#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tzy n LYS 15 N 0.00 0.19 -1.00 0.00 3.00 -1.26 -4.75 118.16 114.34 1tzy n LYS 15 Ca 0.00 0.08 -0.30 0.00 -0.00 0.00 0.00 58.31 58.09 1tzy n LYS 15 Cb 0.00 -0.83 0.15 0.00 0.00 0.00 0.00 35.03 34.35 1tzy n LYS 15 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1tzy s SER 16 N -5.89 3.31 0.39 3.14 1.04 -1.26 -4.86 113.70 109.56 1tzy s SER 16 Ca -0.12 1.78 0.11 0.00 0.48 0.00 0.00 55.95 58.21 1tzy s SER 16 Cb 0.04 -2.40 0.78 0.00 0.10 0.00 0.00 66.02 64.54 1tzy s SER 16 CO 0.16 -2.79 1.88 0.03 0.98 0.00 0.00 173.24 173.50 1tzy h ARG 17 N -1.65 0.10 -0.15 4.02 3.08 -1.99 -2.60 114.38 115.19 1tzy h ARG 17 Ca -0.47 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.54 1tzy h ARG 17 Cb 1.27 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.30 1tzy h ARG 17 CO 0.49 0.35 0.07 0.77 -1.07 0.00 0.00 179.97 180.59 1tzy h SER 18 N 0.10 0.19 -0.58 7.04 0.02 -1.85 -2.34 113.55 116.12 1tzy h SER 18 Ca 0.02 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1tzy h SER 18 Cb 0.50 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 1tzy h SER 18 CO 0.04 0.25 0.37 0.28 -1.14 0.00 0.00 176.83 176.63 1tzy h SER 19 N 0.12 0.62 -0.19 3.07 0.02 -1.67 0.79 113.55 116.30 1tzy h SER 19 Ca 0.05 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1tzy h SER 19 Cb 0.11 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1tzy h SER 19 CO -0.01 0.44 0.13 -0.09 -1.14 0.00 0.00 176.83 176.16 1tzy h ARG 20 N 0.74 0.25 -0.00 3.45 2.43 -1.34 -1.60 114.38 118.31 1tzy h ARG 20 Ca 0.22 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1tzy h ARG 20 Cb -0.03 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1tzy h ARG 20 CO -0.08 0.17 -0.44 0.00 -1.51 0.00 0.00 179.97 178.12 1tzy n ALA 21 N -2.51 3.40 -2.01 2.80 0.00 -0.26 -4.95 120.51 116.98 1tzy n ALA 21 Ca -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 53.44 53.09 1tzy n ALA 21 Cb 0.08 -1.16 -0.00 0.00 0.00 0.00 0.00 19.45 18.37 1tzy n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tzy n GLY 22 N 1.49 0.29 3.49 0.00 0.00 0.11 -5.05 105.19 105.53 1tzy n GLY 22 Ca 0.06 -0.81 -0.28 0.00 0.00 0.00 0.00 46.02 45.00 1tzy n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tzy s LEU 23 N -0.61 2.71 -0.09 0.99 1.43 -0.38 -5.00 118.68 117.72 1tzy s LEU 23 Ca 0.00 -0.65 -0.09 0.00 -1.03 0.00 0.00 54.13 52.36 1tzy s LEU 23 Cb 0.00 -1.48 -0.28 0.00 0.03 0.00 0.00 46.19 44.46 1tzy s LEU 23 CO 0.00 0.14 0.51 -0.61 0.23 0.00 0.00 176.35 176.63 1tzy h GLN 24 N 3.35 0.33 -7.05 1.70 5.75 -1.96 -3.36 115.11 113.87 1tzy h GLN 24 Ca -0.48 -0.56 -0.51 0.00 -0.15 0.00 0.00 58.65 56.95 1tzy h GLN 24 Cb 1.19 0.21 0.08 0.00 1.07 0.00 0.00 27.48 30.03 1tzy h GLN 24 CO 0.49 1.27 0.48 -0.06 -2.65 0.00 0.00 178.83 178.35 1tzy s PHE 25 N -2.56 2.66 -0.63 3.99 2.99 -1.26 -4.92 117.98 118.26 1tzy s PHE 25 Ca -0.19 1.52 -0.25 0.00 0.00 0.00 0.00 56.93 58.00 1tzy s PHE 25 Cb 0.06 -3.42 0.05 0.00 0.00 0.00 0.00 43.02 39.71 1tzy s PHE 25 CO 0.81 -1.80 1.06 -1.25 -0.00 0.00 0.00 175.22 174.03 1tzy s PRO 26 N -3.01 3.26 0.17 0.24 0.04 -1.26 -4.76 135.00 129.69 1tzy s PRO 26 Ca 0.70 -0.34 -0.14 0.00 0.04 0.00 0.00 61.00 61.26 1tzy s PRO 26 Cb -0.29 -4.12 0.06 0.00 0.04 0.00 0.00 34.50 30.19 1tzy s PRO 26 CO 0.33 -1.75 1.78 0.28 0.04 0.00 0.00 177.00 177.68 1tzy h VAL 27 N 6.03 1.18 -0.37 -0.36 2.07 -1.90 -0.42 116.25 122.48 1tzy h VAL 27 Ca -0.27 -0.46 -0.04 0.00 0.82 0.00 0.00 66.70 66.76 1tzy h VAL 27 Cb 1.06 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1tzy