#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gbh s LYS 3 N 0.00 4.33 0.53 2.61 -0.14 -1.26 -5.01 119.74 120.80 3gbh s LYS 3 Ca 0.00 2.07 -0.09 0.00 -1.36 0.00 0.00 55.97 56.59 3gbh s LYS 3 Cb 0.00 -3.24 -0.04 0.00 -1.68 0.00 0.00 37.83 32.86 3gbh s LYS 3 CO 0.00 -0.42 0.89 -0.51 -0.76 0.00 0.00 175.35 174.56 3gbh s LEU 4 N 0.98 3.50 -0.18 3.17 1.43 -1.26 -5.02 118.68 121.31 3gbh s LEU 4 Ca 0.64 1.19 -0.29 0.00 -1.03 0.00 0.00 54.13 54.64 3gbh s LEU 4 Cb -0.37 -4.17 -0.01 0.00 0.03 0.00 0.00 46.19 41.67 3gbh s LEU 4 CO 0.31 -0.67 1.20 -0.89 0.23 0.00 0.00 176.35 176.54 3gbh s THR 5 N -2.85 4.39 0.54 5.49 2.01 -1.26 -4.91 115.64 119.04 3gbh s THR 5 Ca 0.52 1.68 -0.06 0.00 0.31 0.00 0.00 61.69 64.13 3gbh s THR 5 Cb -0.11 -4.08 -0.02 0.00 0.01 0.00 0.00 72.50 68.30 3gbh s THR 5 CO 0.45 -0.14 0.86 -0.13 -0.69 0.00 0.00 174.62 174.97 3gbh s ARG 6 N 3.38 3.33 -0.20 4.92 0.52 -1.26 -3.95 118.95 125.69 3gbh s ARG 6 Ca 0.52 0.21 0.00 0.00 -0.52 0.00 0.00 55.73 55.94 3gbh s ARG 6 Cb -0.20 -2.30 0.05 0.00 0.52 0.00 0.00 34.95 33.02 3gbh s ARG 6 CO 0.13 -0.43 -0.06 0.42 0.02 0.00 0.00 175.30 175.37 3gbh s ILE 7 N -2.89 1.36 -0.15 1.52 1.01 -0.68 -4.94 121.20 116.43 3gbh s ILE 7 Ca 0.51 -0.91 0.20 0.00 0.00 0.00 0.00 60.65 60.44 3gbh s ILE 7 Cb -0.10 -1.55 -0.14 0.00 0.01 0.00 0.00 42.46 40.67 3gbh s ILE 7 CO 0.46 0.05 0.77 0.59 0.00 0.00 0.00 174.94 176.81 3gbh n ASN 8 N 4.77 0.61 -4.66 3.58 3.02 -1.26 -4.55 115.26 116.76 3gbh n ASN 8 Ca -0.13 0.25 -0.42 0.00 -0.03 0.00 0.00 54.58 54.26 3gbh n ASN 8 Cb 0.46 0.72 -0.04 0.00 -0.61 0.00 0.00 39.78 40.31 3gbh n ASN 8 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3gbh s ASP 9 N -5.34 6.90 0.18 6.41 2.15 -1.26 -4.97 116.67 120.73 3gbh s ASP 9 Ca -0.04 1.11 -0.16 0.00 0.43 0.00 0.00 52.55 53.89 3gbh s ASP 9 Cb 0.10 -2.44 0.12 0.00 -0.30 0.00 0.00 42.92 40.40 3gbh s ASP 9 CO 0.83 -0.45 1.66 0.15 -0.17 0.00 0.00 175.17 177.19 3gbh h PHE 10 N 7.48 -0.24 -0.57 -5.34 3.57 -2.00 -1.06 116.94 118.79 3gbh h PHE 10 Ca -0.27 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.22 3gbh h PHE 10 Cb 1.11 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 40.01 3gbh h PHE 10 CO 0.73 -0.19 0.13 -0.91 -2.23 0.00 0.00 178.31 175.84 3gbh h ASN 11 N -0.00 0.82 -0.52 0.41 2.35 -2.00 -2.15 115.58 114.49 3gbh h ASN 11 Ca 0.22 -0.16 -0.12 0.00 -0.55 0.00 0.00 56.30 55.69 3gbh h ASN 11 Cb 0.33 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 3gbh h ASN 11 CO -0.46 0.81 -0.14 -0.08 -1.65 0.00 0.00 177.43 175.91 3gbh h GLU 12 N 0.84 1.02 -0.09 0.81 4.81 -1.78 -1.08 114.58 119.11 3gbh h GLU 12 Ca 0.18 -0.39 0.03 0.00 -0.13 0.00 0.00 59.36 59.05 3gbh h GLU 12 Cb 0.32 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3gbh h GLU 12 CO 0.00 1.08 -0.13 0.28 -0.73 0.00 0.00 179.01 179.51 3gbh h VAL 13 N 0.90 0.65 -0.73 0.32 2.07 -0.99 -1.05 116.25 117.42 3gbh h VAL 13 Ca 0.13 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.68 3gbh h VAL 13 Cb 0.71 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 3gbh h VAL 13 CO 0.05 0.00 0.47 0.25 0.02 0.00 0.00 177.57 178.36 3gbh h LEU 14 N -0.18 0.79 -1.49 2.57 6.46 -1.24 -2.02 115.31 120.20 3gbh h LEU 14 Ca 0.08 -0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.80 3gbh h LEU 14 Cb 0.29 -0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 40.03 3gbh h LEU 14 CO -0.20 0.55 -0.15 0.78 -0.62 0.00 0.00 178.44 178.80 3gbh h ASN 15 N 0.93 0.00 0.21 1.25 2.35 -0.91 -3.09 115.58 116.31 3gbh h ASN 15 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 3gbh h ASN 15 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 3gbh h ASN 15 CO -0.09 0.15 -0.72 -1.20 -1.65 0.00 0.00 177.43 173.93 3gbh n SER 16 N -3.42 0.89 -4.60 5.81 7.64 -0.42 -4.86 113.62 114.66 3gbh n SER 16 Ca -0.01 -0.74 -0.43 0.00 1.01 0.00 0.00 58.87 58.70 3gbh n SER 16 Cb 0.34 0.61 -0.02 0.00 -1.01 0.00 0.00 64.21 64.13 3gbh n SER 16 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 3gbh s ARG 17 N -2.93 3.60 0.06 1.43 3.00 -0.88 -4.97 118.95 118.27 3gbh s ARG 17 Ca 0.11 0.93 -0.02 0.00 -1.00 0.00 0.00 55.73 55.75 3gbh s ARG 17 Cb 0.17 -4.01 -0.04 0.00 0.00 0.00 0.00 34.95 31.07 3gbh s ARG 17 CO 0.76 -1.53 -0.00 0.15 0.00 0.00 0.00 175.30 174.67 3gbh s LYS 18 N 4.86 0.66 -0.56 5.12 1.02 -1.26 -5.05 119.74 124.53 3gbh s LYS 18 Ca 0.60 -1.22 -0.28 0.00 0.02 0.00 0.00 55.97 55.09 3gbh s LYS 18 Cb -0.13 0.22 0.02 0.00 -0.52 0.00 0.00 37.83 37.42 3gbh s LYS 18 CO 0.32 -0.14 1.28 -1.12 -0.92 0.00 0.00 175.35 174.78 3gbh s SER 19 N -2.93 6.33 -0.09 2.83 0.01 -1.26 -4.39 113.70 114.21 3gbh s SER 19 Ca 0.08 0.22 -0.16 0.00 1.31 0.00 0.00 55.95 57.40 3gbh s SER 19 Cb 0.08 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.71 3gbh s SER 19 CO -0.09 -1.56 0.41 -0.69 0.41 0.00 0.00 173.24 171.73 3gbh s VAL 20 N 5.36 5.16 -0.47 3.43 1.01 -0.67 -4.51 120.40 129.71 3gbh s VAL 20 Ca 0.47 0.83 0.06 0.00 0.00 0.00 0.00 61.98 63.34 3gbh s VAL 20 Cb -0.09 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 3gbh s VAL 20 CO 0.26 0.43 0.43 0.29 0.00 0.00 0.00 175.10 176.51 3gbh n LYS 21 N 3.00 2.89 -3.92 2.72 5.02 -1.26 -4.12 118.16 122.48 3gbh n LYS 21 Ca -0.10 -0.37 -0.28 0.00 -2.02 0.00 0.00 58.31 55.53 3gbh n LYS 21 Cb 0.52 -0.91 -0.17 0.00 -0.02 0.00 0.00 