#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cys s VAL 2 N 0.00 0.05 -0.46 2.03 -7.23 -1.26 -5.05 120.40 108.48 3cys s VAL 2 Ca 0.00 -1.98 0.03 0.00 -1.81 0.00 0.00 61.98 58.22 3cys s VAL 2 Cb 0.00 -2.41 0.13 0.00 0.56 0.00 0.00 36.38 34.66 3cys s VAL 2 CO 0.00 -0.10 0.23 0.20 -0.31 0.00 0.00 175.10 175.12 3cys s ASN 3 N -3.14 4.03 0.42 4.85 0.01 -1.26 -4.44 114.94 115.41 3cys s ASN 3 Ca 0.36 -2.73 -0.23 0.00 -0.71 0.00 0.00 52.86 49.55 3cys s ASN 3 Cb 0.07 -1.33 -0.09 0.00 0.41 0.00 0.00 41.25 40.31 3cys s ASN 3 CO 0.10 -0.26 1.05 -2.16 -1.51 0.00 0.00 177.10 174.31 3cys s PRO 4 N 0.16 4.05 0.14 -0.60 0.04 -1.26 -4.71 135.00 132.82 3cys s PRO 4 Ca 0.17 1.48 0.02 0.00 0.04 0.00 0.00 61.00 62.71 3cys s PRO 4 Cb -0.25 -2.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 3cys s PRO 4 CO -0.01 -0.23 0.28 0.99 0.04 0.00 0.00 177.00 178.06 3cys s THR 5 N -1.75 5.33 0.33 1.26 2.01 -1.26 -3.79 115.64 117.77 3cys s THR 5 Ca 0.61 -0.67 0.10 0.00 0.31 0.00 0.00 61.69 62.03 3cys s THR 5 Cb -0.21 -3.74 -0.06 0.00 0.01 0.00 0.00 72.50 68.51 3cys s THR 5 CO 0.26 -0.08 -0.06 0.68 -0.69 0.00 0.00 174.62 174.72 3cys s VAL 6 N -1.73 2.45 0.09 3.82 -7.23 -0.96 -0.64 120.40 116.19 3cys s VAL 6 Ca 0.35 -2.13 0.04 0.00 -1.81 0.00 0.00 61.98 58.43 3cys s VAL 6 Cb -0.11 -2.68 -0.03 0.00 0.56 0.00 0.00 36.38 34.12 3cys s VAL 6 CO 0.28 -0.23 -0.12 0.72 -0.31 0.00 0.00 175.10 175.45 3cys s PHE 7 N -2.56 1.12 -0.22 2.82 -0.71 -0.27 -2.12 117.98 116.04 3cys s PHE 7 Ca 0.33 -0.56 -0.04 0.00 -1.04 0.00 0.00 56.93 55.62 3cys s PHE 7 Cb 0.00 -0.62 0.11 0.00 -1.21 0.00 0.00 43.02 41.31 3cys s PHE 7 CO 0.18 0.03 0.39 0.12 -1.34 0.00 0.00 175.22 174.59 3cys s PHE 8 N -1.90 -0.80 -0.07 3.49 5.36 0.17 -2.09 117.98 122.13 3cys s PHE 8 Ca 0.02 1.11 -0.18 0.00 -0.96 0.00 0.00 56.93 56.92 3cys s PHE 8 Cb -0.06 0.13 -0.05 0.00 -0.34 0.00 0.00 43.02 42.70 3cys s PHE 8 CO 0.01 -0.61 0.48 0.34 -1.46 0.00 0.00 175.22 173.98 3cys s ASP 9 N 2.57 6.76 -0.04 6.13 -1.08 -0.72 -0.92 116.67 129.37 3cys s ASP 9 Ca 0.07 0.91 -0.07 0.00 -0.52 0.00 0.00 52.55 52.94 3cys s ASP 9 Cb -0.14 -2.29 -0.04 0.00 -1.46 0.00 0.00 42.92 38.99 3cys s ASP 9 CO -0.14 0.11 0.23 -0.63 0.52 0.00 0.00 175.17 175.25 3cys s ILE 10 N 0.03 5.36 -0.20 4.11 1.09 -0.47 -3.05 121.20 128.08 3cys s ILE 10 Ca 0.26 0.20 -0.05 0.00 -1.10 0.00 0.00 60.65 59.96 3cys s ILE 10 Cb -0.16 -3.52 0.07 0.00 -1.06 0.00 0.00 42.46 37.79 3cys s ILE 10 CO 0.12 0.46 0.13 0.00 -0.10 0.00 0.00 174.94 175.55 3cys s ALA 11 N -1.19 0.29 -0.53 9.38 0.00 -1.00 -2.84 121.76 125.87 3cys s ALA 11 Ca 0.23 -0.29 -0.16 0.00 0.00 0.00 0.00 51.96 51.73 3cys s ALA 11 Cb -0.13 -1.15 0.11 0.00 0.00 0.00 0.00 23.12 21.95 3cys s ALA 11 CO 0.12 -1.25 0.51 0.08 0.00 0.00 0.00 175.76 175.22 3cys s VAL 12 N 2.18 5.15 -0.30 0.00 1.01 0.85 -2.11 120.40 127.18 3cys s VAL 12 Ca 0.04 -1.30 -0.22 0.00 0.00 0.00 0.00 61.98 60.50 3cys s VAL 12 Cb -0.16 -4.32 0.03 0.00 0.00 0.00 0.00 36.38 31.94 3cys s VAL 12 CO -0.14 -0.84 0.41 -0.90 0.00 0.00 0.00 175.10 173.63 3cys n ASP 13 N 5.43 -6.26 -3.85 3.32 5.75 0.01 -2.17 116.55 118.78 3cys n ASP 13 Ca -0.13 0.20 -0.30 0.00 -0.01 0.00 0.00 54.79 54.55 3cys n ASP 13 Cb 0.41 -2.28 -0.02 0.00 -1.03 0.00 0.00 41.12 38.20 3cys n ASP 13 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cys n GLY 14 N 0.32 -0.46 2.77 6.12 0.00 -1.26 -4.89 105.19 107.78 3cys n GLY 14 Ca -0.03 0.10 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 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 -6.52 0.32 -0.29 1.61 2.56 -0.92 -5.12 118.70 110.35 3cys s GLU 15 Ca 0.59 -0.08 -0.29 0.00 0.00 0.00 0.00 54.97 55.19 3cys s GLU 15 Cb -0.32 -0.66 -0.00 0.00 2.00 0.00 0.00 34.13 35.14 3cys s GLU 15 CO 0.72 -0.99 1.34 -1.25 -0.56 0.00 0.00 175.26 174.53 3cys s PRO 16 N 2.38 3.90 0.10 4.30 0.04 -1.26 -0.11 135.00 144.35 3cys s PRO 16 Ca 0.09 1.31 -0.12 0.00 0.04 0.00 0.00 61.00 62.32 3cys s PRO 16 Cb -0.14 -3.90 -0.17 0.00 0.04 0.00 0.00 34.50 30.33 3cys s PRO 16 CO -0.31 -1.14 1.27 -0.07 0.04 0.00 0.00 177.00 176.79 3cys h LEU 17 N 10.98 0.91 0.00 -3.56 -0.00 -1.91 -3.49 115.31 118.24 3cys h LEU 17 Ca -0.27 -0.64 0.00 0.00 -0.00 0.00 0.00 57.88 56.96 3cys h LEU 17 Cb 1.11 -0.27 0.00 0.00 -0.00 0.00 0.00 40.66 41.49 3cys h LEU 17 CO 1.03 1.44 0.00 0.61 -0.00 0.00 0.00 178.44 181.52 3cys n GLY 18 N 0.84 0.23 3.63 0.83 0.00 -1.26 -4.94 105.19 104.53 3cys n GLY 18 Ca -0.09 -1.57 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 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 2.69 0.02 1.61 3.52 -1.26 -1.37 118.95 122.16 3cys s ARG 19 Ca 0.00 -0.64 0.06 0.00 -0.13 0.00 0.00 55.73 55.02 3cys s ARG 19 Cb 0.00 -2.59 -0.02 0.00 -1.56 0.00 0.00 34.95 30.78 3cys s ARG 19 CO 0.00 0.62 -0.18 0.08 -0.81 0.00 0.00 175.30 175.01 3cys s VAL 20 N -1.00 1.46 0.13 7.11 1.01 -0.10 -4.58 120.40 124.43 3cys s VAL 20 Ca 0.17 -1.00 0.08 0.00 0.00 0.00 0.00 61.98 61.23 3cys s VAL 20 Cb -0.11 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 3cys s VAL 20 CO 0.07 0.24 -0.18 -0.94 0.00 0.00 0.00 175.10 174.29 3cys s SER 21 N -0.89 2.47 -0.02 3.32 1.04 -1.22 0.42 113.70 118.82 3cys s SER 21 Ca 0.06 -0.79 0.01 0.00 0.48 0.00 0.00 55.95 55.71 3cys s SER 21 Cb -0.08 -0.13 0.02 0.00 