h VAL 27 CO 1.17 0.19 0.09 1.23 0.02 0.00 0.00 177.57 180.28 1tzy h GLY 28 N 0.73 0.64 0.97 2.17 0.00 -1.94 -0.18 103.07 105.46 1tzy h GLY 28 Ca 0.19 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1tzy h GLY 28 CO -0.03 0.37 0.20 -0.09 0.00 0.00 0.00 176.54 176.99 1tzy h ARG 29 N 0.46 0.50 -0.81 4.80 1.12 -1.95 -2.45 114.38 116.05 1tzy h ARG 29 Ca 0.12 -0.06 0.05 0.00 -1.11 0.00 0.00 59.98 58.98 1tzy h ARG 29 Cb 0.30 -0.10 -0.05 0.00 -0.01 0.00 0.00 29.97 30.12 1tzy h ARG 29 CO 0.00 0.41 0.53 0.28 -3.11 0.00 0.00 179.97 178.08 1tzy h VAL 30 N 0.46 1.09 -0.58 0.20 2.07 -0.55 -0.82 116.25 118.12 1tzy h VAL 30 Ca 0.13 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1tzy h VAL 30 Cb 0.05 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 29.85 1tzy h VAL 30 CO -0.02 0.17 0.34 -0.74 0.02 0.00 0.00 177.57 177.34 1tzy h HIS 31 N 0.95 0.78 -0.26 1.57 -0.00 -0.68 -0.87 115.15 116.64 1tzy h HIS 31 Ca 0.33 -0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.62 1tzy h HIS 31 Cb 0.12 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.27 1tzy h HIS 31 CO -0.00 0.55 -0.11 -0.09 -0.00 0.00 0.00 177.93 178.28 1tzy h ARG 32 N 0.79 0.54 -0.83 5.26 9.65 -0.96 -1.19 114.38 127.64 1tzy h ARG 32 Ca 0.21 -0.23 0.05 0.00 -1.10 0.00 0.00 59.98 58.91 1tzy h ARG 32 Cb 0.01 -0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 28.52 1tzy h ARG 32 CO -0.04 0.78 0.51 -0.07 2.80 0.00 0.00 179.97 183.96 1tzy h LEU 33 N 0.27 0.82 -0.37 3.80 3.38 -0.96 0.11 115.31 122.37 1tzy h LEU 33 Ca 0.06 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1tzy h LEU 33 Cb 0.61 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1tzy h LEU 33 CO 0.04 0.54 0.21 -0.07 0.09 0.00 0.00 178.44 179.25 1tzy h LEU 34 N 0.96 0.45 -0.93 1.67 3.38 -0.92 -2.37 115.31 117.54 1tzy h LEU 34 Ca 0.35 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 58.17 1tzy h LEU 34 Cb 0.12 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1tzy h LEU 34 CO -0.16 0.38 -0.13 0.03 0.09 0.00 0.00 178.44 178.66 1tzy h ARG 35 N 0.48 0.64 -0.00 1.13 3.08 -0.83 -3.10 114.38 115.78 1tzy h ARG 35 Ca 0.13 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1tzy h ARG 35 Cb 0.02 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1tzy h ARG 35 CO -0.02 0.75 -0.19 0.36 -1.07 0.00 0.00 179.97 179.79 1tzy n LYS 36 N -4.17 0.45 -0.02 0.04 2.85 0.34 -4.18 118.16 113.46 1tzy n LYS 36 Ca 0.01 -0.18 0.12 0.00 -1.05 0.00 0.00 58.31 57.21 1tzy n LYS 36 Cb 0.35 -1.50 0.58 0.00 -0.65 0.00 0.00 35.03 33.82 1tzy n LYS 36 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1tzy n GLY 37 N 1.37 -0.36 2.63 2.58 0.00 -0.90 -4.94 105.19 105.57 1tzy n GLY 37 Ca 0.11 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1tzy n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1tzy n ASN 38 N -0.25 -2.95 -0.07 1.61 5.03 -1.26 -4.95 115.26 112.43 1tzy n ASN 38 Ca 0.18 -0.37 -0.10 0.00 0.87 0.00 0.00 54.58 55.16 1tzy n ASN 38 Cb 0.23 -3.40 -0.06 0.00 -1.02 0.00 0.00 39.78 35.52 1tzy n ASN 38 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1tzy n TYR 39 N -3.35 0.00 -3.93 3.10 4.02 -1.26 -5.07 117.16 110.68 1tzy n TYR 39 Ca -0.12 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.69 1tzy n TYR 39 Cb 0.58 -0.52 -0.03 0.00 -0.02 0.00 0.00 39.34 39.35 1tzy n TYR 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1tzy s ALA 40 N -2.27 -0.68 0.19 -0.72 0.00 -1.26 -5.04 121.76 111.97 1tzy s ALA 40 Ca -0.19 -0.64 -0.13 0.00 0.00 0.00 0.00 51.96 51.01 1tzy s ALA 40 Cb 0.05 0.94 0.12 0.00 0.00 