35.03 34.45 3gbh n LYS 21 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3gbh s VAL 22 N -1.07 1.15 0.32 -0.18 1.01 -1.26 -3.51 120.40 116.86 3gbh s VAL 22 Ca 0.04 -0.43 0.07 0.00 0.00 0.00 0.00 61.98 61.67 3gbh s VAL 22 Cb 0.04 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 3gbh s VAL 22 CO 0.16 0.33 0.26 -0.36 0.00 0.00 0.00 175.10 175.49 3gbh s PHE 23 N 1.65 2.91 -0.33 5.22 0.08 -1.26 -0.99 117.98 125.26 3gbh s PHE 23 Ca 0.04 -0.28 -0.29 0.00 0.12 0.00 0.00 56.93 56.52 3gbh s PHE 23 Cb -0.13 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.60 3gbh s PHE 23 CO -0.09 0.25 1.39 0.34 -0.10 0.00 0.00 175.22 177.01 3gbh s ASP 24 N -3.95 6.51 0.57 1.36 -1.08 0.75 -4.56 116.67 116.27 3gbh s ASP 24 Ca 0.39 1.13 0.35 0.00 -0.52 0.00 0.00 52.55 53.91 3gbh s ASP 24 Cb -0.06 -2.54 1.56 0.00 -1.46 0.00 0.00 42.92 40.43 3gbh s ASP 24 CO 0.26 -1.23 2.06 -0.33 0.52 0.00 0.00 175.17 176.45 3gbh h GLU 25 N 9.99 0.00 -0.21 4.34 5.08 -1.90 -2.37 114.58 129.51 3gbh h GLU 25 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 3gbh h GLU 25 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3gbh h GLU 25 CO 1.05 0.02 0.00 0.09 -1.00 0.00 0.00 179.01 179.17 3gbh n ASN 26 N -3.14 3.24 -4.53 1.42 5.03 -1.26 -4.89 115.26 111.13 3gbh n ASN 26 Ca -0.00 -1.99 -0.37 0.00 0.87 0.00 0.00 54.58 53.08 3gbh n ASN 26 Cb 0.26 -0.13 -0.12 0.00 -1.02 0.00 0.00 39.78 38.78 3gbh n ASN 26 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 3gbh s TYR 27 N -1.73 3.17 -0.08 3.10 6.14 -0.89 -5.07 117.35 121.99 3gbh s TYR 27 Ca 0.33 -0.10 0.05 0.00 0.64 0.00 0.00 57.07 57.99 3gbh s TYR 27 Cb 0.21 -2.31 -0.01 0.00 0.42 0.00 0.00 41.96 40.27 3gbh s TYR 27 CO 0.31 -0.23 -0.23 0.15 0.64 0.00 0.00 175.55 176.19 3gbh s LYS 28 N 1.66 2.82 -0.06 4.97 -0.14 -1.26 -4.40 119.74 123.32 3gbh s LYS 28 Ca 0.07 -0.86 -0.30 0.00 -1.36 0.00 0.00 55.97 53.51 3gbh s LYS 28 Cb -0.16 -2.27 -0.03 0.00 -1.68 0.00 0.00 37.83 33.70 3gbh s LYS 28 CO 0.08 0.30 1.14 0.42 -0.76 0.00 0.00 175.35 176.53 3gbh s ILE 29 N 0.05 4.42 0.36 2.17 1.01 -1.26 -4.98 121.20 122.97 3gbh s ILE 29 Ca -0.09 1.72 -0.28 0.00 0.00 0.00 0.00 60.65 62.00 3gbh s ILE 29 Cb -0.15 -4.11 -0.11 0.00 0.01 0.00 0.00 42.46 38.09 3gbh s ILE 29 CO 0.06 0.01 1.44 -2.65 0.00 0.00 0.00 174.94 173.79 3gbh n PRO 30 N 5.07 2.52 -0.32 2.79 -0.02 -1.26 -4.87 135.00 138.91 3gbh n PRO 30 Ca 0.10 0.89 0.05 0.00 -2.02 0.00 0.00 63.50 62.52 3gbh n PRO 30 Cb 0.47 -2.58 0.25 0.00 -0.02 0.00 0.00 33.50 31.62 3gbh n PRO 30 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3gbh h ARG 31 N 2.92 0.98 -0.89 -0.52 2.43 -2.05 -0.22 114.38 117.02 3gbh h ARG 31 Ca -0.49 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 58.64 3gbh h ARG 31 Cb 1.25 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.54 3gbh h ARG 31 CO 0.64 0.65 0.59 0.93 -1.51 0.00 0.00 179.97 181.27 3gbh h GLU 32 N 1.00 1.14 -1.55 0.20 5.08 -2.04 -0.97 114.58 117.45 3gbh h GLU 32 Ca 0.42 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 3gbh h GLU 32 Cb 0.30 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3gbh h GLU 32 CO -0.18 0.76 0.00 -1.91 -1.00 0.00 0.00 179.01 176.68 3gbh n GLU 33 N -4.41 0.76 0.00 2.33 2.13 -0.10 -1.63 120.64 119.72 3gbh n GLU 33 Ca 0.11 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.93 3gbh n GLU 33 Cb 0.05 -1.12 0.00 0.00 0.27 0.00 0.00 31.44 30.64 3gbh n GLU 33 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3gbh n ASP 35 N 1.02 0.00 -0.19 4.31 8.00 -0.37 -1.30 116.55 128.03 3gbh n ASP 35 Ca 0.00 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.43 3gbh n ASP 35 Cb 0.38 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.50 3gbh n ASP 35 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 3gbh h GLU 36 N 0.00 0.74 -0.32 -1.24 4.81 -1.57 -0.61 114.58 116.40 3gbh h GLU 36 Ca 0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3gbh h GLU 36 Cb 0.00 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 3gbh h GLU 36 CO 0.00 0.58 0.20 0.82 -0.73 0.00 0.00 179.01 179.88 3gbh h ILE 37 N 0.71 1.10 -0.47 2.32 2.04 -1.48 -1.09 117.51 120.65 3gbh h ILE 37 Ca 0.19 -0.21 -0.13 0.00 1.00 0.00 0.00 64.86 65.71 3gbh h ILE 37 Cb 0.05 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 3gbh h ILE 37 CO -0.03 0.10 -0.21 0.40 0.00 0.00 0.00 178.15 178.40 3gbh h ILE 38 N 0.42 1.27 -0.50 -0.67 2.04 -1.80 0.17 117.51 118.44 3gbh h ILE 38 Ca 0.12 -1.37 0.04 0.00 1.00 0.00 0.00 64.86 64.65 3gbh h ILE 38 Cb -0.02 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 3gbh h ILE 38 CO -0.02 0.47 0.26 0.74 0.00 0.00 0.00 178.15 179.59 3gbh h THR 39 N 0.82 0.97 -0.35 -0.27 2.02 -0.95 -0.89 112.91 114.26 3gbh h THR 39 Ca 0.11 -0.17 -0.04 0.00 0.77 0.00 0.00 66.41 67.07 3gbh h THR 39 Cb 0.77 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 3gbh h THR 39 CO 0.06 0.09 0.06 0.11 0.37 0.00 0.00 175.52 176.21 3gbh h LYS 40 N 0.51 0.58 -0.74 6.66 1.57 -0.88 -3.03 116.57 121.23 3gbh h LYS 40 Ca 0.22 -0.16 0.11 0.00 -1.87 0.00 0.00 60.65 58.95 3gbh h LYS 40 Cb 0.11 -0.07 -0.08 0.00 0.08 0.00 0.00 32.23 32.28 3gbh h LYS 40 CO -0.14 0.66 0.36 0.00 -0.57 0.00 0.00 179.45 179.75 3gbh h ALA 41 N 0.90 1.05 0.00 3.86 0.00 -0.72 -2.81 119.26 121.53 3gbh h ALA 41 Ca 0.11 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3gbh