0.10 0.00 0.00 66.02 65.93 3cys s SER 21 CO 0.01 -0.03 -0.01 -0.36 0.98 0.00 0.00 173.24 173.84 3cys s PHE 22 N -1.74 0.27 0.28 5.02 0.40 -0.90 -0.80 117.98 120.50 3cys s PHE 22 Ca 0.11 -0.01 -0.29 0.00 -0.60 0.00 0.00 56.93 56.14 3cys s PHE 22 Cb -0.07 -0.31 -0.09 0.00 0.51 0.00 0.00 43.02 43.06 3cys s PHE 22 CO 0.05 -0.08 0.99 -1.21 0.70 0.00 0.00 175.22 175.66 3cys s GLU 23 N 0.65 4.70 -0.27 0.44 2.02 0.10 -2.26 118.70 124.08 3cys s GLU 23 Ca -0.06 1.53 -0.01 0.00 0.02 0.00 0.00 54.97 56.45 3cys s GLU 23 Cb -0.09 -3.10 0.04 0.00 0.10 0.00 0.00 34.13 31.08 3cys s GLU 23 CO -0.01 0.35 -0.05 -0.51 0.02 0.00 0.00 175.26 175.05 3cys s LEU 24 N -1.54 3.49 -1.33 1.80 2.01 -1.25 -2.16 118.68 119.71 3cys s LEU 24 Ca 0.45 -1.14 -0.16 0.00 0.01 0.00 0.00 54.13 53.29 3cys s LEU 24 Cb -0.26 -1.65 0.01 0.00 0.01 0.00 0.00 46.19 44.30 3cys s LEU 24 CO 0.32 -0.19 2.14 0.49 1.01 0.00 0.00 176.35 180.12 3cys n PHE 25 N 4.60 3.34 0.24 0.29 3.72 -1.21 -4.42 117.46 124.02 3cys n PHE 25 Ca -0.15 -2.75 0.14 0.00 -0.05 0.00 0.00 57.45 54.65 3cys n PHE 25 Cb 0.45 -2.43 0.39 0.00 -0.94 0.00 0.00 39.48 36.95 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 6.50 1.00 -0.67 4.37 0.00 -1.82 -1.96 119.26 126.69 3cys h ALA 26 Ca 0.53 -0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.94 3cys h ALA 26 Cb 0.67 -0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.26 3cys h ALA 26 CO 1.86 0.00 0.59 -3.47 0.00 0.00 0.00 179.25 178.23 3cys n ASP 27 N -3.10 6.88 0.00 0.00 2.03 -1.26 -3.31 116.55 117.79 3cys n ASP 27 Ca 0.03 -3.35 0.00 0.00 0.52 0.00 0.00 54.79 51.98 3cys n ASP 27 Cb 0.44 -1.08 0.00 0.00 -0.72 0.00 0.00 41.12 39.75 3cys n ASP 27 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 3cys n LYS 28 N 0.08 0.00 -3.63 -0.67 2.85 -1.23 -5.02 118.16 110.54 3cys n LYS 28 Ca 0.45 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 57.43 3cys n LYS 28 Cb 0.56 0.00 -0.11 0.00 -0.65 0.00 0.00 35.03 34.82 3cys n LYS 28 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 3cys s VAL 29 N -0.80 1.43 1.08 0.58 -7.23 -0.74 -4.98 120.40 109.73 3cys s VAL 29 Ca 0.00 -3.18 -0.18 0.00 -1.81 0.00 0.00 61.98 56.81 3cys s VAL 29 Cb 0.00 -1.96 0.24 0.00 0.56 0.00 0.00 36.38 35.22 3cys s VAL 29 CO 0.00 -1.09 1.22 -2.16 -0.31 0.00 0.00 175.10 172.76 3cys s PRO 30 N -0.39 -0.26 0.00 4.82 0.04 -1.21 -2.98 135.00 135.02 3cys s PRO 30 Ca 0.27 -0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.07 3cys s PRO 30 Cb -0.05 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.77 3cys s PRO 30 CO -0.14 -3.04 0.00 1.17 0.04 0.00 0.00 177.00 175.02 3cys n LYS 31 N -4.25 0.00 -0.03 4.56 4.81 -1.26 -4.16 118.16 117.83 3cys n LYS 31 Ca 0.14 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.47 3cys n LYS 31 Cb 0.59 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.58 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 1.18 -0.89 3.15 2.02 -1.96 0.12 112.91 116.54 3cys h THR 32 Ca 0.00 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.62 3cys h THR 32 Cb 0.00 1.33 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 3cys h THR 32 CO 0.00 0.17 0.56 0.00 0.37 0.00 0.00 175.52 176.62 3cys h ALA 33 N 0.84 1.13 -0.15 6.16 0.00 -1.69 -2.94 119.26 122.60 3cys h ALA 33 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3cys h ALA 33 Cb 0.23 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3cys h ALA 33 CO -0.00 0.55 0.10 1.49 0.00 0.00 0.00 179.25 181.39 3cys h GLU 34 N 1.21 0.20 0.05 0.00 4.57 -1.77 0.13 114.58 118.97 3cys h GLU 34 Ca 0.32 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.51 3cys h GLU 34 Cb -0.10 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.39 3cys h GLU 34 CO -0.07 0.15 -0.47 -0.97 -1.18 0.00 0.00 179.01 176.47 3cys h ASN 35 N 0.19 -1.44 -0.53 1.04 -1.24 -0.81 0.29 115.58 113.08 3cys h ASN 35 Ca 0.05 0.16 -0.02 0.00 0.71 0.00 0.00 56.30 57.21 3cys h ASN 35 Cb -0.00 0.55 -0.02 0.00 0.73 0.00 0.00 38.32 39.57 3cys h ASN 35 CO -0.01 -0.50 0.27 0.15 -1.29 0.00 0.00 177.43 176.04 3cys h PHE 36 N -0.65 0.75 -0.69 0.67 3.57 -1.39 -0.15 116.94 119.05 3cys h PHE 36 Ca 0.02 -0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.63 3cys h PHE 36 Cb 0.70 -0.23 -0.10 0.00 2.79 0.00 0.00 35.95 39.11 3cys h PHE 36 CO -0.45 0.57 0.20 -0.09 -2.23 0.00 0.00 178.31 176.32 3cys h ARG 37 N 0.71 0.32 -0.15 1.11 9.65 -0.17 0.30 114.38 126.14 3cys h ARG 37 Ca 0.18 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 58.97 3cys h ARG 37 Cb 0.09 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.60 3cys h ARG 37 CO -0.03 0.21 -0.21 0.00 2.80 0.00 0.00 179.97 182.74 3cys h ALA 38 N 1.54 0.23 -0.19 2.80 0.00 0.41 -1.98 119.26 122.06 3cys h ALA 38 Ca 0.37 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3cys h ALA 38 Cb 0.58 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3cys h ALA 38 CO -0.43 0.17 -0.12 -0.07 0.00 0.00 0.00 179.25 178.80 3cys h LEU 39 N 0.03 0.30 0.31 0.00 3.38 -0.61 0.36 115.31 119.08 3cys h LEU 39 Ca 0.02 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3cys h LEU 39 Cb 0.77 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3cys h LEU 39 CO 0.05 0.45 -0.15 0.28 0.09 0.00 0.00 178.44 179.16 3cys h SER 40 N 0.30 -0.35 0.86 -0.43 0.02 -0.21 -3.20 113.55 