#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gjh n ALA 4 N 0.00 -3.97 -0.40 -1.41 0.00 -1.26 -5.15 120.51 108.32 1gjh n ALA 4 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1gjh n ALA 4 Cb 0.00 -3.54 0.00 0.00 0.00 0.00 0.00 19.45 15.91 1gjh n ALA 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gjh n GLY 5 N 1.96 -0.22 1.55 0.00 0.00 -1.26 -4.68 105.19 102.54 1gjh n GLY 5 Ca 0.05 -0.46 0.01 0.00 0.00 0.00 0.00 46.02 45.62 1gjh n GLY 5 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1gjh n ARG 6 N -0.69 0.19 -0.12 1.61 0.63 -1.26 -4.91 116.66 112.11 1gjh n ARG 6 Ca 0.00 -1.91 -0.25 0.00 -0.92 0.00 0.00 57.85 54.77 1gjh n ARG 6 Cb 0.00 -0.03 -0.08 0.00 0.45 0.00 0.00 32.46 32.80 1gjh n ARG 6 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1gjh n THR 7 N 0.25 1.41 0.00 5.15 -2.24 -1.26 -5.05 114.28 112.53 1gjh n THR 7 Ca -0.01 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1gjh n THR 7 Cb 1.02 -1.90 0.00 0.00 -2.10 0.00 0.00 70.33 67.35 1gjh n THR 7 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gjh n GLY 8 N 1.42 1.65 3.51 3.38 0.00 -1.26 -4.92 105.19 108.98 1gjh n GLY 8 Ca -0.46 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 1gjh n GLY 8 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1gjh n TYR 9 N -0.63 0.20 -3.48 1.61 4.01 -1.26 -5.00 117.16 112.61 1gjh n TYR 9 Ca 0.00 0.61 -0.10 0.00 -0.16 0.00 0.00 57.90 58.24 1gjh n TYR 9 Cb 0.00 -2.09 -0.09 0.00 -0.31 0.00 0.00 39.34 36.85 1gjh n TYR 9 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1gjh s ASP 10 N -0.87 0.23 0.53 7.72 1.01 -1.26 -5.01 116.67 119.02 1gjh s ASP 10 Ca 0.63 0.43 0.36 0.00 0.71 0.00 0.00 52.55 54.68 1gjh s ASP 10 Cb -0.60 1.06 1.52 0.00 1.01 0.00 0.00 42.92 45.91 1gjh s ASP 10 CO 0.57 -0.28 1.78 -0.55 0.21 0.00 0.00 175.17 176.91 1gjh h ASN 11 N 8.21 0.05 -0.23 0.27 7.08 -1.94 0.40 115.58 129.42 1gjh h ASN 11 Ca -0.18 0.01 -0.09 0.00 -3.08 0.00 0.00 56.30 52.97 1gjh h ASN 11 Cb 1.14 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 37.38 1gjh h ASN 11 CO 0.22 0.00 -0.19 -0.09 -2.08 0.00 0.00 177.43 175.29 1gjh h ARG 12 N 0.04 0.54 -0.31 4.14 2.43 -1.91 -2.44 114.38 116.87 1gjh h ARG 12 Ca 0.60 -0.27 -0.15 0.00 -0.81 0.00 0.00 59.98 59.35 1gjh h ARG 12 Cb 2.30 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 31.85 1gjh h ARG 12 CO -0.05 0.85 -0.40 1.49 -1.51 0.00 0.00 179.97 180.36 1gjh h GLU 13 N 0.24 0.81 -0.02 0.20 4.81 -0.74 -1.89 114.58 118.00 1gjh h GLU 13 Ca 0.04 -0.46 0.02 0.00 -0.13 0.00 0.00 59.36 58.83 1gjh h GLU 13 Cb 0.73 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 1gjh h GLU 13 CO 0.05 1.10 -0.14 0.82 -0.73 0.00 0.00 179.01 180.10 1gjh h ILE 14 N 0.58 0.64 -0.53 2.32 2.04 -0.91 -0.76 117.51 120.90 1gjh h ILE 14 Ca 0.04 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.81 1gjh h ILE 14 Cb 0.99 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1gjh h ILE 14 CO 0.09 0.00 -0.00 0.58 0.00 0.00 0.00 178.15 178.82 1gjh h VAL 15 N -0.23 1.25 -0.01 1.67 2.07 -1.47 -1.86 116.25 117.68 1gjh h VAL 15 Ca 0.05 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.52 1gjh h VAL 15 Cb 0.30 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1gjh h VAL 15 CO -0.15 0.38 -0.08 0.24 0.02 0.00 0.00 177.57 177.98 1gjh h MET 16 N 0.83 -0.14 -0.39 1.57 2.86 -0.86 0.20 114.93 119.00 1gjh h MET 16 Ca 0.15 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.78 1gjh h MET 16 Cb 0.50 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 1gjh h MET 16 CO 0.02 -0.09 0.15 0.87 1.06 0.00 0.00 176.91 178.92 1gjh h LYS 17 N -0.14 0.58 0.83 1.72 1.57 -1.06 -0.10 116.57 119.96 1gjh h LYS 17 Ca 0.04 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1gjh h LYS 17 Cb 0.19 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.41 1gjh h LYS 17 CO -0.09 0.56 -0.41 -0.92 -0.57 0.00 0.00 179.45 178.02 1gjh h TYR 18 N 0.48 -1.06 -0.68 -1.35 3.20 -1.09 -2.73 116.97 113.74 1gjh h TYR 18 Ca 0.13 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.10 1gjh h TYR 18 Cb 0.20 0.35 -0.09 0.00 1.54 0.00 0.00 36.73 38.73 1gjh h TYR 18 CO -0.00 -0.65 0.22 0.82 -1.64 0.00 0.00 178.16 176.91 1gjh h ILE 19 N -1.12 0.65 -0.19 1.81 2.04 -0.63 -2.55 117.51 117.51 1gjh h ILE 19 Ca -0.11 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1gjh h ILE 19 Cb 0.87 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 1gjh h ILE 19 CO 0.18 0.07 -0.21 -0.74 0.00 0.00 0.00 178.15 177.44 1gjh h HIS 20 N 0.36 -0.66 -1.02 1.37 2.76 -0.87 0.18 115.15 117.27 1gjh h HIS 20 Ca 0.37 0.03 0.25 0.00 -2.20 0.00 0.00 60.37 58.82 1gjh h HIS 20 Cb 0.55 0.31 -0.11 0.00 1.55 0.00 0.00 27.41 29.72 1gjh h HIS 20 CO -0.20 -0.18 0.63 0.10 -1.30 0.00 0.00 177.93 176.98 1gjh h TYR 21 N -0.13 0.85 -0.10 5.26 -0.00 -1.19 0.92 116.97 122.58 1gjh h TYR 21 Ca 0.03 0.03 0.03 0.00 0.00 0.00 0.00 58.73 58.82 1gjh h TYR 21 Cb 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 36.73 36.69 1gjh h TYR 21 CO -0.70 0.09 0.08 -0.22 -0.00 0.00 0.00 178.16 177.40 1gjh h LYS 22 N 0.52 0.00 0.04 0.10 1.63 -0.29 -0.81 116.57 117.76 1gjh h LYS 22 Ca 0.61 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 60.14 1gjh h LYS 22 Cb 1.31 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.91 1gjh h LYS 22 CO -0.38 0.00 -1.48 -0.07 -3.45 0.00 0.00 179.45 174.07 1gjh h LEU 23 N 0.00 0.13 -1.96 5.20 -0.00 0.19 -3.35 115.31 115.52 1gjh h LEU 23 Ca 0.05 -0.64 0.12 0.00 -0.00 0.00 0.00 57.88 57.41 1gjh h LEU 23 Cb 0.21 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 40.81 1gjh h LEU 23 CO -0.00 1.60 0.45 0.28 -0.00 0.00 0.00 178.44 180.78 