h ALA 41 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3gbh h ALA 41 CO 0.01 -0.08 0.00 0.25 0.00 0.00 0.00 179.25 179.42 3gbh n THR 42 N -4.89 0.00 1.09 0.00 -2.24 -0.36 -1.96 114.28 105.92 3gbh n THR 42 Ca 0.13 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 62.01 3gbh n THR 42 Cb 0.33 -0.47 0.55 0.00 -2.10 0.00 0.00 70.33 68.64 3gbh n THR 42 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3gbh n LYS 43 N -0.94 0.43 -1.20 -0.78 5.02 -1.06 -4.85 118.16 114.76 3gbh n LYS 43 Ca 0.20 0.06 -0.35 0.00 -2.02 0.00 0.00 58.31 56.21 3gbh n LYS 43 Cb 0.09 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.71 3gbh n LYS 43 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gbh n ALA 44 N -1.18 -0.37 -1.83 7.82 0.00 -0.83 -4.99 120.51 119.13 3gbh n ALA 44 Ca 0.12 -0.28 -0.31 0.00 0.00 0.00 0.00 53.44 52.97 3gbh n ALA 44 Cb 0.13 -2.14 0.02 0.00 0.00 0.00 0.00 19.45 17.46 3gbh n ALA 44 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3gbh s PRO 45 N -3.67 3.45 0.07 0.00 0.04 -1.26 -5.05 135.00 128.59 3gbh s PRO 45 Ca 0.72 0.76 -0.14 0.00 0.04 0.00 0.00 61.00 62.38 3gbh s PRO 45 Cb -0.31 -2.06 0.02 0.00 0.04 0.00 0.00 34.50 32.19 3gbh s PRO 45 CO 0.52 -0.68 0.32 -1.54 0.04 0.00 0.00 177.00 175.66 3gbh s SER 46 N -4.13 -0.12 0.10 6.66 1.04 -1.26 -4.92 113.70 111.07 3gbh s SER 46 Ca 0.56 -0.29 -0.34 0.00 0.48 0.00 0.00 55.95 56.36 3gbh s SER 46 Cb -0.11 0.39 -0.13 0.00 0.10 0.00 0.00 66.02 66.26 3gbh s SER 46 CO 0.54 -0.70 1.64 -0.24 0.98 0.00 0.00 173.24 175.46 3gbh n SER 47 N 0.25 3.16 -2.34 7.02 2.88 -1.26 -1.24 113.62 122.09 3gbh n SER 47 Ca -0.17 1.06 -0.05 0.00 -1.33 0.00 0.00 58.87 58.37 3gbh n SER 47 Cb 0.61 -1.41 -0.00 0.00 -0.75 0.00 0.00 64.21 62.65 3gbh n SER 47 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3gbh n VAL 48 N 3.80 -0.23 -2.80 2.46 0.24 -1.26 -4.54 118.33 116.00 3gbh n VAL 48 Ca 0.18 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.47 3gbh n VAL 48 Cb 0.29 -0.73 -0.01 0.00 -1.47 0.00 0.00 33.84 31.92 3gbh n VAL 48 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3gbh n ASN 49 N -1.43 -5.77 0.00 -1.34 5.15 -0.37 -5.10 115.26 106.41 3gbh n ASN 49 Ca -0.06 1.20 0.00 0.00 -0.60 0.00 0.00 54.58 55.12 3gbh n ASN 49 Cb 0.51 -4.36 0.00 0.00 -0.53 0.00 0.00 39.78 35.40 3gbh n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gbh n GLN 51 N 1.23 0.00 0.00 1.20 6.02 -1.26 -4.98 117.38 119.59 3gbh n GLN 51 Ca -0.11 0.00 0.15 0.00 -0.01 0.00 0.00 57.00 57.03 3gbh n GLN 51 Cb 0.26 0.00 0.81 0.00 1.02 0.00 0.00 30.24 32.33 3gbh n GLN 51 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3gbh n PRO 52 N 0.00 0.74 -2.23 -1.09 -0.04 -1.26 -4.89 135.00 126.23 3gbh n PRO 52 Ca 0.00 -0.07 -0.41 0.00 -0.04 0.00 0.00 63.50 62.99 3gbh n PRO 52 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 3gbh n PRO 52 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 3gbh s TRP 53 N -2.30 3.23 -0.06 0.54 -2.14 -1.26 -0.54 118.94 116.41 3gbh s TRP 53 Ca 0.37 1.48 -0.02 0.00 2.66 0.00 0.00 56.10 60.58 3gbh s TRP 53 Cb 0.21 -3.55 0.03 0.00 -3.10 0.00 0.00 33.47 27.06 3gbh s TRP 53 CO 0.42 -1.48 0.06 1.03 -2.66 0.00 0.00 176.95 174.33 3gbh s ARG 54 N -1.49 -0.04 -0.25 3.25 1.81 -0.10 -4.92 118.95 117.21 3gbh s ARG 54 Ca 0.49 0.30 -0.07 0.00 -1.72 0.00 0.00 55.73 54.72 3gbh s ARG 54 Cb -0.37 -0.72 -0.03 0.00 -0.45 0.00 0.00 34.95 33.38 3gbh s ARG 54 CO 0.48 -0.38 0.07 0.42 -0.68 0.00 0.00 175.30 175.21 3gbh s ILE 55 N 2.16 4.33 -0.43 1.52 1.01 -1.26 -0.49 121.20 128.04 3gbh s ILE 55 Ca 0.05 -0.17 -0.20 0.00 0.00 0.00 0.00 60.65 60.33 3gbh s ILE 55 Cb -0.13 -3.03 0.02 0.00 0.01 0.00 0.00 42.46 39.34 3gbh s ILE 55 CO -0.04 0.33 0.61 0.00 0.00 0.00 0.00 174.94 175.84 3gbh s ALA 56 N 1.62 3.37 -0.78 9.38 0.00 -0.19 -4.95 121.76 130.21 3gbh s ALA 56 Ca 0.06 -1.23 -0.20 0.00 0.00 0.00 0.00 51.96 50.59 3gbh s ALA 56 Cb -0.15 -3.24 0.11 0.00 0.00 0.00 0.00 23.12 19.83 3gbh s ALA 56 CO 0.04 -1.71 1.00 0.08 0.00 0.00 0.00 175.76 175.17 3gbh s VAL 57 N 2.69 4.61 -0.54 0.00 1.01 -1.26 -0.70 120.40 126.22 3gbh s VAL 57 Ca 0.21 -1.07 -0.25 0.00 0.00 0.00 0.00 61.98 60.87 3gbh s VAL 57 Cb -0.15 -4.70 0.04 0.00 0.00 0.00 0.00 36.38 31.57 3gbh s VAL 57 CO 0.18 -1.43 0.95 -0.69 0.00 0.00 0.00 175.10 174.11 3gbh s VAL 58 N 3.14 4.38 0.00 2.92 1.01 -1.26 -4.80 120.40 125.79 3gbh s VAL 58 Ca 0.25 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.64 3gbh s VAL 58 Cb -0.12 -4.53 0.00 0.00 0.00 0.00 0.00 36.38 31.73 3gbh s VAL 58 CO -0.00 -1.08 0.00 0.00 0.00 0.00 0.00 175.10 174.02 3gbh n GLN 59 N 7.47 2.37 -2.06 2.72 10.64 -1.26 -4.49 117.38 132.76 3gbh n GLN 59 Ca 0.03 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 54.85 3gbh n GLN 59 Cb 0.48 -0.84 0.02 0.00 -0.86 0.00 0.00 30.24 29.04 3gbh n GLN 59 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 3gbh s SER 60 N -1.91 5.42 0.26 2.61 1.04 -1.26 -4.89 113.70 114.98 3gbh s SER 60 Ca 0.00 2.17 -0.03 0.00 0.48 0.00 0.00 55.95 58.58 3gbh s SER 60 Cb 0.00 -2.58 0.43 0.00 0.10 0.00 0.00 66.02 63.97 3gbh s SER 60 CO 0.00 -1.42 1.84 0.44 0.98 0.00 0.00 173.24 175.08 3gbh h ASP 61 N 0.80 0.87 0.00 7.02 3.32 -2.02 -1.25 116.42 125.15 3gbh h ASP 61 Ca -0.49 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3gbh