0.00 0.00 23.12 24.24 1tzy s ALA 40 CO 0.31 -0.95 1.83 1.49 0.00 0.00 0.00 175.76 178.44 1tzy h GLU 41 N 2.11 0.68 -5.31 0.00 4.81 -1.98 -3.44 114.58 111.46 1tzy h GLU 41 Ca -0.23 -0.04 -0.39 0.00 -0.13 0.00 0.00 59.36 58.57 1tzy h GLU 41 Cb 1.25 -0.15 -0.17 0.00 0.63 0.00 0.00 28.75 30.30 1tzy h GLU 41 CO 0.30 0.45 -0.75 0.50 -0.73 0.00 0.00 179.01 178.79 1tzy s ARG 42 N -6.14 1.02 -0.14 1.92 3.52 -1.26 -5.11 118.95 112.76 1tzy s ARG 42 Ca -0.13 -1.28 -0.01 0.00 -0.13 0.00 0.00 55.73 54.19 1tzy s ARG 42 Cb 0.14 -0.82 0.04 0.00 -1.56 0.00 0.00 34.95 32.74 1tzy s ARG 42 CO 0.75 0.15 -0.05 0.08 -0.81 0.00 0.00 175.30 175.41 1tzy s VAL 43 N -2.41 0.99 0.80 7.11 1.01 -1.26 -5.08 120.40 121.56 1tzy s VAL 43 Ca 0.10 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.51 1tzy s VAL 43 Cb -0.03 -1.13 0.07 0.00 0.00 0.00 0.00 36.38 35.29 1tzy s VAL 43 CO 0.02 0.20 1.09 -0.83 0.00 0.00 0.00 175.10 175.58 1tzy s GLY 44 N 1.70 1.63 0.37 4.51 0.00 -1.26 -4.94 107.32 109.33 1tzy s GLY 44 Ca 0.02 -0.10 0.16 0.00 0.00 0.00 0.00 44.72 44.81 1tzy s GLY 44 CO -0.08 0.32 1.78 0.00 0.00 0.00 0.00 173.10 175.13 1tzy h ALA 45 N -1.13 1.17 -0.00 3.20 0.00 -2.04 -2.87 119.26 117.59 1tzy h ALA 45 Ca -0.47 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 53.92 1tzy h ALA 45 Cb 1.26 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1tzy h ALA 45 CO 0.57 0.49 -0.77 0.78 0.00 0.00 0.00 179.25 180.32 1tzy h GLY 46 N 1.53 0.00 0.30 0.00 0.00 -2.01 -3.37 103.07 99.52 1tzy h GLY 46 Ca -0.00 -0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.35 1tzy h GLY 46 CO 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 176.54 176.25 1tzy h ALA 47 N 1.23 -0.55 0.00 3.60 0.00 -1.89 -0.93 119.26 120.72 1tzy h ALA 47 Ca -0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1tzy h ALA 47 Cb 1.36 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 19.75 1tzy h ALA 47 CO 0.10 -0.88 -0.17 -1.00 0.00 0.00 0.00 179.25 177.30 1tzy h PRO 48 N -0.53 0.00 -0.03 0.00 0.13 -1.74 0.72 132.00 130.55 1tzy h PRO 48 Ca 0.05 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 1tzy h PRO 48 Cb 0.59 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.72 1tzy h PRO 48 CO -0.26 0.17 -0.02 0.28 -0.23 0.00 0.00 178.00 177.94 1tzy h VAL 49 N 0.00 1.34 -0.20 1.56 2.07 -1.61 0.44 116.25 119.86 1tzy h VAL 49 Ca -0.00 -1.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.45 1tzy h VAL 49 Cb 0.37 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1tzy h VAL 49 CO 0.02 0.28 0.06 0.22 0.02 0.00 0.00 177.57 178.18 1tzy h TYR 50 N -0.34 0.33 -0.32 1.57 3.20 -0.65 -1.96 116.97 118.79 1tzy h TYR 50 Ca 0.01 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1tzy h TYR 50 Cb 0.47 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1tzy h TYR 50 CO 0.08 0.41 0.14 1.25 -1.64 0.00 0.00 178.16 178.40 1tzy h LEU 51 N 0.15 0.43 -0.99 2.82 5.85 -0.88 -1.91 115.31 120.78 1tzy h LEU 51 Ca 0.07 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.72 1tzy h LEU 51 Cb 0.24 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.09 1tzy h LEU 51 CO -0.00 0.45 0.64 0.00 -0.34 0.00 0.00 178.44 179.19 1tzy h ALA 52 N 1.00 1.39 -0.25 1.25 0.00 -0.83 -1.28 119.26 120.53 1tzy h ALA 52 Ca 0.11 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1tzy h ALA 52 Cb 0.14 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1tzy h ALA 52 CO -0.01 0.41 -0.31 0.00 0.00 0.00 0.00 179.25 179.34 1tzy h ALA 53 N 1.46 0.99 -0.20 0.00 0.00 -0.93 -0.64 119.26 119.94 1tzy h ALA 53 Ca 0.44 