1gjh h SER 24 N -0.67 0.00 -0.82 -0.43 0.02 -0.29 0.91 113.55 112.27 1gjh h SER 24 Ca -0.37 0.00 0.12 0.00 -0.84 0.00 0.00 61.79 60.69 1gjh h SER 24 Cb 1.53 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.99 1gjh h SER 24 CO -0.12 0.00 0.44 -0.61 -1.14 0.00 0.00 176.83 175.40 1gjh h GLN 25 N 0.00 0.67 0.07 3.45 -0.00 -1.29 -2.81 115.11 115.21 1gjh h GLN 25 Ca 0.20 -0.04 -0.21 0.00 -0.00 0.00 0.00 58.65 58.60 1gjh h GLN 25 Cb 1.10 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 28.42 1gjh h GLN 25 CO -0.00 0.44 -1.06 0.00 0.00 0.00 0.00 178.83 178.21 1gjh h ARG 26 N 0.69 0.15 0.00 1.69 -0.00 -1.07 -3.49 114.38 112.35 1gjh h ARG 26 Ca 0.42 -0.26 0.00 0.00 -0.50 0.00 0.00 59.98 59.64 1gjh h ARG 26 Cb 0.48 0.10 0.00 0.00 0.00 0.00 0.00 29.97 30.55 1gjh h ARG 26 CO -0.30 1.12 0.00 0.41 0.00 0.00 0.00 179.97 181.21 1gjh n GLY 27 N 1.64 0.33 3.60 0.04 0.00 -0.71 -5.09 105.19 105.00 1gjh n GLY 27 Ca -0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1gjh n GLY 27 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1gjh s TYR 28 N -1.04 1.84 -1.04 1.61 5.04 -1.24 -4.88 117.35 117.64 1gjh s TYR 28 Ca 0.00 0.64 -0.25 0.00 -2.44 0.00 0.00 57.07 55.02 1gjh s TYR 28 Cb 0.00 -4.14 -0.12 0.00 0.35 0.00 0.00 41.96 38.06 1gjh s TYR 28 CO 0.00 -2.85 2.04 -1.21 -1.34 0.00 0.00 175.55 172.19 1gjh s GLU 29 N 5.69 2.08 0.11 4.97 2.02 -1.26 -4.45 118.70 127.87 1gjh s GLU 29 Ca 0.78 -0.56 -0.31 0.00 0.02 0.00 0.00 54.97 54.90 1gjh s GLU 29 Cb -0.21 -5.08 -0.10 0.00 0.10 0.00 0.00 34.13 28.84 1gjh s GLU 29 CO 0.33 -4.26 1.87 1.87 0.02 0.00 0.00 175.26 175.08 1gjh n TRP 30 N 16.11 2.63 -1.71 1.61 -0.00 -1.26 -4.87 117.44 129.95 1gjh n TRP 30 Ca 0.43 -0.20 -0.38 0.00 -0.00 0.00 0.00 57.50 57.35 1gjh n TRP 30 Cb 0.46 -2.75 -0.02 0.00 -0.00 0.00 0.00 31.31 29.00 1gjh n TRP 30 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 177.69 177.44 1gjh n ASP 31 N 5.94 8.17 0.11 5.87 9.92 -1.26 -4.65 116.55 140.66 1gjh n ASP 31 Ca 0.18 -2.93 -0.12 0.00 -0.53 0.00 0.00 54.79 51.39 1gjh n ASP 31 Cb 0.38 -1.43 -0.08 0.00 -0.64 0.00 0.00 41.12 39.36 1gjh n ASP 31 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1gjh h ALA 32 N 4.63 -0.32 -0.58 2.24 0.00 -2.00 -3.34 119.26 119.89 1gjh h ALA 32 Ca 0.74 -0.20 -0.74 0.00 0.00 0.00 0.00 54.91 54.71 1gjh h ALA 32 Cb 0.34 0.12 -0.11 0.00 0.00 0.00 0.00 17.79 18.15 1gjh h ALA 32 CO 1.53 -0.46 2.46 0.41 0.00 0.00 0.00 179.25 183.19 1gjh n GLY 33 N 0.00 4.68 0.46 0.00 0.00 -1.26 -4.75 105.19 104.33 1gjh n GLY 33 Ca -0.09 -1.92 0.28 0.00 0.00 0.00 0.00 46.02 44.29 1gjh n GLY 33 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1gjh h ASP 34 N 5.70 0.17 -0.39 1.61 3.58 -1.97 -3.18 116.42 121.94 1gjh h ASP 34 Ca 0.49 0.03 -0.69 0.00 0.42 0.00 0.00 57.03 57.28 1gjh h ASP 34 Cb 0.59 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.59 1gjh h ASP 34 CO 1.70 0.04 2.67 -0.67 -2.88 0.00 0.00 179.24 180.10 1gjh n ASP 35 N -4.37 4.29 -2.98 2.28 2.03 -1.26 -4.81 116.55 111.73 1gjh n ASP 35 Ca 0.23 -2.87 -0.33 0.00 0.52 0.00 0.00 54.79 52.34 1gjh n ASP 35 Cb 1.00 -1.69 -0.04 0.00 -0.72 0.00 0.00 41.12 39.67 1gjh n ASP 35 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1gjh n VAL 36 N 5.75 4.28 -1.63 5.18 3.14 -1.20 -4.55 118.33 129.30 1gjh n VAL 36 Ca 0.50 -3.41 -0.25 0.00 -2.96 0.00 0.00 64.34 58.23 1gjh n VAL 36 Cb 0.42 -1.96 0.08 0.00 -1.06 0.00 0.00 33.84 31.32 1gjh n VAL 36 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1gjh n GLU 37 N 1.71 2.90 -3.23 1.45 1.02 -1.26 -4.99 120.64 118.24 1gjh n GLU 37 Ca 0.58 -3.62 -0.14 0.00 -0.02 0.00 0.00 57.16 53.96 1gjh n GLU 37 Cb 0.41 -2.20 0.01 0.00 -0.02 0.00 0.00 31.44 29.65 1gjh n GLU 37 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1gjh n GLU 38 N -0.88 -1.31 -3.40 3.49 0.28 -1.26 -4.90 120.64 112.66 1gjh n GLU 38 Ca 0.50 1.29 -0.45 0.00 -0.16 0.00 0.00 57.16 58.34 1gjh n GLU 38 Cb 0.90 -2.11 -0.04 0.00 1.43 0.00 0.00 31.44 31.62 1gjh n GLU 38 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1gjh s ASN 39 N -1.33 6.45 -0.80 -1.84 3.04 -1.26 -4.93 114.94 114.27 1gjh s ASN 39 Ca 0.15 -2.64 0.01 0.00 0.04 0.00 0.00 52.86 50.42 1gjh s ASN 39 Cb -0.02 -2.15 0.34 0.00 -1.54 0.00 0.00 41.25 37.89 1gjh s ASN 39 CO 0.44 -0.56 1.53 0.54 -3.04 0.00 0.00 177.10 176.01 1gjh n ARG 40 N 4.00 4.13 0.00 0.43 3.00 -1.26 -4.90 116.66 122.06 1gjh n ARG 40 Ca 0.10 -4.51 0.00 0.00 -0.01 0.00 0.00 57.85 53.44 1gjh n ARG 40 Cb 0.45 -2.34 0.00 0.00 0.00 0.00 0.00 32.46 30.56 1gjh n ARG 40 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1gjh n THR 41 N -0.25 0.00 -1.48 0.55 -2.24 -1.26 -3.67 114.28 105.94 1gjh n THR 41 Ca 0.43 1.10 -0.13 0.00 -2.27 0.00 0.00 64.05 63.18 1gjh n THR 41 Cb 0.34 -1.84 0.17 0.00 -2.10 0.00 0.00 70.33 66.89 1gjh n THR 41 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1gjh n GLU 42 N -1.10 2.16 -0.90 -0.78 1.02 -1.26 -5.07 120.64 114.71 1gjh n GLU 42 Ca 0.00 -3.28 0.01 0.00 -0.02 0.00 0.00 57.16 53.87 1gjh n GLU 42 Cb 0.00 -1.97 -0.01 0.00 -0.02 0.00 0.00 31.44 29.44 1gjh n GLU 42 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gjh n ALA 43 N -1.07 -1.46 0.19 0.62 0.00 -1.24 -4.67 120.51 112.87 1gjh n ALA 43 Ca 0.42 0.32 0.05 0.00 0.00 0.00 0.00 53.44 54.23 1gjh n ALA 43 Cb 1.10 -1.04 0.35 0.00 0.00 0.00 0.00 19.45 19.85 1gjh n ALA 43 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1gjh h PRO 44 N -0.03 0.00 -6.07 0.00 0.13 -1.93 -3.45 132.00 120.65 1gjh h PRO 44 Ca -0.02 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 64.39 1gjh h PRO 44 Cb 0.60 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.72 1gjh h PRO 44 CO 0.01 0.37 1.12 0.39 -0.23 0.00 0.00 178.00 179.66 1gjh n GLU 45 N -3.58 0.95 -2.77 0.86 -0.58 -1.26 -4.84 120.64 109.42 1gjh n GLU 45 Ca -0.00 0.32 -0.10 0.00 -0.42 0.00 0.00 57.16 56.95 1gjh n GLU 45 Cb 0.49 -2.13 0.06 0.00 -0.57 0.00 0.00 31.44 29.30 1gjh n GLU 45 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1gjh n GLY 46 N 5.39 1.67 0.52 0.62 0.00 -1.26 -4.95 105.19 107.18 1gjh n GLY 46 Ca 0.35 -0.82 0.34 0.00 0.00 0.00 0.00 46.02 45.89 1gjh n GLY 46 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1gjh h THR 47 N 2.37 0.38 0.00 2.61 1.35 -1.99 -1.77 112.91 115.87 1gjh h THR 47 Ca -0.13 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1gjh h THR 47 Cb 1.17 0.