#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 0.01 -0.33 1.12 0.11 -1.26 -5.10 120.40 114.95 3cys s VAL 2 Ca 0.00 -0.11 -0.35 0.00 -2.93 0.00 0.00 61.98 58.59 3cys s VAL 2 Cb 0.00 -0.82 -0.11 0.00 -1.53 0.00 0.00 36.38 33.92 3cys s VAL 2 CO 0.00 -0.06 2.18 0.59 -3.33 0.00 0.00 175.10 174.48 3cys n ASN 3 N 1.80 2.25 -4.72 3.54 3.02 -1.26 -4.87 115.26 115.02 3cys n ASN 3 Ca -0.17 0.41 -0.42 0.00 -0.03 0.00 0.00 54.58 54.37 3cys n ASN 3 Cb 0.56 -1.29 -0.03 0.00 -0.61 0.00 0.00 39.78 38.41 3cys n ASN 3 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3cys s PRO 4 N 6.16 4.48 0.55 3.52 0.04 -1.20 -4.80 135.00 143.74 3cys s PRO 4 Ca 1.08 1.73 -0.05 0.00 0.04 0.00 0.00 61.00 63.80 3cys s PRO 4 Cb -0.81 -3.34 -0.00 0.00 0.04 0.00 0.00 34.50 30.38 3cys s PRO 4 CO 0.48 -0.17 0.85 0.99 0.04 0.00 0.00 177.00 179.19 3cys s THR 5 N 0.77 4.03 0.14 1.26 2.01 -1.21 -4.02 115.64 118.62 3cys s THR 5 Ca 0.56 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.59 3cys s THR 5 Cb -0.29 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 3cys s THR 5 CO 0.30 -0.56 -0.04 0.68 -0.69 0.00 0.00 174.62 174.31 3cys s VAL 6 N -2.88 0.78 0.05 3.82 -7.23 0.36 -1.87 120.40 113.44 3cys s VAL 6 Ca 0.52 -1.98 0.06 0.00 -1.81 0.00 0.00 61.98 58.77 3cys s VAL 6 Cb -0.10 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.91 3cys s VAL 6 CO 0.44 -0.68 -0.18 0.72 -0.31 0.00 0.00 175.10 175.10 3cys s PHE 7 N -3.58 1.53 -0.17 2.82 -0.12 -1.26 -0.64 117.98 116.55 3cys s PHE 7 Ca 0.18 -0.38 -0.04 0.00 -0.05 0.00 0.00 56.93 56.64 3cys s PHE 7 Cb 0.05 -0.89 0.06 0.00 -0.63 0.00 0.00 43.02 41.61 3cys s PHE 7 CO -0.00 0.09 0.06 -0.06 -0.05 0.00 0.00 175.22 175.26 3cys s PHE 8 N -0.93 0.54 0.08 3.49 0.40 0.39 -3.63 117.98 118.32 3cys s PHE 8 Ca 0.04 -0.52 -0.24 0.00 -0.60 0.00 0.00 56.93 55.62 3cys s PHE 8 Cb -0.09 -0.83 -0.06 0.00 0.51 0.00 0.00 43.02 42.55 3cys s PHE 8 CO 0.02 -0.54 0.72 0.34 0.70 0.00 0.00 175.22 176.46 3cys s ASP 9 N 2.02 7.21 0.03 1.36 2.15 -1.07 -1.96 116.67 126.41 3cys s ASP 9 Ca 0.01 1.43 0.01 0.00 0.43 0.00 0.00 52.55 54.44 3cys s ASP 9 Cb -0.16 -2.45 -0.04 0.00 -0.30 0.00 0.00 42.92 39.97 3cys s ASP 9 CO -0.08 0.12 0.06 -0.63 -0.17 0.00 0.00 175.17 174.47 3cys s ILE 10 N -0.53 4.54 -0.27 4.11 -1.09 -0.39 -3.05 121.20 124.52 3cys s ILE 10 Ca 0.35 -0.58 -0.04 0.00 -2.23 0.00 0.00 60.65 58.15 3cys s ILE 10 Cb -0.21 -3.11 0.10 0.00 -1.58 0.00 0.00 42.46 37.66 3cys s ILE 10 CO 0.22 0.27 0.14 0.00 -1.23 0.00 0.00 174.94 174.34 3cys s ALA 11 N -1.25 0.49 -0.86 9.38 0.00 -0.14 -3.21 121.76 126.17 3cys s ALA 11 Ca 0.25 -0.88 -0.25 0.00 0.00 0.00 0.00 51.96 51.07 3cys s ALA 11 Cb -0.12 -1.36 0.03 0.00 0.00 0.00 0.00 23.12 21.67 3cys s ALA 11 CO 0.16 -1.57 1.41 0.08 0.00 0.00 0.00 175.76 175.84 3cys s VAL 12 N 2.13 3.77 -0.31 0.00 1.01 0.35 -0.15 120.40 127.21 3cys s VAL 12 Ca 0.08 -0.14 -0.19 0.00 0.00 0.00 0.00 61.98 61.73 3cys s VAL 12 Cb -0.16 -4.89 0.03 0.00 0.00 0.00 0.00 36.38 31.36 3cys s VAL 12 CO -0.32 -1.80 0.39 0.47 0.00 0.00 0.00 175.10 173.84 3cys n ASP 13 N 9.57 -6.59 -4.17 3.32 9.92 0.06 -2.60 116.55 126.06 3cys n ASP 13 Ca 0.18 0.33 -0.34 0.00 -0.53 0.00 0.00 54.79 54.44 3cys n ASP 13 Cb 0.50 -2.82 -0.03 0.00 -0.64 0.00 0.00 41.12 38.13 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 0.31 -0.39 3.22 0.44 0.00 -1.26 -4.92 105.19 102.58 3cys n GLY 14 Ca -0.01 0.14 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 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 -6.86 0.42 -0.54 1.61 -6.30 -1.07 -5.11 118.70 100.85 3cys s GLU 15 Ca 0.57 0.97 -0.28 0.00 -2.50 0.00 0.00 54.97 53.73 3cys s GLU 15 Cb -0.31 0.26 0.01 0.00 0.00 0.00 0.00 34.13 34.09 3cys s GLU 15 CO 0.92 -0.42 1.48 -1.25 0.02 0.00 0.00 175.26 176.01 3cys s PRO 16 N 2.70 3.27 0.01 4.30 0.04 -1.26 0.13 135.00 144.18 3cys s PRO 16 Ca 0.06 0.58 -0.19 0.00 0.04 0.00 0.00 61.00 61.49 3cys s PRO 16 Cb -0.14 -4.14 -0.26 0.00 0.04 0.00 0.00 34.50 30.00 3cys s PRO 16 CO -0.16 -1.97 1.07 1.25 0.04 0.00 0.00 177.00 177.23 3cys h LEU 17 N 13.35 0.60 0.00 -3.56 5.85 -1.91 -3.48 115.31 126.16 3cys h LEU 17 Ca -0.27 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 57.65 3cys h LEU 17 Cb 1.10 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.95 3cys h LEU 17 CO 1.16 1.33 0.00 0.61 -0.34 0.00 0.00 178.44 181.20 3cys n GLY 18 N 1.22 -0.64 3.30 3.75 0.00 -1.26 -5.03 105.19 106.53 3cys n GLY 18 Ca -0.11 -0.74 -0.10 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.48 0.42 0.10 1.61 3.52 -1.26 -1.26 118.95 121.59 3cys s ARG 19 Ca 0.00 0.83 0.05 0.00 -0.13 0.00 0.00 55.73 56.47 3cys s ARG 19 Cb 0.00 -0.01 -0.04 0.00 -1.56 0.00 0.00 34.95 33.34 3cys s ARG 19 CO 0.00 -0.16 0.02 0.08 -0.81 0.00 0.00 175.30 174.43 3cys s VAL 20 N 1.44 4.13 0.05 7.11 1.01 -0.83 -4.31 120.40 129.00 3cys s VAL 20 Ca -0.10 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 60.95 3cys s VAL 20 Cb -0.08 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 3cys s VAL 20 CO -0.13 0.10 -0.12 -0.94 0.00 0.00 0.00 175.10 174.00 3cys s SER 21 N -2.40 1.45 -0.08 3.32 1.04 -0.62 -0.46 113.70 115.95 3cys s SER 21 Ca 0.27 -0.51 -0.01 0.00 0.48 0.00 0.00 55.95 56.19 3cys s SER 21 Cb -0.12 -0.06 0.03 0.00 0.10 0.00 0.00 66.02 65.97 3cys s SER 21 CO 0.19 -0.05 -0.03 -0.36 0.98 0.00 0.00 173.24 173.97 3cys s PHE 22 N -1.05 0.95 0.58 5.02 0.08 0.18 -2.11 117.98 121.64 3cys s PHE 22 Ca -0.02 -0.36 0.27 0.00 0.12 0.00 0.00 56.93 56.94 3cys s PHE 22 Cb -0.09 -0.92 1.64 0.00 -0.57 0.00 0.00 43.02 43.08 3cys s PHE 22 CO 0.01 -0.36 2.15 1.05 -0.10 0.00 0.00 175.22 177.97 3cys h GLU 23 N 8.07 0.00 -4.49 0.44 4.11 -1.71 0.10 114.58 121.11 3cys h GLU 23 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.17 3cys h GLU 23 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3cys h GLU 23 CO 0.34 0.00 -0.81 1.28 0.07 0.00 0.00 179.01 179.89 3cys n LEU 24 N -3.95 -5.33 -4.09 3.06 4.77 -1.26 -3.22 117.00 106.97 3cys n LEU 24 Ca 0.00 2.66 -0.41 0.00 -0.03 0.00 0.00 56.01 58.24 3cys n LEU 24 Cb 0.24 -2.94 -0.02 0.00 -2.33 0.00 0.00 43.42 38.37 3cys n LEU 24 CO 0.29 -2.37 2.19 0.49 -1.33 0.00 0.00 177.39 176.66 3cys n PHE 25 N 1.89 3.45 0.18 -1.77 3.72 -0.34 -4.16 117.46 120.44 3cys n PHE 25 Ca 0.00 -2.50 0.06 0.00 -0.05 0.00 0.00 57.45 54.96 3cys n PHE 25 Cb 0.00 -2.43 0.23 0.00 -0.94 0.00 0.00 39.48 36.33 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 7.37 0.86 -0.60 4.37 0.00 -1.83 -1.88 119.26 127.55 3cys h ALA 26 Ca 0.46 -0.34 -0.45 0.00 0.00 0.00 0.00 54.91 54.57 3cys h ALA 26 Cb 0.76 -0.06 -0.18 0.00 0.00 0.00 0.00 17.79 18.31 3cys h ALA 26 CO 1.68 0.46 0.51 -3.47 0.00 0.00 0.00 179.25 178.43 3cys n ASP 27 N -3.33 6.71 0.01 0.00 2.03 -1.26 -3.39 116.55 117.31 3cys n ASP 27 Ca 0.01 -3.25 0.00 0.00 0.52 0.00 0.00 54.79 52.07 3cys n ASP 27 Cb 0.59 -1.10 0.00 0.00 -0.72 0.00 0.00 41.12 39.88 3cys n ASP 27 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3cys n LYS 28 N 0.29 0.00 -3.43 -0.67 5.02 -1.20 -5.03 118.16 113.15 3cys n LYS 28 Ca 0.42 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.44 3cys n LYS 28 Cb 0.56 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.48 3cys n LYS 28 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3cys n VAL 29 N -2.38 -0.57 0.04 -0.18 0.24 -0.71 -4.96 118.33 109.81 3cys n VAL 29 Ca 0.00 -3.81 -0.15 0.00 -2.04 0.00 0.00 64.34 58.34 3cys n VAL 29 Cb 0.00 -1.80 -0.05 0.00 -1.47 0.00 0.00 33.84 30.52 3cys n VAL 29 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3cys h PRO 30 N 5.23 0.54 0.00 7.34 0.13 -1.72 -1.06 132.00 142.45 3cys h PRO 30 Ca 0.21 -0.52 -0.04 0.00 -0.87 0.00 0.00 66.00 64.78 3cys h PRO 30 Cb 0.87 0.13 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 3cys h PRO 30 CO 0.46 1.15 -0.17 1.57 -0.23 0.00 0.00 178.00 180.77 3cys h LYS 31 N 0.33 0.00 0.09 0.86 5.09 -1.93 0.18 116.57 121.20 3cys h LYS 31 Ca -0.08 0.00 -0.30 0.00 0.09 0.00 0.00 60.65 60.36 3cys h LYS 31 Cb 1.52 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.83 3cys h LYS 31 CO 0.16 0.17 -1.62 1.15 -2.09 0.00 0.00 179.45 177.23 3cys h THR 32 N 0.00 0.82 -0.56 0.07 2.02 -1.95 -3.36 112.91 109.95 3cys h THR 32 Ca -0.00 -2.31 0.03 0.00 0.77 0.00 0.00 66.41 64.89 3cys h THR 32 Cb 0.55 2.48 -0.03 0.00 -1.74 0.00 0.00 68.15 69.41 3cys h THR 32 CO 0.02 0.67 0.37 0.00 0.37 0.00 0.00 175.52 176.96 3cys h ALA 33 N -0.13 1.69 -1.00 6.16 0.00 -0.82 -1.37 119.26 123.80 3cys h ALA 33 Ca -0.37 -0.03 0.19 0.00 0.00 0.00 0.00 54.91 54.70 3cys h ALA 33 Cb 1.75 -0.19 -0.11 0.00 0.00 0.00 0.00 17.79 19.24 3cys h ALA 33 CO -0.01 0.25 0.61 1.49 0.00 0.00 0.00 179.25 181.60 3cys h GLU 34 N 0.67 0.73 -0.46 0.00 4.57 -0.79 0.19 114.58 119.48 3cys h GLU 34 Ca 0.22 -0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.45 3cys h GLU 34 Cb 0.06 -0.16 -0.08 0.00 -0.16 0.00 0.00 28.75 28.40 3cys h GLU 34 CO -0.06 0.48 -0.08 -0.97 -1.18 0.00 0.00 179.01 177.20 3cys h ASN 35 N 0.75 -0.36 -0.05 1.04 -0.73 -1.42 0.02 115.58 114.83 3cys h ASN 35 Ca 0.58 0.13 -0.18 0.00 1.87 0.00 0.00 56.30 58.70 3cys h ASN 35 Cb 0.92 0.26 0.01 0.00 0.27 0.00 0.00 38.32 39.78 3cys h ASN 35 CO -0.37 -0.13 -0.67 0.15 -0.37 0.00 0.00 177.43 176.04 3cys h PHE 36 N 0.03 0.76 -0.76 0.67 3.04 -1.04 -2.76 116.94 116.88 3cys h PHE 36 Ca 0.23 -0.38 0.10 0.00 3.98 0.00 0.00 57.97 61.90 3cys h PHE 36 Cb 0.35 -0.10 -0.07 0.00 2.56 0.00 0.00 35.95 38.68 3cys h PHE 36 CO -0.37 1.19 0.39 -0.09 -2.02 0.00 0.00 178.31 177.42 3cys h ARG 37 N 0.12 0.63 0.05 1.11 9.65 -0.12 0.67 114.38 126.49 3cys h ARG 37 Ca -0.07 -0.04 -0.20 0.00 -1.10 0.00 0.00 59.98 58.57 3cys h ARG 37 Cb 1.34 -0.14 0.02 0.00 -1.39 0.00 0.00 29.97 29.80 3cys h ARG 37 CO 0.13 0.42 -0.82 0.00 2.80 0.00 0.00 179.97 182.50 3cys h ALA 38 N 1.45 0.03 0.00 2.80 0.00 -1.08 -3.21 119.26 119.26 3cys h ALA 38 Ca 0.38 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3cys h ALA 38 Cb 0.41 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3cys h ALA 38 CO -0.28 0.46 0.00 -0.07 0.00 0.00 0.00 179.25 179.36 3cys h LEU 39 N -0.03 0.00 0.16 0.00 3.38 -1.15 0.52 115.31 118.20 3cys h LEU 39 Ca -0.12 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.87 3cys h LEU 39 Cb 1.55 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.26 3cys h LEU 39 CO 0.16 0.00 -0.28 0.28 0.09 