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1tzy h ALA 53 Cb 0.20 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1tzy h ALA 53 CO -0.18 0.60 -0.32 0.28 0.00 0.00 0.00 179.25 179.63 1tzy h VAL 54 N 0.45 1.33 -0.57 0.00 2.07 -0.69 -1.25 116.25 117.59 1tzy h VAL 54 Ca 0.06 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.04 1tzy h VAL 54 Cb 0.77 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 1tzy h VAL 54 CO 0.06 0.47 0.35 -0.07 0.02 0.00 0.00 177.57 178.41 1tzy h LEU 55 N 0.23 0.68 -0.67 2.57 3.38 -1.00 -1.07 115.31 119.45 1tzy h LEU 55 Ca 0.02 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1tzy h LEU 55 Cb 0.90 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1tzy h LEU 55 CO 0.07 0.53 0.30 -0.08 0.09 0.00 0.00 178.44 179.35 1tzy h GLU 56 N 0.77 0.98 -0.30 1.13 4.81 -1.05 -0.67 114.58 120.25 1tzy h GLU 56 Ca 0.21 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 59.14 1tzy h GLU 56 Cb -0.03 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.18 1tzy h GLU 56 CO -0.04 0.79 -0.34 -0.92 -0.73 0.00 0.00 179.01 177.78 1tzy h TYR 57 N 0.93 0.92 -0.18 0.92 3.20 -0.82 -0.96 116.97 120.97 1tzy h TYR 57 Ca 0.23 -0.29 -0.12 0.00 3.14 0.00 0.00 58.73 61.69 1tzy h TYR 57 Cb 0.16 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 1tzy h TYR 57 CO 0.01 1.06 -0.40 -0.07 -1.64 0.00 0.00 178.16 177.11 1tzy h LEU 58 N 0.52 0.44 -0.52 2.82 3.38 -1.12 0.35 115.31 121.19 1tzy h LEU 58 Ca 0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1tzy h LEU 58 Cb 0.92 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1tzy h LEU 58 CO 0.08 0.80 0.23 0.74 0.09 0.00 0.00 178.44 180.38 1tzy h THR 59 N 0.35 1.20 -0.78 0.22 2.02 -0.99 -2.10 112.91 112.84 1tzy h THR 59 Ca 0.03 -0.61 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 1tzy h THR 59 Cb 0.86 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 67.88 1tzy h THR 59 CO 0.07 0.24 0.44 0.00 0.37 0.00 0.00 175.52 176.64 1tzy h ALA 60 N 1.07 1.00 0.00 6.16 0.00 -0.46 -1.29 119.26 125.74 1tzy h ALA 60 Ca 0.17 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1tzy h ALA 60 Cb 0.16 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1tzy h ALA 60 CO -0.02 0.49 -0.15 0.93 0.00 0.00 0.00 179.25 180.50 1tzy h GLU 61 N 1.08 -0.25 -0.60 0.00 4.39 -0.70 -0.32 114.58 118.18 1tzy h GLU 61 Ca 0.28 0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.90 1tzy h GLU 61 Cb 0.01 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1tzy h GLU 61 CO -0.05 -0.16 -0.01 0.97 -1.16 0.00 0.00 179.01 178.60 1tzy h ILE 62 N -0.26 1.26 -0.70 3.13 2.10 -1.20 -2.08 117.51 119.77 1tzy h ILE 62 Ca 0.05 -1.16 -0.05 0.00 1.08 0.00 0.00 64.86 64.78 1tzy h ILE 62 Cb 0.32 0.81 -0.03 0.00 -1.09 0.00 0.00 36.82 36.83 1tzy h ILE 62 CO -0.15 0.42 0.23 -0.07 -1.08 0.00 0.00 178.15 177.51 1tzy h LEU 63 N 0.96 1.01 -0.13 2.19 3.38 -1.07 0.18 115.31 121.84 1tzy h LEU 63 Ca 0.17 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1tzy h LEU 63 Cb 0.56 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1tzy h LEU 63 CO 0.03 0.94 -0.10 -0.08 0.09 0.00 0.00 178.44 179.32 1tzy h GLU 64 N 1.02 -0.11 -0.11 1.13 4.57 -0.92 0.65 114.58 120.81 1tzy h GLU 64 Ca 0.23 0.01 -0.17 0.00 -1.18 0.00 0.00 59.36 58.25 1tzy h GLU 64 Cb 0.28 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 1tzy h GLU 64 CO -0.01 -0.07 -0.64 -0.07 -1.18 0.00 0.00 179.01 177.04 1tzy h LEU 65 N -0.11 0.46 -0.19 1.64 3.38 -1.20 -1.30 115.31 118.00 1tzy h LEU 65 Ca 0.08 -0.27 -0.21 0.00 0.09 0.00 0.00 57.88 57.57 1tzy h LEU 65 Cb 0.23 