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.89 1gjh h THR 47 CO 0.27 0.02 0.00 1.21 -0.25 0.00 0.00 175.52 176.77 1gjh n GLU 48 N -4.28 0.00 0.00 4.72 2.13 -1.26 -2.29 120.64 119.66 1gjh n GLU 48 Ca 0.27 0.57 0.04 0.00 0.66 0.00 0.00 57.16 58.70 1gjh n GLU 48 Cb 1.24 -1.34 0.22 0.00 0.27 0.00 0.00 31.44 31.83 1gjh n GLU 48 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1gjh n SER 49 N -1.90 0.00 -0.04 4.31 3.41 -0.97 -3.56 113.62 114.86 1gjh n SER 49 Ca 0.00 -1.56 -0.15 0.00 -0.26 0.00 0.00 58.87 56.90 1gjh n SER 49 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 1gjh n SER 49 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1gjh h GLU 50 N 0.00 0.08 -0.98 4.33 4.39 -0.90 -2.79 114.58 118.71 1gjh h GLU 50 Ca 0.00 -0.12 0.25 0.00 0.34 0.00 0.00 59.36 59.84 1gjh h GLU 50 Cb 0.00 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.63 1gjh h GLU 50 CO 0.00 1.02 0.66 -0.24 -1.16 0.00 0.00 179.01 179.29 1gjh h VAL 92 N -0.80 0.57 -0.03 3.13 3.04 -1.58 0.56 116.25 121.13 1gjh h VAL 92 Ca -0.03 -0.09 -0.16 0.00 -1.01 0.00 0.00 66.70 65.41 1gjh h VAL 92 Cb 1.10 0.28 0.01 0.00 -2.01 0.00 0.00 31.29 30.68 1gjh h VAL 92 CO 0.03 0.05 -0.61 0.58 -1.01 0.00 0.00 177.57 176.61 1gjh h VAL 93 N 0.26 1.40 0.40 1.51 2.07 -1.75 -3.19 116.25 116.95 1gjh h VAL 93 Ca 0.51 -2.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.00 1gjh h VAL 93 Cb 1.53 2.46 -0.03 0.00 -1.52 0.00 0.00 31.29 33.73 1gjh h VAL 93 CO -0.15 0.60 -0.49 0.45 0.02 0.00 0.00 177.57 178.00 1gjh h HIS 94 N 0.01 -1.36 -1.16 1.57 -0.00 -0.62 0.95 115.15 114.53 1gjh h HIS 94 Ca -0.07 0.02 0.33 0.00 -0.00 0.00 0.00 60.37 60.65 1gjh h HIS 94 Cb 1.30 0.54 -0.07 0.00 -0.00 0.00 0.00 27.41 29.18 1gjh h HIS 94 CO 0.13 -0.62 0.80 -0.07 -0.00 0.00 0.00 177.93 178.17 1gjh h LEU 95 N -0.90 0.15 0.22 2.43 3.38 -1.50 0.13 115.31 119.22 1gjh h LEU 95 Ca -0.05 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1gjh h LEU 95 Cb 0.81 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1gjh h LEU 95 CO -0.11 0.02 -0.11 0.74 0.09 0.00 0.00 178.44 179.07 1gjh h THR 96 N 0.13 0.38 0.64 0.22 2.02 -1.22 -2.38 112.91 112.70 1gjh h THR 96 Ca 0.59 -0.95 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 1gjh h THR 96 Cb 2.06 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 1gjh h THR 96 CO -0.12 0.11 -0.49 0.25 0.37 0.00 0.00 175.52 175.63 1gjh h LEU 97 N -1.01 -1.30 -0.06 2.58 5.85 0.24 0.86 115.31 122.46 1gjh h LEU 97 Ca -0.03 0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1gjh h LEU 97 Cb 0.40 0.41 -0.06 0.00 0.37 0.00 0.00 40.66 41.77 1gjh h LEU 97 CO 0.05 -0.70 -0.43 -0.09 -0.34 0.00 0.00 178.44 176.93 1gjh h ARG 98 N -1.09 -0.52 0.86 1.25 2.43 -0.96 0.38 114.38 116.73 1gjh h ARG 98 Ca -0.08 0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1gjh h ARG 98 Cb 0.91 0.12 0.01 0.00 -0.42 0.00 0.00 29.97 30.58 1gjh h ARG 98 CO 0.02 -0.35 -0.43 0.37 -1.51 0.00 0.00 179.97 178.07 1gjh h GLN 99 N -0.54 -1.13 -0.27 0.20 4.15 -1.36 -2.57 115.11 113.60 1gjh h GLN 99 Ca 0.06 0.08 0.04 0.00 0.77 0.00 0.00 58.65 59.59 1gjh h GLN 99 Cb 0.65 0.26 -0.07 0.00 0.21 0.00 0.00 27.48 28.53 1gjh h GLN 99 CO -0.36 -0.75 -0.49 0.00 -1.93 0.00 0.00 178.83 175.30 1gjh h ALA 100 N -1.43 -0.78 -0.76 3.38 0.00 0.87 -0.64 119.26 119.90 1gjh h ALA 100 Ca -0.12 -0.02 0.15 0.00 0.00 0.00 0.00 54.91 54.92 1gjh h ALA 100 Cb 0.90 1.04 -0.14 0.00 0.00 0.00 0.00 17.79 19.59 1gjh h ALA 100 CO 0.18 -0.99 -0.22 0.78 0.00 0.00 0.00 179.25 179.00 1gjh h GLY 101 N -0.42 0.44 2.00 0.00 0.00 -0.26 0.87 103.07 105.70 1gjh h GLY 101 Ca 0.05 0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.64 1gjh h GLY 101 CO -0.48 -0.28 -0.15 -1.80 0.00 0.00 0.00 176.54 173.83 1gjh h ASP 102 N -0.02 0.00 -0.32 0.19 3.58 -0.96 -2.35 116.42 116.54 1gjh h ASP 102 Ca 0.35 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.71 1gjh h ASP 102 Cb 0.56 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.61 1gjh h ASP 102 CO -0.79 0.15 -0.17 -0.78 -2.88 0.00 0.00 179.24 174.77 1gjh h ASP 103 N 0.00 0.71 0.84 2.28 3.58 0.22 -2.44 116.42 121.61 1gjh h ASP 103 Ca -0.00 -0.42 -0.04 0.00 0.42 0.00 0.00 57.03 56.99 1gjh h ASP 103 Cb 0.31 -0.20 0.01 0.00 1.72 0.00 0.00 39.33 41.18 1gjh h ASP 103 CO 0.02 0.97 -0.40 0.15 -2.88 0.00 0.00 179.24 177.09 1gjh h PHE 104 N 0.44 -1.05 -1.02 0.28 3.04 -0.58 -2.65 116.94 115.41 1gjh h PHE 104 Ca 0.07 -0.02 0.27 0.00 3.98 0.00 0.00 57.97 62.26 1gjh h PHE 104 Cb 0.71 0.35 -0.13 0.00 2.56 0.00 0.00 35.95 39.44 1gjh h PHE 104 CO 0.06 -0.65 0.61 1.03 -2.02 0.00 0.00 178.31 177.34 1gjh h SER 105 N -1.14 0.61 -0.53 0.41 0.87 -1.56 0.74 113.55 112.95 1gjh h SER 105 Ca -0.12 0.14 0.04 0.00 -1.23 0.00 0.00 61.79 60.63 1gjh h SER 105 Cb 0.86 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.85 1gjh h SER 105 CO 0.19 0.05 0.35 -0.09 -0.53 0.00 0.00 176.83 