h ASP 61 Cb 1.26 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.67 3gbh h ASP 61 CO 0.56 0.51 0.00 1.21 -1.72 0.00 0.00 179.24 179.80 3gbh n GLU 62 N -4.63 0.25 0.00 3.56 2.13 -1.26 -0.87 120.64 119.83 3gbh n GLU 62 Ca 0.15 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.97 3gbh n GLU 62 Cb 0.26 -1.05 0.00 0.00 0.27 0.00 0.00 31.44 30.92 3gbh n GLU 62 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3gbh n LYS 64 N -0.18 0.00 -0.28 5.31 5.02 -0.47 -1.65 118.16 125.90 3gbh n LYS 64 Ca 0.00 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.23 3gbh n LYS 64 Cb 0.02 0.00 0.06 0.00 -0.02 0.00 0.00 35.03 35.09 3gbh n LYS 64 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3gbh h GLU 65 N 0.00 1.11 -0.44 1.97 4.57 -1.24 -1.98 114.58 118.58 3gbh h GLU 65 Ca 0.00 -0.17 -0.01 0.00 -1.18 0.00 0.00 59.36 58.00 3gbh h GLU 65 Cb 0.00 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.37 3gbh h GLU 65 CO 0.00 0.87 0.21 0.87 -1.18 0.00 0.00 179.01 179.79 3gbh h LYS 66 N 1.09 0.60 -0.02 1.92 1.57 -1.57 -3.04 116.57 117.12 3gbh h LYS 66 Ca 0.26 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3gbh h LYS 66 Cb 0.13 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3gbh h LYS 66 CO -0.03 0.47 -0.12 1.33 -0.57 0.00 0.00 179.45 180.53 3gbh n VAL 67 N -4.40 0.00 -0.05 0.50 0.24 -1.06 -4.60 118.33 108.96 3gbh n VAL 67 Ca 0.03 -0.37 -0.08 0.00 -2.04 0.00 0.00 64.34 61.89 3gbh n VAL 67 Cb 0.12 1.14 -0.02 0.00 -1.47 0.00 0.00 33.84 33.61 3gbh n VAL 67 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3gbh h LYS 68 N 3.46 -0.04 -0.90 7.34 3.64 -1.24 -1.88 116.57 126.95 3gbh h LYS 68 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3gbh h LYS 68 Cb 0.80 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.59 3gbh h LYS 68 CO 0.00 -0.03 0.54 1.49 -2.27 0.00 0.00 179.45 179.19 3gbh h GLU 69 N -0.04 1.22 0.00 1.90 4.81 -1.81 -1.91 114.58 118.75 3gbh h GLU 69 Ca 0.12 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3gbh h GLU 69 Cb 0.22 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 3gbh h GLU 69 CO -0.26 0.86 -0.00 0.77 -0.73 0.00 0.00 179.01 179.65 3gbh h SER 70 N 1.24 0.00 0.14 1.04 0.02 -1.65 -1.84 113.55 112.50 3gbh h SER 70 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 3gbh h SER 70 Cb -0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.49 3gbh h SER 70 CO -0.06 0.00 -0.25 0.49 -1.14 0.00 0.00 176.83 175.88 3gbh n PHE 71 N -3.12 0.00 0.00 3.45 3.01 -0.72 -0.25 117.46 119.82 3gbh n PHE 71 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 3gbh n PHE 71 Cb 0.09 -0.08 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 3gbh n PHE 71 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3gbh n GLY 72 N 1.33 3.38 0.00 1.37 0.00 -0.70 -0.11 105.19 110.47 3gbh n GLY 72 Ca 0.13 0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.28 3gbh n GLY 72 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3gbh n PHE 73 N 14.00 0.00 -0.66 1.61 -1.74 -1.26 -3.03 117.46 126.38 3gbh n PHE 73 Ca 0.00 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.77 3gbh n PHE 73 Cb 0.00 -0.07 0.19 0.00 1.52 0.00 0.00 39.48 41.12 3gbh n PHE 73 CO 0.00 0.00 0.00 0.09 -0.56 0.00 0.00 176.76 176.29 3gbh n ASN 74 N -1.07 3.87 0.01 5.98 3.02 0.85 -4.60 115.26 123.33 3gbh n ASN 74 Ca 0.13 -3.11 -0.03 0.00 -0.03 0.00 0.00 54.58 51.54 3gbh n ASN 74 Cb 0.08 -0.73 0.20 0.00 -0.61 0.00 0.00 39.78 38.73 3gbh n ASN 74 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3gbh h SER 75 N 1.39 0.49 -0.27 6.41 4.64 -1.69 -2.14 113.55 122.37 3gbh h SER 75 Ca 0.36 -0.16 -0.02 0.00 -0.47 0.00 0.00 61.79 61.50 3gbh h SER 75 Cb 2.24 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 64.19 3gbh h SER 75 CO 0.73 0.73 0.07 -0.09 -0.87 0.00 0.00 176.83 177.41 3gbh h ARG 76 N 0.43 0.43 -0.60 4.77 2.43 -1.89 0.24 114.38 120.20 3gbh h ARG 76 Ca 0.07 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3gbh h ARG 76 Cb 0.65 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.11 3gbh h ARG 76 CO 0.05 0.51 0.38 1.96 -1.51 0.00 0.00 179.97 181.36 3gbh h GLN 77 N 0.28 0.74 0.21 0.20 7.50 -1.57 -0.62 115.11 121.85 3gbh h GLN 77 Ca 0.09 -0.04 -0.01 0.00 0.50 0.00 0.00 58.65 59.18 3gbh h GLN 77 Cb 0.27 -0.17 0.00 0.00 0.05 0.00 0.00 27.48 27.63 3gbh h GLN 77 CO -0.00 0.49 -0.10 1.25 -1.50 0.00 0.00 178.83 178.97 3gbh h LEU 78 N 0.77 -0.24 -0.37 1.46 5.85 -0.86 -2.00 115.31 119.92 3gbh h LEU 78 Ca 0.23 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 3gbh h LEU 78 Cb -0.03 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 3gbh h LEU 78 CO -0.08 -0.10 0.17 0.74 -0.34 0.00 0.00 178.44 178.83 3gbh h THR 79 N -0.37 1.17 0.00 1.05 2.02 -0.43 -3.31 112.91 113.05 3gbh h THR 79 Ca -0.03 -0.51 -0.06 0.00 0.77 0.00 0.00 66.41 66.57 3gbh h THR 79 Cb 0.28 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 3gbh h THR 79 CO 0.05 0.19 -0.62 0.71 0.37 0.00 0.00 175.52 176.21 3gbh h THR 80 N 0.45 0.37 -3.95 3.16 1.35 -1.10 -3.47 112.91 109.71 3gbh h THR 80 Ca 0.12 -1.57 -0.56 0.00 -0.55 0.00 0.00 66.41 63.86 3gbh h THR 80 Cb 0.14 2.04 0.17 0.00 -1.73 0.00 0.00 68.15 68.77 3gbh h THR 80 CO -0.01 0.21 0.34 -1.54 -0.25 0.00 0.00 175.52 174.27 3gbh n SER 81 N -3.01 1.42 -0.09 5.36 3.41 -0.75 -3.83 113.62 