0.00 0.00 178.44 178.69 3cys h SER 40 N 0.00 -0.79 0.10 -0.43 0.02 -0.87 -2.95 113.55 108.63 3cys h SER 40 Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3cys h SER 40 Cb 0.56 0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.39 3cys h SER 40 CO 0.00 -0.38 -1.06 1.07 -1.14 0.00 0.00 176.83 175.32 3cys n THR 41 N -5.39 0.02 -1.20 -2.27 5.66 -1.13 -3.76 114.28 106.20 3cys n THR 41 Ca -0.07 -0.08 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 3cys n THR 41 Cb 0.30 0.72 0.00 0.00 -1.55 0.00 0.00 70.33 69.80 3cys n THR 41 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3cys n GLY 42 N 1.46 0.41 3.52 1.09 0.00 0.18 -4.92 105.19 106.92 3cys n GLY 42 Ca 0.03 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 3cys n GLY 42 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3cys n GLU 43 N -2.50 1.35 0.00 1.61 0.28 -0.74 -2.32 120.64 118.31 3cys n GLU 43 Ca 0.00 -2.26 0.00 0.00 -0.16 0.00 0.00 57.16 54.74 3cys n GLU 43 Cb 0.12 -3.63 0.00 0.00 1.43 0.00 0.00 31.44 29.36 3cys n GLU 43 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3cys n LYS 44 N 8.09 0.00 0.00 3.44 4.76 -1.26 -4.88 118.16 128.31 3cys n LYS 44 Ca 0.45 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.89 3cys n LYS 44 Cb 0.46 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.65 3cys n LYS 44 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3cys n GLY 45 N -0.68 1.20 3.52 0.72 0.00 -0.98 -5.14 105.19 103.83 3cys n GLY 45 Ca 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 0.59 0.00 1.61 -0.71 -1.25 -5.11 117.98 113.11 3cys s PHE 46 Ca 0.00 -0.92 -0.01 0.00 -1.04 0.00 0.00 56.93 54.96 3cys s PHE 46 Cb 0.00 0.06 0.00 0.00 -1.21 0.00 0.00 43.02 41.87 3cys s PHE 46 CO 0.00 -0.99 0.02 0.41 -1.34 0.00 0.00 175.22 173.33 3cys n GLY 47 N -0.40 0.98 2.77 1.99 0.00 -1.26 -4.29 105.19 104.96 3cys n GLY 47 Ca -0.01 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 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 -0.02 2.81 -2.73 1.61 4.02 -1.15 -4.44 117.16 117.26 3cys n TYR 48 Ca 0.00 -2.79 -0.05 0.00 -0.01 0.00 0.00 57.90 55.05 3cys n TYR 48 Cb 0.01 -1.89 0.04 0.00 -0.02 0.00 0.00 39.34 37.48 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 3.22 1.62 -2.50 -0.72 3.00 -1.26 -4.77 118.16 116.75 3cys n LYS 49 Ca 0.45 -3.46 -0.03 0.00 -0.00 0.00 0.00 58.31 55.27 3cys n LYS 49 Cb 0.33 -1.51 -0.02 0.00 0.00 0.00 0.00 35.03 33.84 3cys n LYS 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3cys n GLY 50 N -0.39 -0.79 3.54 3.14 0.00 -1.26 -5.12 105.19 104.31 3cys n GLY 50 Ca 0.10 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 3cys n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3cys s SER 51 N -0.14 -0.21 -0.07 1.61 1.04 -1.26 -4.85 113.70 109.82 3cys s SER 51 Ca 0.02 -0.58 -0.03 0.00 0.48 0.00 0.00 55.95 55.85 3cys s SER 51 Cb 0.05 0.58 0.04 0.00 0.10 0.00 0.00 66.02 66.79 3cys s SER 51 CO -0.01 -1.07 0.12 0.00 0.98 0.00 0.00 173.24 173.26 3cys n PHE 53 N 4.96 -1.33 0.14 0.00 1.16 0.39 -4.73 117.46 118.03 3cys n PHE 53 Ca -0.12 0.04 0.00 0.00 -1.87 0.00 0.00 57.45 55.51 3cys n PHE 53 Cb 0.50 -0.05 0.00 0.00 -1.61 0.00 0.00 39.48 38.32 3cys n PHE 53 CO 0.00 0.00 0.00 1.58 -1.87 0.00 0.00 176.76 176.47 3cys n HIS 54 N -0.36 -3.67 -3.30 2.97 -0.00 -1.26 -3.11 115.22 106.50 3cys n HIS 54 Ca 0.00 0.93 0.03 0.00 0.46 0.00 0.00 57.72 59.14 3cys n HIS 54 Cb 0.01 2.51 -0.03 0.00 -0.12 0.00 0.00 29.99 32.36 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 -2.00 0.27 -0.21 1.57 3.52 -1.26 -4.73 118.95 116.11 3cys s ARG 55 Ca 0.00 0.60 -0.00 0.00 -0.13 0.00 0.00 55.73 56.20 3cys s ARG 55 Cb 0.00 0.35 0.05 0.00 -1.56 0.00 0.00 34.95 33.80 3cys s ARG 55 CO 0.00 -0.16 -0.05 0.42 -0.81 0.00 0.00 175.30 174.70 3cys s ILE 56 N 2.60 1.31 -0.16 4.11 1.01 -1.26 -4.28 121.20 124.54 3cys s ILE 56 Ca -0.00 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.64 3cys s ILE 56 Cb -0.08 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.81 3cys s ILE 56 CO -0.16 -0.01 0.04 -0.63 0.00 0.00 0.00 174.94 174.19 3cys s ILE 57 N 1.52 4.64 -0.51 2.92 1.01 -1.10 -0.42 121.20 129.26 3cys s ILE 57 Ca -0.03 -0.09 -0.28 0.00 0.00 0.00 0.00 60.65 60.25 3cys s ILE 57 Cb -0.17 -3.06 0.01 0.00 0.01 0.00 0.00 42.46 39.24 3cys s ILE 57 CO -0.07 0.50 1.47 -2.16 0.00 0.00 0.00 174.94 174.68 3cys s PRO 58 N 0.10 3.32 0.00 2.79 0.04 -1.25 -3.46 135.00 136.54 3cys s PRO 58 Ca 0.04 0.65 0.00 0.00 0.04 0.00 0.00 61.00 61.73 3cys s PRO 58 Cb -0.12 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.29 3cys s PRO 58 CO 0.01 -1.90 0.00 0.41 0.04 0.00 0.00 177.00 175.56 3cys n GLY 59 N 5.26 0.74 2.16 0.56 0.00 -1.26 -4.98 105.19 107.67 3cys n GLY 59 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.38 -3.97 -3.44 1.61 7.35 -1.22 -5.04 117.46 112.37 3cys n PHE 60 Ca 0.00 1.10 -0.11 0.00 -0.76 0.00 0.00 57.45 57.68 3cys n PHE 60 Cb 0.11 2.87 -0.02 0.00 0.35 0.00 0.00 39.48 42.79 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 -1.67 1.18 -0.01 -4.13 0.23 -1.24 -3.65 119.30 110.01 3cys s MET 61 Ca 0.00 -0.43 -0.02 0.00 -1.03 0.00 0.00 55.69 54.21 3cys s MET 61 Cb 0.00 0.54 0.00 0.00 -1.53 