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 40.85 1tzy h LEU 65 CO -0.19 0.98 -0.70 0.00 0.09 0.00 0.00 178.44 178.62 1tzy h ALA 66 N 1.02 0.34 -0.88 1.53 0.00 -0.54 -1.50 119.26 119.24 1tzy h ALA 66 Ca -0.01 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 1tzy h ALA 66 Cb 1.18 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1tzy h ALA 66 CO 0.11 0.66 0.55 0.78 0.00 0.00 0.00 179.25 181.35 1tzy h GLY 67 N 0.55 1.26 0.66 0.00 0.00 -0.78 0.17 103.07 104.93 1tzy h GLY 67 Ca -0.03 -0.51 0.04 0.00 0.00 0.00 0.00 47.33 46.83 1tzy h GLY 67 CO 0.15 0.49 0.09 3.43 0.00 0.00 0.00 176.54 180.70 1tzy h ASN 68 N 1.20 0.07 -0.68 0.19 -0.26 -1.15 -1.12 115.58 113.84 1tzy h ASN 68 Ca 0.32 0.04 -0.07 0.00 -0.56 0.00 0.00 56.30 56.03 1tzy h ASN 68 Cb -0.08 0.05 -0.03 0.00 -1.06 0.00 0.00 38.32 37.20 1tzy h ASN 68 CO -0.06 0.08 0.14 0.00 -1.06 0.00 0.00 177.43 176.53 1tzy h ALA 69 N 1.23 0.95 0.30 -0.83 0.00 -0.55 -1.01 119.26 119.36 1tzy h ALA 69 Ca 0.15 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1tzy h ALA 69 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1tzy h ALA 69 CO -0.18 0.66 -0.25 0.00 0.00 0.00 0.00 179.25 179.48 1tzy h ALA 70 N 1.10 -0.56 -0.66 0.00 0.00 -0.43 -3.05 119.26 115.67 1tzy h ALA 70 Ca 0.21 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.14 1tzy h ALA 70 Cb 0.40 0.35 -0.08 0.00 0.00 0.00 0.00 17.79 18.46 1tzy h ALA 70 CO 0.01 -0.84 0.26 0.00 0.00 0.00 0.00 179.25 178.67 1tzy h ARG 71 N -0.57 0.42 -0.25 0.00 3.08 -1.03 -1.16 114.38 114.86 1tzy h ARG 71 Ca -0.02 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.08 1tzy h ARG 71 Cb 0.50 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1tzy h ARG 71 CO -0.02 0.28 0.31 -0.44 -1.07 0.00 0.00 179.97 179.02 1tzy h ASP 72 N 0.43 0.00 -0.43 7.04 3.45 -1.08 -0.09 116.42 125.74 1tzy h ASP 72 Ca 0.34 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.80 1tzy h ASP 72 Cb 0.45 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.22 1tzy h ASP 72 CO -0.33 0.00 0.00 0.59 -1.57 0.00 0.00 179.24 177.93 1tzy n ASN 73 N -3.66 3.97 -2.62 6.45 3.02 -0.62 -4.98 115.26 116.82 1tzy n ASN 73 Ca 0.03 -2.52 -0.21 0.00 -0.03 0.00 0.00 54.58 51.86 1tzy n ASN 73 Cb 0.44 -0.47 0.02 0.00 -0.61 0.00 0.00 39.78 39.16 1tzy n ASN 73 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1tzy n LYS 74 N 0.39 -3.43 -4.11 3.52 4.81 -0.05 -5.02 118.16 114.28 1tzy n LYS 74 Ca 0.20 0.91 -0.27 0.00 -0.87 0.00 0.00 58.31 58.28 1tzy n LYS 74 Cb 0.77 -5.61 -0.06 0.00 0.02 0.00 0.00 35.03 30.14 1tzy n LYS 74 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1tzy s LYS 75 N -5.38 2.77 0.00 1.64 -0.14 -0.54 -4.99 119.74 113.11 1tzy s LYS 75 Ca 0.17 -0.90 0.02 0.00 -1.36 0.00 0.00 55.97 53.90 1tzy s LYS 75 Cb -0.08 -2.58 0.04 0.00 -1.68 0.00 0.00 37.83 33.53 1tzy s LYS 75 CO 0.21 0.49 0.86 0.25 -0.76 0.00 0.00 175.35 176.39 1tzy n THR 76 N -0.19 0.59 -4.03 2.17 -2.24 -1.26 -3.46 114.28 105.87 1tzy n THR 76 Ca -0.09 -0.80 -0.25 0.00 -2.27 0.00 0.00 64.05 60.64 1tzy n THR 76 Cb 0.54 0.72 -0.17 0.00 -2.10 0.00 0.00 70.33 69.33 1tzy n THR 76 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1tzy s ARG 77 N -0.67 1.37 0.04 -0.78 3.52 -1.26 -5.09 118.95 116.08 1tzy s ARG 77 Ca 0.04 -0.22 -0.30 0.00 -0.13 0.00 0.00 55.73 55.11 1tzy s ARG 77 Cb 0.02 -1.41 -0.06 0.00 -1.56 0.00 0.00 34.95 31.94 1tzy s ARG 77 CO 0.03 -0.21 1.32 0.42 -0.81 0.00 0.00 175.30 176.05 1tzy s ILE 78 N 1.50 3.76 0.42 4.11 1.01 -1.26 -4.95 121.20 125.78 1tzy s ILE 78 Ca 0.00 1.21 0.07 0.00 0.00 0.00 0.00 