35 2d85 h SER 30 Ca -0.32 -0.91 0.14 0.00 -1.23 0.00 0.00 61.79 59.47 2d85 h SER 30 Cb 1.18 -0.18 -0.12 0.00 -0.44 0.00 0.00 62.40 62.84 2d85 h SER 30 CO 0.50 1.44 0.49 -0.55 -0.53 0.00 0.00 176.83 178.17 2d85 s SER 31 N -7.07 -0.27 0.62 6.23 0.15 -1.26 -4.99 113.70 107.10 2d85 s SER 31 Ca -0.12 -0.20 0.23 0.00 0.70 0.00 0.00 55.95 56.56 2d85 s SER 31 Cb 0.02 0.43 0.90 0.00 -1.71 0.00 0.00 66.02 65.67 2d85 s SER 31 CO 0.86 -0.76 1.38 -0.26 1.20 0.00 0.00 173.24 175.66 2d85 h PHE 32 N 2.00 0.00 -1.33 3.44 0.04 -1.99 0.80 116.94 119.90 2d85 h PHE 32 Ca -0.23 0.00 -0.69 0.00 2.80 0.00 0.00 57.97 59.85 2d85 h PHE 32 Cb 1.24 0.00 -0.30 0.00 2.20 0.00 0.00 35.95 39.08 2d85 h PHE 32 CO 0.32 0.00 0.68 1.63 -0.60 0.00 0.00 178.31 180.34 2d85 n LYS 33 N -3.18 2.84 -3.53 1.51 4.01 -1.26 -4.63 118.16 113.91 2d85 n LYS 33 Ca 0.16 -3.52 -0.38 0.00 -0.51 0.00 0.00 58.31 54.06 2d85 n LYS 33 Cb 1.25 -2.28 -0.06 0.00 -0.51 0.00 0.00 35.03 33.43 2d85 n LYS 33 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2d85 s ASP 34 N -1.86 6.71 0.17 4.39 2.15 0.28 -5.00 116.67 123.50 2d85 s ASP 34 Ca 0.58 0.85 -0.08 0.00 0.43 0.00 0.00 52.55 54.33 2d85 s ASP 34 Cb 0.47 -2.23 0.03 0.00 -0.30 0.00 0.00 42.92 40.90 2d85 s ASP 34 CO -0.15 0.29 1.51 1.55 -0.17 0.00 0.00 175.17 178.19 2d85 h PRO 35 N 5.10 0.82 -0.91 4.34 0.13 -1.94 -3.17 132.00 136.37 2d85 h PRO 35 Ca -0.50 -0.44 0.22 0.00 -0.87 0.00 0.00 66.00 64.41 2d85 h PRO 35 Cb 1.21 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 32.24 2d85 h PRO 35 CO 0.64 1.07 0.42 0.87 -0.23 0.00 0.00 178.00 180.76 2d85 h LYS 36 N 0.67 0.41 -0.95 0.86 1.79 -1.94 0.47 116.57 117.88 2d85 h LYS 36 Ca 0.05 -0.02 0.27 0.00 -2.18 0.00 0.00 60.65 58.77 2d85 h LYS 36 Cb 0.98 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 31.49 2d85 h LYS 36 CO 0.09 0.27 0.69 0.82 -1.08 0.00 0.00 179.45 180.25 2d85 h ILE 37 N 0.42 0.51 -1.00 1.86 2.04 -1.87 0.65 117.51 120.13 2d85 h ILE 37 Ca 0.57 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.62 2d85 h ILE 37 Cb 1.07 0.52 -0.11 0.00 -0.74 0.00 0.00 36.82 37.56 2d85 h ILE 37 CO -0.52 0.00 0.61 0.77 0.00 0.00 0.00 178.15 179.01 2d85 h SER 38 N 0.00 0.78 0.74 1.72 4.64 -0.22 0.66 113.55 121.87 2d85 h SER 38 Ca 0.45 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2d85 h SER 38 Cb 1.82 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.87 2d85 h SER 38 CO -0.00 0.28 -0.12 0.35 -0.87 0.00 0.00 176.83 176.47 2d85 n THR 39 N -4.76 0.00 -1.95 2.95 -2.24 0.22 -4.68 114.28 103.82 2d85 n THR 39 Ca 0.23 -0.01 -0.13 0.00 -2.27 0.00 0.00 64.05 61.87 2d85 n THR 39 Cb 0.57 -0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.49 2d85 n THR 39 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2d85 n SER 40 N -1.38 -4.28 0.09 3.42 7.64 0.23 -4.92 113.62 114.42 2d85 n SER 40 Ca 0.09 0.10 -0.13 0.00 1.01 0.00 0.00 58.87 59.95 2d85 n SER 40 Cb 0.32 -3.29 -0.08 0.00 -1.01 0.00 0.00 64.21 60.15 2d85 n SER 40 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2d85 h LEU 41 N 0.00 -0.21 -1.17 -3.43 3.38 -1.78 0.18 115.31 112.28 2d85 h LEU 41 Ca -0.30 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.32 2d85 h LEU 41 Cb 1.10 