#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cys n VAL 2 N 0.00 -7.62 -2.36 3.17 0.31 -1.26 -4.83 118.33 105.74 3cys n VAL 2 Ca 0.00 -0.69 -0.42 0.00 -0.01 0.00 0.00 64.34 63.22 3cys n VAL 2 Cb 0.00 -5.45 -0.03 0.00 -0.91 0.00 0.00 33.84 27.45 3cys n VAL 2 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3cys s ASN 3 N -3.23 6.97 0.46 4.52 -0.87 -1.26 -4.95 114.94 116.58 3cys s ASN 3 Ca 0.26 1.94 -0.21 0.00 -1.57 0.00 0.00 52.86 53.27 3cys s ASN 3 Cb -0.07 -2.56 -0.09 0.00 -0.02 0.00 0.00 41.25 38.52 3cys s ASN 3 CO 0.80 -0.63 1.04 -2.16 -2.57 0.00 0.00 177.10 173.58 3cys s PRO 4 N 2.24 3.90 -0.07 -0.60 0.04 -1.26 -4.87 135.00 134.38 3cys s PRO 4 Ca 0.59 1.40 0.02 0.00 0.04 0.00 0.00 61.00 63.06 3cys s PRO 4 Cb -0.28 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.07 3cys s PRO 4 CO 0.24 -0.36 -0.14 0.99 0.04 0.00 0.00 177.00 177.78 3cys s THR 5 N -1.90 1.26 0.18 1.26 2.01 -1.26 -0.81 115.64 116.39 3cys s THR 5 Ca 0.65 -0.55 0.04 0.00 0.31 0.00 0.00 61.69 62.14 3cys s THR 5 Cb -0.18 -1.15 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 3cys s THR 5 CO 0.22 0.38 0.22 0.68 -0.69 0.00 0.00 174.62 175.43 3cys s VAL 6 N 0.66 4.85 0.10 3.82 -7.23 -0.07 0.50 120.40 123.03 3cys s VAL 6 Ca -0.14 -0.99 0.08 0.00 -1.81 0.00 0.00 61.98 59.12 3cys s VAL 6 Cb -0.16 -3.52 -0.04 0.00 0.56 0.00 0.00 36.38 33.22 3cys s VAL 6 CO 0.04 -0.16 -0.18 0.12 -0.31 0.00 0.00 175.10 174.61 3cys s PHE 7 N -1.83 2.55 0.03 2.82 5.36 0.36 -1.50 117.98 125.76 3cys s PHE 7 Ca 0.33 -0.26 -0.23 0.00 -0.96 0.00 0.00 56.93 55.81 3cys s PHE 7 Cb -0.10 -1.37 0.05 0.00 -0.34 0.00 0.00 43.02 41.26 3cys s PHE 7 CO 0.26 0.36 0.53 -0.06 -1.46 0.00 0.00 175.22 174.85 3cys s PHE 8 N -1.10 -0.44 -0.01 10.12 0.08 0.19 -3.03 117.98 123.79 3cys s PHE 8 Ca 0.17 0.56 0.00 0.00 0.12 0.00 0.00 56.93 57.79 3cys s PHE 8 Cb -0.11 0.34 0.01 0.00 -0.57 0.00 0.00 43.02 42.69 3cys s PHE 8 CO 0.09 -0.62 -0.00 0.34 -0.10 0.00 0.00 175.22 174.93 3cys s ASP 9 N -1.80 0.19 -0.05 1.36 -1.08 -1.08 0.02 116.67 114.24 3cys s ASP 9 Ca -0.07 -0.01 -0.02 0.00 -0.52 0.00 0.00 52.55 51.93 3cys s ASP 9 Cb -0.01 -0.07 -0.04 0.00 -1.46 0.00 0.00 42.92 41.34 3cys s ASP 9 CO 0.01 -0.04 0.08 -0.63 0.52 0.00 0.00 175.17 175.11 3cys s ILE 10 N 0.46 4.86 -0.10 4.11 1.09 -1.23 -0.69 121.20 129.70 3cys s ILE 10 Ca -0.04 -0.23 0.00 0.00 -1.10 0.00 0.00 60.65 59.28 3cys s ILE 10 Cb -0.06 -3.17 0.02 0.00 -1.06 0.00 0.00 42.46 38.19 3cys s ILE 10 CO -0.01 0.46 -0.09 0.00 -0.10 0.00 0.00 174.94 175.19 3cys s ALA 11 N -1.11 1.37 -0.58 9.38 0.00 0.14 -0.27 121.76 130.69 3cys s ALA 11 Ca 0.20 -0.55 -0.12 0.00 0.00 0.00 0.00 51.96 51.48 3cys s ALA 11 Cb -0.12 -0.84 0.15 0.00 0.00 0.00 0.00 23.12 22.31 3cys s ALA 11 CO 0.10 -0.28 0.49 0.08 0.00 0.00 0.00 175.76 176.15 3cys s VAL 12 N 1.43 4.82 -0.33 0.00 1.01 0.19 -1.55 120.40 125.97 3cys s VAL 12 Ca 0.00 -1.90 -0.15 0.00 0.00 0.00 0.00 61.98 59.93 3cys s VAL 12 Cb -0.13 -4.10 0.02 0.00 0.00 0.00 0.00 36.38 32.17 3cys s VAL 12 CO -0.06 -0.87 0.37 0.47 0.00 0.00 0.00 175.10 175.01 3cys n ASP 13 N 4.75 -7.14 -4.12 3.32 9.92 0.04 -3.03 116.55 120.30 3cys n ASP 13 Ca -0.05 0.56 -0.35 0.00 -0.53 0.00 0.00 54.79 54.43 3cys n ASP 13 Cb 0.41 -3.80 -0.01 0.00 -0.64 0.00 0.00 41.12 37.08 3cys n ASP 13 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3cys n GLY 14 N 0.25 -0.46 3.23 0.44 0.00 -1.26 -4.92 105.19 102.47 3cys n GLY 14 Ca 0.02 0.14 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 3cys n GLY 14 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cys s GLU 15 N -6.82 0.31 -0.26 1.61 2.12 -1.17 -5.12 118.70 109.37 3cys s GLU 15 Ca 0.72 0.95 -0.29 0.00 0.36 0.00 0.00 54.97 56.71 3cys s GLU 15 Cb -0.39 0.22 -0.01 0.00 0.26 0.00 0.00 34.13 34.22 3cys s GLU 15 CO 0.88 -0.24 1.33 -1.25 -0.54 0.00 0.00 175.26 175.44 3cys s PRO 16 N 2.38 3.98 0.09 4.30 0.04 -1.26 0.53 135.00 145.06 3cys s PRO 16 Ca -0.03 1.40 -0.17 0.00 0.04 0.00 0.00 61.00 62.24 3cys s PRO 16 Cb -0.11 -3.87 -0.09 0.00 0.04 0.00 0.00 34.50 30.47 3cys s PRO 16 CO -0.12 -1.03 1.44 1.25 0.04 0.00 0.00 177.00 178.58 3cys h LEU 17 N 10.67 0.59 0.00 -3.56 7.12 -1.00 -3.48 115.31 125.65 3cys h LEU 17 Ca -0.27 -0.42 0.00 0.00 0.13 0.00 0.00 57.88 57.32 3cys h LEU 17 Cb 1.10 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 41.07 3cys h LEU 17 CO 1.01 0.88 0.00 0.61 -0.13 0.00 0.00 178.44 180.81 3cys n GLY 18 N 0.00 0.55 3.80 3.75 0.00 -1.25 -5.03 105.19 107.02 3cys n GLY 18 Ca -0.04 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 43.92 3cys n GLY 18 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3cys s ARG 19 N -2.00 4.39 0.00 1.61 3.52 -1.26 -3.47 118.95 121.75 3cys s ARG 19 Ca 0.00 1.01 0.01 0.00 -0.13 0.00 0.00 55.73 56.62 3cys s ARG 19 Cb 0.00 -3.04 -0.01 0.00 -1.56 0.00 0.00 34.95 30.34 3cys s ARG 19 CO 0.00 0.47 -0.04 0.08 -0.81 0.00 0.00 175.30 175.00 3cys s VAL 20 N -1.36 0.28 -0.01 7.11 1.01 0.10 -4.70 120.40 122.83 3cys s VAL 20 Ca 0.40 -0.28 -0.12 0.00 0.00 0.00 0.00 61.98 61.98 3cys s VAL 20 Cb -0.19 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 35.94 3cys s VAL 20 CO 0.23 -0.01 0.25 -0.94 0.00 0.00 0.00 175.10 174.64 3cys s SER 21 N -0.31 -0.12 -0.04 3.32 1.04 -1.26 0.57 113.70 116.90 3cys s SER 21 Ca -0.01 -0.01 0.03 0.00 0.48 0.00 0.00 55.95 56.43 3cys s SER 21 Cb -0.03 0.28 0.01 0.00 0.10 