176.80 1gjh h ARG 106 N 0.50 0.55 0.00 2.24 2.43 -1.18 0.56 114.38 119.48 1gjh h ARG 106 Ca 0.66 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.80 1gjh h ARG 106 Cb 1.37 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1gjh h ARG 106 CO -0.48 0.36 0.00 -0.09 -1.51 0.00 0.00 179.97 178.25 1gjh h ARG 107 N 0.56 0.00 -4.28 0.20 2.43 0.83 -3.39 114.38 110.73 1gjh h ARG 107 Ca 0.22 0.00 -0.68 0.00 -0.81 0.00 0.00 59.98 58.70 1gjh h ARG 107 Cb 0.16 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 29.35 1gjh h ARG 107 CO -0.06 0.00 -0.55 0.71 -1.51 0.00 0.00 179.97 178.56 1gjh s TYR 108 N -3.24 3.56 0.03 2.20 1.51 0.19 -4.94 117.35 116.66 1gjh s TYR 108 Ca 0.07 -2.63 -0.18 0.00 -1.01 0.00 0.00 57.07 53.32 1gjh s TYR 108 Cb 0.10 -3.14 -0.20 0.00 -0.11 0.00 0.00 41.96 38.61 1gjh s TYR 108 CO 0.54 -0.93 1.18 -0.09 -1.11 0.00 0.00 175.55 175.14 1gjh h ARG 109 N 7.68 0.50 -4.45 -0.62 9.65 -1.78 -3.42 114.38 121.95 1gjh h ARG 109 Ca -0.09 -0.47 -0.65 0.00 -1.10 0.00 0.00 59.98 57.68 1gjh h ARG 109 Cb 1.01 0.11 -0.40 0.00 -1.39 0.00 0.00 29.97 29.31 1gjh h ARG 109 CO 0.67 1.10 -0.72 -0.98 2.80 0.00 0.00 179.97 182.84 1gjh s ARG 110 N -3.48 1.42 0.00 0.20 1.70 -1.26 -4.58 118.95 112.95 1gjh s ARG 110 Ca -0.13 -1.83 0.00 0.00 -0.47 0.00 0.00 55.73 53.30 1gjh s ARG 110 Cb 0.05 -3.06 0.00 0.00 -0.57 0.00 0.00 34.95 31.37 1gjh s ARG 110 CO 0.84 -0.96 0.00 -3.47 -1.08 0.00 0.00 175.30 170.63 1gjh n ASP 111 N 4.24 -0.03 -0.09 -2.89 2.03 -1.26 -4.93 116.55 113.62 1gjh n ASP 111 Ca 0.03 0.01 -0.09 0.00 0.52 0.00 0.00 54.79 55.27 1gjh n ASP 111 Cb 0.41 0.21 -0.14 0.00 -0.72 0.00 0.00 41.12 40.89 1gjh n ASP 111 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1gjh n PHE 112 N -2.20 0.00 -0.07 -0.67 3.01 -1.26 -4.23 117.46 112.04 1gjh n PHE 112 Ca 0.00 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.36 1gjh n PHE 112 Cb 0.00 -0.87 -0.07 0.00 -0.01 0.00 0.00 39.48 38.53 1gjh n PHE 112 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1gjh h ALA 113 N 0.80 0.04 -0.92 4.37 0.00 -1.89 -2.97 119.26 118.68 1gjh h ALA 113 Ca -0.48 -0.44 0.25 0.00 0.00 0.00 0.00 54.91 54.24 1gjh h ALA 113 Cb 2.06 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.96 1gjh h ALA 113 CO 0.02 0.15 0.65 1.49 0.00 0.00 0.00 179.25 181.56 1gjh h GLU 114 N -1.00 0.11 0.05 0.00 4.81 -1.82 0.35 114.58 117.08 1gjh h GLU 114 Ca -0.05 -0.01 -0.23 0.00 -0.13 0.00 0.00 59.36 58.94 1gjh h GLU 114 Cb 0.67 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1gjh h GLU 114 CO -0.03 0.08 -1.05 1.98 -0.73 0.00 0.00 179.01 179.25 1gjh h MET 115 N 0.12 0.16 -1.09 1.92 4.05 -1.74 -3.25 114.93 115.11 1gjh h MET 115 Ca 0.46 -0.24 0.30 0.00 -0.28 0.00 0.00 59.70 59.94 1gjh h MET 115 Cb 1.61 0.08 -0.06 0.00 -0.80 0.00 0.00 31.60 32.44 1gjh h MET 115 CO -0.07 1.07 0.76 1.03 0.23 0.00 0.00 176.91 179.93 1gjh h SER 116 N 0.06 0.13 -1.11 1.39 0.87 -0.12 0.21 113.55 114.98 1gjh h SER 116 Ca -0.07 0.02 0.31 0.00 -1.23 0.00 0.00 61.79 60.83 1gjh h SER 116 Cb 1.76 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.66 1gjh h SER 116 CO 0.16 0.02 0.78 -1.28 -0.53 0.00 0.00 176.83 175.98 1gjh h SER 117 N 0.11 0.13 -1.16 6.23 0.87 -1.58 -1.89 113.55 116.26 1gjh h SER 117 Ca 0.54 0.03 -0.69 0.00 -1.23 0.00 0.00 61.79 60.44 1gjh h SER 117 Cb 1.94 0.01 -0.14 0.00 -0.44 0.00 0.00 62.40 63.76 1gjh h SER 117 CO -0.09 0.02 1.94 0.00 -0.53 0.00 0.00 176.83 178.18 1gjh n GLN 118 N -4.33 4.15 -3.25 2.24 1.13 0.75 -4.70 117.38 113.36 1gjh n GLN 118 Ca 0.25 -3.25 -0.17 0.00 -1.94 0.00 0.00 57.00 51.89 1gjh n GLN 118 Cb 1.11 -2.52 -0.07 0.00 0.11 0.00 0.00 30.24 28.87 1gjh n GLN 118 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1gjh s LEU 119 N -2.20 0.06 0.25 1.08 0.20 -0.71 -5.12 118.68 112.24 1gjh s LEU 119 Ca 0.55 -2.03 -0.30 0.00 0.69 0.00 0.00 54.13 53.04 1gjh s LEU 119 Cb 0.23 0.57 -0.14 0.00 -0.43 0.00 0.00 46.19 46.41 1gjh s LEU 119 CO -0.12 -0.19 1.15 1.41 -0.29 0.00 0.00 176.35 178.31 1gjh n HIS 120 N 3.59 1.54 -3.34 5.38 8.25 -1.26 -4.93 115.22 124.45 1gjh n HIS 120 Ca 0.18 0.63 -0.45 0.00 -0.26 0.00 0.00 57.72 57.82 1gjh n HIS 120 Cb 0.48 -2.31 -0.06 0.00 1.12 0.00 0.00 29.99 29.22 1gjh n HIS 120 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1gjh s LEU 121 N 0.30 6.01 -0.05 2.41 1.98 -1.26 -5.00 118.68 123.07 1gjh s LEU 121 Ca 0.64 -1.66 -0.30 0.00 -2.89 0.00 0.00 54.13 49.92 1gjh s LEU 121 Cb -0.72 -2.19 0.09 0.00 0.66 0.00 0.00 46.19 44.03 1gjh s LEU 121 CO 0.56 -0.79 0.77 0.28 -1.89 0.00 0.00 176.35 175.28 1gjh s THR 122 N 1.60 0.00 -0.81 3.68 -1.32 -1.26 -5.05 115.64 112.48 1gjh s THR 122 Ca 0.03 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.42 1gjh s THR 122 Cb -0.28 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.63 1gjh s THR 122 CO 0.04 0.00 1.98 -0.81 -2.21 0.00 0.00 174.62 173.62 1gjh n PRO 123 N 0.61 1.78 -3.64 7.08 -0.04 -1.26 -4.62 135.00 134.91 1gjh n PRO 123 Ca -0.16 -1.49 -0.03 0.00 -0.04 0.00 0.00 63.50 61.79 1gjh n PRO 123 Cb 0.59 -2.54 -0.04 0.00 -0.04 0.00 0.00 33.50 31.46 1gjh n PRO 123 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1gjh s PHE 124 N 3.95 -0.08 -0.85 0.54 5.36 -1.26 -4.97 117.98 120.68 1gjh s PHE 124 Ca 0.42 0.14 -0.02 0.00 -0.96 0.00 0.00 56.93 56.50 1gjh s PHE 124 Cb 0.11 0.49 0.01 0.00 -0.34 0.00 0.00 43.02 43.29 1gjh s PHE 124 CO 0.01 -0.07 0.09 0.25 -1.46 0.00 0.00 175.22 174.04 1gjh n THR 125 N 0.61 -0.51 -0.03 0.12 -2.24 -1.26 -4.82 114.28 106.15 1gjh n THR 125 Ca -0.02 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.61 1gjh n THR 125 Cb 0.59 -1.35 -0.10 0.00 -2.10 0.00 0.00 