116.13 3gbh n SER 81 Ca 0.00 0.77 -0.06 0.00 -0.26 0.00 0.00 58.87 59.32 3gbh n SER 81 Cb 0.66 -1.49 0.14 0.00 -0.26 0.00 0.00 64.21 63.25 3gbh n SER 81 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3gbh h SER 82 N 0.22 0.74 0.00 4.04 0.02 -1.26 -3.49 113.55 113.83 3gbh h SER 82 Ca -0.49 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.24 3gbh h SER 82 Cb 1.34 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.68 3gbh h SER 82 CO 0.51 0.88 0.00 0.00 -1.14 0.00 0.00 176.83 177.08 3gbh n ALA 83 N -2.49 0.00 -3.65 3.77 0.00 -0.94 -4.74 120.51 112.47 3gbh n ALA 83 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.42 3gbh n ALA 83 Cb 0.36 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.76 3gbh n ALA 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gbh s LEU 85 N 0.00 -1.06 -0.28 0.00 1.43 0.58 -1.54 118.68 117.81 3gbh s LEU 85 Ca 0.00 1.52 -0.04 0.00 -1.03 0.00 0.00 54.13 54.58 3gbh s LEU 85 Cb 0.00 2.25 0.03 0.00 0.03 0.00 0.00 46.19 48.50 3gbh s LEU 85 CO 0.00 -0.22 0.02 -0.63 0.23 0.00 0.00 176.35 175.74 3gbh s ILE 86 N 2.58 3.38 -0.26 -0.59 1.01 0.13 0.02 121.20 127.47 3gbh s ILE 86 Ca -0.07 -0.97 -0.14 0.00 0.00 0.00 0.00 60.65 59.47 3gbh s ILE 86 Cb -0.10 -2.78 -0.04 0.00 0.01 0.00 0.00 42.46 39.54 3gbh s ILE 86 CO -0.19 0.07 0.31 -0.63 0.00 0.00 0.00 174.94 174.50 3gbh s ILE 87 N 1.38 5.23 0.16 2.92 1.01 -0.34 -1.02 121.20 130.54 3gbh s ILE 87 Ca -0.00 0.45 0.06 0.00 0.00 0.00 0.00 60.65 61.16 3gbh s ILE 87 Cb -0.18 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 3gbh s ILE 87 CO -0.01 0.21 0.07 -0.36 0.00 0.00 0.00 174.94 174.85 3gbh s PHE 88 N 1.82 3.01 -0.16 3.97 0.40 0.35 -0.52 117.98 126.86 3gbh s PHE 88 Ca 0.13 -0.06 -0.06 0.00 -0.60 0.00 0.00 56.93 56.33 3gbh s PHE 88 Cb -0.16 -1.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.87 3gbh s PHE 88 CO 0.09 0.52 0.06 0.20 0.70 0.00 0.00 175.22 176.79 3gbh s GLY 89 N -2.94 1.93 -0.47 4.36 0.00 0.75 -0.92 107.32 110.02 3gbh s GLY 89 Ca 0.29 -0.74 -0.25 0.00 0.00 0.00 0.00 44.72 44.02 3gbh s GLY 89 CO 0.21 -0.12 0.89 -0.35 0.00 0.00 0.00 173.10 173.73 3gbh s ASP 90 N -0.06 6.45 0.27 1.64 2.15 0.30 -1.36 116.67 126.06 3gbh s ASP 90 Ca 0.06 -0.03 0.23 0.00 0.43 0.00 0.00 52.55 53.25 3gbh s ASP 90 Cb -0.12 -2.43 1.01 0.00 -0.30 0.00 0.00 42.92 41.08 3gbh s ASP 90 CO 0.01 -1.04 1.71 0.18 -0.17 0.00 0.00 175.17 175.85 3gbh n LEU 91 N 7.09 0.66 -1.74 -1.34 4.77 0.30 -2.04 117.00 124.71 3gbh n LEU 91 Ca 0.04 0.68 -0.18 0.00 -0.03 0.00 0.00 56.01 56.52 3gbh n LEU 91 Cb 0.48 -0.62 0.09 0.00 -2.33 0.00 0.00 43.42 41.05 3gbh n LEU 91 CO 0.63 -0.63 0.56 0.00 -1.33 0.00 0.00 177.39 176.62 3gbh n GLN 92 N -2.25 2.81 0.20 3.23 6.02 -1.26 -4.80 117.38 121.33 3gbh n GLN 92 Ca 0.02 -3.68 0.18 0.00 -0.01 0.00 0.00 57.00 53.50 3gbh n GLN 92 Cb 0.20 -2.11 0.83 0.00 1.02 0.00 0.00 30.24 30.19 3gbh n GLN 92 CO 0.00 0.00 0.00 -2.95 -1.01 0.00 0.00 177.06 173.10 3gbh h ASN 93 N 1.74 0.00 0.34 1.08 7.08 -1.79 -1.87 115.58 122.17 3gbh h ASN 93 Ca 0.35 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.57 3gbh h ASN 93 Cb 1.40 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.64 3gbh h ASN 93 CO 0.75 0.00 0.00 0.10 -2.08 0.00 0.00 177.43 176.20 3gbh h TYR 94 N 0.00 0.00 -0.33 4.14 -0.00 -1.87 -2.39 116.97 116.53 3gbh h TYR 94 Ca 0.09 0.00 0.10 0.00 0.00 0.00 0.00 58.73 58.92 3gbh h TYR 94 Cb 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.27 3gbh h TYR 94 CO 0.00 0.00 0.31 1.49 -0.00 0.00 0.00 178.16 179.96 3gbh h GLU 95 N 0.00 0.00 -0.31 0.10 4.81 -1.75 -2.03 114.58 115.39 3gbh h GLU 95 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3gbh h GLU 95 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 3gbh h GLU 95 CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 179.91 3gbh n LYS 96 N -3.97 2.40 -0.08 1.92 5.02 -0.90 -4.55 118.16 118.00 3gbh n LYS 96 Ca 0.05 -2.10 -0.08 0.00 -2.02 0.00 0.00 58.31 54.16 3gbh n LYS 96 Cb 0.47 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.97 3gbh n LYS 96 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gbh h ALA 97 N 4.50 0.35 -0.59 7.82 0.00 -1.51 0.34 119.26 130.16 3gbh h ALA 97 Ca 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3gbh h ALA 97 Cb 0.93 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 3gbh h ALA 97 CO 0.00 -0.25 0.31 0.93 0.00 0.00 0.00 179.25 180.24 3gbh h GLU 98 N 0.30 0.83 0.08 0.00 4.39 -1.80 -0.47 114.58 117.91 3gbh h GLU 98 Ca 0.12 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.72 3gbh h GLU 98 Cb 0.04 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 3gbh h GLU 98 CO -0.08 0.65 -0.11 0.37 -1.16 0.00 0.00 179.01 178.68 3gbh h GLN 99 N 0.80 -0.22 -0.03 2.33 4.15 -1.76 0.17 115.11 120.55 3gbh h GLN 99 Ca 0.21 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.64 3gbh h GLN 99 Cb 0.08 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 27.81 3gbh h GLN 99 CO -0.03 -0.14 0.01 0.82 -1.93 0.00 0.00 178.83 177.56 3gbh h ILE 100 N -0.22 1.16 -0.13 2.39 2.04 -0.72 -1.09 117.51 120.94 3gbh h ILE 100 Ca 0.01 -0.48 -0.15 0.00 1.00 0.00 0.00 64.86 65.25 3gbh h ILE 100 Cb 0.23 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3gbh h ILE 100 CO -0.05 0.13 -0.54 1.88 0.00 0.00 0.00 178.15 179.56 3gbh h TYR 101 N -0.14 0.47 -0.74 1.37 -1.99 -1.13 -1.85 116.97 112.96 3gbh h TYR 101 Ca 0.01 -0.16 0.05 0.00 2.00 0.00 0.00 58.73 60.63 3gbh h TYR 101 Cb 0.20 -0.09 -0.05 0.00 2.00 0.00 0.00 36.73 38.79 3gbh h TYR 101 CO -0.01 0.84 0.44 0.78 -0.00 0.00 0.00 178.16 180.21 3gbh h GLY 102 N 1.26 1.09 1.35 3.88 0.00 -0.57 -2.28 103.07 107.79 3gbh h GLY 102 Ca 0.01 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 3gbh h GLY 102 CO 0.09 0.22 0.38 -0.55 0.00 0.00 0.00 176.54 176.68 3gbh h ASP 103 N 0.82 0.76 -0.58 0.19 3.32 -0.70 -1.08 116.42 119.14 3gbh h ASP 103 Ca 0.32 -0.04 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 3gbh h ASP 103 Cb 0.14 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 3gbh h ASP 103 CO -0.16 0.59 0.09 0.00 -1.72 0.00 0.00 179.24 178.04 3gbh h ALA 104 N 1.54 1.00 -0.26 3.45 0.00 -0.81 -0.80 119.26 123.39 3gbh h ALA 104 Ca 0.23 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 3gbh h ALA 104 Cb -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3gbh h ALA 104 CO -0.04 0.63 -0.21 0.28 0.00 0.00 0.00 179.25 179.91 3gbh h VAL 105 N 0.94 1.31 -0.74 0.00 2.07 -0.99 -0.03 116.25 118.80 3gbh h VAL 105 Ca 0.19 -1.35 0.08 0.00 0.82 0.00 0.00 66.70 66.45 3gbh h VAL 105 Cb 0.42 1.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3gbh h VAL 105 CO 0.01 0.42 0.48 -0.33 0.02 0.00 0.00 177.57 178.18 3gbh h GLU 106 N 0.31 0.67 -0.60 1.57 5.08 -0.99 -1.91 114.58 118.71 3gbh h GLU 106 Ca 0.05 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3gbh h GLU 106 Cb 0.75 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.85 3gbh h GLU 106 CO 0.05 0.44 0.00 1.04 -1.00 0.00 0.00 179.01 179.55 3gbh n GLN 107 N -4.49 2.85 -1.83 2.33 6.02 -0.32 -4.91 117.38 117.02 3gbh n GLN 107 Ca 0.12 -2.03 -0.13 0.00 -0.01 0.00 0.00 57.00 54.95 3gbh n GLN 107 Cb 0.30 -1.67 -0.03 0.00 1.02 0.00 0.00 30.24 29.86 3gbh n GLN 107 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3gbh n GLN 108 N 0.80 -0.98 -0.17 -1.09 1.13 -0.72 -5.03 117.38 111.31 3gbh n GLN 108 Ca 0.18 0.79 0.10 0.00 -1.94 0.00 0.00 57.00 56.14 3gbh n GLN 108 Cb 0.64 -4.94 0.28 0.00 0.11 0.00 0.00 30.24 26.33 3gbh n GLN 108 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3gbh n LEU 109 N -1.69 2.56 -4.83 1.08 4.77 -0.05 -5.03 117.00 113.81 3gbh n LEU 109 Ca -0.14 -1.15 -0.22 0.00 -0.03 0.00 0.00 56.01 54.47 3gbh n LEU 109 Cb 0.53 -0.23 -0.04 0.00 -2.33 0.00 0.00 43.42 41.35 3gbh n LEU 109 CO 0.19 0.58 -0.14 0.42 -1.33 0.00 0.00 177.39 177.11 3gbh s THR 111 N -1.55 3.99 0.43 -5.08 -4.23 -1.26 -4.98 115.64 102.95 3gbh s THR 111 Ca 0.35 -1.41 0.17 0.00 -1.18 0.00 0.00 61.69 59.61 3gbh s THR 111 Cb 0.19 -3.28 0.19 0.00 1.34 0.00 0.00 72.50 70.94 3gbh s THR 111 CO 0.27 -0.27 1.98 -0.33 -0.54 0.00 0.00 174.62 175.73 3gbh h GLU 112 N 1.40 0.00 -0.55 3.99 4.39 -1.99 -2.22 114.58 119.60 3gbh h GLU 112 Ca -0.47 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.20 3gbh h GLU 112 Cb 1.25 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.87 3gbh h GLU 112 CO 0.60 0.20 0.21 0.38 -1.16 0.00 0.00 179.01 179.24 3gbh h ASP 113 N 0.00 0.77 -0.37 1.42 2.03 -2.05 -1.05 116.42 117.17 3gbh h ASP 113 Ca -0.00 -0.18 -0.11 0.00 -0.73 0.00 0.00 57.03 56.01 3gbh h ASP 113 Cb 0.38 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 38.67 3gbh h ASP 113 CO 0.03 0.74 -0.21 0.40 -1.03 0.00 0.00 179.24 179.17 3gbh h ILE 114 N 0.76 1.28 -0.50 4.15 1.08 -1.93 -1.73 117.51 120.62 3gbh h ILE 114 Ca 0.18 -1.35 0.07 0.00 -0.39 0.00 0.00 64.86 63.38 3gbh h ILE 114 Cb 0.21 1.36 -0.06 0.00 -3.07 0.00 0.00 36.82 35.26 3gbh h ILE 114 CO -0.01 0.44 0.18 0.50 -0.69 0.00 0.00 178.15 178.57 3gbh h LYS 115 N 0.59 0.34 -0.55 2.37 3.64 -1.27 -0.34 116.57 121.35 3gbh h LYS 115 Ca 0.08 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.32 3gbh h LYS 115 Cb 0.76 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 3gbh h LYS 115 CO 0.06 0.23 -0.11 0.00 -2.27 0.00 0.00 179.45 177.36 3gbh h ALA 116 N 1.34 0.75 -0.43 5.00 0.00 -1.08 -1.43 119.26 123.41 3gbh h ALA 116 Ca 0.24 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3gbh h ALA 116 Cb 0.26 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3gbh h ALA 116 CO -0.25 0.66 -0.09 1.96 0.00 0.00 0.00 179.25 181.54 3gbh h GLN 117 N 0.91 0.81 0.08 0.00 4.20 -1.00 0.09 115.11 120.21 3gbh h GLN 117 Ca 0.14 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 3gbh h GLN 117 Cb 0.68 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.41 3gbh h GLN 117 CO 0.05 0.92 -0.04 -0.07 -0.67 0.00 0.00 178.83 179.02 3gbh h LEU 118 N 0.64 -0.09 -1.42 1.46 3.38 -0.97 -2.98 115.31 115.32 3gbh h LEU 118 Ca 0.11 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3gbh h LEU 118 Cb 0.61 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3gbh h LEU 118 CO 0.04 -0.02 -0.07 -0.07 0.09 0.00 0.00 178.44 178.41 3gbh h LEU 119 N -0.16 0.27 -1.96 1.67 3.38 -1.13 0.56 115.31 117.95 3gbh h LEU 119 Ca -0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3gbh h LEU 119 Cb 0.13 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 3gbh h LEU 119 CO 0.02 0.39 -0.09 0.44 0.09 0.00 0.00 178.44 179.28 3gbh h ASP 120 N 0.28 0.00 0.00 -0.43 3.32 -0.82 -1.36 116.42 117.41 3gbh h ASP 120 Ca 0.06 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.75 3gbh