0.00 0.00 66.02 66.38 3cys s SER 21 CO -0.00 -0.43 -0.11 -0.36 0.98 0.00 0.00 173.24 173.33 3cys s PHE 22 N -1.36 1.20 -0.16 5.02 0.08 -0.56 -3.72 117.98 118.47 3cys s PHE 22 Ca -0.14 -0.36 -0.17 0.00 0.12 0.00 0.00 56.93 56.38 3cys s PHE 22 Cb -0.06 -0.87 -0.04 0.00 -0.57 0.00 0.00 43.02 41.48 3cys s PHE 22 CO 0.03 -0.17 0.43 -1.21 -0.10 0.00 0.00 175.22 174.20 3cys s GLU 23 N 0.40 4.27 0.19 0.44 2.02 -0.24 -0.89 118.70 124.89 3cys s GLU 23 Ca -0.08 0.32 0.04 0.00 0.02 0.00 0.00 54.97 55.27 3cys s GLU 23 Cb -0.12 -3.48 -0.03 0.00 0.10 0.00 0.00 34.13 30.60 3cys s GLU 23 CO 0.02 0.08 0.29 -0.51 0.02 0.00 0.00 175.26 175.16 3cys s LEU 24 N 0.90 4.23 -0.93 1.80 1.43 0.01 -0.17 118.68 125.96 3cys s LEU 24 Ca 0.22 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.39 3cys s LEU 24 Cb -0.15 -2.79 0.31 0.00 0.03 0.00 0.00 46.19 43.59 3cys s LEU 24 CO 0.08 0.00 1.41 0.49 0.23 0.00 0.00 176.35 178.57 3cys n PHE 25 N -0.88 2.86 0.26 0.29 3.72 -0.40 -4.11 117.46 119.20 3cys n PHE 25 Ca -0.08 -3.00 0.08 0.00 -0.05 0.00 0.00 57.45 54.40 3cys n PHE 25 Cb 0.55 -1.03 0.64 0.00 -0.94 0.00 0.00 39.48 38.70 3cys n PHE 25 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3cys h ALA 26 N 4.52 1.96 -0.73 4.37 0.00 -1.84 0.28 119.26 127.82 3cys h ALA 26 Ca 0.30 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 3cys h ALA 26 Cb 0.51 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3cys h ALA 26 CO 1.14 0.02 0.38 0.22 0.00 0.00 0.00 179.25 181.01 3cys h ASP 27 N 0.00 0.93 0.12 0.00 3.58 -1.88 -2.69 116.42 116.49 3cys h ASP 27 Ca -0.00 -0.11 -0.31 0.00 0.42 0.00 0.00 57.03 57.03 3cys h ASP 27 Cb 0.03 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 3cys h ASP 27 CO 0.00 0.78 -1.61 0.11 -2.88 0.00 0.00 179.24 175.64 3cys h LYS 28 N 1.01 0.26 -2.82 0.28 1.57 -1.61 -3.43 116.57 111.83 3cys h LYS 28 Ca 0.25 -0.44 -0.58 0.00 -1.87 0.00 0.00 60.65 58.01 3cys h LYS 28 Cb 0.07 0.17 -0.40 0.00 0.08 0.00 0.00 32.23 32.15 3cys h LYS 28 CO -0.04 1.21 -0.80 0.14 -0.57 0.00 0.00 179.45 179.39 3cys s VAL 29 N -2.51 0.53 0.33 0.50 -7.23 0.85 -5.06 120.40 107.81 3cys s VAL 29 Ca -0.20 -1.78 -0.06 0.00 -1.81 0.00 0.00 61.98 58.13 3cys s VAL 29 Cb 0.05 -1.39 0.08 0.00 0.56 0.00 0.00 36.38 35.68 3cys s VAL 29 CO 0.77 -0.90 0.36 -0.81 -0.31 0.00 0.00 175.10 174.22 3cys n PRO 30 N 4.15 -1.01 0.00 4.82 -0.04 -1.02 -3.44 135.00 138.46 3cys n PRO 30 Ca 0.07 -0.57 0.00 0.00 -0.04 0.00 0.00 63.50 62.96 3cys n PRO 30 Cb 0.37 -0.45 0.00 0.00 -0.04 0.00 0.00 33.50 33.38 3cys n PRO 30 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3cys n LYS 31 N -2.17 0.00 0.13 0.54 4.81 -1.26 -3.97 118.16 116.24 3cys n LYS 31 Ca 0.05 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.36 3cys n LYS 31 Cb 0.17 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.14 3cys n LYS 31 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 3cys h THR 32 N 0.00 0.78 -0.80 3.15 2.02 -1.93 0.88 112.91 117.01 3cys h THR 32 Ca 0.00 -0.61 0.02 0.00 0.77 0.00 0.00 66.41 66.59 3cys h THR 32 Cb 0.00 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.48 3cys h THR 32 CO 0.00 0.13 0.53 0.00 0.37 0.00 0.00 175.52 176.55 3cys h ALA 33 N -0.07 1.46 -0.22 6.16 0.00 -1.68 -1.34 119.26 123.57 3cys h ALA 33 Ca -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3cys h ALA 33 Cb 0.47 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3cys h ALA 33 CO 0.06 0.48 0.08 1.49 0.00 0.00 0.00 179.25 181.36 3cys h GLU 34 N 1.05 0.34 -0.43 0.00 4.57 -1.79 0.79 114.58 119.10 3cys h GLU 34 Ca 0.31 -0.06 0.05 0.00 -1.18 0.00 0.00 59.36 58.47 3cys h GLU 34 Cb -0.05 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.44 3cys h GLU 34 CO -0.08 0.40 0.16 -0.97 -1.18 0.00 0.00 179.01 177.34 3cys h ASN 35 N 0.20 0.17 -0.62 1.04 -1.24 -0.31 0.29 115.58 115.11 3cys h ASN 35 Ca 0.07 0.05 -0.02 0.00 0.71 0.00 0.00 56.30 57.11 3cys h ASN 35 Cb 0.19 0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.24 3cys h ASN 35 CO -0.00 0.13 0.31 0.15 -1.29 0.00 0.00 177.43 176.73 3cys h PHE 36 N 0.33 0.88 -0.74 0.67 3.57 -0.92 0.35 116.94 121.08 3cys h PHE 36 Ca 0.20 -0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 3cys h PHE 36 Cb 0.18 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 3cys h PHE 36 CO -0.15 0.66 0.26 -0.09 -2.23 0.00 0.00 178.31 176.76 3cys h ARG 37 N 0.85 1.12 -0.31 1.11 1.12 -0.29 -0.46 114.38 117.53 3cys h ARG 37 Ca 0.21 -0.22 -0.11 0.00 -1.11 0.00 0.00 59.98 58.75 3cys h ARG 37 Cb 0.10 -0.17 -0.01 0.00 -0.01 0.00 0.00 29.97 29.87 3cys h ARG 37 CO -0.03 0.93 -0.28 0.00 -3.11 0.00 0.00 179.97 177.49 3cys h ALA 38 N 1.19 0.94 -0.19 2.80 0.00 0.31 0.22 119.26 124.53 3cys h ALA 38 Ca 0.24 -0.38 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 3cys h ALA 38 Cb 0.26 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3cys h ALA 38 CO -0.01 0.61 -0.49 -0.07 0.00 0.00 0.00 179.25 179.28 3cys h LEU 39 N 0.54 0.56 -0.07 0.00 3.38 -0.71 0.57 115.31 119.58 3cys h LEU 39 Ca 0.07 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3cys h LEU 39 Cb 0.75 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 3cys h LEU 39 CO 0.06 0.96 -0.00 0.28 0.09 0.00 0.00 178.44 179.83 3cys h SER 40 N 0.41 0.13 1.28 -0.43 0.02 -0.30 -3.07 113.55 111.59 3cys h SER 40 Ca 0.02 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3cys h SER 40 Cb 1.01 