0.00 0.00 34.83 33.84 3cys s MET 61 CO 0.00 -0.51 0.05 0.00 -2.03 0.00 0.00 175.02 172.52 3cys n GLN 63 N 2.75 0.00 0.00 0.00 -0.06 -1.26 -0.30 117.38 118.51 3cys n GLN 63 Ca -0.14 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.86 3cys n GLN 63 Cb 0.59 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.77 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 4.31 0.00 1.69 0.00 -1.26 -4.83 105.19 105.11 3cys n GLY 64 Ca 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.50 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 -1.89 -1.85 0.00 -0.02 0.00 -1.18 -4.89 105.19 95.36 3cys n GLY 65 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 -0.69 0.00 -4.47 1.61 5.75 -1.26 -4.82 116.55 112.67 3cys n ASP 66 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 54.79 54.45 3cys n ASP 66 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.04 3cys n ASP 66 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 3cys n PHE 67 N 0.00 3.01 -1.02 2.11 7.35 -1.26 -4.73 117.46 122.93 3cys n PHE 67 Ca 0.00 -1.78 -0.14 0.00 -0.76 0.00 0.00 57.45 54.78 3cys n PHE 67 Cb 0.00 -2.54 0.24 0.00 0.35 0.00 0.00 39.48 37.53 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 7.32 2.96 -2.87 -2.13 -2.24 -1.26 0.03 114.28 116.08 3cys n THR 68 Ca 0.46 -1.67 -0.25 0.00 -2.27 0.00 0.00 64.05 60.32 3cys n THR 68 Cb 0.46 -0.44 0.02 0.00 -2.10 0.00 0.00 70.33 68.27 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 -0.56 -1.26 -1.41 -0.78 3.00 -1.26 -2.96 116.66 111.43 3cys n ARG 69 Ca 0.48 0.87 -0.10 0.00 -0.00 0.00 0.00 57.85 59.09 3cys n ARG 69 Cb 1.48 -1.39 -0.09 0.00 0.00 0.00 0.00 32.46 32.46 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 -0.53 0.64 0.00 -0.14 8.25 -1.26 -1.78 115.22 120.39 3cys n HIS 70 Ca -0.10 -0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 3cys n HIS 70 Cb 0.47 -1.97 0.00 0.00 1.12 0.00 0.00 29.99 29.62 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 15.27 0.00 -2.82 0.41 5.15 -1.26 -5.01 115.26 127.00 3cys n ASN 71 Ca 0.30 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 54.17 3cys n ASN 71 Cb 0.47 0.10 0.05 0.00 -0.53 0.00 0.00 39.78 39.86 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 -1.05 1.81 5.00 8.20 0.00 -0.74 -5.01 105.19 113.40 3cys n GLY 72 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.03 0.00 -3.09 2.61 -1.04 -1.24 -4.91 114.28 106.59 3cys n THR 73 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 3cys n THR 73 Cb 0.76 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.27 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 0.00 1.87 5.11 3.41 0.00 -1.16 -4.08 105.19 110.34 3cys n GLY 74 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 0.00 1.66 5.47 -0.02 0.00 0.10 -4.87 105.19 107.53 3cys n GLY 75 Ca 0.00 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.09 3cys n GLY 75 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cys n LYS 76 N 0.00 -0.78 -4.24 1.61 4.01 -1.26 -4.79 118.16 112.71 3cys n LYS 76 Ca 0.00 0.52 -0.18 0.00 -0.51 0.00 0.00 58.31 58.14 3cys n LYS 76 Cb 0.00 -0.95 -0.08 0.00 -0.51 0.00 0.00 35.03 33.49 3cys n LYS 76 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 3cys s SER 77 N -4.84 1.32 0.30 4.39 1.04 0.45 -3.96 113.70 112.41 3cys s SER 77 Ca 0.00 -1.66 0.25 0.00 0.48 0.00 0.00 55.95 55.02 3cys s SER 77 Cb 0.00 0.55 0.66 0.00 0.10 0.00 0.00 66.02 67.33 3cys s SER 77 CO 0.00 -1.07 1.72 0.16 0.98 0.00 0.00 173.24 175.03 3cys h ILE 78 N 2.21 0.00 -0.00 -1.02 3.07 -1.91 -2.95 117.51 116.90 3cys h ILE 78 Ca -0.27 -0.66 0.00 0.00 1.55 0.00 0.00 64.86 65.48 3cys h ILE 78 Cb 1.24 1.65 0.00 0.00 -0.27 0.00 0.00 36.82 39.43 3cys h ILE 78 CO 0.39 0.00 -0.75 -1.22 -1.05 0.00 0.00 178.15 175.52 3cys n TYR 79 N -2.58 0.00 0.00 0.16 4.01 -1.26 -5.04 117.16 112.45 3cys n TYR 79 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 3cys n TYR 79 Cb 0.46 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 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 1.47 -0.02 0.06 2.72 0.00 -1.11 -4.86 105.19 103.45 3cys n GLY 80 Ca 0.06 -0.06 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 1.67 -4.00 1.61 2.13 -1.26 -0.41 120.64 120.38 3cys n GLU 81 Ca 0.00 0.02 -0.10 0.00 0.66 0.00 0.00 57.16 57.73 3cys n GLU 81 Cb 0.00 -1.29 -0.04 0.00 0.27 0.00 0.00 31.44 30.38 3cys n GLU 81 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 3cys s LYS 82 N -2.28 1.72 0.22 5.31 -2.85 -1.26 -3.55 119.74 117.05 3cys s LYS 82 Ca -0.09 -1.40 -0.22 0.00 -1.00 0.00 0.00 55.97 53.26 3cys s LYS 82 Cb 0.04 0.48 0.04 0.00 -2.06 0.00 0.00 37.83 36.33 3cys s LYS 82 CO 0.44 -0.73 0.72 -0.59 0.10 0.00 0.00 175.35 175.28 3cys s PHE 83 N -3.58 -0.29 1.31 1.78 -0.71 -1.26 -4.73 117.98 110.49 3cys s PHE 83 Ca 0.24 -0.07 -0.21 0.00 -1.04 0.00 0.00 56.93 55.85 3cys s PHE 83 Cb -0.01 0.65 0.33 0.00 -1.21 0.00 0.00 43.02 42.78 3cys s PHE 83 CO 0.12 -1.06 1.03 -1.83 -1.34 0.00 0.00 175.22 172.14 3cys s GLU 84 N -3.77 -2.04 0.51 1.99 1.03 -1.26 -3.84 118.70 111.31 3cys s GLU 84 Ca 0.08 0.01 0.08 0.00 0.03 0.00 0.00 54.97 55.17 3cys s GLU 84 Cb -0.04 -1.49 0.05 0.00 -0.80 0.00 0.00 34.13 31.85 