110.53 3cys h SER 40 Ca 0.06 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3cys h SER 40 Cb 0.40 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.03 3cys h SER 40 CO 0.02 -0.20 0.00 0.00 -1.14 0.00 0.00 176.83 175.51 3cys h THR 41 N -0.52 0.00 -1.05 -2.27 1.03 -1.33 -3.41 112.91 105.37 3cys h THR 41 Ca -0.04 -0.39 -0.23 0.00 -0.01 0.00 0.00 66.41 65.74 3cys h THR 41 Cb 0.32 1.31 -0.05 0.00 -1.07 0.00 0.00 68.15 68.66 3cys h THR 41 CO 0.07 0.00 -0.25 0.61 -0.01 0.00 0.00 175.52 175.94 3cys n GLY 42 N -0.07 0.59 0.17 2.99 0.00 0.13 -4.85 105.19 104.14 3cys n GLY 42 Ca 0.01 -0.47 0.13 0.00 0.00 0.00 0.00 46.02 45.69 3cys n GLY 42 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3cys h GLU 43 N 0.00 0.00 0.00 1.61 4.39 -1.83 -2.75 114.58 116.00 3cys h GLU 43 Ca -0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.45 3cys h GLU 43 Cb 0.96 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 3cys h GLU 43 CO 0.32 0.00 -0.10 1.17 -1.16 0.00 0.00 179.01 179.25 3cys n LYS 44 N -2.60 0.28 0.00 2.33 3.00 -1.26 -4.90 118.16 115.02 3cys n LYS 44 Ca 0.03 0.20 0.00 0.00 -0.00 0.00 0.00 58.31 58.55 3cys n LYS 44 Cb 0.38 -1.80 0.00 0.00 0.00 0.00 0.00 35.03 33.61 3cys n LYS 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3cys n GLY 45 N 1.31 1.41 3.62 3.14 0.00 -1.04 -5.08 105.19 108.55 3cys n GLY 45 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 3cys n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3cys s PHE 46 N -1.03 0.57 0.00 1.61 -0.71 -1.26 -5.05 117.98 112.11 3cys s PHE 46 Ca 0.00 -0.97 0.00 0.00 -1.04 0.00 0.00 56.93 54.92 3cys s PHE 46 Cb 0.00 0.27 0.00 0.00 -1.21 0.00 0.00 43.02 42.08 3cys s PHE 46 CO 0.00 -1.22 0.00 0.41 -1.34 0.00 0.00 175.22 173.07 3cys n GLY 47 N -0.50 2.67 3.26 1.99 0.00 -1.25 -4.37 105.19 106.97 3cys n GLY 47 Ca -0.02 -1.39 -0.23 0.00 0.00 0.00 0.00 46.02 44.38 3cys n GLY 47 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3cys n TYR 48 N 1.66 -1.88 -2.69 1.61 4.02 -1.22 -4.56 117.16 114.09 3cys n TYR 48 Ca 0.00 0.51 -0.07 0.00 -0.01 0.00 0.00 57.90 58.33 3cys n TYR 48 Cb 0.00 -3.55 0.10 0.00 -0.02 0.00 0.00 39.34 35.87 3cys n TYR 48 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 3cys n LYS 49 N -3.88 1.22 -2.73 -0.72 4.81 -1.26 -4.70 118.16 110.89 3cys n LYS 49 Ca -0.05 -2.07 -0.09 0.00 -0.87 0.00 0.00 58.31 55.23 3cys n LYS 49 Cb 0.57 -0.26 0.09 0.00 0.02 0.00 0.00 35.03 35.45 3cys n LYS 49 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3cys n GLY 50 N -0.58 0.56 3.92 3.14 0.00 -1.26 -4.96 105.19 105.99 3cys n GLY 50 Ca -0.02 0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.09 3cys n GLY 50 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3cys n SER 51 N 0.49 -4.95 -3.75 1.61 7.64 -1.26 -4.72 113.62 108.67 3cys n SER 51 Ca 0.06 0.54 -0.20 0.00 1.01 0.00 0.00 58.87 60.28 3cys n SER 51 Cb 0.69 -1.53 -0.17 0.00 -1.01 0.00 0.00 64.21 62.19 3cys n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3cys s PHE 53 N 1.76 -0.37 0.01 0.00 5.36 -1.26 -4.40 117.98 119.07 3cys s PHE 53 Ca 0.01 0.68 0.00 0.00 -0.96 0.00 0.00 56.93 56.66 3cys s PHE 53 Cb -0.13 0.22 0.00 0.00 -0.34 0.00 0.00 43.02 42.78 3cys s PHE 53 CO -0.03 -0.18 0.00 1.58 -1.46 0.00 0.00 175.22 175.12 3cys n HIS 54 N 4.23 -2.04 -3.65 10.12 -0.00 -1.26 -4.61 115.22 118.01 3cys n HIS 54 Ca -0.12 0.02 0.00 0.00 0.46 0.00 0.00 57.72 58.08 3cys n HIS 54 Cb 0.55 0.45 -0.06 0.00 -0.12 0.00 0.00 29.99 30.81 3cys n HIS 54 CO 0.00 0.00 0.00 0.50 0.46 0.00 0.00 176.34 177.30 3cys s ARG 55 N -1.02 0.18 -0.06 1.57 3.52 -1.26 -5.00 118.95 116.89 3cys s ARG 55 Ca 0.00 0.30 0.01 0.00 -0.13 0.00 0.00 55.73 55.91 3cys s ARG 55 Cb 0.00 0.04 0.02 0.00 -1.56 0.00 0.00 34.95 33.45 3cys s ARG 55 CO 0.00 -0.04 -0.06 0.42 -0.81 0.00 0.00 175.30 174.82 3cys s ILE 56 N 1.08 0.66 -0.07 4.11 1.01 -1.24 -3.65 121.20 123.09 3cys s ILE 56 Ca -0.07 -0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.43 3cys s ILE 56 Cb -0.03 -0.68 0.01 0.00 0.01 0.00 0.00 42.46 41.78 3cys s ILE 56 CO -0.12 0.26 -0.12 -0.63 0.00 0.00 0.00 174.94 174.33 3cys s ILE 57 N 1.05 1.17 -0.02 2.92 1.01 -0.33 -3.98 121.20 123.01 3cys s ILE 57 Ca -0.09 -0.49 -0.30 0.00 0.00 0.00 0.00 60.65 59.77 3cys s ILE 57 Cb -0.14 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 3cys s ILE 57 CO -0.01 0.37 1.20 -2.16 0.00 0.00 0.00 174.94 174.34 3cys s PRO 58 N 0.76 4.38 -0.43 2.79 0.04 -1.26 -2.72 135.00 138.55 3cys s PRO 58 Ca -0.13 1.70 -0.02 0.00 0.04 0.00 0.00 61.00 62.59 3cys s PRO 58 Cb -0.16 -3.50 0.00 0.00 0.04 0.00 0.00 34.50 30.88 3cys s PRO 58 CO 0.03 -0.39 0.37 0.41 0.04 0.00 0.00 177.00 177.46 3cys n GLY 59 N 3.33 0.38 2.03 0.56 0.00 -1.26 -4.86 105.19 105.38 3cys n GLY 59 Ca 0.10 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.97 -3.83 -3.57 1.61 7.35 -1.22 -4.86 117.46 109.97 3cys n PHE 60 Ca -0.02 1.00 -0.14 0.00 -0.76 0.00 0.00 57.45 57.52 3cys n PHE 60 Cb 0.53 2.67 -0.06 0.00 0.35 0.00 0.00 39.48 42.97 3cys n PHE 60 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3cys s MET 61 N -1.62 0.82 -0.00 -4.13 0.23 -1.10 -1.04 119.30 112.46 3cys s MET 61 Ca 0.00 0.40 -0.05 0.00 -1.03 0.00 0.00 55.69 55.00 3cys s MET 61 Cb 0.00 0.39 -0.00 0.00 -1.53 0.00 0.00 34.83 33.69 