60.65 61.93 1tzy s ILE 78 Cb -0.13 -3.77 -0.06 0.00 0.01 0.00 0.00 42.46 38.50 1tzy s ILE 78 CO -0.05 0.05 0.11 0.27 0.00 0.00 0.00 174.94 175.31 1tzy s ILE 79 N 1.69 2.10 0.37 2.92 -4.36 -1.26 -5.03 121.20 117.63 1tzy s ILE 79 Ca 0.62 -1.83 0.13 0.00 -0.26 0.00 0.00 60.65 59.30 1tzy s ILE 79 Cb -0.31 -2.93 0.35 0.00 1.25 0.00 0.00 42.46 40.81 1tzy s ILE 79 CO 0.28 0.00 1.82 -0.65 0.24 0.00 0.00 174.94 176.62 1tzy h PRO 80 N 1.55 0.53 -0.78 0.37 0.11 -1.89 -0.71 132.00 131.18 1tzy h PRO 80 Ca -0.43 -0.03 0.19 0.00 0.11 0.00 0.00 66.00 65.83 1tzy h PRO 80 Cb 1.25 -0.12 -0.13 0.00 0.11 0.00 0.00 31.00 32.11 1tzy h PRO 80 CO 0.75 0.35 0.11 -0.09 -0.21 0.00 0.00 178.00 178.91 1tzy h ARG 81 N 0.55 0.17 0.00 1.05 9.65 -1.79 -0.37 114.38 123.64 1tzy h ARG 81 Ca 0.53 -0.01 -0.16 0.00 -1.10 0.00 0.00 59.98 59.24 1tzy h ARG 81 Cb 1.10 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.62 1tzy h ARG 81 CO -0.27 0.11 -0.74 0.45 2.80 0.00 0.00 179.97 182.33 1tzy h HIS 82 N 0.18 0.00 -0.34 2.20 3.86 -1.47 -0.48 115.15 119.09 1tzy h HIS 82 Ca 0.45 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.56 1tzy h HIS 82 Cb 0.82 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.29 1tzy h HIS 82 CO -0.34 0.74 -0.17 -0.07 0.86 0.00 0.00 177.93 178.95 1tzy h LEU 83 N 0.00 0.74 -0.32 2.43 3.38 -1.14 -1.55 115.31 118.86 1tzy h LEU 83 Ca -0.01 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 1tzy h LEU 83 Cb 1.32 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 1tzy h LEU 83 CO 0.10 0.99 0.18 -0.61 0.09 0.00 0.00 178.44 179.19 1tzy h GLN 84 N 0.50 0.44 -0.67 1.13 5.75 -0.78 -1.61 115.11 119.87 1tzy h GLN 84 Ca 0.08 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1tzy h GLN 84 Cb 0.71 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.13 1tzy h GLN 84 CO 0.05 0.35 0.43 -0.07 -2.65 0.00 0.00 178.83 176.94 1tzy h LEU 85 N 0.40 0.73 -0.36 -2.39 3.38 -1.07 -1.16 115.31 114.84 1tzy h LEU 85 Ca 0.11 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1tzy h LEU 85 Cb 0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1tzy h LEU 85 CO -0.02 0.52 0.18 0.00 0.09 0.00 0.00 178.44 179.22 1tzy h ALA 86 N 1.26 0.47 -0.30 1.53 0.00 -1.04 -1.29 119.26 119.90 1tzy h ALA 86 Ca 0.25 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1tzy h ALA 86 Cb -0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1tzy h ALA 86 CO -0.07 0.02 -0.11 0.82 0.00 0.00 0.00 179.25 179.90 1tzy h ILE 87 N 0.45 1.29 0.00 0.00 2.04 -1.15 -2.85 117.51 117.29 1tzy h ILE 87 Ca 0.13 -1.19 -0.13 0.00 1.00 0.00 0.00 64.86 64.67 1tzy h ILE 87 Cb 0.10 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1tzy h ILE 87 CO -0.02 0.38 -0.60 0.03 0.00 0.00 0.00 178.15 177.94 1tzy h ARG 88 N 0.36 0.00 -0.01 2.37 -0.00 -1.17 -2.54 114.38 113.39 1tzy h ARG 88 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.55 1tzy h ARG 88 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.59 1tzy h ARG 88 CO 0.04 0.60 -0.13 0.09 0.00 0.00 0.00 179.97 180.56 1tzy n ASN 89 N -3.29 0.77 -4.43 7.04 5.03 -0.49 -4.74 115.26 115.15 1tzy n ASN 89 Ca 0.01 -0.83 -0.36 0.00 0.87 0.00 0.00 54.58 54.28 1tzy n ASN 89 Cb 0.75 0.01 -0.13 0.00 -1.02 0.00 0.00 39.78 39.39 1tzy n ASN 89 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1tzy s ASP 90 N -2.39 4.87 0.23 6.41 3.68 -0.98 -5.01 116.67 123.48 1tzy s ASP 90 Ca 0.30 -0.23 -0.08 0.00 2.13 0.00 0.00 52.55 54.67 1tzy s ASP 90 Cb 0.20 -1.85 0.24 0.00 -1.45 0.00 0.00 42.92 40.06 1tzy s ASP 90 CO 0.46 0.01 1.87 -0.08 0.13 0.00 0.00 175.17 177.56 