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2d85 h LEU 41 CO 0.38 0.20 -0.34 1.55 0.09 0.00 0.00 178.44 180.32 2d85 h PRO 42 N -0.67 0.00 0.22 1.13 0.13 -1.85 -0.45 132.00 130.50 2d85 h PRO 42 Ca -0.03 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.79 2d85 h PRO 42 Cb 0.48 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.64 2d85 h PRO 42 CO 0.04 0.34 -1.41 0.28 -0.23 0.00 0.00 178.00 177.02 2d85 h VAL 43 N 0.00 1.35 -0.01 1.56 2.07 -1.90 -2.45 116.25 116.87 2d85 h VAL 43 Ca -0.00 -2.82 -0.10 0.00 0.82 0.00 0.00 66.70 64.60 2d85 h VAL 43 Cb 0.75 3.01 0.01 0.00 -1.52 0.00 0.00 31.29 33.55 2d85 h VAL 43 CO 0.04 0.84 -0.38 -0.07 0.02 0.00 0.00 177.57 178.02 2d85 h LEU 44 N 0.13 0.34 -0.85 2.57 3.38 -0.88 -3.16 115.31 116.84 2d85 h LEU 44 Ca -0.22 -0.76 -0.06 0.00 0.09 0.00 0.00 57.88 56.93 2d85 h LEU 44 Cb 2.11 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.73 2d85 h LEU 44 CO 0.25 1.06 0.16 0.44 0.09 0.00 0.00 178.44 180.44 2d85 h ASP 45 N -0.34 0.95 -0.70 -0.43 3.32 -1.22 -2.54 116.42 115.46 2d85 h ASP 45 Ca -0.05 -0.19 0.05 0.00 0.02 0.00 0.00 57.03 56.87 2d85 h ASP 45 Cb 1.11 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.37 2d85 h ASP 45 CO 0.07 0.92 0.46 0.25 -1.72 0.00 0.00 179.24 179.22 2d85 h LEU 46 N 0.96 0.66 -0.01 1.55 5.85 -1.51 -1.17 115.31 121.64 2d85 h LEU 46 Ca 0.20 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 2d85 h LEU 46 Cb 0.34 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 2d85 h LEU 46 CO 0.00 0.44 -0.01 0.40 -0.34 0.00 0.00 178.44 178.93 2d85 h ILE 47 N 0.76 1.36 -0.44 4.05 2.04 -1.42 -3.24 117.51 120.61 2d85 h ILE 47 Ca 0.29 -1.06 0.05 0.00 1.00 0.00 0.00 64.86 65.14 2d85 h ILE 47 Cb 0.20 2.06 -0.05 0.00 -0.74 0.00 0.00 36.82 38.29 2d85 h ILE 47 CO -0.09 0.28 0.17 -2.24 0.00 0.00 0.00 178.15 176.26 2d85 h ASP 48 N -0.42 0.19 -0.90 1.72 3.04 -1.20 -1.94 116.42 116.91 2d85 h ASP 48 Ca 0.00 0.05 0.27 0.00 -3.24 0.00 0.00 57.03 54.11 2d85 h ASP 48 Cb 0.46 0.02 -0.17 0.00 -1.04 0.00 0.00 39.33 38.60 2d85 h ASP 48 CO 0.00 0.14 0.09 0.00 -2.04 0.00 0.00 179.24 177.43 2d85 n ALA 49 N -2.37 0.53 -0.05 4.15 0.00 -0.48 -1.45 120.51 120.84 2d85 n ALA 49 Ca 0.03 0.96 -0.02 0.00 0.00 0.00 0.00 53.44 54.41 2d85 n ALA 49 Cb 0.16 -0.74 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 2d85 n ALA 49 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2d85 h ILE 50 N 0.00 0.25 -3.48 0.00 2.04 -1.51 -3.42 117.51 111.39 2d85 h ILE 50 Ca 0.58 -1.18 -0.72 0.00 1.00 0.00 0.00 64.86 64.54 2d85 h ILE 50 Cb 1.27 0.48 -0.31 0.00 -0.74 0.00 0.00 36.82 37.51 2d85 h ILE 50 CO -0.82 0.09 -0.32 -1.58 0.00 0.00 0.00 178.15 175.52 2d85 s GLN 51 N -1.68 2.65 0.32 2.37 2.00 -0.53 -5.07 119.66 119.71 2d85 s GLN 51 Ca -0.03 -2.12 -0.29 0.00 -2.00 0.00 0.00 55.36 50.92 2d85 s GLN 51 Cb -0.00 -3.92 -0.10 0.00 0.80 0.00 0.00 33.01 29.79 2d85 s GLN 51 CO 0.10 -1.19 1.22 -1.25 -0.50 0.00 0.00 175.29 173.67 2d85 s PRO 52 N 0.71 4.41 0.00 1.67 0.04 -0.92 -3.39 135.00 137.52 2d85 s PRO 52 Ca 0.11 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.19 2d85 s PRO 52 Cb -0.21 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.27 2d85 s PRO 52 CO -0.03 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.34 