3cys s MET 61 CO 0.00 -0.22 0.10 0.00 -2.03 0.00 0.00 175.02 172.87 3cys n GLN 63 N 1.72 0.00 0.00 0.00 0.00 -1.24 -4.02 117.38 113.84 3cys n GLN 63 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.79 3cys n GLN 63 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.80 3cys n GLN 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3cys n GLY 64 N 0.00 1.84 0.00 1.69 0.00 -1.26 -4.71 105.19 102.75 3cys n GLY 64 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 3cys n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cys n GLY 65 N 0.97 -0.31 3.63 -0.02 0.00 -1.26 -4.64 105.19 103.55 3cys n GLY 65 Ca 0.00 -1.35 -0.32 0.00 0.00 0.00 0.00 46.02 44.35 3cys n GLY 65 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cys n ASP 66 N 0.98 -5.05 0.00 1.61 5.75 -1.26 -4.82 116.55 113.76 3cys n ASP 66 Ca 0.00 -0.55 0.00 0.00 -0.01 0.00 0.00 54.79 54.23 3cys n ASP 66 Cb 0.00 -1.56 0.00 0.00 -1.03 0.00 0.00 41.12 38.53 3cys n ASP 66 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3cys n PHE 67 N -1.33 -1.14 0.00 2.11 3.72 -1.26 -3.78 117.46 115.78 3cys n PHE 67 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 3cys n PHE 67 Cb 0.68 0.35 0.00 0.00 -0.94 0.00 0.00 39.48 39.57 3cys n PHE 67 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 3cys n THR 68 N -2.04 0.00 -2.17 4.37 5.66 -1.26 -3.08 114.28 115.76 3cys n THR 68 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 3cys n THR 68 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 3cys n THR 68 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 3cys n ARG 69 N 0.00 3.84 -1.89 1.09 3.00 -1.26 -4.88 116.66 116.56 3cys n ARG 69 Ca 0.00 -3.41 -0.38 0.00 -0.00 0.00 0.00 57.85 54.06 3cys n ARG 69 Cb 0.00 -2.86 -0.04 0.00 0.00 0.00 0.00 32.46 29.56 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 3.41 3.10 0.01 -0.14 8.25 -1.26 -2.38 115.22 126.20 3cys n HIS 70 Ca 0.48 -2.13 0.00 0.00 -0.26 0.00 0.00 57.72 55.80 3cys n HIS 70 Cb 0.33 -2.37 0.00 0.00 1.12 0.00 0.00 29.99 29.07 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 9.74 -0.09 -0.75 0.41 2.85 -1.26 -4.96 115.26 121.20 3cys n ASN 71 Ca 0.48 0.04 0.03 0.00 -0.11 0.00 0.00 54.58 55.03 3cys n ASN 71 Cb 0.44 0.25 0.20 0.00 1.24 0.00 0.00 39.78 41.91 3cys n ASN 71 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3cys n GLY 72 N -1.16 4.91 2.72 8.20 0.00 -1.17 -4.99 105.19 113.72 3cys n GLY 72 Ca 0.00 -1.23 -0.02 0.00 0.00 0.00 0.00 46.02 44.77 3cys n GLY 72 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3cys n THR 73 N -1.11 -8.85 0.00 2.61 -1.04 -1.21 -5.03 114.28 99.65 3cys n THR 73 Ca 0.24 0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.36 3cys n THR 73 Cb 0.83 -6.45 0.00 0.00 -1.82 0.00 0.00 70.33 62.89 3cys n THR 73 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3cys n GLY 74 N -1.21 -0.74 1.94 3.41 0.00 -1.00 -4.82 105.19 102.76 3cys n GLY 74 Ca 0.03 -1.26 -0.07 0.00 0.00 0.00 0.00 46.02 44.73 3cys n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cys n GLY 75 N 2.99 0.21 3.80 -0.02 0.00 -1.18 -4.88 105.19 106.11 3cys n GLY 75 Ca 0.00 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.68 2.47 -0.93 1.61 3.01 -1.26 -3.83 119.74 116.14 3cys s LYS 76 Ca 0.04 0.92 -0.02 0.00 -1.01 0.00 0.00 55.97 55.91 3cys s LYS 76 Cb -0.02 -1.94 0.27 0.00 -1.01 0.00 0.00 37.83 35.13 3cys s LYS 76 CO 0.26 -1.42 1.07 0.45 0.51 0.00 0.00 175.35 176.21 3cys n SER 77 N -3.34 5.06 0.00 2.83 2.88 0.15 -4.76 113.62 116.44 3cys n SER 77 Ca 0.08 -3.30 0.00 0.00 -1.33 0.00 0.00 58.87 54.32 3cys n SER 77 Cb 0.54 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 3cys n SER 77 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 3cys n ILE 78 N 1.65 0.00 0.29 2.46 -5.35 -1.26 -0.45 119.36 116.69 3cys n ILE 78 Ca 0.25 0.00 0.07 0.00 -0.27 0.00 0.00 62.75 62.80 3cys n ILE 78 Cb 0.37 0.00 0.32 0.00 -1.74 0.00 0.00 39.64 38.59 3cys n ILE 78 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3cys n TYR 79 N 0.00 0.32 -0.82 4.28 4.01 -1.26 -4.80 117.16 118.89 3cys n TYR 79 Ca 0.00 0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.88 3cys n TYR 79 Cb 0.00 -0.73 0.00 0.00 -0.31 0.00 0.00 39.34 38.30 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 -0.62 -1.43 0.20 2.72 0.00 0.40 -5.00 105.19 101.46 3cys n GLY 80 Ca 0.01 -1.03 -0.07 0.00 0.00 0.00 0.00 46.02 44.93 3cys n GLY 80 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3cys h GLU 81 N 0.00 0.42 -4.15 1.61 5.08 -1.87 0.44 114.58 116.11 3cys h GLU 81 Ca 0.00 -0.26 -0.14 0.00 -1.00 0.00 0.00 59.36 57.97 3cys h GLU 81 Cb 0.00 0.03 -0.14 0.00 0.50 0.00 0.00 28.75 29.14 3cys h GLU 81 CO 0.00 0.85 -0.52 0.15 -1.00 0.00 0.00 179.01 178.49 3cys s LYS 82 N -3.96 0.92 0.06 2.33 1.02 -1.26 -4.08 119.74 114.76 3cys s LYS 82 Ca -0.06 -1.25 -0.28 0.00 0.02 0.00 0.00 55.97 54.40 3cys s LYS 82 Cb 0.12 0.29 0.09 0.00 -0.52 0.00 0.00 37.83 37.80 3cys s LYS 82 CO 0.82 -0.28 0.98 -0.59 -0.92 0.00 0.00 175.35 175.36 3cys s PHE 83 N -3.97 -0.20 0.66 3.18 -0.71 0.00 -4.96 117.98 111.98 3cys s PHE 83 Ca 0.16 -0.01 -0.14 0.00 -1.04 0.00 0.00 56.93 55.91 3cys s PHE 83 Cb 0.06 0.58 -0.00 0.00 -1.21 0.00 0.00 43.02 42.45 3cys s PHE 83 CO -0.03 -0.62 1.08 -1.21 -1.34 0.00 0.00 175.22 173.09 