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.51 3cys h SER 40 CO 0.09 0.42 -0.49 0.00 -1.14 0.00 0.00 176.83 175.71 3cys h THR 41 N -0.17 0.00 -0.83 -2.27 1.03 -1.01 -2.66 112.91 107.00 3cys h THR 41 Ca 0.02 -0.77 -0.14 0.00 -0.01 0.00 0.00 66.41 65.51 3cys h THR 41 Cb 0.36 1.50 -0.02 0.00 -1.07 0.00 0.00 68.15 68.91 3cys h THR 41 CO 0.00 0.00 -0.17 0.61 -0.01 0.00 0.00 175.52 175.96 3cys n GLY 42 N 1.23 0.28 3.59 2.99 0.00 0.20 -4.95 105.19 108.53 3cys n GLY 42 Ca 0.03 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.99 3cys n GLY 42 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3cys s GLU 43 N -3.92 3.60 0.00 1.61 -1.05 -0.88 -3.78 118.70 114.28 3cys s GLU 43 Ca 0.00 0.61 0.00 0.00 -0.15 0.00 0.00 54.97 55.43 3cys s GLU 43 Cb 0.00 -3.98 0.00 0.00 -0.44 0.00 0.00 34.13 29.71 3cys s GLU 43 CO 0.00 -1.55 0.00 1.17 0.95 0.00 0.00 175.26 175.83 3cys n LYS 44 N 8.10 0.00 -1.25 -4.83 4.81 -1.26 -4.55 118.16 119.17 3cys n LYS 44 Ca 0.13 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.36 3cys n LYS 44 Cb 0.49 0.00 0.13 0.00 0.02 0.00 0.00 35.03 35.67 3cys n LYS 44 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3cys n GLY 45 N 0.00 5.34 4.27 3.14 0.00 -1.26 -5.05 105.19 111.62 3cys n GLY 45 Ca 0.00 -1.73 0.03 0.00 0.00 0.00 0.00 46.02 44.31 3cys n GLY 45 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3cys n PHE 46 N -1.01 -1.85 -4.00 1.61 1.16 -1.25 -4.70 117.46 107.42 3cys n PHE 46 Ca 0.49 0.26 -0.12 0.00 -1.87 0.00 0.00 57.45 56.21 3cys n PHE 46 Cb 1.07 -0.42 -0.03 0.00 -1.61 0.00 0.00 39.48 38.50 3cys n PHE 46 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 3cys s GLY 47 N -2.46 1.04 -0.98 4.97 0.00 -1.25 -4.07 107.32 104.56 3cys s GLY 47 Ca 0.00 -1.21 -0.02 0.00 0.00 0.00 0.00 44.72 43.49 3cys s GLY 47 CO 0.00 -0.76 1.25 -1.72 0.00 0.00 0.00 173.10 171.87 3cys n TYR 48 N -0.52 2.94 -3.20 1.90 4.02 -1.26 -4.96 117.16 116.07 3cys n TYR 48 Ca -0.02 -3.14 -0.46 0.00 -0.01 0.00 0.00 57.90 54.28 3cys n TYR 48 Cb 0.61 -1.14 -0.04 0.00 -0.02 0.00 0.00 39.34 38.75 3cys n TYR 48 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 3cys s LYS 49 N -2.51 3.19 0.00 -0.72 2.20 -1.26 -3.89 119.74 116.76 3cys s LYS 49 Ca 0.33 -1.72 0.00 0.00 -0.36 0.00 0.00 55.97 54.21 3cys s LYS 49 Cb 0.05 -4.37 0.00 0.00 -1.51 0.00 0.00 37.83 32.00 3cys s LYS 49 CO 0.05 -1.44 0.00 0.41 -0.36 0.00 0.00 175.35 174.01 3cys n GLY 50 N 5.01 1.11 3.69 5.54 0.00 -0.79 -5.00 105.19 114.75 3cys n GLY 50 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 3cys n GLY 50 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3cys s SER 51 N -1.21 3.40 0.13 1.61 0.15 -1.25 -4.47 113.70 112.06 3cys s SER 51 Ca 0.00 2.26 0.11 0.00 0.70 0.00 0.00 55.95 59.02 3cys s SER 51 Cb 0.00 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.69 3cys s SER 51 CO 0.00 -2.79 -0.27 0.00 1.20 0.00 0.00 173.24 171.39 3cys s PHE 53 N -1.06 2.96 -1.00 0.00 0.08 -1.25 -4.33 117.98 113.38 3cys s PHE 53 Ca 0.14 1.02 0.28 0.00 0.12 0.00 0.00 56.93 58.48 3cys s PHE 53 Cb -0.10 -3.89 0.98 0.00 -0.57 0.00 0.00 43.02 39.44 3cys s PHE 53 CO 0.06 -1.13 1.75 -2.39 -0.10 0.00 0.00 175.22 173.41 3cys n HIS 54 N 7.27 0.01 -3.65 0.36 1.44 -1.26 -4.69 115.22 114.70 3cys n HIS 54 Ca 0.13 0.00 -0.06 0.00 -2.01 0.00 0.00 57.72 55.78 3cys n HIS 54 Cb 0.47 -0.42 -0.07 0.00 0.12 0.00 0.00 29.99 30.09 3cys n HIS 54 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 3cys s ARG 55 N -3.00 0.59 -0.04 -1.40 6.06 -1.26 -4.60 118.95 115.30 3cys s ARG 55 Ca 0.13 1.18 0.01 0.00 -2.50 0.00 0.00 55.73 54.55 3cys s ARG 55 Cb 0.18 0.29 0.02 0.00 0.06 0.00 0.00 34.95 35.51 3cys s ARG 55 CO 0.59 -0.17 -0.03 0.42 -2.50 0.00 0.00 175.30 173.61 3cys s ILE 56 N 1.96 0.39 -0.10 4.11 1.01 -1.26 -4.11 121.20 123.20 3cys s ILE 56 Ca -0.08 -0.04 0.01 0.00 0.00 0.00 0.00 60.65 60.54 3cys s ILE 56 Cb -0.08 -0.44 0.02 0.00 0.01 0.00 0.00 42.46 41.97 3cys s ILE 56 CO -0.18 0.19 -0.12 -0.63 0.00 0.00 0.00 174.94 174.20 3cys s ILE 57 N 0.96 1.25 -0.25 2.92 1.01 -0.87 -3.10 121.20 123.13 3cys s ILE 57 Ca -0.11 -0.50 -0.29 0.00 0.00 0.00 0.00 60.65 59.76 3cys s ILE 57 Cb -0.14 -1.17 -0.01 0.00 0.01 0.00 0.00 42.46 41.15 3cys s ILE 57 CO -0.01 0.39 1.32 -2.16 0.00 0.00 0.00 174.94 174.49 3cys s PRO 58 N 1.06 4.01 0.00 2.79 0.04 -1.26 -2.84 135.00 138.80 3cys s PRO 58 Ca -0.06 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.40 3cys s PRO 58 Cb -0.15 -3.86 0.00 0.00 0.04 0.00 0.00 34.50 30.54 3cys s PRO 58 CO -0.02 -1.00 0.00 0.41 0.04 0.00 0.00 177.00 176.43 3cys n GLY 59 N 4.11 0.84 1.55 0.56 0.00 -1.26 -4.92 105.19 106.08 3cys n GLY 59 Ca 0.15 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3cys n GLY 59 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3cys n PHE 60 N -1.27 -3.19 -3.66 1.61 7.35 -1.22 -4.86 117.46 112.23 3cys n PHE 60 Ca 0.00 0.71 -0.15 0.00 -0.76 0.00 0.00 57.45 57.26 3cys n PHE 60 Cb 0.30 1.99 -0.08 0.00 0.35 0.00 0.00 39.48 42.05 3cys n PHE 60 CO 0.00 0.00 0.00 1.41 -0.76 0.00 0.00 176.76 177.41 3cys s MET 61 N -1.57 0.75 -0.31 -4.13 0.00 -1.13 0.01 119.30 112.92 3cys s MET 61 Ca 0.00 0.44 0.01 0.00 0.00 0.00 0.00 55.69 56.14 3cys s MET 61 Cb 0.00 0.36 0.15 0.00 0.00 0.00 0.00 34.83 35.34 3cys s MET 61 CO 0.00 -0.16 0.37 0.00 0.00 0.00 0.00 175.02 175.22 3cys n GLN 63 N 5.13 0.00 0.00 0.00 -0.06 -1.26 -1.20 117.38 119.99 3cys n GLN 63 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.02 3cys n GLN 63 Cb 0.48 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.66 3cys n GLN 63 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3cys n GLY 64 N 0.00 4.26 3.08 1.69 0.00 -0.85 -4.25 105.19 109.12 3cys n GLY 64 Ca 0.00 -1.25 0.03 0.00 0.00 0.00 0.00 46.02 44.80 3cys n GLY 64 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cys s GLY 65 N 0.00 -1.22 0.40 -0.02 0.00 -1.06 -4.62 107.32 100.80 3cys s GLY 65 Ca 0.00 1.29 0.08 0.00 0.00 0.00 0.00 44.72 46.08 3cys s GLY 65 CO 0.00 3.95 0.31 0.99 0.00 0.00 0.00 173.10 178.36 3cys s ASP 66 N 2.50 4.93 0.00 1.64 1.01 -1.26 -3.21 116.67 122.27 3cys s ASP 66 Ca 0.18 -0.78 0.00 0.00 0.71 0.00 0.00 52.55 52.66 3cys s ASP 66 Cb -0.03 -0.61 0.00 0.00 1.01 0.00 0.00 42.92 43.29 3cys s ASP 66 CO -0.19 -0.57 0.00 0.33 0.21 0.00 0.00 175.17 174.95 3cys n PHE 67 N -1.44 -0.98 0.45 4.23 7.35 -1.26 -4.70 117.46 121.11 3cys n PHE 67 Ca 0.02 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.77 3cys n PHE 67 Cb 0.62 0.28 -0.08 0.00 0.35 0.00 0.00 39.48 40.65 3cys n PHE 67 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 3cys n THR 68 N -2.06 0.00 -2.74 -2.13 -2.24 -1.26 -4.77 114.28 99.09 3cys n THR 68 Ca 0.00 -0.23 -0.07 0.00 -2.27 0.00 0.00 64.05 61.49 3cys n THR 68 Cb 0.00 0.81 0.05 0.00 -2.10 0.00 0.00 70.33 69.08 3cys n THR 68 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3cys n ARG 69 N -1.45 0.60 -1.30 -0.78 3.00 -1.26 -4.92 116.66 110.55 3cys n ARG 69 Ca 0.01 -1.58 -0.49 0.00 -0.00 0.00 0.00 57.85 55.79 3cys n ARG 69 Cb 0.23 -1.20 -0.13 0.00 0.00 0.00 0.00 32.46 31.36 3cys n ARG 69 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 3cys n HIS 70 N 1.92 0.86 0.00 -0.14 8.25 -1.26 -3.54 115.22 121.30 3cys n HIS 70 Ca 0.10 0.57 0.00 0.00 -0.26 0.00 0.00 57.72 58.13 3cys n HIS 70 Cb 0.63 -2.22 0.00 0.00 1.12 0.00 0.00 29.99 29.52 3cys n HIS 70 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3cys n ASN 71 N 8.40 0.00 0.00 0.41 5.15 -1.26 -5.03 115.26 122.93 3cys n ASN 71 Ca 0.57 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.55 3cys n ASN 71 Cb -0.01 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.24 3cys n ASN 71 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3cys n GLY 72 N 0.00 0.05 0.00 8.20 0.00 -1.24 -4.94 105.19 107.25 3cys n GLY 72 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3cys n GLY 72 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3cys n THR 73 N 0.00 0.00 -0.30 2.61 5.66 -1.26 -5.01 114.28 115.98 3cys n THR 73 Ca 0.00 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.93 3cys n THR 73 Cb 0.00 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.76 3cys n THR 73 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 3cys h GLY 74 N 0.00 -0.36 -3.89 1.09 0.00 -1.91 -3.42 103.07 94.58 3cys h GLY 74 Ca 0.00 0.59 -0.49 0.00 0.00 0.00 0.00 47.33 47.43 3cys h GLY 74 CO 0.00 -0.13 0.34 0.61 0.00 0.00 0.00 176.54 177.36 3cys n GLY 75 N -1.40 0.07 3.96 4.60 0.00 -1.26 -4.31 105.19 106.85 3cys n GLY 75 Ca 0.04 0.55 -0.26 0.00 0.00 0.00 0.00 46.02 46.36 3cys n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cys s LYS 76 N 1.46 1.38 0.18 1.61 -0.14 -1.26 -4.54 119.74 118.43 3cys s LYS 76 Ca 0.58 -0.74 0.03 0.00 -1.36 0.00 0.00 55.97 54.48 3cys s LYS 76 Cb -0.83 -2.14 0.03 0.00 -1.68 0.00 0.00 37.83 33.21 3cys s LYS 76 CO 0.44 -1.76 0.22 0.45 -0.76 0.00 0.00 175.35 173.94 3cys n SER 77 N -3.18 0.94 -0.03 2.83 2.88 0.67 -4.50 113.62 113.23 3cys n SER 77 Ca 0.14 -1.52 -0.08 0.00 -1.33 0.00 0.00 58.87 56.08 3cys n SER 77 Cb 0.60 -0.10 -0.14 0.00 -0.75 0.00 0.00 64.21 63.82 3cys n SER 77 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3cys n ILE 78 N -1.25 1.51 1.00 2.46 0.00 -1.26 -3.99 119.36 117.84 3cys n ILE 78 Ca 0.03 -0.80 0.11 0.00 0.00 0.00 0.00 62.75 62.10 3cys n ILE 78 Cb 0.19 -0.89 0.06 0.00 0.00 0.00 0.00 39.64 39.01 3cys n ILE 78 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 3cys n TYR 79 N -2.97 0.00 0.00 9.51 4.01 -1.26 -4.82 117.16 121.63 3cys n TYR 79 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 3cys n TYR 79 Cb 1.05 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.96 3cys n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3cys n GLY 80 N 1.50 -0.54 0.13 2.72 0.00 -1.26 -4.97 105.19 102.77 3cys n GLY 80 Ca 0.05 0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 3cys n GLY 80 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3cys n GLU 81 N 0.00 0.67 -4.38 1.61 2.13 -1.26 -0.24 120.64 119.17 3cys n GLU 81 Ca 0.00 0.31 -0.21 0.00 0.66 0.00 0.00 57.16 57.93 3cys n GLU 81 Cb 0.00 -1.65 -0.09 0.00 0.27 0.00 0.00 31.44 29.97 3cys n GLU 81 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3cys s LYS 82 N -2.50 1.71 -0.02 5.31 1.02 -1.26 -2.73 119.74 121.27 3cys s LYS 82 Ca -0.29 -2.00 -0.29 0.00 0.02 0.00 0.00 55.97 53.42 3cys s LYS 82 Cb 0.08 -0.21 0.10 0.00 -0.52 0.00 0.00 37.83 37.28 3cys s LYS 82 CO 0.66 -0.47 0.90 -0.59 -0.92 0.00 0.00 175.35 174.93 3cys s PHE 83 N -3.47 -0.35 0.96 3.18 -0.71 -1.13 -4.83 117.98 111.64 3cys s PHE 83 Ca 0.33 0.25 -0.11 0.00 -1.04 0.00 0.00 56.93 56.36 3cys s PHE 83 Cb 0.04 0.53 0.12 0.00 -1.21 0.00 0.00 43.02 42.50 3cys s PHE 83 CO 0.18 -0.52 0.84 -0.85 -1.34 0.00 0.00 175.22 173.53 