70.33 67.37 1gjh n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gjh h ALA 126 N 0.99 0.11 0.01 6.98 0.00 -1.93 -3.05 119.26 122.38 1gjh h ALA 126 Ca -0.25 -0.45 -0.19 0.00 0.00 0.00 0.00 54.91 54.02 1gjh h ALA 126 Cb 1.18 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1gjh h ALA 126 CO 0.30 0.18 -0.89 -0.09 0.00 0.00 0.00 179.25 178.75 1gjh h ARG 127 N -0.20 0.12 -0.11 0.00 2.43 -1.98 -2.98 114.38 111.66 1gjh h ARG 127 Ca -0.02 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 58.98 1gjh h ARG 127 Cb 0.99 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 1gjh h ARG 127 CO 0.07 0.93 -0.05 0.78 -1.51 0.00 0.00 179.97 180.19 1gjh h GLY 128 N 2.13 0.17 1.53 2.80 0.00 -1.95 -1.55 103.07 106.20 1gjh h GLY 128 Ca -0.03 -0.08 -0.26 0.00 0.00 0.00 0.00 47.33 46.95 1gjh h GLY 128 CO 0.13 0.08 -1.33 3.21 0.00 0.00 0.00 176.54 178.63 1gjh h ARG 129 N 0.16 0.07 -0.19 4.80 2.47 -1.53 -3.28 114.38 116.88 1gjh h ARG 129 Ca 0.04 -0.13 -0.04 0.00 -1.26 0.00 0.00 59.98 58.59 1gjh h ARG 129 Cb 0.19 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.56 1gjh h ARG 129 CO 0.01 0.91 -0.02 0.35 0.56 0.00 0.00 179.97 181.78 1gjh h PHE 130 N 0.02 0.39 -0.97 3.04 3.04 -1.28 -2.92 116.94 118.26 1gjh h PHE 130 Ca -0.15 -0.07 0.07 0.00 3.98 0.00 0.00 57.97 61.80 1gjh h PHE 130 Cb 1.90 -0.10 -0.07 0.00 2.56 0.00 0.00 35.95 40.25 1gjh h PHE 130 CO 0.02 0.58 0.62 0.00 -2.02 0.00 0.00 178.31 177.50 1gjh h ALA 131 N 0.76 1.35 -0.42 2.41 0.00 -1.43 -1.06 119.26 120.87 1gjh h ALA 131 Ca 0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1gjh h ALA 131 Cb 0.43 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1gjh h ALA 131 CO 0.01 0.38 0.20 0.00 0.00 0.00 0.00 179.25 179.84 1gjh h THR 132 N 1.11 1.15 0.18 0.00 1.03 -1.59 0.16 112.91 114.94 1gjh h THR 132 Ca 0.42 -0.42 -0.01 0.00 -0.01 0.00 0.00 66.41 66.39 1gjh h THR 132 Cb 0.20 0.62 0.00 0.00 -1.07 0.00 0.00 68.15 67.90 1gjh h THR 132 CO -0.18 0.17 -0.08 0.58 -0.01 0.00 0.00 175.52 175.99 1gjh h VAL 133 N 0.59 0.90 0.00 0.00 2.07 -1.03 -2.88 116.25 115.90 1gjh h VAL 133 Ca 0.15 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.62 1gjh h VAL 133 Cb 0.07 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1gjh h VAL 133 CO -0.02 0.21 -0.27 0.58 0.02 0.00 0.00 177.57 178.09 1gjh h VAL 134 N -0.77 1.16 -0.59 2.57 2.07 -1.26 -2.43 116.25 117.00 1gjh h VAL 134 Ca -0.02 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.54 1gjh h VAL 134 Cb 0.52 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1gjh h VAL 134 CO 0.04 0.26 0.25 -0.33 0.02 0.00 0.00 177.57 177.81 1gjh h GLU 135 N 0.00 0.88 -0.17 1.57 4.39 -0.70 -2.38 114.58 118.17 1gjh h GLU 135 Ca -0.00 -0.15 -0.11 0.00 0.34 0.00 0.00 59.36 59.43 1gjh h GLU 135 Cb 0.48 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1gjh h GLU 135 CO 0.03 0.75 -0.36 0.93 -1.16 0.00 0.00 179.01 179.20 1gjh h GLU 136 N 0.82 0.37 -0.22 2.33 5.08 -1.24 -2.99 114.58 118.72 1gjh h GLU 136 Ca 0.20 -0.17 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1gjh h GLU 136 Cb 0.19 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 1gjh h GLU 136 CO -0.02 0.69 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.59 1gjh h LEU 137 N 0.32 -0.12 -6.16 1.33 -0.00 -0.97 -3.16 115.31 106.55 1gjh h LEU 137 Ca 0.03 0.05 -0.68 0.00 -0.00 0.00 0.00 57.88 57.29 1gjh h LEU 137 Cb 0.79 0.10 -0.36 0.00 -0.00 0.00 0.00 40.66 41.18 1gjh h LEU 137 CO 0.06 -0.03 -0.03 0.49 -0.00 0.00 0.00 178.44 178.93 1gjh n PHE 138 N -5.16 3.28 0.12 1.13 3.01 -1.01 -4.86 117.46 113.97 1gjh n PHE 138 Ca -0.02 -3.50 -0.06 0.00 1.01 0.00 0.00 57.45 54.88 1gjh n PHE 138 Cb 0.12 -0.80 -0.03 0.00 -0.01 0.00 0.00 39.48 38.76 1gjh n PHE 138 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1gjh h ARG 139 N 4.20 -0.37 0.00 -1.08 2.43 -1.49 -3.43 114.38 114.64 1gjh h ARG 139 Ca 0.23 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1gjh h ARG 139 Cb 0.56 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1gjh h ARG 139 CO 1.01 -0.25 0.00 -0.25 -1.51 0.00 0.00 179.97 178.97 1gjh n ASP 140 N -4.82 0.00 -4.31 -3.80 9.92 -1.26 -5.04 116.55 107.24 1gjh n ASP 140 Ca -0.05 0.25 -0.16 0.00 -0.53 0.00 0.00 54.79 54.30 1gjh n ASP 140 Cb 0.15 -0.26 -0.10 0.00 -0.64 0.00 0.00 41.12 40.27 1gjh n ASP 140 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1gjh s GLY 141 N -1.55 1.66 0.23 0.44 0.00 -1.26 -5.17 107.32 101.68 1gjh s GLY 141 Ca 0.00 -1.83 0.06 0.00 0.00 0.00 0.00 44.72 42.95 1gjh s GLY 141 CO 0.00 -1.59 0.26 0.14 0.00 0.00 0.00 173.10 171.91 1gjh s VAL 142 N -3.73 4.83 0.01 1.40 1.01 -1.26 -4.76 120.40 117.90 1gjh s VAL 142 Ca 0.36 -1.16 -0.28 0.00 0.00 0.00 0.00 61.98 60.89 1gjh s VAL 142 Cb 0.08 -3.60 0.10 0.00 0.00 0.00 0.00 36.38 32.96 1gjh s VAL 142 CO 0.12 -0.30 0.89 0.21 0.00 0.00 0.00 175.10 176.02 1gjh s ASN 143 N -3.79 -0.36 0.11 3.32 3.84 -1.26 -5.02 114.94 111.78 1gjh s ASN 143 Ca 0.33 -0.03 -0.27 0.00 0.21 0.00 0.00 52.86 53.10 1gjh s ASN 143 Cb -0.09 0.40 -0.09 0.00 -0.55 0.00 0.00 41.25 40.92 1gjh s ASN 143 CO 0.27 -0.65 1.46 -0.50 -2.79 0.00 0.00 177.10 174.89 1gjh h TRP 144 N 2.00 -1.45 -0.84 0.43 -0.00 -2.00 0.16 115.95 114.26 1gjh h TRP 144 Ca -0.23 0.07 0.18 0.00 -0.00 0.00 0.00 58.89 58.92 1gjh h TRP 144 Cb 1.24 0.68 -0.16 0.00 -0.00 0.00 0.00 29.16 30.93 1gjh h TRP 144 CO 0.26 -0.40 -0.13 0.78 -0.00 0.00 0.00 178.44 178.95 1gjh h GLY 145 N -0.31 0.74 1.01 1.49 0.00 -1.98 0.18 103.07 104.19 1gjh h GLY 145 Ca 0.07 0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.59 1gjh h GLY 145 CO -0.52 -0.34 -0.31 3.21 0.00 0.00 0.00 176.54 178.58 