3cys s GLU 84 N -3.08 2.93 0.74 1.99 2.02 -1.26 -3.37 118.70 118.67 3cys s GLU 84 Ca 0.10 1.19 -0.11 0.00 0.02 0.00 0.00 54.97 56.17 3cys s GLU 84 Cb -0.01 -1.98 0.04 0.00 0.10 0.00 0.00 34.13 32.28 3cys s GLU 84 CO -0.03 -1.12 1.08 0.16 0.02 0.00 0.00 175.26 175.36 3cys s ASP 85 N -3.05 4.90 -0.08 -0.19 -4.77 -1.26 -4.97 116.67 107.25 3cys s ASP 85 Ca 0.63 1.63 -0.04 0.00 -3.30 0.00 0.00 52.55 51.47 3cys s ASP 85 Cb -0.17 -2.43 -0.01 0.00 -1.09 0.00 0.00 42.92 39.22 3cys s ASP 85 CO 0.45 -1.75 -0.07 -0.33 0.70 0.00 0.00 175.17 174.16 3cys h GLU 86 N -0.93 0.00 -1.29 2.11 4.39 -1.95 -3.51 114.58 113.39 3cys h GLU 86 Ca -0.44 0.00 0.27 0.00 0.34 0.00 0.00 59.36 59.53 3cys h GLU 86 Cb 1.23 0.00 -0.21 0.00 -0.10 0.00 0.00 28.75 29.67 3cys h GLU 86 CO 0.55 0.00 0.87 0.54 -1.16 0.00 0.00 179.01 179.82 3cys s ASN 87 N -4.83 -0.09 -0.76 1.42 4.22 -1.26 -5.04 114.94 108.60 3cys s ASN 87 Ca -0.06 0.02 -0.01 0.00 -2.14 0.00 0.00 52.86 50.67 3cys s ASN 87 Cb 0.01 0.09 0.39 0.00 1.28 0.00 0.00 41.25 43.02 3cys s ASN 87 CO 0.09 -0.15 1.94 0.49 -2.04 0.00 0.00 177.10 177.44 3cys n PHE 88 N 0.04 3.07 0.23 1.54 3.72 -1.26 -4.56 117.46 120.24 3cys n PHE 88 Ca 0.02 -2.57 0.06 0.00 -0.05 0.00 0.00 57.45 54.91 3cys n PHE 88 Cb 0.58 -1.16 0.53 0.00 -0.94 0.00 0.00 39.48 38.48 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 1.77 1.09 -4.09 4.37 2.04 -1.96 -3.43 117.51 117.31 3cys h ILE 89 Ca 0.56 -0.56 -0.46 0.00 1.00 0.00 0.00 64.86 65.39 3cys h ILE 89 Cb 0.34 1.30 0.09 0.00 -0.74 0.00 0.00 36.82 37.82 3cys h ILE 89 CO 1.42 0.16 0.31 -0.76 0.00 0.00 0.00 178.15 179.28 3cys s LEU 90 N -8.62 2.68 0.32 1.44 2.01 -1.26 -5.10 118.68 110.15 3cys s LEU 90 Ca -0.04 0.56 0.07 0.00 0.01 0.00 0.00 54.13 54.72 3cys s LEU 90 Cb 0.16 -3.09 -0.03 0.00 0.01 0.00 0.00 46.19 43.23 3cys s LEU 90 CO 0.69 -1.81 0.27 -0.54 1.01 0.00 0.00 176.35 175.97 3cys s LYS 91 N -5.42 1.73 -0.71 1.70 1.02 -1.26 -4.91 119.74 111.88 3cys s LYS 91 Ca 0.62 -2.00 -0.04 0.00 0.02 0.00 0.00 55.97 54.57 3cys s LYS 91 Cb -0.10 0.32 0.18 0.00 -0.52 0.00 0.00 37.83 37.71 3cys s LYS 91 CO 0.47 -0.64 0.56 -1.01 -0.92 0.00 0.00 175.35 173.81 3cys s HIS 92 N -3.48 3.55 0.11 3.18 3.76 -1.26 -4.91 115.29 116.24 3cys s HIS 92 Ca 0.41 -2.71 -0.16 0.00 -0.15 0.00 0.00 55.06 52.45 3cys s HIS 92 Cb 0.03 -3.28 -0.04 0.00 1.11 0.00 0.00 32.58 30.39 3cys s HIS 92 CO 0.27 -0.83 1.53 1.79 -0.85 0.00 0.00 174.74 176.65 3cys h THR 93 N 4.93 1.27 0.00 1.30 1.35 -1.94 -3.41 112.91 116.40 3cys h THR 93 Ca 0.04 -1.07 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 3cys h THR 93 Cb 0.93 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 3cys h THR 93 CO 0.75 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.98 3cys n GLY 94 N -0.26 -0.75 3.81 5.82 0.00 -1.26 -4.83 105.19 107.73 3cys n GLY 94 Ca -0.02 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.89 3.13 -0.25 1.61 0.04 -1.24 -4.00 135.00 133.41 3cys s PRO 95 Ca 0.00 1.05 -0.00 0.00 0.04 0.00 0.00 61.00 62.08 3cys s PRO 95 Cb 0.00 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.53 3cys s PRO 95 CO 0.00 -0.95 0.03 0.41 0.04 0.00 0.00 177.00 176.53 3cys n GLY 96 N -1.60 0.33 3.14 0.56 0.00 0.84 -4.90 105.19 103.55 3cys n GLY 96 Ca 0.08 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.29 1.89 -0.93 -0.61 -1.09 -1.21 -1.02 121.20 115.93 3cys s ILE 97 Ca 0.01 -0.88 -0.23 0.00 -2.23 0.00 0.00 60.65 57.32 3cys s ILE 97 Cb -0.01 -1.68 0.06 0.00 -1.58 0.00 0.00 42.46 39.26 3cys s ILE 97 CO 0.02 0.52 1.33 -0.22 -1.23 0.00 0.00 174.94 175.35 3cys s LEU 98 N 0.81 3.80 0.28 2.97 2.96 -0.86 -1.32 118.68 127.31 3cys s LEU 98 Ca -0.08 -1.37 0.06 0.00 -0.22 0.00 0.00 54.13 52.52 3cys s LEU 98 Cb -0.16 -2.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.98 3cys s LEU 98 CO -0.01 -1.47 0.30 -0.44 -1.32 0.00 0.00 176.35 173.41 3cys s SER 99 N 4.43 5.77 0.43 3.68 0.01 -1.24 -2.46 113.70 124.31 3cys s SER 99 Ca 0.40 -0.20 0.04 0.00 1.31 0.00 0.00 55.95 57.50 3cys s SER 99 Cb -0.03 -1.42 0.04 0.00 0.21 0.00 0.00 66.02 64.81 3cys s SER 99 CO -0.04 -0.17 0.30 0.80 0.41 0.00 0.00 173.24 174.54 3cys n MET 100 N -1.35 0.87 -4.04 12.44 1.56 0.20 -3.13 117.12 123.66 3cys n MET 100 Ca -0.06 -2.70 -0.10 0.00 -0.27 0.00 0.00 57.70 54.57 3cys n MET 100 Cb 0.58 0.32 -0.08 0.00 2.15 0.00 0.00 33.22 36.19 3cys n MET 100 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3cys s ALA 101 N -2.62 0.35 -0.13 -5.12 0.00 -1.11 -4.51 121.76 108.62 3cys s ALA 101 Ca 0.23 -1.14 -0.30 0.00 0.00 0.00 0.00 51.96 50.75 3cys s ALA 101 Cb -0.02 0.92 0.10 0.00 0.00 0.00 0.00 23.12 24.12 3cys s ALA 101 CO 0.14 -0.61 0.85 0.54 0.00 0.00 0.00 175.76 176.69 3cys s ASN 102 N -3.01 -0.53 -0.49 0.00 4.22 -1.26 -4.58 114.94 109.29 3cys s ASN 102 Ca 0.22 0.66 0.03 0.00 -2.14 0.00 0.00 52.86 51.62 3cys s ASN 102 Cb 0.05 0.55 0.54 0.00 1.28 0.00 0.00 41.25 43.66 3cys s ASN 102 CO 0.02 -0.43 1.82 0.00 -2.04 0.00 0.00 177.10 176.48 3cys n ALA 103 N 1.10 5.64 0.00 3.54 0.00 -1.26 -5.00 120.51 124.52 3cys n ALA 103 Ca -0.14 -3.25 0.00 0.00 0.00 0.00 0.00 53.44 50.04 3cys n ALA 103 Cb 0.57 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.01 0.04 3.68 0.00 0.00 -1.26 -5.00 105.19 101.64 3cys n GLY 104 Ca 0.55 