1tzy h GLU 91 N 7.90 0.97 -0.05 4.34 4.81 -1.85 -0.74 114.58 129.95 1tzy h GLU 91 Ca -0.38 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 58.77 1tzy h GLU 91 Cb 1.17 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.33 1tzy h GLU 91 CO 0.60 0.64 -0.07 0.93 -0.73 0.00 0.00 179.01 180.38 1tzy h GLU 92 N 1.00 0.13 -0.28 1.92 4.39 -1.95 -2.17 114.58 117.63 1tzy h GLU 92 Ca 0.32 -0.08 -0.07 0.00 0.34 0.00 0.00 59.36 59.88 1tzy h GLU 92 Cb 0.02 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1tzy h GLU 92 CO -0.12 0.63 -0.13 -0.07 -1.16 0.00 0.00 179.01 178.16 1tzy h LEU 93 N -0.36 0.45 -0.93 1.33 3.38 -1.76 -1.64 115.31 115.79 1tzy h LEU 93 Ca 0.00 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1tzy h LEU 93 Cb 0.62 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1tzy h LEU 93 CO 0.02 0.61 0.30 -1.13 0.09 0.00 0.00 178.44 178.33 1tzy h ASN 94 N 0.43 0.99 -0.10 -0.43 -0.00 -0.88 -0.76 115.58 114.83 1tzy h ASN 94 Ca 0.08 -0.14 -0.04 0.00 -0.00 0.00 0.00 56.30 56.21 1tzy h ASN 94 Cb 0.49 -0.26 -0.00 0.00 -0.00 0.00 0.00 38.32 38.55 1tzy h ASN 94 CO 0.03 0.87 -0.07 0.11 -0.00 0.00 0.00 177.43 178.37 1tzy h LYS 95 N 1.06 0.23 -0.47 6.67 1.57 -1.09 -2.46 116.57 122.07 1tzy h LYS 95 Ca 0.25 -0.11 0.06 0.00 -1.87 0.00 0.00 60.65 58.98 1tzy h LYS 95 Cb 0.19 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.44 1tzy h LYS 95 CO -0.02 0.62 0.18 1.25 -0.57 0.00 0.00 179.45 180.90 1tzy h LEU 96 N -0.16 0.19 -3.94 2.94 5.85 -1.03 -3.09 115.31 116.07 1tzy h LEU 96 Ca 0.02 0.05 -0.63 0.00 0.84 0.00 0.00 57.88 58.17 1tzy h LEU 96 Cb 0.56 0.03 -0.31 0.00 0.37 0.00 0.00 40.66 41.32 1tzy h LEU 96 CO 0.02 0.14 0.55 0.18 -0.34 0.00 0.00 178.44 178.99 1tzy n LEU 97 N -5.00 7.04 0.23 2.25 4.77 -0.32 -4.74 117.00 121.24 1tzy n LEU 97 Ca 0.04 -4.28 0.10 0.00 -0.03 0.00 0.00 56.01 51.84 1tzy n LEU 97 Cb 0.18 -0.85 0.53 0.00 -2.33 0.00 0.00 43.42 40.95 1tzy n LEU 97 CO 0.25 1.53 0.84 1.23 -1.33 0.00 0.00 177.39 179.91 1tzy h GLY 98 N 1.90 0.00 -2.37 -0.72 0.00 -1.36 -2.69 103.07 97.83 1tzy h GLY 98 Ca 0.56 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.87 1tzy h GLY 98 CO 1.37 0.00 0.02 0.28 0.00 0.00 0.00 176.54 178.21 1tzy n LYS 99 N -3.58 3.55 -3.88 4.80 4.76 -1.26 -4.99 118.16 117.56 1tzy n LYS 99 Ca -0.01 -2.98 -0.36 0.00 -2.87 0.00 0.00 58.31 52.09 1tzy n LYS 99 Cb 0.37 -2.01 -0.07 0.00 -1.84 0.00 0.00 35.03 31.48 1tzy n LYS 99 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1tzy s VAL 100 N -2.85 5.38 -0.19 -0.18 1.01 -1.02 -5.09 120.40 117.46 1tzy s VAL 100 Ca 0.47 0.17 -0.06 0.00 0.00 0.00 0.00 61.98 62.56 1tzy s VAL 100 Cb 0.38 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 1tzy s VAL 100 CO 0.11 0.57 0.02 -0.89 0.00 0.00 0.00 175.10 174.91 1tzy s THR 101 N -0.63 4.20 -0.36 3.92 2.01 -1.26 -5.08 115.64 118.44 1tzy s THR 101 Ca 0.13 -0.23 -0.16 0.00 0.31 0.00 0.00 61.69 61.74 1tzy s THR 101 Cb -0.12 -2.90 -0.01 0.00 0.01 0.00 0.00 72.50 69.49 1tzy s THR 101 CO 0.02 0.44 0.38 -0.63 -0.69 0.00 0.00 174.62 174.14 1tzy s ILE 102 N 0.80 5.15 0.19 1.82 -1.09 -1.26 -5.04 121.20 121.77 1tzy s ILE 102 Ca 0.01 -0.01 -0.33 0.00 -2.23 0.00 0.00 60.65 58.09 1tzy s ILE 102 Cb -0.14 -3.87 -0.13 0.00 -1.58 0.00 0.00 42.46 36.74 1tzy s ILE 102 CO 0.02 -0.16 1.60 0.00 -1.23 0.00 0.00 174.94 175.17 1tzy n ALA 103 N 5.43 1.79 -2.33 9.38 0.00 -1.26 -1.71 120.51 131.81 1tzy n ALA 103 Ca -0.09 0.43 -0.17 0.00 0.00 0.00 0.00 53.44 53.61 1tzy n ALA 103 Cb 0.49 -2.39 -0.01 0.00 0.00 0.00 0.00 19.45 17.54 1tzy n ALA 103 