3cys s GLU 84 CO 0.00 -4.27 0.70 0.34 -1.33 0.00 0.00 175.26 170.70 3cys s ASP 85 N -3.57 5.34 0.00 0.83 -1.08 -1.26 -4.89 116.67 112.04 3cys s ASP 85 Ca 0.70 -0.56 0.00 0.00 -0.52 0.00 0.00 52.55 52.17 3cys s ASP 85 Cb -0.11 -0.25 0.00 0.00 -1.46 0.00 0.00 42.92 41.10 3cys s ASP 85 CO 0.57 -1.08 0.00 1.21 0.52 0.00 0.00 175.17 176.39 3cys n GLU 86 N -2.09 0.00 -3.61 4.34 0.00 -1.26 -5.08 120.64 112.93 3cys n GLU 86 Ca 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 57.16 57.27 3cys n GLU 86 Cb 0.60 -0.22 -0.01 0.00 0.00 0.00 0.00 31.44 31.80 3cys n GLU 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3cys s ASN 87 N -3.24 -0.03 -0.76 4.31 4.22 -1.26 -5.03 114.94 113.15 3cys s ASN 87 Ca 0.00 -0.02 -0.01 0.00 -2.14 0.00 0.00 52.86 50.69 3cys s ASN 87 Cb 0.00 0.04 0.38 0.00 1.28 0.00 0.00 41.25 42.95 3cys s ASN 87 CO 0.00 -0.07 1.91 0.49 -2.04 0.00 0.00 177.10 177.39 3cys n PHE 88 N -0.21 3.07 0.24 1.54 3.72 -1.26 -4.60 117.46 119.96 3cys n PHE 88 Ca -0.01 -2.53 0.09 0.00 -0.05 0.00 0.00 57.45 54.95 3cys n PHE 88 Cb 0.59 -1.10 0.62 0.00 -0.94 0.00 0.00 39.48 38.65 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 1.88 0.86 -4.40 4.37 2.04 -1.96 -3.43 117.51 116.88 3cys h ILE 89 Ca 0.54 -0.58 -0.47 0.00 1.00 0.00 0.00 64.86 65.36 3cys h ILE 89 Cb 0.30 1.34 0.10 0.00 -0.74 0.00 0.00 36.82 37.82 3cys h ILE 89 CO 1.39 0.15 0.37 -0.76 0.00 0.00 0.00 178.15 179.30 3cys s LEU 90 N -7.97 2.58 0.34 1.44 2.01 -1.26 -5.10 118.68 110.72 3cys s LEU 90 Ca -0.03 0.67 0.07 0.00 0.01 0.00 0.00 54.13 54.85 3cys s LEU 90 Cb 0.14 -3.16 -0.03 0.00 0.01 0.00 0.00 46.19 43.15 3cys s LEU 90 CO 0.64 -1.91 0.26 -0.54 1.01 0.00 0.00 176.35 175.82 3cys s LYS 91 N -5.53 1.80 -0.69 1.70 1.02 -1.26 -4.93 119.74 111.84 3cys s LYS 91 Ca 0.62 -2.05 -0.01 0.00 0.02 0.00 0.00 55.97 54.55 3cys s LYS 91 Cb -0.10 0.21 0.17 0.00 -0.52 0.00 0.00 37.83 37.59 3cys s LYS 91 CO 0.48 -0.64 0.51 -1.01 -0.92 0.00 0.00 175.35 173.77 3cys s HIS 92 N -3.40 3.51 0.27 3.18 3.76 -1.26 -4.92 115.29 116.44 3cys s HIS 92 Ca 0.39 -2.94 0.06 0.00 -0.15 0.00 0.00 55.06 52.41 3cys s HIS 92 Cb 0.02 -3.10 0.36 0.00 1.11 0.00 0.00 32.58 30.98 3cys s HIS 92 CO 0.26 -0.76 1.64 1.79 -0.85 0.00 0.00 174.74 176.82 3cys h THR 93 N 4.88 1.35 0.00 1.30 1.35 -1.93 -3.44 112.91 116.42 3cys h THR 93 Ca 0.04 -1.73 0.00 0.00 -0.55 0.00 0.00 66.41 64.17 3cys h THR 93 Cb 0.88 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 3cys h THR 93 CO 0.74 0.51 0.00 0.61 -0.25 0.00 0.00 175.52 177.14 3cys n GLY 94 N 0.02 -0.41 3.77 5.82 0.00 -1.26 -4.88 105.19 108.24 3cys n GLY 94 Ca -0.02 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.00 4.51 0.00 1.61 0.04 -1.23 -3.99 135.00 133.93 3cys s PRO 95 Ca 0.00 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.73 3cys s PRO 95 Cb 0.00 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.55 3cys s PRO 95 CO 0.00 0.12 0.00 0.41 0.04 0.00 0.00 177.00 177.57 3cys n GLY 96 N 0.95 0.83 2.75 0.56 0.00 -1.24 -4.88 105.19 104.16 3cys n GLY 96 Ca 0.01 -0.19 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.09 0.47 -1.05 -0.61 -1.09 -1.26 -3.52 121.20 112.05 3cys s ILE 97 Ca 0.00 -0.26 -0.21 0.00 -2.23 0.00 0.00 60.65 57.95 3cys s ILE 97 Cb 0.00 -0.82 0.07 0.00 -1.58 0.00 0.00 42.46 40.13 3cys s ILE 97 CO 0.00 0.00 1.43 -0.22 -1.23 0.00 0.00 174.94 174.92 3cys s LEU 98 N 1.91 3.91 0.00 2.97 2.96 -1.00 -0.53 118.68 128.89 3cys s LEU 98 Ca 0.02 -1.76 -0.03 0.00 -0.22 0.00 0.00 54.13 52.13 3cys s LEU 98 Cb -0.15 -2.53 0.07 0.00 0.50 0.00 0.00 46.19 44.08 3cys s LEU 98 CO -0.07 -1.35 0.46 -0.24 -1.32 0.00 0.00 176.35 173.83 3cys n SER 99 N 8.24 0.28 -3.83 3.68 2.88 -0.56 -3.09 113.62 121.22 3cys n SER 99 Ca 0.34 -1.31 -0.13 0.00 -1.33 0.00 0.00 58.87 56.43 3cys n SER 99 Cb 0.50 -0.33 -0.14 0.00 -0.75 0.00 0.00 64.21 63.49 3cys n SER 99 CO 0.00 0.00 0.00 -0.32 -1.23 0.00 0.00 175.04 173.49 3cys s MET 100 N -3.81 0.05 -0.09 -1.46 1.75 0.22 -3.28 119.30 112.69 3cys s MET 100 Ca 0.28 0.12 -0.08 0.00 -1.25 0.00 0.00 55.69 54.76 3cys s MET 100 Cb -0.01 -0.03 -0.04 0.00 2.84 0.00 0.00 34.83 37.59 3cys s MET 100 CO 0.19 -0.05 0.19 0.00 -0.65 0.00 0.00 175.02 174.70 3cys s ALA 101 N 0.29 3.86 -0.13 4.11 0.00 -1.25 -3.63 121.76 125.01 3cys s ALA 101 Ca -0.02 -0.59 -0.09 0.00 0.00 0.00 0.00 51.96 51.26 3cys s ALA 101 Cb -0.03 -2.02 0.05 0.00 0.00 0.00 0.00 23.12 21.11 3cys s ALA 101 CO -0.01 0.62 0.33 0.54 0.00 0.00 0.00 175.76 177.23 3cys s ASN 102 N -1.16 -0.38 -0.38 0.00 4.22 -1.26 -4.64 114.94 111.34 3cys s ASN 102 Ca 0.18 0.69 -0.05 0.00 -2.14 0.00 0.00 52.86 51.55 3cys s ASN 102 Cb -0.13 0.62 -0.03 0.00 1.28 0.00 0.00 41.25 42.99 3cys s ASN 102 CO 0.07 -0.16 3.01 0.00 -2.04 0.00 0.00 177.10 177.98 3cys n ALA 103 N 3.81 6.47 0.00 3.54 0.00 -0.94 -4.91 120.51 128.49 3cys n ALA 103 Ca -0.21 -2.75 0.00 0.00 0.00 0.00 0.00 53.44 50.48 3cys n ALA 103 Cb 0.55 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.76 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 1.41 -0.24 3.74 0.00 0.00 -1.26 -4.80 105.19 104.04 3cys n GLY 104 Ca 0.48 -2.28 -0.41 0.00 0.00 0.00 0.00 46.02 43.82 