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 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 -1.97 4.32 -1.27 1.61 0.04 -1.26 -3.77 135.00 132.70 3cys s PRO 105 Ca 0.00 1.70 -0.04 0.00 0.04 0.00 0.00 61.00 62.70 3cys s PRO 105 Cb 0.00 -3.61 0.01 0.00 0.04 0.00 0.00 34.50 30.94 3cys s PRO 105 CO 0.00 -0.52 1.05 0.09 0.04 0.00 0.00 177.00 177.66 3cys n ASN 106 N 5.55 -3.60 -0.27 6.66 4.13 -1.26 -4.87 115.26 121.60 3cys n ASN 106 Ca 0.12 -0.61 0.06 0.00 1.68 0.00 0.00 54.58 55.83 3cys n ASN 106 Cb 0.46 -5.00 -0.00 0.00 -1.54 0.00 0.00 39.78 33.69 3cys n ASN 106 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3cys n THR 107 N -4.46 0.00 -1.75 3.41 -2.24 -1.25 -4.22 114.28 103.77 3cys n THR 107 Ca -0.18 -0.37 -0.42 0.00 -2.27 0.00 0.00 64.05 60.81 3cys n THR 107 Cb 0.63 1.14 -0.03 0.00 -2.10 0.00 0.00 70.33 69.97 3cys n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3cys s ASN 108 N -1.55 6.40 0.00 3.42 -0.87 -1.22 -4.47 114.94 116.66 3cys s ASN 108 Ca 0.10 2.84 0.00 0.00 -1.57 0.00 0.00 52.86 54.23 3cys s ASN 108 Cb 0.10 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.73 3cys s ASN 108 CO 0.31 -0.96 0.00 0.61 -2.57 0.00 0.00 177.10 174.49 3cys n GLY 109 N 3.98 0.13 0.00 0.66 0.00 -1.26 -0.82 105.19 107.88 3cys n GLY 109 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.13 0.00 -2.51 1.61 3.41 -1.25 -4.75 113.62 109.00 3cys n SER 110 Ca 0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.41 3cys n SER 110 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 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 -1.00 -2.77 4.33 3.00 -1.26 -4.56 117.38 115.13 3cys n GLN 111 Ca 0.00 0.70 -0.16 0.00 -0.01 0.00 0.00 57.00 57.53 3cys n GLN 111 Cb 0.00 -1.09 0.02 0.00 0.00 0.00 0.00 30.24 29.16 3cys n GLN 111 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 3cys n PHE 112 N -0.39 -1.47 -2.06 1.08 1.16 -1.26 -2.74 117.46 111.78 3cys n PHE 112 Ca -0.07 -1.47 -0.04 0.00 -1.87 0.00 0.00 57.45 54.00 3cys n PHE 112 Cb 0.37 -0.32 -0.04 0.00 -1.61 0.00 0.00 39.48 37.88 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 -1.51 0.00 -0.51 2.97 3.72 -1.18 -4.73 117.46 116.21 3cys n PHE 113 Ca 0.03 -0.39 0.00 0.00 -0.05 0.00 0.00 57.45 57.04 3cys n PHE 113 Cb 0.40 0.35 0.00 0.00 -0.94 0.00 0.00 39.48 39.30 3cys n PHE 113 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3cys n ILE 114 N 0.06 0.00 -3.62 4.37 5.41 -1.24 -3.21 119.36 121.13 3cys n ILE 114 Ca -0.18 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.55 3cys n ILE 114 Cb 0.72 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 39.59 3cys n ILE 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3cys n THR 116 N 4.00 2.21 -3.88 0.00 -1.04 -0.21 -0.11 114.28 115.26 3cys n THR 116 Ca -0.18 -2.24 -0.02 0.00 -2.04 0.00 0.00 64.05 59.58 3cys n THR 116 Cb 0.57 -0.26 0.01 0.00 -1.82 0.00 0.00 70.33 68.83 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 -2.95 -1.80 0.14 2.41 0.00 -1.22 -4.31 121.76 114.02 3cys s ALA 117 Ca 0.39 -0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.90 3cys s ALA 117 Cb 0.34 0.75 -0.07 0.00 0.00 0.00 0.00 23.12 24.14 3cys s ALA 117 CO 0.04 -1.08 0.92 0.21 0.00 0.00 0.00 175.76 175.85 3cys s LYS 118 N -2.25 4.70 -0.40 0.00 2.20 -1.26 -3.66 119.74 119.07 3cys s LYS 118 Ca 0.22 1.39 0.01 0.00 -0.36 0.00 0.00 55.97 57.23 3cys s LYS 118 Cb -0.02 -3.35 0.14 0.00 -1.51 0.00 0.00 37.83 33.10 3cys s LYS 118 CO 0.03 0.32 0.24 0.95 -0.36 0.00 0.00 175.35 176.53 3cys s THR 119 N -0.36 0.77 -0.57 3.43 -4.23 -1.26 -4.96 115.64 108.46 3cys s THR 119 Ca 0.44 -2.19 0.24 0.00 -1.18 0.00 0.00 61.69 59.00 3cys s THR 119 Cb -0.24 -1.54 0.24 0.00 1.34 0.00 0.00 72.50 72.30 3cys s THR 119 CO 0.29 -0.96 1.58 -0.33 -0.54 0.00 0.00 174.62 174.66 3cys h GLU 120 N 6.78 0.00 0.00 3.99 5.08 -1.95 -1.66 114.58 126.82 3cys h GLU 120 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3cys h GLU 120 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 3cys h GLU 120 CO 0.38 0.00 -0.66 -2.67 -1.00 0.00 0.00 179.01 175.06 3cys n TRP 121 N -2.56 0.08 0.43 4.33 2.14 -1.26 -3.20 117.44 117.40 3cys n TRP 121 Ca 0.04 0.02 0.08 0.00 2.07 0.00 0.00 57.50 59.72 3cys n TRP 121 Cb 0.48 -0.27 -0.12 0.00 -0.81 0.00 0.00 31.31 30.59 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 -1.61 0.43 -0.02 5.67 4.77 -1.15 -4.58 117.00 120.51 3cys n LEU 122 Ca 0.05 -0.27 -0.09 0.00 -0.03 0.00 0.00 56.01 55.67 3cys n LEU 122 Cb 0.36 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.41 3cys n LEU 122 CO 0.37 0.11 0.82 -0.78 -1.33 0.00 0.00 177.39 176.57 3cys h ASP 123 N 0.00 -0.23 -2.70 -1.43 3.58 -1.26 -0.37 116.42 114.00 3cys h ASP 123 Ca 0.00 0.06 -0.80 0.00 0.42 0.00 0.00 57.03 56.71 3cys h ASP 123 Cb 0.59 0.13 -0.29 0.00 1.72 0.00 0.00 39.33 41.49 3cys h ASP 123 CO 0.00 -0.09 0.77 0.61 -2.88 0.00 0.00 179.24 177.65 3cys n GLY 124 N -1.21 5.43 0.56 -0.78 0.00 -1.26 -4.30 105.19 103.62 3cys n GLY 124 Ca -0.03 -2.65 0.00 0.00 0.00 0.00 0.00 46.02 43.34 3cys n GLY 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cys n LYS 125 N 0.91 0.00 -3.50 1.61 5.02 -1.08 -5.07 118.16 116.05 3cys n LYS 125 Ca 0.32 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.41 3cys n LYS 125 Cb 0.32 