1gjh h ARG 146 N 0.02 -0.83 -0.70 4.80 3.08 -1.54 -1.58 114.38 117.63 1gjh h ARG 146 Ca 0.43 0.06 0.15 0.00 0.07 0.00 0.00 59.98 60.69 1gjh h ARG 146 Cb 0.72 0.19 -0.12 0.00 0.08 0.00 0.00 29.97 30.83 1gjh h ARG 146 CO -0.83 -0.55 -0.04 0.82 -1.07 0.00 0.00 179.97 178.31 1gjh h ILE 147 N -0.87 0.37 0.00 2.04 2.04 0.98 0.84 117.51 122.91 1gjh h ILE 147 Ca -0.09 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1gjh h ILE 147 Cb 0.66 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1gjh h ILE 147 CO 0.14 0.01 -0.07 0.58 0.00 0.00 0.00 178.15 178.82 1gjh h VAL 148 N 0.08 0.73 0.29 1.67 2.07 -0.52 -1.93 116.25 118.65 1gjh h VAL 148 Ca 0.37 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 1gjh h VAL 148 Cb 0.62 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1gjh h VAL 148 CO -0.64 0.07 -0.14 0.00 0.02 0.00 0.00 177.57 176.88 1gjh h ALA 149 N 1.93 -0.58 -1.01 1.67 0.00 0.17 -2.71 119.26 118.73 1gjh h ALA 149 Ca -0.00 -0.08 0.24 0.00 0.00 0.00 0.00 54.91 55.07 1gjh h ALA 149 Cb 0.15 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 17.97 1gjh h ALA 149 CO 0.01 -0.56 0.60 0.35 0.00 0.00 0.00 179.25 179.66 1gjh h PHE 150 N -0.69 0.99 -0.23 0.00 3.04 -1.23 0.17 116.94 118.99 1gjh h PHE 150 Ca -0.04 0.03 0.04 0.00 3.98 0.00 0.00 57.97 61.99 1gjh h PHE 150 Cb 0.29 -0.29 -0.04 0.00 2.56 0.00 0.00 35.95 38.48 1gjh h PHE 150 CO 0.05 0.08 -0.04 0.74 -2.02 0.00 0.00 178.31 177.12 1gjh h PHE 151 N 0.58 -0.09 -0.39 0.41 0.04 -1.39 0.51 116.94 116.62 1gjh h PHE 151 Ca 0.63 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 61.36 1gjh h PHE 151 Cb 1.22 0.07 -0.02 0.00 2.20 0.00 0.00 35.95 39.42 1gjh h PHE 151 CO -0.01 -0.08 -0.03 0.93 -0.60 0.00 0.00 178.31 178.52 1gjh h GLU 152 N 0.02 0.63 0.28 1.51 4.39 -0.41 -3.03 114.58 117.97 1gjh h GLU 152 Ca 0.11 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1gjh h GLU 152 Cb 0.16 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1gjh h GLU 152 CO -0.22 0.67 -0.13 0.35 -1.16 0.00 0.00 179.01 178.52 1gjh h PHE 153 N 0.59 -0.35 -0.88 4.33 3.57 -0.07 -2.04 116.94 122.10 1gjh h PHE 153 Ca 0.12 -0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.82 1gjh h PHE 153 Cb 0.42 0.11 -0.12 0.00 2.79 0.00 0.00 35.95 39.15 1gjh h PHE 153 CO 0.02 -0.14 0.38 0.78 -2.23 0.00 0.00 178.31 177.12 1gjh h GLY 154 N -0.49 1.49 0.93 2.40 0.00 -0.83 0.61 103.07 107.18 1gjh h GLY 154 Ca -0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 1gjh h GLY 154 CO 0.06 -0.25 0.08 -1.33 0.00 0.00 0.00 176.54 175.10 1gjh h GLY 155 N 0.40 0.66 0.30 4.60 0.00 -1.40 0.21 103.07 107.86 1gjh h GLY 155 Ca 0.54 -0.43 0.13 0.00 0.00 0.00 0.00 47.33 47.58 1gjh h GLY 155 CO -0.52 0.40 0.44 -2.08 0.00 0.00 0.00 176.54 174.78 1gjh h VAL 156 N 0.47 0.77 -0.02 4.60 2.07 -0.18 0.35 116.25 124.31 1gjh h VAL 156 Ca 0.12 -0.23 -0.26 0.00 0.82 0.00 0.00 66.70 67.15 1gjh h VAL 156 Cb 0.34 0.06 0.02 0.00 -1.52 0.00 0.00 31.29 30.18 1gjh h VAL 156 CO 0.00 0.12 -1.01 0.24 0.02 0.00 0.00 177.57 176.95 1gjh h MET 157 N 0.66 0.71 -0.99 1.57 2.86 -1.03 -2.34 114.93 116.36 1gjh h MET 157 Ca 0.44 -0.74 0.08 0.00 -2.06 0.00 0.00 59.70 57.42 1gjh h MET 157 Cb 0.57 0.20 -0.07 0.00 0.06 0.00 0.00 31.60 32.37 1gjh h MET 157 CO -0.33 1.31 0.64 0.00 1.06 0.00 0.00 176.91 179.59 1gjh h VAL 159 N 1.12 1.52 -0.61 0.00 3.04 -1.00 -3.28 116.25 117.04 1gjh h VAL 159 Ca 0.44 -2.76 0.13 0.00 -1.01 0.00 0.00 66.70 63.49 1gjh h VAL 159 Cb 0.23 2.56 -0.11 0.00 -2.01 0.00 0.00 31.29 31.97 1gjh h VAL 159 CO -0.18 0.80 -0.02 -0.08 -1.01 0.00 0.00 177.57 177.07 1gjh h GLU 160 N 0.09 0.09 -0.73 4.17 4.81 -0.68 0.41 114.58 122.74 1gjh h GLU 160 Ca -0.05 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.28 1gjh h GLU 160 Cb 1.58 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.89 1gjh h GLU 160 CO 0.14 0.06 0.48 0.77 -0.73 0.00 0.00 179.01 179.73 1gjh h SER 161 N 0.10 0.52 1.10 1.04 0.02 -1.57 0.23 113.55 114.99 1gjh h SER 161 Ca 0.32 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.26 1gjh h SER 161 Cb 0.51 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 1gjh h SER 161 CO -0.54 0.30 -0.11 0.58 -1.14 0.00 0.00 176.83 175.92 1gjh h VAL 162 N 0.57 0.25 0.54 2.27 2.07 -0.35 0.83 116.25 122.43 1gjh h VAL 162 Ca 0.34 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 1gjh h VAL 162 Cb 0.55 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 1gjh h VAL 162 CO -0.12 0.10 -0.45 -1.13 0.02 0.00 0.00 177.57 176.00 1gjh h ASN 163 N 0.00 -1.20 0.00 0.57 -1.24 0.50 -3.38 115.58 110.83 1gjh h ASN 163 Ca -0.00 0.09 0.00 0.00 0.71 0.00 0.00 56.30 57.10 1gjh h ASN 163 Cb 0.69 0.38 0.00 0.00 0.73 0.00 0.00 38.32 40.12 1gjh h ASN 163 CO 0.01 -0.64 0.00 0.54 -1.29 0.00 0.00 177.43 176.06 1gjh n ARG 164 N -5.55 0.00 -2.67 6.67 1.74 -1.23 -4.97 116.66 110.65 1gjh n ARG 164 Ca -0.12 0.25 -0.04 0.00 -0.77 0.00 0.00 57.85 57.17 1gjh n ARG 164 Cb 0.44 -0.78 0.10 0.00 -1.02 0.00 0.00 32.46 31.20 1gjh n ARG 164 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1gjh n GLU 165 N -1.25 0.20 -2.74 5.56 2.13 -1.10 -5.03 120.64 118.41 1gjh n GLU 165 Ca 0.00 -0.79 -0.03 0.00 0.66 0.00 0.00 57.16 57.00 1gjh n GLU 165 Cb 0.00 -0.25 0.08 0.00 0.27 0.00 0.00 31.44 31.54 1gjh n GLU 165 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1gjh n MET 166 N 0.85 1.44 -0.15 5.31 2.81 0.28 -4.98 117.12 122.69 1gjh n MET 166 Ca -0.03 -2.47 -0.06 0.00 -1.81 0.00 0.00 57.70 53.33 1gjh n MET 166 Cb 0.74 -0.66 -0.00 0.00 -0.71 0.00 0.00 33.22 32.59 1gjh n MET 166 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 1gjh h SER 167 N 2.06 -1.02 -0.97 