h ASP 120 Cb 0.31 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.80 3gbh h ASP 120 CO 0.01 0.09 -2.38 -2.67 -1.72 0.00 0.00 179.24 172.58 3gbh n TRP 121 N -4.10 0.00 -0.14 4.55 4.27 -0.95 -4.53 117.44 116.55 3gbh n TRP 121 Ca -0.03 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 53.49 3gbh n TRP 121 Cb 0.18 -0.98 -0.01 0.00 -1.36 0.00 0.00 31.31 29.14 3gbh n TRP 121 CO 0.00 0.00 0.00 0.82 -2.29 0.00 0.00 177.69 176.22 3gbh h ILE 122 N 0.00 1.23 -0.09 -1.67 2.04 -0.81 -2.96 117.51 115.25 3gbh h ILE 122 Ca -0.54 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 3gbh h ILE 122 Cb 2.14 0.97 -0.00 0.00 -0.74 0.00 0.00 36.82 39.19 3gbh h ILE 122 CO 0.00 0.27 0.00 -0.07 0.00 0.00 0.00 178.15 178.36 3gbh h LEU 123 N 0.52 0.16 -1.21 1.44 3.38 -1.48 -0.58 115.31 117.54 3gbh h LEU 123 Ca 0.13 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.81 3gbh h LEU 123 Cb 0.31 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 3gbh h LEU 123 CO 0.00 0.43 0.54 -0.65 0.09 0.00 0.00 178.44 178.85 3gbh h PRO 124 N -0.11 1.03 0.24 1.13 0.11 -1.78 0.13 132.00 132.74 3gbh h PRO 124 Ca 0.03 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 3gbh h PRO 124 Cb 0.35 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.23 3gbh h PRO 124 CO 0.00 0.68 -0.12 -0.92 -0.21 0.00 0.00 178.00 177.44 3gbh h TYR 125 N 1.06 -0.30 -0.47 0.65 3.20 -1.30 -2.36 116.97 117.45 3gbh h TYR 125 Ca 0.32 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.11 3gbh h TYR 125 Cb -0.04 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 3gbh h TYR 125 CO -0.00 -0.03 0.02 1.88 -1.64 0.00 0.00 178.16 178.39 3gbh h TYR 126 N -0.55 0.80 0.00 -3.82 -1.99 -0.99 -2.87 116.97 107.56 3gbh h TYR 126 Ca -0.03 -0.10 -0.05 0.00 2.00 0.00 0.00 58.73 60.55 3gbh h TYR 126 Cb 0.40 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 38.90 3gbh h TYR 126 CO 0.00 0.73 -0.23 0.87 -0.00 0.00 0.00 178.16 179.54 3gbh h LYS 127 N 0.72 0.00 -0.24 4.88 1.57 -0.73 -3.13 116.57 119.63 3gbh h LYS 127 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3gbh h LYS 127 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3gbh h LYS 127 CO 0.01 0.23 0.00 0.09 -0.57 0.00 0.00 179.45 179.21 3gbh n ASN 128 N -3.27 3.08 -4.77 0.86 3.02 -0.89 -4.97 115.26 108.32 3gbh n ASN 128 Ca 0.01 -1.95 -0.39 0.00 -0.03 0.00 0.00 54.58 52.22 3gbh n ASN 128 Cb 0.50 -0.14 -0.02 0.00 -0.61 0.00 0.00 39.78 39.50 3gbh n ASN 128 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3gbh s LEU 129 N -1.69 4.29 0.81 3.41 1.43 -1.09 -5.02 118.68 120.82 3gbh s LEU 129 Ca 0.35 2.38 -0.13 0.00 -1.03 0.00 0.00 54.13 55.69 3gbh s LEU 129 Cb 0.21 -3.90 0.09 0.00 0.03 0.00 0.00 46.19 42.62 3gbh s LEU 129 CO 0.31 -0.55 1.20 -0.94 0.23 0.00 0.00 176.35 176.60 3gbh s SER 130 N -1.00 3.55 0.23 2.29 1.04 -1.26 -4.92 113.70 113.63 3gbh s SER 130 Ca 0.54 2.36 -0.07 0.00 0.48 0.00 0.00 55.95 59.26 3gbh s SER 130 Cb -0.32 -2.59 0.38 0.00 0.10 0.00 0.00 66.02 63.59 3gbh s SER 130 CO 0.41 -2.69 1.71 -0.09 0.98 0.00 0.00 173.24 173.56 3gbh h ARG 131 N -0.95 0.31 -0.29 4.02 2.43 -2.00 -2.38 114.38 115.53 3gbh h ARG 131 Ca -0.46 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 58.67 3gbh h ARG 131 Cb 1.30 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 3gbh h ARG 131 CO 0.46 0.21 0.08 1.49 -1.51 0.00 0.00 179.97 180.70 3gbh h GLU 132 N 0.32 0.46 -0.24 0.20 4.81 -2.04 0.67 114.58 118.76 3gbh h GLU 132 Ca 0.37 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 3gbh h GLU 132 Cb 0.56 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.88 3gbh h GLU 132 CO -0.42 0.52 0.00 0.41 -0.73 0.00 0.00 179.01 178.79 3gbh n GLY 133 N -0.60 0.00 2.32 1.92 0.00 -0.90 -1.43 105.19 106.50 3gbh n GLY 133 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3gbh n GLY 133 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3gbh n LYS 135 N 0.46 0.00 -0.14 1.61 4.81 0.23 -2.43 118.16 122.70 3gbh n LYS 135 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.36 3gbh n LYS 135 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 3gbh n LYS 135 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 3gbh h ASP 136 N 0.00 0.51 -0.00 3.14 3.32 -1.50 -0.63 116.42 121.26 3gbh h ASP 136 Ca 0.00 -0.06 0.01 0.00 0.02 0.00 0.00 57.03 56.99 3gbh h ASP 136 Cb 0.00 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3gbh h ASP 136 CO 0.00 0.42 -0.03 0.40 -1.72 0.00 0.00 179.24 178.31 3gbh h ILE 137 N 0.55 0.92 0.00 0.35 2.04 -1.76 -2.11 117.51 117.51 3gbh h ILE 137 Ca 0.15 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.89 3gbh h ILE 137 Cb 0.01 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3gbh h ILE 137 CO -0.03 0.00 -0.58 -0.37 0.00 0.00 0.00 178.15 177.18 3gbh h VAL 138 N -0.05 1.28 -0.47 1.67 -1.51 -1.83 -1.50 116.25 113.84 3gbh h VAL 138 Ca 0.01 -2.07 -0.03 0.00 -1.23 0.00 0.00 66.70 63.38 3gbh h VAL 138 Cb 0.07 2.16 -0.02 0.00 -2.13 0.00 0.00 31.29 31.37 3gbh h VAL 138 CO -0.03 0.56 0.17 0.78 -1.23 0.00 0.00 177.57 177.82 3gbh h ASN 139 N 0.00 0.66 0.05 4.19 2.35 -0.90 -1.62 115.58 120.31 3gbh h ASN 139 Ca -0.01 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.56 3gbh h ASN 139 Cb 1.11 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.31 3gbh h ASN 139 CO 0.07 0.67 -0.02 0.40 -1.65 