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.31 3cys n LYS 125 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3cys s HIS 126 N -2.00 2.85 -0.01 2.13 3.76 -0.17 -5.07 115.29 116.78 3cys s HIS 126 Ca 0.00 -0.38 -0.02 0.00 -0.15 0.00 0.00 55.06 54.51 3cys s HIS 126 Cb 0.00 -2.08 -0.04 0.00 1.11 0.00 0.00 32.58 31.57 3cys s HIS 126 CO 0.00 -0.08 0.14 0.08 -0.85 0.00 0.00 174.74 174.03 3cys s VAL 127 N -2.35 5.17 -0.06 -0.90 1.01 -1.26 -4.85 120.40 117.16 3cys s VAL 127 Ca 0.47 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 62.22 3cys s VAL 127 Cb -0.06 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.92 3cys s VAL 127 CO 0.29 0.33 -0.15 -0.69 0.00 0.00 0.00 175.10 174.88 3cys s VAL 128 N -1.28 1.31 -0.02 2.92 1.01 -1.26 0.59 120.40 123.67 3cys s VAL 128 Ca 0.26 -0.61 0.13 0.00 0.00 0.00 0.00 61.98 61.76 3cys s VAL 128 Cb -0.12 -1.16 0.23 0.00 0.00 0.00 0.00 36.38 35.33 3cys s VAL 128 CO 0.17 0.39 1.10 2.22 0.00 0.00 0.00 175.10 178.98 3cys n PHE 129 N 3.48 -0.03 -3.85 5.22 -1.74 -1.03 -4.67 117.46 114.84 3cys n PHE 129 Ca -0.20 -0.59 0.03 0.00 -0.56 0.00 0.00 57.45 56.13 3cys n PHE 129 Cb 0.53 0.21 0.01 0.00 1.52 0.00 0.00 39.48 41.74 3cys n PHE 129 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 3cys s GLY 130 N -1.55 -0.26 -0.18 4.97 0.00 -1.24 -3.31 107.32 105.75 3cys s GLY 130 Ca 0.17 0.33 -0.19 0.00 0.00 0.00 0.00 44.72 45.03 3cys s GLY 130 CO -0.08 3.83 0.53 1.25 0.00 0.00 0.00 173.10 178.62 3cys s LYS 131 N -2.11 0.65 -0.02 2.90 2.20 -0.92 -2.04 119.74 120.40 3cys s LYS 131 Ca 0.24 0.65 -0.30 0.00 -0.36 0.00 0.00 55.97 56.21 3cys s LYS 131 Cb 0.02 0.31 -0.05 0.00 -1.51 0.00 0.00 37.83 36.60 3cys s LYS 131 CO -0.03 -0.09 1.40 0.08 -0.36 0.00 0.00 175.35 176.35 3cys s VAL 132 N 0.10 3.78 -1.00 4.02 1.01 -0.19 0.03 120.40 128.15 3cys s VAL 132 Ca -0.01 1.13 -0.03 0.00 0.00 0.00 0.00 61.98 63.07 3cys s VAL 132 Cb -0.04 -3.73 0.29 0.00 0.00 0.00 0.00 36.38 32.91 3cys s VAL 132 CO 0.01 -0.02 1.28 1.17 0.00 0.00 0.00 175.10 177.55 3cys n LYS 133 N 5.58 3.96 -0.81 2.72 4.81 0.02 -4.89 118.16 129.55 3cys n LYS 133 Ca 0.13 -4.56 0.09 0.00 -0.87 0.00 0.00 58.31 53.10 3cys n LYS 133 Cb 0.44 -2.47 -0.05 0.00 0.02 0.00 0.00 35.03 32.97 3cys n LYS 133 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 3cys n GLU 134 N 1.44 -1.90 0.00 1.64 2.13 -1.26 -4.38 120.64 118.31 3cys n GLU 134 Ca 0.26 1.55 0.00 0.00 0.66 0.00 0.00 57.16 59.63 3cys n GLU 134 Cb 0.35 -2.17 0.00 0.00 0.27 0.00 0.00 31.44 29.89 3cys n GLU 134 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cys n GLY 135 N -3.18 0.70 0.34 8.31 0.00 -1.26 -3.44 105.19 106.66 3cys n GLY 135 Ca -0.05 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.14 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 3.31 0.00 -0.55 1.61 2.86 -1.93 0.37 114.93 120.60 3cys h MET 136 Ca 0.00 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 3cys h MET 136 Cb 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 3cys h MET 136 CO 0.00 0.00 0.10 -0.91 1.06 0.00 0.00 176.91 177.16 3cys h ASN 137 N 0.00 0.82 0.32 1.22 2.35 -1.97 0.64 115.58 118.96 3cys h ASN 137 Ca 0.13 -0.16 -0.15 0.00 -0.55 0.00 0.00 56.30 55.57 3cys h ASN 137 Cb 0.60 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 3cys h ASN 137 CO -0.00 0.82 -0.62 0.40 -1.65 0.00 0.00 177.43 176.38 3cys h ILE 138 N 0.83 1.38 -0.26 2.81 5.03 -1.29 -0.32 117.51 125.70 3cys h ILE 138 Ca 0.18 -1.99 -0.14 0.00 -0.12 0.00 0.00 64.86 62.78 3cys h ILE 138 Cb 0.35 2.00 -0.01 0.00 -3.03 0.00 0.00 36.82 36.13 3cys h ILE 138 CO 0.00 0.59 -0.43 0.58 -0.68 0.00 0.00 178.15 178.22 3cys h VAL 139 N 0.21 1.30 0.00 1.67 2.07 -0.92 -1.56 116.25 119.02 3cys h VAL 139 Ca -0.01 -1.61 -0.06 0.00 0.82 0.00 0.00 66.70 65.84 3cys h VAL 139 Cb 1.13 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 32.45 3cys h VAL 139 CO 0.10 0.51 -0.31 -0.33 0.02 0.00 0.00 177.57 177.56 3cys h GLU 140 N 0.51 0.00 -0.16 1.57 3.07 0.71 0.31 114.58 120.58 3cys h GLU 140 Ca 0.04 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.71 3cys h GLU 140 Cb 0.95 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.87 3cys h GLU 140 CO 0.09 0.31 -0.64 0.00 -1.40 0.00 0.00 179.01 177.36 3cys h ALA 141 N 1.69 0.30 -0.29 3.43 0.00 -0.84 -3.06 119.26 120.49 3cys h ALA 141 Ca -0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 3cys h ALA 141 Cb 0.73 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3cys h ALA 141 CO 0.04 0.58 0.08 1.98 0.00 0.00 0.00 179.25 181.93 3cys h MET 142 N 0.43 0.45 0.00 0.00 1.85 -0.48 -2.65 114.93 114.54 3cys h MET 142 Ca -0.03 -0.10 -0.01 0.00 -0.61 0.00 0.00 59.70 58.94 3cys h MET 142 Cb 1.27 -0.06 -0.00 0.00 0.43 0.00 0.00 31.60 33.24 3cys h MET 142 CO 0.13 0.52 -0.06 1.05 -0.40 0.00 0.00 176.91 178.15 3cys h GLU 143 N 0.30 0.00 0.00 0.39 -0.00 -1.06 -2.22 114.58 112.00 3cys h GLU 143 Ca 0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 59.36 59.40 3cys h GLU 143 Cb 0.26 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.00 3cys h GLU 143 CO -0.00 0.06 -0.25 -0.09 -0.00 0.00 0.00 179.01 178.73 3cys h ARG 144 N 0.00 0.00 -0.00 1.06 9.65 -1.36 -1.65 114.38 122.08 3cys h ARG 144 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3cys h ARG 144 Cb 0.41 