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 -0.69 4.60 -1.55 1.61 0.04 -1.26 -2.92 135.00 134.83 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 0.11 0.04 0.09 0.04 0.00 0.00 177.00 177.28 3cys n ASN 106 N 2.04 -5.31 -3.67 6.66 4.13 -1.26 -4.91 115.26 112.93 3cys n ASN 106 Ca 0.02 0.02 -0.28 0.00 1.68 0.00 0.00 54.58 56.03 3cys n ASN 106 Cb 0.46 -4.44 -0.11 0.00 -1.54 0.00 0.00 39.78 34.15 3cys n ASN 106 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 3cys n THR 107 N -3.86 0.38 -4.19 3.41 -1.04 -1.15 -4.41 114.28 103.43 3cys n THR 107 Ca -0.21 -4.24 -0.28 0.00 -2.04 0.00 0.00 64.05 57.29 3cys n THR 107 Cb 0.66 -1.95 -0.04 0.00 -1.82 0.00 0.00 70.33 67.18 3cys n THR 107 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 3cys s ASN 108 N -0.82 4.44 0.00 8.00 0.01 -1.25 -2.21 114.94 123.12 3cys s ASN 108 Ca 0.29 -1.31 0.00 0.00 -0.71 0.00 0.00 52.86 51.13 3cys s ASN 108 Cb -0.00 0.19 0.00 0.00 0.41 0.00 0.00 41.25 41.85 3cys s ASN 108 CO -0.18 -0.88 0.00 0.61 -1.51 0.00 0.00 177.10 175.14 3cys n GLY 109 N -1.49 -2.20 0.00 0.66 0.00 -1.26 -4.01 105.19 96.90 3cys n GLY 109 Ca -0.06 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.65 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 -0.82 0.00 -2.77 1.61 3.41 -1.25 -4.52 113.62 109.27 3cys n SER 110 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 3cys n SER 110 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 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 -0.80 -2.41 4.33 6.02 -1.26 -4.37 117.38 118.89 3cys n GLN 111 Ca 0.00 0.47 -0.21 0.00 -0.01 0.00 0.00 57.00 57.25 3cys n GLN 111 Cb 0.00 -1.01 0.11 0.00 1.02 0.00 0.00 30.24 30.36 3cys n GLN 111 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 177.06 178.02 3cys n PHE 112 N -0.98 -2.99 -3.68 1.08 1.16 -1.26 -3.81 117.46 106.98 3cys n PHE 112 Ca -0.11 -1.62 -0.09 0.00 -1.87 0.00 0.00 57.45 53.75 3cys n PHE 112 Cb 0.33 -0.68 -0.02 0.00 -1.61 0.00 0.00 39.48 37.49 3cys n PHE 112 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 3cys s PHE 113 N -2.86 -0.28 -0.22 2.97 0.40 -1.21 -4.66 117.98 112.13 3cys s PHE 113 Ca 0.62 -0.06 -0.05 0.00 -0.60 0.00 0.00 56.93 56.84 3cys s PHE 113 Cb -0.03 0.58 -0.02 0.00 0.51 0.00 0.00 43.02 44.06 3cys s PHE 113 CO 0.41 -1.03 -0.01 0.42 0.70 0.00 0.00 175.22 175.71 3cys s ILE 114 N -3.85 3.74 -1.21 0.64 1.01 0.59 -1.49 121.20 120.62 3cys s ILE 114 Ca 0.07 -0.37 -0.20 0.00 0.00 0.00 0.00 60.65 60.15 3cys s ILE 114 Cb -0.03 -2.71 0.06 0.00 0.01 0.00 0.00 42.46 39.79 3cys s ILE 114 CO -0.02 0.41 1.66 0.00 0.00 0.00 0.00 174.94 176.99 3cys n THR 116 N 6.60 3.82 0.00 0.00 -1.04 -1.24 -3.66 114.28 118.76 3cys n THR 116 Ca 0.44 -2.23 0.00 0.00 -2.04 0.00 0.00 64.05 60.22 3cys n THR 116 Cb 0.48 -2.45 0.00 0.00 -1.82 0.00 0.00 70.33 66.54 3cys n THR 116 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3cys n ALA 117 N 3.49 0.00 -2.79 2.41 0.00 -1.26 -4.54 120.51 117.82 3cys n ALA 117 Ca 0.68 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.68 3cys n ALA 117 Cb 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.77 3cys n ALA 117 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3cys s LYS 118 N -2.00 4.05 -0.79 0.00 2.36 -1.26 -3.57 119.74 118.53 3cys s LYS 118 Ca 0.00 -2.33 -0.21 0.00 -2.55 0.00 0.00 55.97 50.87 3cys s LYS 118 Cb 0.00 -5.26 0.09 0.00 -1.05 0.00 0.00 37.83 31.61 3cys s LYS 118 CO 0.00 -1.97 1.08 0.95 1.55 0.00 0.00 175.35 176.95 3cys s THR 119 N 2.70 4.40 -0.16 3.43 -4.23 -1.26 -4.83 115.64 115.68 3cys s THR 119 Ca 0.47 -0.77 0.17 0.00 -1.18 0.00 0.00 61.69 60.38 3cys s THR 119 Cb 0.00 -4.76 -0.04 0.00 1.34 0.00 0.00 72.50 69.04 3cys s THR 119 CO 0.03 -1.54 1.07 -0.08 -0.54 0.00 0.00 174.62 173.56 3cys h GLU 120 N 9.36 0.00 -0.01 3.99 4.81 -1.91 -3.28 114.58 127.54 3cys h GLU 120 Ca -0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3cys h GLU 120 Cb 1.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3cys h GLU 120 CO 1.18 0.29 -0.07 -2.67 -0.73 0.00 0.00 179.01 177.01 3cys n TRP 121 N -2.96 0.00 0.67 0.92 2.14 -1.26 -2.49 117.44 114.45 3cys n TRP 121 Ca -0.04 0.00 0.08 0.00 2.07 0.00 0.00 57.50 59.60 3cys n TRP 121 Cb 0.75 -0.05 -0.09 0.00 -0.81 0.00 0.00 31.31 31.11 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 -0.23 0.67 0.13 5.67 4.77 -1.24 -4.64 117.00 122.14 3cys n LEU 122 Ca 0.17 -0.45 -0.14 0.00 -0.03 0.00 0.00 56.01 55.57 3cys n LEU 122 Cb 0.33 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.34 3cys n LEU 122 CO 0.20 0.17 0.78 -0.78 -1.33 0.00 0.00 177.39 176.43 3cys h ASP 123 N 0.00 -0.23 -1.98 -1.43 1.82 -1.56 -1.13 116.42 111.91 3cys h ASP 123 Ca 0.00 -0.02 -0.77 0.00 -0.39 0.00 0.00 57.03 55.84 3cys h ASP 123 Cb 0.42 0.06 -0.25 0.00 0.68 0.00 0.00 39.33 40.24 3cys h ASP 123 CO 0.00 -0.13 1.19 0.61 -1.61 0.00 0.00 179.24 179.30 3cys n GLY 124 N -1.10 5.78 1.37 -0.78 0.00 -1.26 -4.18 105.19 105.01 3cys n GLY 124 Ca -0.09 -2.45 0.00 0.00 0.00 0.00 0.00 46.02 43.48 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 0.10 0.00 -2.93 1.61 0.00 -1.16 -5.13 118.16 110.66 3cys n LYS 125 Ca 0.51 0.00 -0.20 0.00 0.00 0.00 0.00 58.31 58.62 3cys n