3cys n GLU 84 N -0.15 -0.58 -0.91 1.99 0.28 -1.26 -4.15 120.64 115.86 3cys n GLU 84 Ca -0.09 -0.12 -0.11 0.00 -0.16 0.00 0.00 57.16 56.69 3cys n GLU 84 Cb 0.61 -2.16 0.07 0.00 1.43 0.00 0.00 31.44 31.39 3cys n GLU 84 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3cys n ASP 85 N -3.19 0.17 0.00 -1.84 9.92 -1.26 -4.83 116.55 115.52 3cys n ASP 85 Ca 0.09 -1.26 0.00 0.00 -0.53 0.00 0.00 54.79 53.10 3cys n ASP 85 Cb 0.53 -0.35 0.00 0.00 -0.64 0.00 0.00 41.12 40.66 3cys n ASP 85 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3cys n GLU 86 N -1.98 0.00 0.00 -1.24 -0.58 -1.26 -5.00 120.64 110.58 3cys n GLU 86 Ca 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 3cys n GLU 86 Cb 0.22 -0.02 0.00 0.00 -0.57 0.00 0.00 31.44 31.08 3cys n GLU 86 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 3cys n ASN 87 N -1.35 0.00 -2.29 1.62 0.23 -1.26 -5.03 115.26 107.18 3cys n ASN 87 Ca 0.00 0.00 -0.30 0.00 -0.53 0.00 0.00 54.58 53.75 3cys n ASN 87 Cb 0.00 0.00 0.04 0.00 -2.08 0.00 0.00 39.78 37.74 3cys n ASN 87 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 3cys n PHE 88 N -0.07 3.04 0.06 -2.53 3.72 -1.26 -4.66 117.46 115.76 3cys n PHE 88 Ca 0.00 -2.65 0.02 0.00 -0.05 0.00 0.00 57.45 54.77 3cys n PHE 88 Cb 0.00 -0.85 0.39 0.00 -0.94 0.00 0.00 39.48 38.08 3cys n PHE 88 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 3cys h ILE 89 N 1.74 1.15 -3.46 4.37 2.04 -1.96 -3.43 117.51 117.97 3cys h ILE 89 Ca 0.48 -0.57 -0.46 0.00 1.00 0.00 0.00 64.86 65.31 3cys h ILE 89 Cb 1.02 0.92 0.12 0.00 -0.74 0.00 0.00 36.82 38.14 3cys h ILE 89 CO 1.18 0.20 0.30 -0.76 0.00 0.00 0.00 178.15 179.06 3cys s LEU 90 N -9.08 2.80 0.31 1.44 2.01 -1.26 -5.11 118.68 109.78 3cys s LEU 90 Ca -0.07 0.14 0.03 0.00 0.01 0.00 0.00 54.13 54.24 3cys s LEU 90 Cb 0.16 -2.39 -0.02 0.00 0.01 0.00 0.00 46.19 43.95 3cys s LEU 90 CO 0.74 -2.25 0.31 -1.59 1.01 0.00 0.00 176.35 174.57 3cys s LYS 91 N -5.55 1.69 -0.44 1.70 -2.85 -1.26 -4.89 119.74 108.14 3cys s LYS 91 Ca 0.69 -1.85 -0.08 0.00 -1.00 0.00 0.00 55.97 53.73 3cys s LYS 91 Cb -0.06 0.35 0.11 0.00 -2.06 0.00 0.00 37.83 36.17 3cys s LYS 91 CO 0.49 -0.64 0.29 -1.01 0.10 0.00 0.00 175.35 174.58 3cys s HIS 92 N -3.49 3.43 0.05 1.78 3.76 -1.26 -4.92 115.29 114.64 3cys s HIS 92 Ca 0.37 -1.90 -0.15 0.00 -0.15 0.00 0.00 55.06 53.23 3cys s HIS 92 Cb 0.02 -3.29 -0.32 0.00 1.11 0.00 0.00 32.58 30.11 3cys s HIS 92 CO 0.22 -0.95 1.06 1.79 -0.85 0.00 0.00 174.74 176.01 3cys h THR 93 N 6.17 1.28 0.00 1.30 1.35 -1.96 -3.43 112.91 117.62 3cys h THR 93 Ca -0.20 -2.57 0.00 0.00 -0.55 0.00 0.00 66.41 63.09 3cys h THR 93 Cb 1.07 2.84 0.00 0.00 -1.73 0.00 0.00 68.15 70.33 3cys h THR 93 CO 0.80 0.78 0.00 0.61 -0.25 0.00 0.00 175.52 177.45 3cys n GLY 94 N 1.52 -0.71 3.81 5.82 0.00 -1.26 -4.82 105.19 109.54 3cys n GLY 94 Ca -0.15 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 3cys n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cys s PRO 95 N -0.99 2.20 -0.62 1.61 0.04 -1.26 -4.03 135.00 131.94 3cys s PRO 95 Ca 0.00 0.68 -0.01 0.00 0.04 0.00 0.00 61.00 61.71 3cys s PRO 95 Cb 0.00 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.61 3cys s PRO 95 CO 0.00 -1.55 0.09 0.41 0.04 0.00 0.00 177.00 175.98 3cys n GLY 96 N -2.09 0.12 3.16 0.56 0.00 -1.20 -4.97 105.19 100.78 3cys n GLY 96 Ca 0.07 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.29 3cys n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cys s ILE 97 N -2.53 1.63 -0.55 -0.61 -1.09 -1.26 -1.32 121.20 115.47 3cys s ILE 97 Ca 0.04 -0.81 -0.18 0.00 -2.23 0.00 0.00 60.65 57.47 3cys s ILE 97 Cb -0.02 -1.40 0.09 0.00 -1.58 0.00 0.00 42.46 39.55 3cys s ILE 97 CO 0.05 0.46 0.64 -0.22 -1.23 0.00 0.00 174.94 174.65 3cys s LEU 98 N 0.11 5.33 0.37 2.97 1.98 -0.25 -3.58 118.68 125.60 3cys s LEU 98 Ca -0.07 -1.28 0.08 0.00 -2.89 0.00 0.00 54.13 49.97 3cys s LEU 98 Cb -0.13 -2.33 -0.05 0.00 0.66 0.00 0.00 46.19 44.33 3cys s LEU 98 CO 0.04 -0.99 0.10 -0.44 -1.89 0.00 0.00 176.35 173.16 3cys s SER 99 N 3.24 4.34 0.54 3.68 0.01 -1.23 -2.70 113.70 121.58 3cys s SER 99 Ca 0.11 -1.00 0.04 0.00 1.31 0.00 0.00 55.95 56.42 3cys s SER 99 Cb -0.23 -0.54 0.03 0.00 0.21 0.00 0.00 66.02 65.48 3cys s SER 99 CO 0.08 -0.37 0.30 -0.32 0.41 0.00 0.00 173.24 173.34 3cys s MET 100 N -3.81 2.24 -0.00 12.44 1.75 -0.17 -2.88 119.30 128.88 3cys s MET 100 Ca 0.38 -2.12 0.00 0.00 -1.25 0.00 0.00 55.69 52.70 3cys s MET 100 Cb 0.01 -1.95 -0.00 0.00 2.84 0.00 0.00 34.83 35.73 3cys s MET 100 CO 0.21 -0.55 -0.01 0.00 -0.65 0.00 0.00 175.02 174.02 3cys s ALA 101 N -2.80 0.07 -0.06 4.11 0.00 -1.26 -4.54 121.76 117.28 3cys s ALA 101 Ca 0.27 -0.03 -0.12 0.00 0.00 0.00 0.00 51.96 52.08 3cys s ALA 101 Cb -0.01 -0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.11 3cys s ALA 101 CO 0.16 0.02 0.28 -0.80 0.00 0.00 0.00 175.76 175.42 3cys s ASN 102 N -0.02 -0.22 -0.16 0.00 0.01 -1.26 -4.67 114.94 108.63 3cys s ASN 102 Ca 0.00 0.29 0.14 0.00 -0.71 0.00 0.00 52.86 52.58 3cys s ASN 102 Cb -0.00 0.44 0.69 0.00 0.41 0.00 0.00 41.25 42.78 3cys s ASN 102 CO -0.00 -0.28 1.57 0.00 -1.51 0.00 0.00 177.10 176.88 3cys n ALA 103 N 2.06 3.39 0.00 0.60 0.00 -1.26 -4.99 120.51 120.31 3cys n ALA 103 Ca -0.18 -1.55 0.00 0.00 0.00 0.00 0.00 53.44 51.71 3cys n ALA 103 Cb 0.57 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3cys