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.99 3cys h ARG 144 CO 0.01 0.25 -0.19 1.19 2.80 0.00 0.00 179.97 184.02 3cys n PHE 145 N -3.82 0.00 -0.32 2.20 3.72 -0.83 -4.85 117.46 113.55 3cys n PHE 145 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3cys n PHE 145 Cb 0.34 -0.23 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 3cys n PHE 145 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3cys n GLY 146 N 1.36 -1.44 0.27 1.37 0.00 -0.62 -0.35 105.19 105.78 3cys n GLY 146 Ca 0.11 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.58 3cys n GLY 146 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3cys n SER 147 N -1.20 0.00 0.00 1.61 2.88 -1.25 -4.67 113.62 110.98 3cys n SER 147 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3cys n SER 147 Cb 0.00 0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 3cys n SER 147 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 3cys n ARG 148 N -1.20 0.00 0.29 -1.46 1.85 -1.26 -4.44 116.66 110.43 3cys n ARG 148 Ca 0.00 0.00 0.13 0.00 -1.00 0.00 0.00 57.85 56.98 3cys n ARG 148 Cb 0.00 0.00 0.83 0.00 -1.05 0.00 0.00 32.46 32.24 3cys n ARG 148 CO 0.00 0.00 0.00 -2.95 -0.01 0.00 0.00 177.63 174.67 3cys h ASN 149 N 0.00 0.00 0.00 2.89 -1.07 -1.98 -3.46 115.58 111.96 3cys h ASN 149 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 3cys h ASN 149 Cb 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.25 3cys h ASN 149 CO 0.00 0.00 0.00 0.61 0.07 0.00 0.00 177.43 178.11 3cys n GLY 150 N -1.37 1.66 3.04 9.14 0.00 -1.26 -4.98 105.19 111.43 3cys n GLY 150 Ca -0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 3cys n GLY 150 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3cys s LYS 151 N -0.42 0.81 0.54 1.61 2.20 -1.26 -3.69 119.74 119.53 3cys s LYS 151 Ca 0.00 -0.38 -0.09 0.00 -0.36 0.00 0.00 55.97 55.14 3cys s LYS 151 Cb 0.00 -0.78 -0.04 0.00 -1.51 0.00 0.00 37.83 35.50 3cys s LYS 151 CO 0.00 0.21 0.91 0.95 -0.36 0.00 0.00 175.35 177.06 3cys s THR 152 N -0.29 4.79 -0.90 3.43 -4.23 -1.26 -3.94 115.64 113.23 3cys s THR 152 Ca 0.03 0.60 0.28 0.00 -1.18 0.00 0.00 61.69 61.42 3cys s THR 152 Cb -0.04 -3.85 0.25 0.00 1.34 0.00 0.00 72.50 70.19 3cys s THR 152 CO -0.00 -0.97 1.86 -0.24 -0.54 0.00 0.00 174.62 174.73 3cys n SER 153 N -2.41 0.31 0.00 3.99 2.88 0.52 -4.85 113.62 114.06 3cys n SER 153 Ca 0.04 0.51 0.00 0.00 -1.33 0.00 0.00 58.87 58.08 3cys n SER 153 Cb 0.54 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 3cys n SER 153 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3cys n LYS 154 N -1.78 2.78 -3.79 -1.46 5.02 -1.26 -5.15 118.16 112.53 3cys n LYS 154 Ca 0.06 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.11 3cys n LYS 154 Cb 0.37 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 35.21 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 2.79 0.79 0.20 1.97 2.36 -1.26 -5.06 119.74 121.52 3cys s LYS 155 Ca 0.00 -0.07 -0.14 0.00 -2.55 0.00 0.00 55.97 53.21 3cys s LYS 155 Cb 0.00 -1.32 -0.07 0.00 -1.05 0.00 0.00 37.83 35.39 3cys s LYS 155 CO 0.00 -0.37 0.60 0.42 1.55 0.00 0.00 175.35 177.56 3cys s ILE 156 N 1.90 4.80 -0.20 5.43 -1.09 -1.26 -0.81 121.20 129.97 3cys s ILE 156 Ca 0.04 0.84 -0.18 0.00 -2.23 0.00 0.00 60.65 59.11 3cys s ILE 156 Cb -0.13 -3.71 0.05 0.00 -1.58 0.00 0.00 42.46 37.09 3cys s ILE 156 CO -0.06 0.10 0.54 0.42 -1.23 0.00 0.00 174.94 174.71 3cys s THR 157 N -1.63 -0.00 -0.45 2.92 -4.23 -0.90 -3.13 115.64 108.22 3cys s THR 157 Ca 0.43 0.01 -0.26 0.00 -1.18 0.00 0.00 61.69 60.69 3cys s THR 157 Cb -0.14 -0.76 0.03 0.00 1.34 0.00 0.00 72.50 72.97 3cys s THR 157 CO 0.20 0.00 0.97 -0.63 -0.54 0.00 0.00 174.62 174.61 3cys s ILE 158 N 0.42 4.44 0.02 2.99 1.01 -1.26 -2.36 121.20 126.45 3cys s ILE 158 Ca -0.01 0.90 -0.20 0.00 0.00 0.00 0.00 60.65 61.35 3cys s ILE 158 Cb -0.04 -4.45 -0.11 0.00 0.01 0.00 0.00 42.46 37.87 3cys s ILE 158 CO -0.01 -0.82 1.11 0.00 0.00 0.00 0.00 174.94 175.22 3cys h ALA 159 N 9.02 -1.01 -2.71 9.38 0.00 -1.86 -3.43 119.26 128.65 3cys h ALA 159 Ca -0.24 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 54.64 3cys h ALA 159 Cb 1.07 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 19.07 3cys h ALA 159 CO 1.04 -0.95 0.35 -0.51 0.00 0.00 0.00 179.25 179.17 3cys s ASP 160 N -3.51 -0.21 0.29 0.00 1.01 -1.26 -5.02 116.67 107.98 3cys s ASP 160 Ca -0.10 -0.53 -0.19 0.00 0.71 0.00 0.00 52.55 52.43 3cys s ASP 160 Cb 0.01 0.63 0.06 0.00 1.01 0.00 0.00 42.92 44.62 3cys s ASP 160 CO 0.31 -1.16 0.88 0.00 0.21 0.00 0.00 175.17 175.41 3cys n GLY 162 N -0.57 -1.29 3.76 0.00 0.00 -0.89 -4.81 105.19 101.40 3cys n GLY 162 Ca -0.06 -1.05 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 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 -1.18 3.48 -1.40 1.61 0.74 -1.26 -1.11 119.66 120.54 3cys s GLN 163 Ca 0.00 -0.26 -0.15 0.00 0.05 0.00 0.00 55.36 55.00 3cys s GLN 163 Cb 0.00 -3.10 0.04 0.00 1.10 0.00 0.00 33.01 31.05 3cys s GLN 163 CO 0.00 0.62 2.09 1.28 -0.55 0.00 0.00 175.29 178.73 3cys n LEU 164 N 2.46 6.27 0.00 3.68 4.77 0.18 -4.92 117.00 129.45 3cys n LEU 164 Ca -0.19 -4.04 0.14 0.00 -0.03 0.00 0.00 56.01 51.89 3cys n LEU 164 Cb 0.54 -1.67 0.83 0.00 -2.33 0.00 0.00 43.42 40.79 3cys n LEU 164 CO 0.32 0.80 1.00 -1.84 -1.33 0.00 0.00 177.39 176.34