2d85 n GLY 53 N 0.91 2.61 0.52 0.56 0.00 -1.26 -4.93 105.19 103.60 2d85 n GLY 53 Ca 0.00 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 2d85 n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d85 h SER 54 N 0.44 -1.29 -3.61 1.61 4.64 -1.93 -3.42 113.55 109.99 2d85 h SER 54 Ca 0.00 0.08 -0.51 0.00 -0.47 0.00 0.00 61.79 60.89 2d85 h SER 54 Cb 0.00 0.39 -0.03 0.00 -0.31 0.00 0.00 62.40 62.45 2d85 h SER 54 CO 0.00 -0.75 0.20 -0.63 -0.87 0.00 0.00 176.83 174.78 2d85 s ILE 55 N -5.93 4.36 -0.23 0.95 -1.09 -1.26 -5.06 121.20 112.95 2d85 s ILE 55 Ca -0.19 1.65 -0.04 0.00 -2.23 0.00 0.00 60.65 59.84 2d85 s ILE 55 Cb 0.03 -4.06 0.08 0.00 -1.58 0.00 0.00 42.46 36.93 2d85 s ILE 55 CO 0.60 0.38 0.11 0.21 -1.23 0.00 0.00 174.94 175.01 2d85 s ASN 56 N -1.35 2.98 0.33 3.58 2.47 -1.26 -5.01 114.94 116.67 2d85 s ASN 56 Ca 0.40 -0.97 0.10 0.00 0.42 0.00 0.00 52.86 52.81 2d85 s ASN 56 Cb -0.21 -0.33 0.88 0.00 -1.45 0.00 0.00 41.25 40.14 2d85 s ASN 56 CO 0.25 -0.39 1.75 1.88 -3.72 0.00 0.00 177.10 176.87 2d85 h TYR 57 N 8.39 0.98 -0.98 0.43 -1.99 -1.97 0.11 116.97 121.95 2d85 h TYR 57 Ca -0.17 0.03 0.28 0.00 2.00 0.00 0.00 58.73 60.88 2d85 h TYR 57 Cb 1.08 -0.29 -0.14 0.00 2.00 0.00 0.00 36.73 39.38 2d85 h TYR 57 CO 0.23 0.11 0.51 0.22 -0.00 0.00 0.00 178.16 179.23 2d85 h ASP 58 N 0.60 0.46 0.47 3.88 1.82 -1.99 0.13 116.42 121.80 2d85 h ASP 58 Ca 0.62 0.18 -0.30 0.00 -0.39 0.00 0.00 57.03 57.14 2d85 h ASP 58 Cb 1.18 0.13 -0.00 0.00 0.68 0.00 0.00 39.33 41.32 2d85 h ASP 58 CO -0.43 -0.08 -1.49 -0.07 -1.61 0.00 0.00 179.24 175.57 2d85 h LEU 59 N 0.37 0.41-10.13 2.28 3.38 -1.25 -3.47 115.31 106.90 2d85 h LEU 59 Ca 0.67 -0.54 -0.42 0.00 0.09 0.00 0.00 57.88 57.68 2d85 h LEU 59 Cb 1.45 -0.13 0.21 0.00 0.09 0.00 0.00 40.66 42.27 2d85 h LEU 59 CO -0.58 1.44 -0.01 -0.76 0.09 0.00 0.00 178.44 178.62 2d85 s LEU 60 N -7.02 0.40 -0.09 1.67 1.43 0.47 -5.02 118.68 110.52 2d85 s LEU 60 Ca -0.08 1.34 -0.08 0.00 -1.03 0.00 0.00 54.13 54.27 2d85 s LEU 60 Cb 0.07 -3.14 -0.03 0.00 0.03 0.00 0.00 46.19 43.12 2d85 s LEU 60 CO 0.86 -4.44 -0.15 0.29 0.23 0.00 0.00 176.35 173.13 2d85 n LYS 61 N -5.06 0.25 -3.04 1.70 4.01 -1.26 -4.95 118.16 109.81 2d85 n LYS 61 Ca 0.04 0.17 -0.14 0.00 -0.51 0.00 0.00 58.31 57.87 2d85 n LYS 61 Cb 0.56 -1.02 -0.02 0.00 -0.51 0.00 0.00 35.03 34.04 2d85 n LYS 61 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 2d85 n THR 62 N -3.47 -0.28 -3.59 -0.18 5.66 -1.26 -4.88 114.28 106.29 2d85 n THR 62 Ca -0.06 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.67 2d85 n THR 62 Cb 0.23 -0.69 -0.16 0.00 -1.55 0.00 0.00 70.33 68.15 2d85 n THR 62 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2d85 s GLU 63 N -5.62 0.13 -1.55 1.09 -1.05 -1.26 -4.89 118.70 105.55 2d85 s GLU 63 Ca 0.23 -0.25 -0.07 0.00 -0.15 0.00 0.00 54.97 54.74 2d85 s GLU 63 Cb -0.13 -1.63 0.07 0.00 -0.44 0.00 0.00 34.13 31.99 2d85 s GLU 63 CO 0.29 -0.78 0.17 0.09 0.95 0.00 0.00 175.26 175.98 2d85 n ASN 64 N 5.26 0.10 -3.87 0.83 3.02 -1.26 -4.85 115.26 114.48 2d85 n ASN 64 Ca -0.07 -1.19 -0.25 0.00 -0.03 0.00 0.00 54.58 53.05 2d85 n ASN 64 Cb 0.47 -1.49 0.14 0.00 -0.61 0.00 0.00 39.78 38.29 2d85 n ASN 64 