7.83 0.02 -1.86 0.84 113.55 120.45 1gjh h SER 167 Ca -0.26 0.20 0.28 0.00 -0.84 0.00 0.00 61.79 61.17 1gjh h SER 167 Cb 1.27 0.50 -0.04 0.00 0.14 0.00 0.00 62.40 64.27 1gjh h SER 167 CO 0.07 -0.30 0.78 -0.65 -1.14 0.00 0.00 176.83 175.60 1gjh h PRO 168 N -0.20 0.00 -0.97 3.45 0.11 -1.93 -0.38 132.00 132.08 1gjh h PRO 168 Ca 0.20 0.00 0.25 0.00 0.11 0.00 0.00 66.00 66.56 1gjh h PRO 168 Cb 0.53 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.57 1gjh h PRO 168 CO -0.58 0.00 0.65 1.25 -0.21 0.00 0.00 178.00 179.12 1gjh h LEU 169 N 0.00 0.31 -1.87 2.35 6.46 -1.17 0.16 115.31 121.56 1gjh h LEU 169 Ca 0.46 0.04 0.30 0.00 -0.12 0.00 0.00 57.88 58.57 1gjh h LEU 169 Cb 2.02 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 41.88 1gjh h LEU 169 CO -0.00 0.09 0.76 -0.37 -0.62 0.00 0.00 178.44 178.30 1gjh h VAL 170 N 0.29 0.47 0.08 1.05 -1.51 -1.21 0.19 116.25 115.62 1gjh h VAL 170 Ca 0.51 -0.03 -0.00 0.00 -1.23 0.00 0.00 66.70 65.95 1gjh h VAL 170 Cb 1.48 0.38 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 1gjh h VAL 170 CO -0.17 0.02 -0.04 -0.78 -1.23 0.00 0.00 177.57 175.37 1gjh h ASP 171 N 0.08 -0.09 0.03 4.19 1.82 -0.89 -1.08 116.42 120.49 1gjh h ASP 171 Ca 0.53 -0.32 -0.01 0.00 -0.39 0.00 0.00 57.03 56.85 1gjh h ASP 171 Cb 1.95 0.02 -0.00 0.00 0.68 0.00 0.00 39.33 41.98 1gjh h ASP 171 CO -0.06 0.28 -0.03 0.78 -1.61 0.00 0.00 179.24 178.60 1gjh h ASN 172 N -0.47 0.00 0.39 2.28 4.21 -0.82 -1.75 115.58 119.42 1gjh h ASN 172 Ca -0.01 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.48 1gjh h ASN 172 Cb 0.40 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.61 1gjh h ASN 172 CO 0.02 0.03 -0.19 0.40 -1.29 0.00 0.00 177.43 176.40 1gjh h ILE 173 N 0.00 0.00 -1.13 2.81 1.08 -0.82 -2.69 117.51 116.75 1gjh h ILE 173 Ca -0.00 -0.47 0.32 0.00 -0.39 0.00 0.00 64.86 64.32 1gjh h ILE 173 Cb 0.05 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 33.73 1gjh h ILE 173 CO 0.00 0.00 0.77 0.00 -0.69 0.00 0.00 178.15 178.24 1gjh h ALA 174 N -1.29 2.72 0.80 1.87 0.00 -1.05 0.83 119.26 123.14 1gjh h ALA 174 Ca -0.05 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1gjh h ALA 174 Cb 0.40 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.27 1gjh h ALA 174 CO 0.09 -1.10 -0.39 1.25 0.00 0.00 0.00 179.25 179.10 1gjh h LEU 175 N 0.17 -0.91 -0.43 0.00 5.85 -1.29 -1.97 115.31 116.73 1gjh h LEU 175 Ca 0.59 0.03 0.04 0.00 0.84 0.00 0.00 57.88 59.39 1gjh h LEU 175 Cb 1.96 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 43.19 1gjh h LEU 175 CO -0.16 -0.64 0.19 -0.50 -0.34 0.00 0.00 178.44 176.99 1gjh h TRP 176 N -1.10 0.35 -1.02 1.25 6.55 -0.79 -0.91 115.95 120.28 1gjh h TRP 176 Ca -0.11 0.02 0.26 0.00 0.95 0.00 0.00 58.89 60.01 1gjh h TRP 176 Cb 0.83 -0.09 -0.09 0.00 -0.86 0.00 0.00 29.16 28.94 1gjh h TRP 176 CO 0.04 0.16 0.66 0.52 -1.05 0.00 0.00 178.44 178.78 1gjh h MET 177 N 0.39 0.38 -0.13 0.49 2.86 -0.87 0.36 114.93 118.40 1gjh h MET 177 Ca 0.19 -0.02 -0.21 0.00 -2.06 0.00 0.00 59.70 57.60 1gjh h MET 177 Cb 0.13 -0.09 0.01 0.00 0.06 0.00 0.00 31.60 31.71 1gjh h MET 177 CO -0.16 0.25 -0.77 0.00 1.06 0.00 0.00 176.91 177.29 1gjh h THR 178 N 0.39 1.31 0.39 2.22 1.03 -0.39 -1.82 112.91 116.04 1gjh h THR 178 Ca 0.57 -2.02 -0.02 0.00 -0.01 0.00 0.00 66.41 64.93 1gjh h THR 178 Cb 1.47 2.02 0.00 0.00 -1.07 0.00 0.00 68.15 70.57 1gjh h THR 178 CO -0.27 0.63 -0.19 -0.33 -0.01 0.00 0.00 175.52 175.36 1gjh h GLU 179 N 0.46 -0.50 0.55 0.00 4.39 0.34 -1.94 114.58 117.88 1gjh h GLU 179 Ca -0.05 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1gjh h GLU 179 Cb 1.38 0.11 0.01 0.00 -0.10 0.00 0.00 28.75 30.15 1gjh h GLU 179 CO 0.15 -0.27 -0.26 -0.92 -1.16 0.00 0.00 179.01 176.55 1gjh h TYR 180 N -0.63 -0.69 -0.91 4.33 5.03 -1.27 0.17 116.97 123.00 1gjh h TYR 180 Ca -0.05 -0.02 0.25 0.00 2.58 0.00 0.00 58.73 61.49 1gjh h TYR 180 Cb 0.46 0.23 -0.16 0.00 1.55 0.00 0.00 36.73 38.81 1gjh h TYR 180 CO -0.02 -0.36 0.14 1.25 -1.32 0.00 0.00 178.16 177.85 1gjh h LEU 181 N -1.00 -0.23 0.09 2.82 6.46 -1.40 0.28 115.31 122.34 1gjh h LEU 181 Ca -0.08 0.24 -0.27 0.00 -0.12 0.00 0.00 57.88 57.65 1gjh h LEU 181 Cb 0.64 0.37 0.01 0.00 -0.73 0.00 0.00 40.66 40.94 1gjh h LEU 181 CO 0.12 -0.26 -1.21 -1.13 -0.62 0.00 0.00 178.44 175.34 1gjh h ASN 182 N 0.10 0.47 0.42 1.25 -1.24 -1.32 0.67 115.58 115.93 1gjh h ASN 182 Ca 0.57 -0.48 0.00 0.00 0.71 0.00 0.00 56.30 57.10 1gjh h ASN 182 Cb 1.18 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 40.08 1gjh h ASN 182 CO -0.78 1.36 0.00 0.54 -1.29 0.00 0.00 177.43 177.26 1gjh n ARG 183 N -3.58 0.15 0.00 6.67 5.12 0.73 -3.63 116.66 122.12 1gjh n ARG 183 Ca -0.09 0.16 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 1gjh n ARG 183 Cb 1.00 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.80 1gjh n ARG 183 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1gjh n HIS 184 N -1.37 0.00 -0.05 -1.55 8.25 0.24 -4.95 115.22 115.79 1gjh n HIS 184 Ca 0.06 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.31 1gjh n HIS 184 Cb 0.16 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.14 1gjh n HIS 184 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1gjh h LEU 185 N 0.00 0.20 -1.85 2.41 3.38 0.13 -3.31 115.31 116.27 1gjh h LEU 185 Ca 0.00 -0.72 0.38 0.00 0.09 0.00 0.00 57.88 57.63 1gjh h LEU 185 Cb 0.00 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 1gjh h LEU 185 CO 0.00 1.63 0.92 -0.74 0.09 0.00 0.00 178.44 180.35 1gjh h HIS 186 N -0.53 0.14 -0.01 1.13 2.76 -1.13 1.01 115.15 118.54 1gjh h HIS 186 Ca -0.37 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 57.74 