n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cys n GLY 104 N 0.80 0.04 3.74 0.00 0.00 -1.26 -5.00 105.19 103.51 3cys n GLY 104 Ca 0.24 -1.54 -0.41 0.00 0.00 0.00 0.00 46.02 44.31 3cys n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cys s PRO 105 N -1.66 4.59 -1.89 1.61 0.04 -1.26 -3.03 135.00 133.41 3cys s PRO 105 Ca 0.00 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.79 3cys s PRO 105 Cb 0.00 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.29 3cys s PRO 105 CO 0.00 0.09 0.00 -1.71 0.04 0.00 0.00 177.00 175.42 3cys n ASN 106 N 2.12 -5.73 -0.06 6.66 5.15 -1.26 -4.79 115.26 117.34 3cys n ASN 106 Ca 0.02 0.14 0.01 0.00 -0.60 0.00 0.00 54.58 54.15 3cys n ASN 106 Cb 0.46 -4.83 0.01 0.00 -0.53 0.00 0.00 39.78 34.88 3cys n ASN 106 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 3cys n THR 107 N -3.52 0.00 -2.60 -0.44 -1.04 -1.17 -4.10 114.28 101.41 3cys n THR 107 Ca -0.23 -0.49 -0.36 0.00 -2.04 0.00 0.00 64.05 60.92 3cys n THR 107 Cb 0.68 1.03 -0.05 0.00 -1.82 0.00 0.00 70.33 70.18 3cys n THR 107 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3cys s ASN 108 N -0.29 6.87 0.00 8.00 4.22 -1.26 -4.63 114.94 127.86 3cys s ASN 108 Ca 0.02 1.98 0.00 0.00 -2.14 0.00 0.00 52.86 52.72 3cys s ASN 108 Cb 0.01 -2.58 0.00 0.00 1.28 0.00 0.00 41.25 39.96 3cys s ASN 108 CO 0.03 -0.41 0.00 0.61 -2.04 0.00 0.00 177.10 175.29 3cys n GLY 109 N 0.32 -0.09 0.00 0.45 0.00 -1.26 -2.82 105.19 101.78 3cys n GLY 109 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3cys n GLY 109 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3cys n SER 110 N -2.01 0.00 0.00 1.61 3.41 -1.26 -4.74 113.62 110.63 3cys n SER 110 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3cys n SER 110 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3cys n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cys n GLN 111 N 0.00 0.00 -0.48 4.33 1.13 -1.20 -4.48 117.38 116.68 3cys n GLN 111 Ca 0.00 0.00 0.04 0.00 -1.94 0.00 0.00 57.00 55.10 3cys n GLN 111 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.34 3cys n GLN 111 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 3cys n PHE 112 N 0.00 -0.84 0.00 1.08 1.16 -1.26 -2.20 117.46 115.39 3cys n PHE 112 Ca 0.00 0.43 0.00 0.00 -1.87 0.00 0.00 57.45 56.01 3cys n PHE 112 Cb 0.00 -0.77 0.00 0.00 -1.61 0.00 0.00 39.48 37.10 3cys n PHE 112 CO 0.00 0.00 0.00 1.19 -1.87 0.00 0.00 176.76 176.08 3cys n PHE 113 N -1.80 0.00 -3.15 2.97 3.72 -1.14 -2.00 117.46 116.05 3cys n PHE 113 Ca -0.00 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.96 3cys n PHE 113 Cb 0.54 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 39.02 3cys n PHE 113 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3cys s ILE 114 N 0.00 4.87 -0.06 4.37 1.01 -0.34 -3.47 121.20 127.58 3cys s ILE 114 Ca 0.00 -0.54 -0.29 0.00 0.00 0.00 0.00 60.65 59.81 3cys s ILE 114 Cb 0.00 -4.32 -0.07 0.00 0.01 0.00 0.00 42.46 38.08 3cys s ILE 114 CO 0.00 -0.84 2.01 0.00 0.00 0.00 0.00 174.94 176.12 3cys n THR 116 N 6.28 1.22 -3.83 0.00 -1.04 0.10 -3.24 114.28 113.77 3cys n THR 116 Ca 0.23 -0.80 -0.06 0.00 -2.04 0.00 0.00 64.05 61.37 3cys n THR 116 Cb 0.43 0.04 -0.01 0.00 -1.82 0.00 0.00 70.33 68.96 3cys n THR 116 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3cys s ALA 117 N -1.71 -1.29 0.01 2.41 0.00 -1.22 -4.60 121.76 115.35 3cys s ALA 117 Ca 0.36 -0.25 -0.30 0.00 0.00 0.00 0.00 51.96 51.76 3cys s ALA 117 Cb 0.23 0.77 -0.06 0.00 0.00 0.00 0.00 23.12 24.05 3cys s ALA 117 CO 0.18 -1.04 1.49 0.21 0.00 0.00 0.00 175.76 176.61 3cys s LYS 118 N -3.47 4.25 -0.36 0.00 2.20 -1.26 -4.22 119.74 116.87 3cys s LYS 118 Ca 0.12 2.09 0.02 0.00 -0.36 0.00 0.00 55.97 57.84 3cys s LYS 118 Cb -0.04 -3.62 0.11 0.00 -1.51 0.00 0.00 37.83 32.76 3cys s LYS 118 CO 0.06 -0.65 0.12 0.95 -0.36 0.00 0.00 175.35 175.48 3cys s THR 119 N 2.64 1.59 -0.46 3.43 -4.23 -1.26 -4.95 115.64 112.40 3cys s THR 119 Ca 0.67 -2.11 0.23 0.00 -1.18 0.00 0.00 61.69 59.30 3cys s THR 119 Cb -0.34 -2.17 -0.07 0.00 1.34 0.00 0.00 72.50 71.27 3cys s THR 119 CO 0.28 -0.71 1.05 1.21 -0.54 0.00 0.00 174.62 175.91 3cys n GLU 120 N 4.24 0.41 -0.07 3.99 4.07 -1.26 -3.55 120.64 128.46 3cys n GLU 120 Ca 0.03 0.03 0.12 0.00 -0.06 0.00 0.00 57.16 57.28 3cys n GLU 120 Cb 0.40 -1.67 0.19 0.00 -0.06 0.00 0.00 31.44 30.29 3cys n GLU 120 CO 0.00 0.00 0.00 -2.67 -0.06 0.00 0.00 177.13 174.40 3cys n TRP 121 N -2.22 0.19 0.14 4.31 2.14 -1.26 -3.56 117.44 117.18 3cys n TRP 121 Ca 0.01 -0.10 0.02 0.00 2.07 0.00 0.00 57.50 59.51 3cys n TRP 121 Cb 0.48 0.00 0.03 0.00 -0.81 0.00 0.00 31.31 31.01 3cys n TRP 121 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 3cys n LEU 122 N 1.25 1.55 0.39 5.67 4.77 -1.24 -4.78 117.00 124.60 3cys n LEU 122 Ca 0.16 -1.18 -0.18 0.00 -0.03 0.00 0.00 56.01 54.78 3cys n LEU 122 Cb 0.57 -0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.55 3cys n LEU 122 CO 0.15 0.35 0.61 -0.78 -1.33 0.00 0.00 177.39 176.40 3cys h ASP 123 N 0.85 -0.93 -1.74 -1.43 1.82 -1.61 -2.43 116.42 110.96 3cys h ASP 123 Ca 0.00 0.04 -0.77 0.00 -0.39 0.00 0.00 57.03 55.91 3cys h ASP 123 Cb 0.26 0.26 -0.19 0.00 0.68 0.00 0.00 39.33 40.33 3cys h ASP 123 CO 0.00 -0.62 1.75 0.61 -1.61 0.00 0.00 179.24 179.38 3cys n GLY 124 N -1.53 5.27 0.47 -0.78 0.00 -1.26 -3.85 105.19 103.50 3cys n GLY 124 Ca -0.14 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 