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2d85 n LEU 65 N -4.20 -1.86 -3.70 3.41 4.77 -1.26 -5.05 117.00 109.11 2d85 n LEU 65 Ca -0.18 -0.26 -0.07 0.00 -0.03 0.00 0.00 56.01 55.47 2d85 n LEU 65 Cb 0.58 -0.80 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 2d85 n LEU 65 CO 0.83 -3.11 0.56 0.54 -1.33 0.00 0.00 177.39 174.88 2d85 s ASN 66 N -1.83 -0.31 0.30 -1.43 2.20 -1.26 -4.91 114.94 107.70 2d85 s ASN 66 Ca 0.43 -0.36 0.20 0.00 -0.94 0.00 0.00 52.86 52.18 2d85 s ASN 66 Cb -0.06 0.59 1.05 0.00 -2.00 0.00 0.00 41.25 40.82 2d85 s ASN 66 CO 0.48 -1.06 1.15 -0.67 -2.94 0.00 0.00 177.10 174.06 2d85 n ASP 67 N -0.42 0.21 0.00 3.54 -0.08 -1.26 0.55 116.55 119.09 2d85 n ASP 67 Ca -0.08 1.12 0.00 0.00 -1.51 0.00 0.00 54.79 54.32 2d85 n ASP 67 Cb 0.61 -0.55 0.00 0.00 2.34 0.00 0.00 41.12 43.52 2d85 n ASP 67 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2d85 n ASP 68 N -4.41 0.00 -0.10 1.67 9.92 -1.26 -3.06 116.55 119.31 2d85 n ASP 68 Ca 0.29 0.60 -0.08 0.00 -0.53 0.00 0.00 54.79 55.07 2d85 n ASP 68 Cb 1.05 -0.43 -0.02 0.00 -0.64 0.00 0.00 41.12 41.08 2d85 n ASP 68 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2d85 h GLU 69 N 0.00 -0.25 -0.92 -1.24 4.39 -1.48 -1.06 114.58 114.02 2d85 h GLU 69 Ca 0.00 0.02 0.20 0.00 0.34 0.00 0.00 59.36 59.92 2d85 h GLU 69 Cb 0.00 0.06 -0.17 0.00 -0.10 0.00 0.00 28.75 28.53 2d85 h GLU 69 CO 0.00 -0.17 -0.14 0.87 -1.16 0.00 0.00 179.01 178.41 2d85 h LYS 70 N -0.26 0.01 0.07 2.33 1.57 -0.06 0.18 116.57 120.41 2d85 h LYS 70 Ca 0.16 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.96 2d85 h LYS 70 Cb 0.53 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 2d85 h LYS 70 CO -0.50 0.01 -0.22 1.25 -0.57 0.00 0.00 179.45 179.42 2d85 h LEU 71 N 0.01 -0.62 -1.18 2.94 5.85 -1.12 0.43 115.31 121.62 2d85 h LEU 71 Ca 0.48 0.08 0.20 0.00 0.84 0.00 0.00 57.88 59.47 2d85 h LEU 71 Cb 0.82 0.24 -0.09 0.00 0.37 0.00 0.00 40.66 42.00 2d85 h LEU 71 CO -0.92 -0.30 0.61 0.78 -0.34 0.00 0.00 178.44 178.28 2d85 h ASN 72 N -0.39 0.66 0.36 1.25 2.35 -0.41 0.20 115.58 119.60 2d85 h ASN 72 Ca 0.04 0.08 -0.16 0.00 -0.55 0.00 0.00 56.30 55.70 2d85 h ASN 72 Cb 0.43 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 2d85 h ASN 72 CO -0.15 0.24 -0.68 0.78 -1.65 0.00 0.00 177.43 175.97 2d85 h ASN 73 N 0.64 0.33 -0.00 5.81 4.21 -0.39 -2.87 115.58 123.32 2d85 h ASN 73 Ca 0.54 -0.21 -0.00 0.00 1.21 0.00 0.00 56.30 57.85 2d85 h ASN 73 Cb 1.01 -0.10 -0.00 0.00 -1.12 0.00 0.00 38.32 38.11 2d85 h ASN 73 CO -0.31 0.91 0.00 0.00 -1.29 0.00 0.00 177.43 176.74 2d85 h ALA 74 N 1.08 0.00 -0.98 -0.83 0.00 0.15 0.63 119.26 119.32 2d85 h ALA 74 Ca -0.02 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.79 2d85 h ALA 74 Cb 1.22 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 2d85 h ALA 74 CO 0.11 -0.37 0.64 0.87 0.00 0.00 0.00 179.25 180.51 2d85 h LYS 75 N -0.25 1.24 0.04 0.00 1.57 -1.27 -2.30 116.57 115.61 2d85 h LYS 75 Ca 0.00 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2d85 h LYS 75 Cb 0.26 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2d85 h LYS 75 CO 0.00 0.82 -0.02 -0.92 -0.57 0.00 0.00 179.45 178.76 2d85 h TYR 76 N 1.28 -0.05 -0.18 -1.35 3.20 -1.40 -2.55 