LYS 125 Cb 0.27 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.32 3cys n LYS 125 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 3cys s HIS 126 N -2.00 2.92 -0.01 5.64 3.76 -0.44 -5.06 115.29 120.10 3cys s HIS 126 Ca 0.00 -0.15 0.02 0.00 -0.15 0.00 0.00 55.06 54.77 3cys s HIS 126 Cb 0.00 -2.46 -0.03 0.00 1.11 0.00 0.00 32.58 31.19 3cys s HIS 126 CO 0.00 -0.53 -0.03 0.08 -0.85 0.00 0.00 174.74 173.41 3cys s VAL 127 N -2.51 3.93 -0.07 -0.90 1.01 -1.24 -4.85 120.40 115.77 3cys s VAL 127 Ca 0.54 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.94 3cys s VAL 127 Cb -0.10 -2.71 -0.00 0.00 0.00 0.00 0.00 36.38 33.57 3cys s VAL 127 CO 0.35 0.43 -0.21 -0.69 0.00 0.00 0.00 175.10 174.99 3cys s VAL 128 N -1.00 1.76 0.00 2.92 1.01 -1.26 0.72 120.40 124.54 3cys s VAL 128 Ca 0.17 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.28 3cys s VAL 128 Cb -0.11 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.74 3cys s VAL 128 CO 0.07 0.49 0.86 2.22 0.00 0.00 0.00 175.10 178.75 3cys n PHE 129 N 3.38 0.00 -3.59 5.22 -1.74 -1.18 -4.73 117.46 114.83 3cys n PHE 129 Ca -0.19 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.63 3cys n PHE 129 Cb 0.53 -0.03 -0.02 0.00 1.52 0.00 0.00 39.48 41.48 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 -0.73 -0.39 -0.03 4.97 0.00 -1.23 -1.19 107.32 108.72 3cys s GLY 130 Ca 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 44.72 45.37 3cys s GLY 130 CO 0.00 0.21 0.10 1.25 0.00 0.00 0.00 173.10 174.66 3cys s LYS 131 N -3.19 0.19 -0.20 2.90 2.20 -1.26 -2.37 119.74 118.01 3cys s LYS 131 Ca 0.07 0.01 -0.29 0.00 -0.36 0.00 0.00 55.97 55.41 3cys s LYS 131 Cb -0.01 0.08 -0.01 0.00 -1.51 0.00 0.00 37.83 36.38 3cys s LYS 131 CO -0.05 -0.03 1.31 0.08 -0.36 0.00 0.00 175.35 176.30 3cys s VAL 132 N -0.26 4.18 -0.10 4.02 1.01 -1.23 -2.13 120.40 125.89 3cys s VAL 132 Ca -0.03 1.39 -0.00 0.00 0.00 0.00 0.00 61.98 63.34 3cys s VAL 132 Cb -0.02 -4.00 -0.00 0.00 0.00 0.00 0.00 36.38 32.35 3cys s VAL 132 CO 0.00 -0.24 -0.01 0.50 0.00 0.00 0.00 175.10 175.36 3cys h LYS 133 N 8.72 0.00 -4.83 2.72 3.11 -1.80 -3.48 116.57 121.01 3cys h LYS 133 Ca -0.27 0.00 -0.28 0.00 -2.81 0.00 0.00 60.65 57.29 3cys h LYS 133 Cb 1.11 0.00 -0.16 0.00 -1.00 0.00 0.00 32.23 32.18 3cys h LYS 133 CO 0.99 0.00 -0.71 -1.21 -2.81 0.00 0.00 179.45 175.71 3cys s GLU 134 N -1.54 0.86 0.00 1.90 2.02 -1.26 -4.85 118.70 115.84 3cys s GLU 134 Ca -0.00 -1.27 0.00 0.00 0.02 0.00 0.00 54.97 53.72 3cys s GLU 134 Cb 0.00 -0.40 0.00 0.00 0.10 0.00 0.00 34.13 33.83 3cys s GLU 134 CO 0.01 0.04 0.00 0.41 0.02 0.00 0.00 175.26 175.73 3cys n GLY 135 N 0.21 0.83 0.36 -1.39 0.00 -1.26 -1.58 105.19 102.36 3cys n GLY 135 Ca -0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 2.81 0.75 -0.29 1.61 2.86 -1.91 0.19 114.93 120.95 3cys h MET 136 Ca 0.00 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.51 3cys h MET 136 Cb 0.00 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.48 3cys h MET 136 CO 0.00 0.50 -0.16 -2.95 1.06 0.00 0.00 176.91 175.35 3cys h ASN 137 N 0.77 0.50 -0.42 1.22 -1.07 -1.98 0.25 115.58 114.86 3cys h ASN 137 Ca 0.53 -0.14 -0.15 0.00 0.07 0.00 0.00 56.30 56.61 3cys h ASN 137 Cb 0.81 -0.14 -0.01 0.00 -2.07 0.00 0.00 38.32 36.92 3cys h ASN 137 CO -0.31 0.69 -0.30 0.40 0.07 0.00 0.00 177.43 177.97 3cys h ILE 138 N 0.47 1.27 -0.50 6.14 1.08 -1.11 -0.83 117.51 124.03 3cys h ILE 138 Ca 0.08 -1.47 -0.13 0.00 -0.39 0.00 0.00 64.86 62.95 3cys h ILE 138 Cb 0.56 1.29 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 3cys h ILE 138 CO 0.04 0.50 -0.19 0.58 -0.69 0.00 0.00 178.15 178.38 3cys h VAL 139 N 0.78 1.27 -0.50 1.67 2.07 -0.55 0.06 116.25 121.05 3cys h VAL 139 Ca 0.08 -1.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.19 3cys h VAL 139 Cb 0.89 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3cys h VAL 139 CO 0.08 0.47 0.07 -0.08 0.02 0.00 0.00 177.57 178.14 3cys h GLU 140 N 0.87 0.79 -0.22 1.57 4.57 -0.33 -0.78 114.58 121.04 3cys h GLU 140 Ca 0.12 -0.18 -0.16 0.00 -1.18 0.00 0.00 59.36 57.96 3cys h GLU 140 Cb 0.77 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 3cys h GLU 140 CO 0.06 0.75 -0.47 0.00 -1.18 0.00 0.00 179.01 178.17 3cys h ALA 141 N 1.33 0.36 -0.05 2.92 0.00 -0.95 -3.04 119.26 119.82 3cys h ALA 141 Ca 0.16 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3cys h ALA 141 Cb 0.35 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3cys h ALA 141 CO 0.01 0.51 0.03 1.98 0.00 0.00 0.00 179.25 181.78 3cys h MET 142 N 0.43 0.06 -0.83 0.00 1.85 -0.45 -2.42 114.93 113.57 3cys h MET 142 Ca 0.00 -0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.10 3cys h MET 142 Cb 1.08 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 33.05 3cys h MET 142 CO 0.10 0.04 0.55 1.05 -0.40 0.00 0.00 176.91 178.26 3cys h GLU 143 N 0.07 1.08 -0.72 0.39 4.11 -1.04 -2.14 114.58 116.33 3cys h GLU 143 Ca 0.02 -0.07 -0.17 0.00 0.07 0.00 0.00 59.36 59.21 3cys h GLU 143 Cb -0.01 -0.24 -0.10 0.00 0.50 0.00 0.00 28.75 28.90 3cys h GLU 143 CO -0.00 0.72 0.22 2.89 0.07 0.00 0.00 179.01 182.90 3cys n ARG 144 N -4.41 4.02 -0.39 1.06 1.85 -0.91 -3.27 116.66 