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1tzy n GLN 104 N 3.30 -1.40 0.02 0.00 1.13 -1.26 -4.85 117.38 114.32 1tzy n GLN 104 Ca 0.16 0.82 0.09 0.00 -1.94 0.00 0.00 57.00 56.13 1tzy n GLN 104 Cb 0.31 -5.27 -0.12 0.00 0.11 0.00 0.00 30.24 25.27 1tzy n GLN 104 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1tzy n GLY 105 N -1.02 -1.14 7.00 1.08 0.00 -0.69 -3.28 105.19 107.14 1tzy n GLY 105 Ca -0.20 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1tzy n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tzy n GLY 106 N 1.27 0.51 3.50 -0.02 0.00 -1.26 -4.53 105.19 104.66 1tzy n GLY 106 Ca -0.05 -0.88 -0.23 0.00 0.00 0.00 0.00 46.02 44.85 1tzy n GLY 106 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1tzy s VAL 107 N 0.00 1.38 0.20 1.61 -7.23 -1.26 -5.02 120.40 110.08 1tzy s VAL 107 Ca 0.00 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.87 1tzy s VAL 107 Cb 0.00 -2.83 -0.08 0.00 0.56 0.00 0.00 36.38 34.03 1tzy s VAL 107 CO 0.00 0.00 1.13 -0.76 -0.31 0.00 0.00 175.10 175.16 1tzy s LEU 108 N -3.55 4.49 -0.02 1.32 1.43 -1.26 -4.96 118.68 116.13 1tzy s LEU 108 Ca 0.35 2.17 -0.31 0.00 -1.03 0.00 0.00 54.13 55.31 1tzy s LEU 108 Cb 0.09 -3.61 -0.09 0.00 0.03 0.00 0.00 46.19 42.60 1tzy s LEU 108 CO 0.16 -0.25 1.98 -2.65 0.23 0.00 0.00 176.35 175.83 1tzy n PRO 109 N 2.14 2.60 -3.32 1.29 -0.02 -1.26 -4.93 135.00 131.50 1tzy n PRO 109 Ca 0.02 0.93 0.03 0.00 -2.02 0.00 0.00 63.50 62.46 1tzy n PRO 109 Cb 0.45 -2.94 -0.03 0.00 -0.02 0.00 0.00 33.50 30.96 1tzy n PRO 109 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1tzy s ASN 110 N 4.79 -0.67 -0.08 2.55 2.47 -1.26 -5.16 114.94 117.58 1tzy s ASN 110 Ca 0.91 0.72 0.02 0.00 0.42 0.00 0.00 52.86 54.94 1tzy s ASN 110 Cb -0.49 1.69 -0.02 0.00 -1.45 0.00 0.00 41.25 40.97 1tzy s ASN 110 CO 0.44 -0.13 -0.15 -0.63 -3.72 0.00 0.00 177.10 172.92 1tzy s ILE 111 N 2.65 2.99 0.23 -5.21 1.01 -1.26 -5.10 121.20 116.51 1tzy s ILE 111 Ca 0.00 -0.72 -0.31 0.00 0.00 0.00 0.00 60.65 59.63 1tzy s ILE 111 Cb -0.08 -2.20 -0.10 0.00 0.01 0.00 0.00 42.46 40.08 1tzy s ILE 111 CO -0.16 0.56 1.52 -1.10 0.00 0.00 0.00 174.94 175.76 1tzy s GLN 112 N -0.27 4.22 0.34 2.79 -1.52 -1.26 -4.89 119.66 119.07 1tzy s GLN 112 Ca 0.02 2.39 0.07 0.00 -1.95 0.00 0.00 55.36 55.88 1tzy s GLN 112 Cb -0.13 -3.11 0.76 0.00 -0.22 0.00 0.00 33.01 30.32 1tzy s GLN 112 CO 0.03 -0.53 1.87 0.00 -0.25 0.00 0.00 175.29 176.40 1tzy h ALA 113 N 5.65 1.77 0.00 6.09 0.00 -1.98 -0.32 119.26 130.46 1tzy h ALA 113 Ca -0.45 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1tzy h ALA 113 Cb 1.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1tzy h ALA 113 CO 0.83 0.00 0.00 1.55 0.00 0.00 0.00 179.25 181.63 1tzy n VAL 114 N -4.56 0.99 0.82 0.00 3.14 -1.26 -1.80 118.33 115.65 1tzy n VAL 114 Ca 0.17 0.44 0.11 0.00 -2.96 0.00 0.00 64.34 62.11 1tzy n VAL 114 Cb 0.43 -1.40 0.10 0.00 -1.06 0.00 0.00 33.84 31.91 1tzy n VAL 114 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1tzy n LEU 115 N -2.16 0.64 -4.82 6.55 4.77 -0.13 -4.92 117.00 116.94 1tzy n LEU 115 Ca 0.01 -0.08 -0.34 0.00 -0.03 0.00 0.00 56.01 55.56 1tzy n LEU 115 Cb 0.14 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 1tzy n LEU 115 CO 0.14 0.11 0.55 -0.76 -1.33 0.00 0.00 177.39 176.10 1tzy s LEU 116 N -3.40 4.15 0.00 2.23 1.43 -0.75 -5.06 118.68 117.28 1tzy s LEU 116 Ca 0.08 1.57 0.07 0.00 -1.03 0.00 0.00 54.13 54.81 1tzy s LEU 116 Cb 0.16 -4.10 0.39 0.00 0.03 0.00 0.00 46.19 42.67 1tzy s LEU 116 CO 0.77 -0.17 0.86 -2.65 0.23 0.00 0.00 176.35 175.38