116.97 115.92 2d85 h TYR 76 Ca 0.38 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.28 2d85 h TYR 76 Cb -0.06 0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.16 2d85 h TYR 76 CO -0.00 0.38 -0.49 0.00 -1.64 0.00 0.00 178.16 176.41 2d85 h ALA 77 N 0.45 -0.82 -0.93 1.82 0.00 -0.66 -0.08 119.26 119.05 2d85 h ALA 77 Ca -0.01 -0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.01 2d85 h ALA 77 Cb 0.45 0.99 -0.09 0.00 0.00 0.00 0.00 17.79 19.14 2d85 h ALA 77 CO 0.01 -1.01 0.54 0.82 0.00 0.00 0.00 179.25 179.62 2d85 h ILE 78 N -0.48 0.80 0.50 0.00 2.04 -1.51 -2.39 117.51 116.48 2d85 h ILE 78 Ca 0.04 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 2d85 h ILE 78 Cb 0.58 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 2d85 h ILE 78 CO -0.42 0.14 -0.41 -1.28 0.00 0.00 0.00 178.15 176.19 2d85 h SER 79 N 0.79 -1.07 -0.89 1.72 0.87 -0.72 -2.87 113.55 111.38 2d85 h SER 79 Ca 0.50 0.08 0.14 0.00 -1.23 0.00 0.00 61.79 61.28 2d85 h SER 79 Cb 0.63 0.34 -0.15 0.00 -0.44 0.00 0.00 62.40 62.78 2d85 h SER 79 CO -0.32 -0.58 -0.37 0.24 -0.53 0.00 0.00 176.83 175.26 2d85 h MET 80 N -0.89 -0.04 -0.92 2.24 2.86 -0.55 0.35 114.93 117.98 2d85 h MET 80 Ca -0.05 0.00 0.23 0.00 -2.06 0.00 0.00 59.70 57.82 2d85 h MET 80 Cb 0.76 0.01 -0.17 0.00 0.06 0.00 0.00 31.60 32.27 2d85 h MET 80 CO -0.01 -0.03 -0.02 0.00 1.06 0.00 0.00 176.91 177.92 2d85 h ALA 81 N 1.31 0.98 -0.26 6.32 0.00 -1.35 0.33 119.26 126.59 2d85 h ALA 81 Ca 0.32 0.32 -0.11 0.00 0.00 0.00 0.00 54.91 55.44 2d85 h ALA 81 Cb 0.59 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 2d85 h ALA 81 CO -0.91 -0.49 -0.27 0.00 0.00 0.00 0.00 179.25 177.58 2d85 h ARG 82 N 0.04 0.64 -0.30 0.00 2.47 -0.34 -1.37 114.38 115.53 2d85 h ARG 82 Ca 0.52 -0.34 0.07 0.00 -1.26 0.00 0.00 59.98 58.97 2d85 h ARG 82 Cb 1.00 0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 29.26 2d85 h ARG 82 CO -0.86 0.95 -0.19 -0.22 0.56 0.00 0.00 179.97 180.21 2d85 h LYS 83 N 0.36 -0.15 0.00 0.04 1.63 0.97 -0.44 116.57 118.98 2d85 h LYS 83 Ca 0.04 0.01 -0.08 0.00 -0.85 0.00 0.00 60.65 59.77 2d85 h LYS 83 Cb 0.83 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.49 2d85 h LYS 83 CO 0.07 -0.10 -0.38 -0.84 -3.45 0.00 0.00 179.45 174.75 2d85 h ILE 84 N -0.16 1.11 0.00 2.00 3.07 -1.09 -3.47 117.51 118.97 2d85 h ILE 84 Ca 0.16 -1.36 0.00 0.00 1.55 0.00 0.00 64.86 65.21 2d85 h ILE 84 Cb 0.40 1.77 0.00 0.00 -0.27 0.00 0.00 36.82 38.71 2d85 h ILE 84 CO -0.39 0.37 0.00 0.61 -1.05 0.00 0.00 178.15 177.69 2d85 n GLY 85 N -0.23 1.14 3.46 0.16 0.00 -0.17 -5.11 105.19 104.44 2d85 n GLY 85 Ca -0.01 -0.57 0.01 0.00 0.00 0.00 0.00 46.02 45.45 2d85 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d85 s ALA 86 N 0.00 -2.58 -0.26 4.61 0.00 -0.59 -4.91 121.76 118.03 2d85 s ALA 86 Ca 0.00 2.10 -0.29 0.00 0.00 0.00 0.00 51.96 53.77 2d85 s ALA 86 Cb 0.00 -1.97 -0.03 0.00 0.00 0.00 0.00 23.12 21.12 2d85 s ALA 86 CO 0.00 -0.83 1.75 1.03 0.00 0.00 0.00 175.76 177.71 2d85 s ARG 87 N 2.26 3.57 -0.28 0.00 0.52 -1.26 -3.46 118.95 120.30 2d85 s ARG 87 Ca -0.04 1.63 -0.04 0.00 -0.52 0.00 0.00 55.73 56.76 2d85 s ARG 87 Cb -0.06 -4.14 0.02 0.00 0.52 0.00 0.00 34.95 31.30 2d85 s ARG 87 CO -0.17 -1.58 0.01 0.14 0.02 0.00 0.00 175.30 173.72 2d85 s VAL 88 N 6.11 3.32 -0.44 3.52 -7.23 -1.26 -4.69 120.40 119.72 2d85 s VAL 88 Ca 0.78 -0.96 0.04 0.00 -1.81 0.00 0.00 61.98 60.02 2d85 s VAL 88 Cb -0.25 -2.74 0.47 0.00 0.56 0.00 0.00 36.38 34.42 2d85 s VAL 88 CO 0.32 0.10 1.58 0.00 -0.31 0.00 0.00 175.10 176.79 2d85 n TYR 89 N 4.74 2.72 -3.50 2.82 9.36 -1.26 -5.00 117.16 127.03 2d85 n TYR 89 Ca -0.15 -2.44 -0.13 0.00 3.32 0.00 0.00 57.90 58.50 2d85 n TYR 89 Cb 0.47 -0.82 0.01 0.00 -0.63 0.00 0.00 39.34 38.37 2d85 n TYR 89 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2d85 n ALA 90 N -0.86 0.50 -3.04 2.98 0.00 -1.26 -4.89 120.51 113.93 2d85 n ALA 90 Ca 0.50 -1.13 -0.22 0.00 0.00 0.00 0.00 53.44 52.60 2d85 n ALA 90 Cb 0.88 0.42 -0.16 0.00 0.00 0.00 0.00 19.45 20.60 2d85 n ALA 90 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2d85 s LEU 91 N 0.00 1.80 0.30 0.00 2.96 -1.26 -5.03 118.68 117.44 2d85 s LEU 91 Ca 0.21 -0.23 0.08 0.00 -0.22 0.00 0.00 54.13 53.97 2d85 s LEU 91 Cb -0.02 -0.66 0.46 0.00 0.50 0.00 0.00 46.19 46.48 2d85 s LEU 91 CO 0.13 0.08 1.69 1.55 -1.32 0.00 0.00 176.35 178.48 2d85 h PRO 92 N 6.41 0.13 -0.43 0.98 0.13 -1.95 -1.79 132.00 135.48 2d85 h PRO 92 Ca -0.33 -0.07 -0.11 0.00 -0.87 0.00 0.00 66.00 64.61 2d85 h PRO 92 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2d85 h PRO 92 CO 0.48 0.58 -0.19 0.93 -0.23 0.00 0.00 178.00 179.57 2d85 h GLU 93 N 0.11 0.84 0.08 0.86 5.08 -1.94 -2.79 114.58 116.82 2d85 h GLU 93 Ca 0.00 -0.33 -0.29 0.00 -1.00 0.00 0.00 59.36 57.75 2d85 h GLU 93 Cb 0.88 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 30.11 2d85 h GLU 93 CO 0.07 0.96 -1.18 -0.44 -1.00 0.00 0.00 179.01 177.42 2d85 h ASP 94 N 0.74 0.85 -0.84 1.42 5.19 -1.95 -3.29 116.42 118.53 2d85 h ASP 94 Ca 0.11 -0.75 0.11 0.00 -0.62 0.00 0.00 57.03 55.87 2d85 h ASP 94 Cb 0.72 -0.26 -0.08 0.00 0.18 0.00 0.00 39.33 39.89 2d85 h ASP 94 CO 0.06 1.56 0.48 0.25 -3.12 0.00 0.00 179.24 178.46 2d85 h LEU 95 N 0.30 0.67 -1.44 1.55 5.85 -1.27 -0.69 115.31 120.28 2d85 h LEU 95 Ca -0.16 0.06 0.33 0.00 0.84 0.00 0.00 57.88 58.94 2d85 h LEU 95 Cb 1.84 -0.07 -0.10 0.00 0.37 0.00 0.00 40.66 42.70 2d85 h LEU 95 CO 0.22 0.37 0.74 0.58 -0.34 0.00 0.00 178.44 180.01 2d85 h VAL 96 N 0.78 0.39 -0.95 1.05 2.07 -1.56 0.76 116.25 118.80 2d85 h VAL 96 Ca 0.42 -0.09 -0.57 0.00 0.82 0.00 0.00 66.70 67.28 2d85 h VAL 96 Cb 0.43 0.11 -0.29 0.00 -1.52 0.00 0.00 31.29 30.01 2d85 h VAL 96 CO -0.27 0.05 0.65 -0.62 0.02 0.00 0.00 177.57 177.40 2d85 n GLU 97 N -4.60 2.47 -3.83 1.57 1.02 -0.29 -4.59 120.64 112.39 2d85 n GLU 97 Ca 0.29 -3.19 -0.25 0.00 -0.02 0.00 0.00 57.16 53.98 2d85 n GLU 97 Cb 1.08 -2.21 -0.07 0.00 -0.02 0.00 0.00 31.44 30.22 2d85 n GLU 97 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2d85 n VAL 98 N -1.03 -0.56 -2.46 2.62 0.31 0.27 -4.79 118.33 112.69 2d85 n VAL 98 Ca 0.59 -0.28 -0.43 0.00 -0.01 0.00 0.00 64.34 64.21 2d85 n VAL 98 Cb 1.15 -0.65 -0.02 0.00 -0.91 0.00 0.00 33.84 33.41 2d85 n VAL 98 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2d85 s ASN 99 N -3.70 6.71 0.00 4.52 0.01 -1.05 -4.82 114.94 116.62 2d85 s ASN 99 Ca 0.15 1.17 0.14 0.00 -0.71 0.00 0.00 52.86 53.62 2d85 s ASN 