1gjh h HIS 186 Cb 1.62 -0.04 0.01 0.00 1.55 0.00 0.00 27.41 30.55 1gjh h HIS 186 CO 0.10 -0.01 -0.27 1.15 -1.30 0.00 0.00 177.93 177.59 1gjh h THR 187 N 0.06 1.53 0.00 6.26 2.02 -1.74 0.57 112.91 121.62 1gjh h THR 187 Ca 0.65 -1.93 -0.08 0.00 0.77 0.00 0.00 66.41 65.83 1gjh h THR 187 Cb 2.43 2.72 -0.01 0.00 -1.74 0.00 0.00 68.15 71.56 1gjh h THR 187 CO -0.09 0.53 -0.36 -0.25 0.37 0.00 0.00 175.52 175.72 1gjh h TRP 188 N -0.46 0.00 0.00 3.16 7.01 -0.41 -0.89 115.95 124.36 1gjh h TRP 188 Ca -0.03 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.95 1gjh h TRP 188 Cb 1.02 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.07 1gjh h TRP 188 CO 0.17 0.36 -0.14 0.82 -2.79 0.00 0.00 178.44 176.87 1gjh h ILE 189 N 0.00 0.70 0.69 2.65 2.04 0.79 -3.20 117.51 121.18 1gjh h ILE 189 Ca -0.00 -1.56 -0.03 0.00 1.00 0.00 0.00 64.86 64.26 1gjh h ILE 189 Cb 0.69 1.36 0.01 0.00 -0.74 0.00 0.00 36.82 38.13 1gjh h ILE 189 CO 0.05 0.24 -0.33 -0.61 0.00 0.00 0.00 178.15 177.49 1gjh h GLN 190 N -1.00 -0.90 -1.05 2.37 4.15 -0.93 0.74 115.11 118.49 1gjh h GLN 190 Ca -0.03 0.06 0.30 0.00 0.77 0.00 0.00 58.65 59.75 1gjh h GLN 190 Cb 0.50 0.20 -0.05 0.00 0.21 0.00 0.00 27.48 28.34 1gjh h GLN 190 CO -0.02 -0.58 0.74 0.22 -1.93 0.00 0.00 178.83 177.27 1gjh h ASP 191 N -0.99 0.09 -1.87 -0.69 3.58 -1.33 -0.37 116.42 114.83 1gjh h ASP 191 Ca -0.10 0.01 -0.68 0.00 0.42 0.00 0.00 57.03 56.69 1gjh h ASP 191 Cb 0.73 0.00 -0.35 0.00 1.72 0.00 0.00 39.33 41.43 1gjh h ASP 191 CO 0.16 0.02 0.12 -3.20 -2.88 0.00 0.00 179.24 173.46 1gjh n ASN 192 N -4.29 5.99 0.00 2.28 5.15 -0.95 -4.98 115.26 118.46 1gjh n ASN 192 Ca 0.23 -3.76 0.00 0.00 -0.60 0.00 0.00 54.58 50.45 1gjh n ASN 192 Cb 1.07 -0.77 0.00 0.00 -0.53 0.00 0.00 39.78 39.55 1gjh n ASN 192 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1gjh n GLY 193 N -0.42 0.68 0.00 8.20 0.00 -0.15 -4.86 105.19 108.63 1gjh n GLY 193 Ca 0.44 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1gjh n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gjh n GLY 194 N 0.00 -0.09 0.20 -0.02 0.00 0.21 -4.59 105.19 100.90 1gjh n GLY 194 Ca 0.00 -1.21 -0.01 0.00 0.00 0.00 0.00 46.02 44.81 1gjh n GLY 194 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1gjh h TRP 195 N 0.00 0.21 0.00 1.61 4.06 -1.95 -2.56 115.95 117.32 1gjh h TRP 195 Ca 0.00 -0.05 -0.09 0.00 2.06 0.00 0.00 58.89 60.81 1gjh h TRP 195 Cb 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 29.16 28.10 1gjh h TRP 195 CO 0.00 0.54 -0.42 0.22 -3.56 0.00 0.00 178.44 175.22 1gjh h ASP 196 N 0.16 0.00 -0.72 -3.49 1.82 -1.97 -3.10 116.42 109.12 1gjh h ASP 196 Ca 0.02 0.00 0.12 0.00 -0.39 0.00 0.00 57.03 56.77 1gjh h ASP 196 Cb 0.74 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 40.71 1gjh h ASP 196 CO 0.06 0.42 0.48 0.00 -1.61 0.00 0.00 179.24 178.58 1gjh h ALA 197 N 1.58 1.98 0.19 -0.78 0.00 -1.78 -0.57 119.26 119.87 1gjh h ALA 197 Ca -0.00 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 1gjh h ALA 197 Cb 1.03 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.76 1gjh h ALA 197 CO 0.05 -0.15 -1.16 0.35 0.00 0.00 0.00 179.25 178.34 1gjh h PHE 198 N 0.50 0.81 0.00 0.00 3.57 -1.64 -3.17 116.94 117.01 1gjh h PHE 198 Ca 0.34 -0.57 -0.01 0.00 3.53 0.00 0.00 57.97 61.25 1gjh h PHE 198 Cb 0.64 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.34 1gjh h PHE 198 CO -0.00 1.44 -0.06 -0.24 -2.23 0.00 0.00 178.31 177.22 1gjh h VAL 199 N -0.05 0.67 0.04 1.41 3.04 -1.34 -0.36 116.25 119.66 1gjh h VAL 199 Ca -0.20 -0.24 -0.23 0.00 -1.01 0.00 0.00 66.70 65.03 1gjh h VAL 199 Cb 1.91 1.14 -0.02 0.00 -2.01 0.00 0.00 31.29 32.31 1gjh h VAL 199 CO 0.22 0.06 -1.07 -0.08 -1.01 0.00 0.00 177.57 175.69 1gjh h GLU 200 N 0.00 0.10 0.00 4.17 4.81 -1.20 -1.37 114.58 121.09 1gjh h GLU 200 Ca -0.00 -0.16 -0.16 0.00 -0.13 0.00 0.00 59.36 58.91 1gjh h GLU 200 Cb 0.14 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 1gjh h GLU 200 CO 0.01 1.07 -0.77 -0.07 -0.73 0.00 0.00 179.01 178.52 1gjh h LEU 201 N 0.03 0.00 -3.22 1.64 3.38 -1.31 -3.28 115.31 112.55 1gjh h LEU 201 Ca -0.05 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1gjh h LEU 201 Cb 1.82 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.51 1gjh h LEU 201 CO 0.15 0.74 -0.19 -1.22 0.09 0.00 0.00 178.44 178.01 1gjh n TYR 202 N -3.27 0.69 -1.48 1.13 4.02 -0.23 -5.03 117.16 113.00 1gjh n TYR 202 Ca 0.01 -1.48 -0.48 0.00 -0.01 0.00 0.00 57.90 55.94 1gjh n TYR 202 Cb 0.84 -0.39 -0.06 0.00 -0.02 0.00 0.00 39.34 39.71 1gjh n TYR 202 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1gjh n GLY 203 N -1.10 0.50 3.06 2.72 0.00 -0.52 -4.88 105.19 104.98 1gjh n GLY 203 Ca 0.27 0.90 -0.36 0.00 0.00 0.00 0.00 46.02 46.83 1gjh n GLY 203 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1gjh n PRO 204 N 8.37 -0.05 -1.52 1.61 -0.02 -1.26 -4.50 135.00 137.63 1gjh n PRO 204 Ca 0.40 -0.01 -0.29 0.00 -2.02 0.00 0.00 63.50 61.58 1gjh n PRO 204 Cb 0.28 -1.13 -0.14 0.00 -0.02 0.00 0.00 33.50 32.49 1gjh n PRO 204 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1gjh n SER 205 N 2.74 0.42 -3.35 2.55 2.88 -1.26 -2.96 113.62 114.64 1gjh n SER 205 Ca -0.01 -0.48 -0.30 0.00 -1.33 0.00 0.00 58.87 56.75 1gjh n SER 205 Cb 0.56 -1.07 0.03 0.00 -0.75 0.00 0.00 64.21 62.98 1gjh n SER 205 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1gjh n MET 206 N 7.75 -2.03 -0.54 -1.46 0.00 -1.26 -5.33 117.12 114.25 1gjh n MET 206 Ca 0.58 1.58 0.00 0.00 -0.00 0.00 0.00 57.70 59.86 1gjh n MET 206 Cb 0.24 -3.03 0.00 0.00 0.00 0.00 0.00 33.22 30.43 1gjh n MET 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51