114.59 3cys n ARG 144 Ca 0.10 -3.09 0.06 0.00 -1.00 0.00 0.00 57.85 53.91 3cys n ARG 144 Cb 0.04 -2.24 0.09 0.00 -1.05 0.00 0.00 32.46 29.30 3cys n ARG 144 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3cys n PHE 145 N 0.04 0.00 -3.45 2.89 3.72 -0.81 -5.08 117.46 114.78 3cys n PHE 145 Ca 0.38 -0.71 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 3cys n PHE 145 Cb 1.36 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.77 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 -0.78 5.57 3.67 1.37 0.00 -1.20 -0.51 105.19 113.30 3cys n GLY 146 Ca 0.10 -2.12 0.02 0.00 0.00 0.00 0.00 46.02 44.03 3cys n GLY 146 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3cys s SER 147 N -0.15 -0.03 0.00 1.61 0.15 0.45 -4.75 113.70 110.98 3cys s SER 147 Ca 0.00 -0.11 0.29 0.00 0.70 0.00 0.00 55.95 56.83 3cys s SER 147 Cb 0.00 0.12 1.32 0.00 -1.71 0.00 0.00 66.02 65.75 3cys s SER 147 CO 0.00 -0.23 1.95 -2.11 1.20 0.00 0.00 173.24 174.05 3cys n ARG 148 N -0.56 0.28 0.04 5.44 1.85 -1.26 -3.17 116.66 119.28 3cys n ARG 148 Ca -0.07 -0.03 0.10 0.00 -1.00 0.00 0.00 57.85 56.85 3cys n ARG 148 Cb 0.62 -1.50 0.41 0.00 -1.05 0.00 0.00 32.46 30.95 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 -1.33 0.20 0.00 2.89 6.94 -1.26 -4.85 115.26 117.85 3cys n ASN 149 Ca 0.11 0.54 0.00 0.00 -0.02 0.00 0.00 54.58 55.21 3cys n ASN 149 Cb 0.29 -0.59 0.00 0.00 -2.36 0.00 0.00 39.78 37.12 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 0.37 0.73 3.19 4.83 0.00 -1.19 -5.07 105.19 108.07 3cys n GLY 150 Ca 0.04 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 3cys n GLY 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cys s LYS 151 N -3.18 0.86 -0.12 1.61 1.02 -1.26 -4.48 119.74 114.19 3cys s LYS 151 Ca 0.00 -1.16 -0.15 0.00 0.02 0.00 0.00 55.97 54.69 3cys s LYS 151 Cb 0.00 0.30 0.04 0.00 -0.52 0.00 0.00 37.83 37.64 3cys s LYS 151 CO 0.00 -0.26 0.40 -0.08 -0.92 0.00 0.00 175.35 174.49 3cys s THR 152 N -3.93 0.01 -0.47 2.17 -1.32 -1.26 -3.05 115.64 107.79 3cys s THR 152 Ca 0.11 -0.10 -0.10 0.00 -1.21 0.00 0.00 61.69 60.40 3cys s THR 152 Cb 0.06 -0.59 0.01 0.00 -1.51 0.00 0.00 72.50 70.47 3cys s THR 152 CO -0.06 -0.05 0.18 -1.54 -2.21 0.00 0.00 174.62 170.93 3cys n SER 153 N 2.46 -1.00 0.00 8.08 3.41 0.33 -2.64 113.62 124.27 3cys n SER 153 Ca -0.15 -0.47 0.00 0.00 -0.26 0.00 0.00 58.87 57.99 3cys n SER 153 Cb 0.57 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 -2.39 0.00 -3.54 4.33 4.01 -1.26 -4.20 118.16 115.10 3cys n LYS 154 Ca -0.06 0.00 -0.25 0.00 -0.51 0.00 0.00 58.31 57.49 3cys n LYS 154 Cb 0.21 0.00 -0.15 0.00 -0.51 0.00 0.00 35.03 34.59 3cys n LYS 154 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 3cys s LYS 155 N 0.00 0.16 -0.49 1.97 1.02 -1.08 -5.00 119.74 116.32 3cys s LYS 155 Ca 0.00 -0.21 -0.24 0.00 0.02 0.00 0.00 55.97 55.54 3cys s LYS 155 Cb 0.00 -1.35 0.03 0.00 -0.52 0.00 0.00 37.83 36.00 3cys s LYS 155 CO 0.00 -0.84 0.88 0.42 -0.92 0.00 0.00 175.35 174.89 3cys s ILE 156 N 2.18 4.50 0.19 2.17 1.01 -1.25 -0.76 121.20 129.24 3cys s ILE 156 Ca 0.06 0.47 0.05 0.00 0.00 0.00 0.00 60.65 61.23 3cys s ILE 156 Cb -0.16 -4.44 -0.04 0.00 0.01 0.00 0.00 42.46 37.84 3cys s ILE 156 CO -0.23 -0.90 0.18 0.42 0.00 0.00 0.00 174.94 174.42 3cys s THR 157 N 3.66 4.61 -0.29 2.92 -4.23 0.79 -0.47 115.64 122.64 3cys s THR 157 Ca 0.32 -1.12 -0.16 0.00 -1.18 0.00 0.00 61.69 59.55 3cys s THR 157 Cb -0.12 -3.40 -0.03 0.00 1.34 0.00 0.00 72.50 70.29 3cys s THR 157 CO 0.23 -0.18 0.44 -0.63 -0.54 0.00 0.00 174.62 173.93 3cys s ILE 158 N -1.86 5.12 0.00 2.99 1.01 -1.25 -0.97 121.20 126.24 3cys s ILE 158 Ca 0.32 0.58 -0.25 0.00 0.00 0.00 0.00 60.65 61.30 3cys s ILE 158 Cb -0.10 -3.79 -0.14 0.00 0.01 0.00 0.00 42.46 38.44 3cys s ILE 158 CO 0.25 0.05 1.06 0.00 0.00 0.00 0.00 174.94 176.30 3cys h ALA 159 N 8.20 -0.79 -1.15 9.38 0.00 -1.83 -3.48 119.26 129.59 3cys h ALA 159 Ca -0.30 -0.19 0.30 0.00 0.00 0.00 0.00 54.91 54.71 3cys h ALA 159 Cb 1.15 0.30 -0.22 0.00 0.00 0.00 0.00 17.79 19.03 3cys h ALA 159 CO 0.69 -0.77 0.93 0.16 0.00 0.00 0.00 179.25 180.27 3cys s ASP 160 N -4.65 -0.05 0.33 0.00 -4.77 -1.26 -5.07 116.67 101.20 3cys s ASP 160 Ca -0.13 0.01 0.04 0.00 -3.30 0.00 0.00 52.55 49.17 3cys s ASP 160 Cb 0.01 0.05 -0.02 0.00 -1.09 0.00 0.00 42.92 41.87 3cys s ASP 160 CO 0.42 -0.07 0.34 0.00 0.70 0.00 0.00 175.17 176.55 3cys n GLY 162 N -0.59 0.16 0.64 0.00 0.00 -1.24 -4.69 105.19 99.47 3cys n GLY 162 Ca 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.97 3cys n GLY 162 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3cys n GLN 163 N 0.00 -1.78 -3.86 1.61 7.27 -1.26 -4.87 117.38 114.49 3cys n GLN 163 Ca 0.00 1.35 -0.36 0.00 0.07 0.00 0.00 57.00 58.06 3cys n GLN 163 Cb 0.00 -1.58 -0.13 0.00 2.41 0.00 0.00 30.24 30.93 3cys n GLN 163 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 3cys s LEU 164 N -3.17 3.65 0.00 1.69 1.43 -0.78 -4.58 118.68 116.93 3cys s LEU 164 Ca 0.00 -0.90 0.00 0.00 -1.03 0.00 0.00 54.13 52.20 3cys s LEU 164 Cb 0.00 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 44.45 3cys s LEU 164 CO 0.00 -0.19 0.29 -1.84 0.23 0.00 0.00 176.35 174.83