99 Cb -0.09 -2.54 0.86 0.00 0.41 0.00 0.00 41.25 39.89 2d85 s ASN 99 CO 0.75 -1.05 1.28 -0.81 -1.51 0.00 0.00 177.10 175.75 2d85 n PRO 100 N 7.26 0.49 0.13 -0.60 -0.04 -1.26 -2.27 135.00 138.71 2d85 n PRO 100 Ca 0.14 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.36 2d85 n PRO 100 Cb 0.47 -1.46 -0.16 0.00 -0.04 0.00 0.00 33.50 32.31 2d85 n PRO 100 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2d85 h LYS 101 N 0.00 0.51 0.01 0.54 6.56 -1.97 -3.34 116.57 118.88 2d85 h LYS 101 Ca 0.00 -0.87 -0.39 0.00 -1.06 0.00 0.00 60.65 58.33 2d85 h LYS 101 Cb 0.00 0.32 -0.06 0.00 -0.57 0.00 0.00 32.23 31.93 2d85 h LYS 101 CO 0.00 1.42 -2.17 -1.33 -2.06 0.00 0.00 179.45 175.31 2d85 n MET 102 N -3.77 0.60 -0.19 3.15 2.81 -1.12 -4.28 117.12 114.32 2d85 n MET 102 Ca -0.17 0.33 0.28 0.00 -1.81 0.00 0.00 57.70 56.33 2d85 n MET 102 Cb 1.07 -1.58 0.47 0.00 -0.71 0.00 0.00 33.22 32.48 2d85 n MET 102 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2d85 h VAL 103 N -0.81 0.04 -1.33 2.03 2.07 -1.67 0.15 116.25 116.74 2d85 h VAL 103 Ca -0.58 0.00 0.41 0.00 0.82 0.00 0.00 66.70 67.35 2d85 h VAL 103 Cb 1.60 0.07 -0.11 0.00 -1.52 0.00 0.00 31.29 31.33 2d85 h VAL 103 CO -0.30 0.00 0.88 -0.03 0.02 0.00 0.00 177.57 178.15 2d85 h MET 104 N 0.00 0.12 0.04 1.57 -1.53 -1.75 -0.63 114.93 112.75 2d85 h MET 104 Ca 0.47 -0.01 -0.33 0.00 -3.44 0.00 0.00 59.70 56.40 2d85 h MET 104 Cb 2.77 -0.03 -0.04 0.00 -0.55 0.00 0.00 31.60 33.75 2d85 h MET 104 CO -0.00 0.08 -1.83 0.25 0.14 0.00 0.00 176.91 175.54 2d85 n THR 105 N -4.53 1.60 -0.31 -0.77 -2.24 0.53 -2.73 114.28 105.83 2d85 n THR 105 Ca 0.34 -0.33 0.28 0.00 -2.27 0.00 0.00 64.05 62.07 2d85 n THR 105 Cb 1.37 -1.86 0.51 0.00 -2.10 0.00 0.00 70.33 68.26 2d85 n THR 105 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2d85 n VAL 106 N -4.00 -0.41 -0.10 2.28 0.31 -0.31 -0.92 118.33 115.19 2d85 n VAL 106 Ca -0.38 1.99 -0.17 0.00 -0.01 0.00 0.00 64.34 65.78 2d85 n VAL 106 Cb 0.86 -3.17 -0.08 0.00 -0.91 0.00 0.00 33.84 30.54 2d85 n VAL 106 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2d85 n PHE 107 N -5.23 0.78 -0.32 3.52 3.72 -0.83 -4.08 117.46 115.02 2d85 n PHE 107 Ca 0.34 0.34 0.02 0.00 -0.05 0.00 0.00 57.45 58.09 2d85 n PHE 107 Cb 1.14 -0.94 0.07 0.00 -0.94 0.00 0.00 39.48 38.82 2d85 n PHE 107 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d85 n ALA 108 N -3.68 0.03 -0.36 4.37 0.00 -0.72 0.20 120.51 120.34 2d85 n ALA 108 Ca -0.26 0.88 0.04 0.00 0.00 0.00 0.00 53.44 54.10 2d85 n ALA 108 Cb 0.57 -0.46 0.19 0.00 0.00 0.00 0.00 19.45 19.75 2d85 n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d85 h LEU 110 N 1.11 -0.07 -1.87 0.00 3.38 0.20 -3.32 115.31 114.74 2d85 h LEU 110 Ca 0.45 0.00 0.34 0.00 0.09 0.00 0.00 57.88 58.77 2d85 h LEU 110 Cb 0.27 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 2d85 h LEU 110 CO -0.20 0.20 0.85 0.00 0.09 0.00 0.00 178.44 179.37 2d85 h MET 111 N -0.57 0.07 -0.18 1.13 -0.00 0.35 0.27 114.93 116.00 2d85 h MET 111 Ca -0.01 -0.00 0.05 0.00 -0.00 0.00 0.00 59.70 59.74 2d85 h MET 111 Cb 0.06 -0.02 -0.01 0.00 -0.00 0.00 0.00 31.60 31.64 2d85 h MET 111 CO 0.01 0.05 0.83 0.78 -0.00 0.00 0.00 176.91 178.58 2d85 h GLY 112 N 0.07 