43.60 3cys n GLY 124 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3cys n LYS 125 N 1.90 0.00 0.21 1.61 0.00 -1.22 -4.98 118.16 115.68 3cys n LYS 125 Ca 0.47 0.00 0.10 0.00 0.00 0.00 0.00 58.31 58.88 3cys n LYS 125 Cb 0.30 0.00 0.23 0.00 0.00 0.00 0.00 35.03 35.56 3cys n LYS 125 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3cys h HIS 126 N 0.00 0.00 -3.23 5.64 3.86 -1.54 -3.45 115.15 116.43 3cys h HIS 126 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3cys h HIS 126 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 3cys h HIS 126 CO 0.00 0.14 -0.76 0.28 0.86 0.00 0.00 177.93 178.46 3cys n VAL 127 N -3.16 -4.75 -5.20 2.45 0.31 -1.26 -1.00 118.33 105.73 3cys n VAL 127 Ca 0.03 2.09 -0.31 0.00 -0.01 0.00 0.00 64.34 66.14 3cys n VAL 127 Cb 0.54 -2.92 -0.16 0.00 -0.91 0.00 0.00 33.84 30.39 3cys n VAL 127 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3cys s VAL 128 N -2.02 1.95 0.00 2.52 1.01 -1.26 -1.26 120.40 121.33 3cys s VAL 128 Ca 0.00 -1.01 0.11 0.00 0.00 0.00 0.00 61.98 61.07 3cys s VAL 128 Cb 0.00 -1.65 0.18 0.00 0.00 0.00 0.00 36.38 34.91 3cys s VAL 128 CO 0.00 0.55 1.01 2.22 0.00 0.00 0.00 175.10 178.87 3cys n PHE 129 N 2.94 0.00 -0.43 5.22 -1.74 -1.10 -4.65 117.46 117.70 3cys n PHE 129 Ca -0.17 -0.32 0.00 0.00 -0.56 0.00 0.00 57.45 56.40 3cys n PHE 129 Cb 0.52 0.07 0.00 0.00 1.52 0.00 0.00 39.48 41.59 3cys n PHE 129 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3cys n GLY 130 N 0.21 -1.83 3.38 4.97 0.00 -1.24 -1.28 105.19 109.39 3cys n GLY 130 Ca -0.04 -1.13 -0.10 0.00 0.00 0.00 0.00 46.02 44.75 3cys n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cys s LYS 131 N -1.86 1.17 0.06 1.61 0.00 0.76 -1.09 119.74 120.38 3cys s LYS 131 Ca 0.00 -0.78 -0.19 0.00 0.00 0.00 0.00 55.97 55.00 3cys s LYS 131 Cb 0.00 0.48 -0.06 0.00 0.00 0.00 0.00 37.83 38.24 3cys s LYS 131 CO 0.00 -0.47 0.54 0.08 0.00 0.00 0.00 175.35 175.51 3cys s VAL 132 N -3.84 4.79 -0.31 1.79 1.01 -0.43 -1.08 120.40 122.34 3cys s VAL 132 Ca 0.06 1.16 -0.02 0.00 0.00 0.00 0.00 61.98 63.18 3cys s VAL 132 Cb 0.01 -3.87 0.11 0.00 0.00 0.00 0.00 36.38 32.63 3cys s VAL 132 CO -0.08 0.55 0.13 -0.75 0.00 0.00 0.00 175.10 174.94 3cys s LYS 133 N -1.05 0.52 -0.14 2.72 2.20 -1.24 -4.88 119.74 117.86 3cys s LYS 133 Ca 0.28 -0.93 -0.10 0.00 -0.36 0.00 0.00 55.97 54.87 3cys s LYS 133 Cb -0.19 -1.62 0.04 0.00 -1.51 0.00 0.00 37.83 34.55 3cys s LYS 133 CO 0.18 -1.03 0.20 0.39 -0.36 0.00 0.00 175.35 174.73 3cys n GLU 134 N 4.87 -3.93 0.00 4.03 1.02 -1.26 -4.73 120.64 120.65 3cys n GLU 134 Ca -0.02 3.02 0.00 0.00 -0.02 0.00 0.00 57.16 60.14 3cys n GLU 134 Cb 0.41 -4.38 0.00 0.00 -0.02 0.00 0.00 31.44 27.45 3cys n GLU 134 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cys n GLY 135 N 1.44 0.48 0.44 0.62 0.00 -1.26 -4.43 105.19 102.48 3cys n GLY 135 Ca -0.33 0.00 0.27 0.00 0.00 0.00 0.00 46.02 45.96 3cys n GLY 135 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3cys h MET 136 N 0.00 0.27 -0.75 1.61 2.86 -1.92 0.55 114.93 117.55 3cys h MET 136 Ca 0.00 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3cys h MET 136 Cb 0.00 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 3cys h MET 136 CO 0.00 0.18 0.37 -0.97 1.06 0.00 0.00 176.91 177.55 3cys h ASN 137 N 0.28 0.98 -0.01 1.22 -1.24 -1.97 0.56 115.58 115.40 3cys h ASN 137 Ca 0.62 -0.13 -0.14 0.00 0.71 0.00 0.00 56.30 57.36 3cys h ASN 137 Cb 1.79 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 40.58 3cys h ASN 137 CO -0.26 0.83 -0.44 0.40 -1.29 0.00 0.00 177.43 176.66 3cys h ILE 138 N 1.06 1.31 -0.42 2.57 1.08 -0.30 -0.33 117.51 122.47 3cys h ILE 138 Ca 0.26 -1.63 -0.11 0.00 -0.39 0.00 0.00 64.86 62.98 3cys h ILE 138 Cb 0.11 1.62 -0.02 0.00 -3.07 0.00 0.00 36.82 35.46 3cys h ILE 138 CO -0.03 0.51 -0.18 0.58 -0.69 0.00 0.00 178.15 178.34 3cys h VAL 139 N 0.45 1.27 -0.32 1.67 2.07 -0.43 -2.93 116.25 118.03 3cys h VAL 139 Ca 0.03 -1.29 -0.12 0.00 0.82 0.00 0.00 66.70 66.14 3cys h VAL 139 Cb 0.95 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 3cys h VAL 139 CO 0.08 0.44 -0.30 -0.08 0.02 0.00 0.00 177.57 177.73 3cys h GLU 140 N 0.72 0.67 -0.50 1.57 4.57 0.50 -1.41 114.58 120.70 3cys h GLU 140 Ca 0.11 -0.30 0.02 0.00 -1.18 0.00 0.00 59.36 58.01 3cys h GLU 140 Cb 0.70 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.24 3cys h GLU 140 CO 0.05 0.89 0.30 0.00 -1.18 0.00 0.00 179.01 179.07 3cys h ALA 141 N 1.10 0.64 0.00 2.92 0.00 -0.88 -0.36 119.26 122.67 3cys h ALA 141 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3cys h ALA 141 Cb 0.80 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3cys h ALA 141 CO 0.07 -0.00 -0.25 0.00 0.00 0.00 0.00 179.25 179.06 3cys n MET 142 N -4.80 0.27 -0.02 0.00 0.00 -1.16 -3.30 117.12 108.10 3cys n MET 142 Ca 0.03 0.16 -0.18 0.00 0.00 0.00 0.00 57.70 57.72 3cys n MET 142 Cb 0.07 -1.76 -0.08 0.00 0.00 0.00 0.00 33.22 31.46 3cys n MET 142 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 3cys h GLU 143 N 0.00 0.79 0.00 3.17 4.81 -0.10 -3.17 114.58 120.08 3cys h GLU 143 Ca 0.00 -0.67 0.00 0.00 -0.13 0.00 0.00 59.36 58.56 3cys h GLU 143 Cb 0.74 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.26 3cys h GLU 143 CO 0.00 1.27 0.00 -2.13 -0.73 0.00 0.00 179.01 177.42 3cys n ARG 144 N -3.93 0.44 -0.11 1.92 3.00 -0.26 -1.88 116.66 115.84 3cys n ARG 144 Ca -0.08 0.04 0.12 