0.00 -0.35 -3.00 0.00 -0.60 1.20 103.07 100.39 2d85 h GLY 112 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.93 2d85 h GLY 112 CO -0.07 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.75 2d85 n LYS 113 N -2.78 1.01 0.00 4.80 5.02 0.08 -4.48 118.16 121.82 2d85 n LYS 113 Ca 0.03 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2d85 n LYS 113 Cb 0.90 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.74 2d85 n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2d85 n GLY 114 N 0.34 1.86 2.59 0.72 0.00 0.41 -4.94 105.19 106.16 2d85 n GLY 114 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2d85 n GLY 114 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2d85 s MET 115 N 0.05 1.38 0.03 1.61 1.75 -1.26 -4.98 119.30 117.88 2d85 s MET 115 Ca 0.00 -2.39 -0.29 0.00 -1.25 0.00 0.00 55.69 51.76 2d85 s MET 115 Cb 0.00 -2.11 0.10 0.00 2.84 0.00 0.00 34.83 35.66 2d85 s MET 115 CO 0.00 -1.32 1.09 -1.59 -0.65 0.00 0.00 175.02 172.56 2d85 s LYS 116 N -0.26 0.77 0.12 4.11 -2.85 -1.26 0.12 119.74 120.48 2d85 s LYS 116 Ca 0.27 -0.39 0.10 0.00 -1.00 0.00 0.00 55.97 54.95 2d85 s LYS 116 Cb -0.04 0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 35.97 2d85 s LYS 116 CO -0.15 -0.35 -0.25 1.03 0.10 0.00 0.00 175.35 175.74 2d85 s ARG 117 N -2.87 1.31 0.74 1.78 0.52 -1.26 -4.98 118.95 114.20 2d85 s ARG 117 Ca 0.12 -1.28 -0.06 0.00 -0.52 0.00 0.00 55.73 53.99 2d85 s ARG 117 Cb 0.01 -1.72 0.10 0.00 0.52 0.00 0.00 34.95 33.86 2d85 s ARG 117 CO -0.02 0.41 1.03 0.14 0.02 0.00 0.00 175.30 176.88 2d85 s VAL 118 N -1.09 2.23 -0.47 3.52 -7.23 -1.26 -4.98 120.40 111.11 2d85 s VAL 118 Ca 0.11 -0.37 -0.28 0.00 -1.81 0.00 0.00 61.98 59.64 2d85 s VAL 118 Cb -0.10 -2.86 -0.01 0.00 0.56 0.00 0.00 36.38 33.97 2d85 s VAL 118 CO 0.05 0.00 1.69 -0.94 -0.31 0.00 0.00 175.10 175.60 2d85 s SER 119 N -4.64 5.80 0.00 4.85 1.04 -1.26 -4.64 113.70 114.85 2d85 s SER 119 Ca 0.64 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.82 2d85 s SER 119 Cb -0.08 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2d85 s SER 119 CO 0.45 -1.88 0.00 0.61 0.98 0.00 0.00 173.24 173.40 2d85 n GLY 120 N 5.43 0.92 3.77 7.32 0.00 -1.26 -4.98 105.19 116.39 2d85 n GLY 120 Ca 0.19 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 2d85 n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d85 s PRO 121 N 0.00 3.79 0.18 1.61 0.04 -1.26 -5.06 135.00 134.29 2d85 s PRO 121 Ca 0.00 1.78 0.04 0.00 0.04 0.00 0.00 61.00 62.86 2d85 s PRO 121 Cb 0.00 -2.43 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 2d85 s PRO 121 CO 0.00 -0.53 -0.06 0.45 0.04 0.00 0.00 177.00 176.90 2d85 s SER 122 N -1.34 1.77 0.48 6.66 0.15 -1.26 -4.63 113.70 115.52 2d85 s SER 122 Ca 0.63 -1.09 0.06 0.00 0.70 0.00 0.00 55.95 56.25 2d85 s SER 122 Cb -0.29 0.00 -0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2d85 s SER 122 CO 0.35 -0.40 0.30 -0.44 1.20 0.00 0.00 173.24 174.25 2d85 s SER 123 N -3.21 4.62 0.00 5.45 0.01 -1.26 -5.11 113.70 114.19 2d85 s SER 123 Ca 0.21 -1.12 0.00 0.00 1.31 0.00 0.00 55.95 56.35 2d85 s SER 123 Cb 0.04 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.22 2d85 s SER 123 CO 0.03 -0.83 0.00 0.61 0.41 0.00 0.00 173.24 173.47