0.00 -0.00 0.00 0.00 57.85 57.93 3cys n ARG 144 Cb 0.76 -1.50 0.18 0.00 0.00 0.00 0.00 32.46 31.91 3cys n ARG 144 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 3cys n PHE 145 N -1.24 0.28 -1.04 -0.14 3.01 -1.20 -4.94 117.46 112.19 3cys n PHE 145 Ca 0.13 -0.14 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3cys n PHE 145 Cb 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.66 3cys n PHE 145 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3cys n GLY 146 N 1.43 1.32 0.18 1.37 0.00 -0.79 -2.24 105.19 106.46 3cys n GLY 146 Ca 0.17 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.35 3cys n GLY 146 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3cys n SER 147 N 0.00 0.00 0.04 1.61 3.41 -1.25 -4.81 113.62 112.61 3cys n SER 147 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3cys n SER 147 Cb 0.00 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3cys n SER 147 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3cys n ARG 148 N -1.14 0.00 -0.29 4.33 1.85 -1.18 -4.25 116.66 115.98 3cys n ARG 148 Ca 0.00 0.00 0.09 0.00 -1.00 0.00 0.00 57.85 56.94 3cys n ARG 148 Cb 0.00 0.00 0.25 0.00 -1.05 0.00 0.00 32.46 31.66 3cys n ARG 148 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 3cys n ASN 149 N -2.72 3.55 -0.02 2.89 6.94 -1.26 -4.38 115.26 120.25 3cys n ASN 149 Ca 0.00 -2.00 -0.05 0.00 -0.02 0.00 0.00 54.58 52.52 3cys n ASN 149 Cb 0.00 -0.38 -0.02 0.00 -2.36 0.00 0.00 39.78 37.02 3cys n ASN 149 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3cys n GLY 150 N 1.21 -0.07 0.12 4.83 0.00 -1.26 -5.02 105.19 104.99 3cys n GLY 150 Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3cys n GLY 150 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3cys n LYS 151 N -3.09 0.00 0.00 1.61 2.85 -1.26 -4.78 118.16 113.49 3cys n LYS 151 Ca -0.09 0.12 0.00 0.00 -1.05 0.00 0.00 58.31 57.29 3cys n LYS 151 Cb 0.57 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.95 3cys n LYS 151 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 3cys n THR 152 N 0.60 0.00 -2.03 0.58 -2.24 -1.26 -4.76 114.28 105.17 3cys n THR 152 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 3cys n THR 152 Cb 0.00 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 3cys n THR 152 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3cys n SER 153 N -3.66 -0.14 0.00 3.42 3.41 -0.95 -4.21 113.62 111.49 3cys n SER 153 Ca 0.00 -1.42 0.00 0.00 -0.26 0.00 0.00 58.87 57.19 3cys n SER 153 Cb 0.00 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3cys n SER 153 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3cys n LYS 154 N 0.03 0.00 -3.01 4.33 5.02 -1.26 -5.12 118.16 118.15 3cys n LYS 154 Ca -0.05 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3cys n LYS 154 Cb 0.61 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.62 3cys n LYS 154 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3cys s LYS 155 N 0.75 0.71 -0.28 1.97 2.20 -1.26 -5.06 119.74 118.77 3cys s LYS 155 Ca 0.00 -0.37 -0.06 0.00 -0.36 0.00 0.00 55.97 55.18 3cys s LYS 155 Cb 0.00 0.05 0.00 0.00 -1.51 0.00 0.00 37.83 36.37 3cys s LYS 155 CO 0.00 -0.98 0.06 0.42 -0.36 0.00 0.00 175.35 174.49 3cys s ILE 156 N 1.64 3.86 0.21 5.43 1.01 -1.26 -0.78 121.20 131.31 3cys s ILE 156 Ca 0.19 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 60.23 3cys s ILE 156 Cb -0.01 -2.94 -0.05 0.00 0.01 0.00 0.00 42.46 39.47 3cys s ILE 156 CO -0.08 0.16 0.00 0.42 0.00 0.00 0.00 174.94 175.44 3cys s THR 157 N 1.50 0.85 0.03 2.92 -4.23 -0.59 -3.93 115.64 112.19 3cys s THR 157 Ca 0.03 -2.01 -0.28 0.00 -1.18 0.00 0.00 61.69 58.25 3cys s THR 157 Cb -0.17 -2.27 -0.04 0.00 1.34 0.00 0.00 72.50 71.37 3cys s THR 157 CO 0.01 -0.37 0.91 -0.63 -0.54 0.00 0.00 174.62 174.00 3cys s ILE 158 N -3.54 4.77 -0.16 2.99 1.01 -0.68 -0.69 121.20 124.90 3cys s ILE 158 Ca 0.27 1.92 -0.26 0.00 0.00 0.00 0.00 60.65 62.58 3cys s ILE 158 Cb 0.06 -4.25 -0.24 0.00 0.01 0.00 0.00 42.46 38.04 3cys s ILE 158 CO 0.07 0.25 0.58 0.00 0.00 0.00 0.00 174.94 175.84 3cys h ALA 159 N 6.29 0.09 -2.95 9.38 0.00 -1.21 -2.11 119.26 128.75 3cys h ALA 159 Ca -0.42 -0.74 0.03 0.00 0.00 0.00 0.00 54.91 53.78 3cys h ALA 159 Cb 1.21 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 19.18 3cys h ALA 159 CO 0.74 0.24 0.13 0.16 0.00 0.00 0.00 179.25 180.51 3cys s ASP 160 N -6.43 -0.24 0.27 0.00 1.47 -1.25 -4.72 116.67 105.77 3cys s ASP 160 Ca -0.22 -0.63 0.02 0.00 1.18 0.00 0.00 52.55 52.90 3cys s ASP 160 Cb -0.00 0.67 -0.04 0.00 -0.34 0.00 0.00 42.92 43.22 3cys s ASP 160 CO 0.65 -1.25 0.16 0.00 0.68 0.00 0.00 175.17 175.42 3cys n GLY 162 N -0.48 -1.04 2.81 0.00 0.00 -1.00 -4.93 105.19 100.55 3cys n GLY 162 Ca 0.02 -1.00 -0.18 0.00 0.00 0.00 0.00 46.02 44.86 3cys n GLY 162 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3cys s GLN 163 N -1.19 0.33 -1.31 1.61 0.74 -1.26 -0.49 119.66 118.09 3cys s GLN 163 Ca 0.00 0.09 -0.06 0.00 0.05 0.00 0.00 55.36 55.44 3cys s GLN 163 Cb 0.00 -0.54 0.13 0.00 1.10 0.00 0.00 33.01 33.70 3cys s GLN 163 CO 0.00 -0.16 2.29 1.28 -0.55 0.00 0.00 175.29 178.15 3cys n LEU 164 N 4.28 7.81 0.00 3.68 4.77 0.18 -4.87 117.00 132.84 3cys n LEU 164 Ca -0.24 -4.86 0.16 0.00 -0.03 0.00 0.00 56.01 51.04 3cys n LEU 164 Cb 0.50 -1.38 0.93 0.00 -2.33 0.00 0.00 43.42 41.15 3cys n LEU 164 CO 0.21 1.95 1.10 1.21 -1.33 0.00 0.00 177.39 180.52