0.00 0.00 177.43 176.90 3gbh h ILE 140 N 0.62 1.17 -0.23 2.81 2.04 -1.21 -2.06 117.51 120.65 3gbh h ILE 140 Ca 0.15 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 3gbh h ILE 140 Cb 0.23 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 3gbh h ILE 140 CO -0.01 0.18 0.14 0.44 0.00 0.00 0.00 178.15 178.90 3gbh h ASP 141 N -0.38 0.27 0.13 1.72 3.32 -1.29 -1.71 116.42 118.48 3gbh h ASP 141 Ca -0.01 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 3gbh h ASP 141 Cb 0.34 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3gbh h ASP 141 CO 0.01 0.23 -0.21 0.28 -1.72 0.00 0.00 179.24 177.84 3gbh h SER 142 N 0.29 0.15 -0.22 6.45 0.02 -1.30 -2.51 113.55 116.42 3gbh h SER 142 Ca 0.08 -0.04 -0.20 0.00 -0.84 0.00 0.00 61.79 60.79 3gbh h SER 142 Cb 0.01 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 62.51 3gbh h SER 142 CO -0.02 0.37 -0.66 0.28 -1.14 0.00 0.00 176.83 175.67 3gbh h SER 143 N 0.15 0.96 0.00 3.07 0.02 -1.06 -0.88 113.55 115.81 3gbh h SER 143 Ca 0.03 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 3gbh h SER 143 Cb 0.45 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3gbh h SER 143 CO 0.03 1.37 0.00 0.18 -1.14 0.00 0.00 176.83 177.27 3gbh n LEU 144 N -3.98 0.00 -1.03 5.07 4.77 -0.67 -4.67 117.00 116.48 3gbh n LEU 144 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3gbh n LEU 144 Cb 0.69 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 3gbh n LEU 144 CO 0.52 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.58 3gbh n ALA 146 N 0.13 -0.21 0.00 -1.18 0.00 -0.34 -4.74 120.51 114.17 3gbh n ALA 146 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3gbh n ALA 146 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.23 3gbh n ALA 146 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3gbh n GLN 148 N -0.98 0.00 0.00 0.00 7.27 -1.26 -4.66 117.38 117.75 3gbh n GLN 148 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 3gbh n GLN 148 Cb 0.10 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.75 3gbh n GLN 148 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 3gbh n LEU 149 N 0.00 0.60 0.00 1.69 0.00 -1.26 -1.03 117.00 117.00 3gbh n LEU 149 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 56.01 55.71 3gbh n LEU 149 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 43.42 43.27 3gbh n LEU 149 CO 0.00 0.11 0.00 0.18 0.00 0.00 0.00 177.39 177.68 3gbh n LEU 151 N 0.60 0.00 -0.25 -1.96 4.77 -1.26 -0.62 117.00 118.28 3gbh n LEU 151 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 3gbh n LEU 151 Cb 0.11 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.25 3gbh n LEU 151 CO 0.00 0.00 1.04 0.74 -1.33 0.00 0.00 177.39 177.84 3gbh h THR 152 N 0.00 1.24 -0.63 -5.08 2.02 -1.47 -0.11 112.91 108.89 3gbh h THR 152 Ca 0.00 -0.70 0.04 0.00 0.77 0.00 0.00 66.41 66.51 3gbh h THR 152 Cb 0.00 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 66.76 3gbh h THR 152 CO 0.00 0.29 0.37 0.00 0.37 0.00 0.00 175.52 176.55 3gbh h ALA 153 N 1.15 0.82 -0.52 6.16 0.00 -1.11 -1.21 119.26 124.54 3gbh h ALA 153 Ca 0.24 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3gbh h ALA 153 Cb 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3gbh h ALA 153 CO -0.03 0.09 0.20 -0.22 0.00 0.00 0.00 179.25 179.29 3gbh h LYS 154 N 0.72 0.79 -0.68 0.00 1.63 -1.49 -1.19 116.57 116.35 3gbh h LYS 154 Ca 0.26 -0.15 0.12 0.00 -0.85 0.00 0.00 60.65 60.03 3gbh h LYS 154 Cb 0.08 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.54 3gbh h LYS 154 CO -0.13 0.71 0.45 0.00 -3.45 0.00 0.00 179.45 177.03 3gbh h ALA 155 N 1.05 2.07 0.00 5.00 0.00 -0.43 0.28 119.26 127.22 3gbh h ALA 155 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3gbh h ALA 155 Cb 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3gbh h ALA 155 CO -0.01 -0.23 0.00 0.72 0.00 0.00 0.00 179.25 179.72 3gbh n HIS 156 N -4.47 0.00 -0.28 0.00 8.25 -0.51 -1.68 115.22 116.52 3gbh n HIS 156 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 3gbh n HIS 156 Cb 0.45 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.46 3gbh n HIS 156 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gbh n GLY 157 N 1.08 0.65 3.96 -1.41 0.00 0.98 -4.63 105.19 105.82 3gbh n GLY 157 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 3gbh n GLY 157 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gbh s TYR 158 N -2.57 2.52 0.19 1.61 2.02 -0.56 -4.79 117.35 115.78 3gbh s TYR 158 Ca 0.00 0.12 0.04 0.00 -0.37 0.00 0.00 57.07 56.86 3gbh s TYR 158 Cb 0.00 -3.06 -0.05 0.00 -0.40 0.00 0.00 41.96 38.46 3gbh s TYR 158 CO 0.00 -1.37 -0.04 -0.51 -1.57 0.00 0.00 175.55 172.06 3gbh s ASP 159 N -4.56 1.72 0.22 2.29 1.01 -0.20 -3.66 116.67 113.49 3gbh s ASP 159 Ca 0.61 -1.14 0.00 0.00 0.71 0.00 0.00 52.55 52.74 3gbh s ASP 159 Cb -0.09 0.02 -0.05 0.00 1.01 0.00 0.00 42.92 43.81 3gbh s ASP 159 CO 0.43 -0.46 0.09 0.42 0.21 0.00 0.00 175.17 175.86 3gbh s THR 160 N -3.42 0.38 -0.16 -1.27 -4.23 -1.26 -1.71 115.64 103.95 3gbh s THR 160 Ca 0.23 -1.99 -0.04 0.00 -1.18 0.00 0.00 61.69 58.72 3gbh s THR 160 Cb 0.05 -2.46 0.07 0.00 1.34 0.00 0.00 72.50 71.50 3gbh s THR 160 CO 0.05 -0.12 0.18 0.21 -0.54 0.00 0.00 174.62 174.41 3gbh s ASN 161 N -3.22 1.35 0.31 3.99 3.04 -0.38 -1.67 114.94 118.36 3gbh s ASN 161 Ca 0.35 -0.12 -0.29 0.00 0.04 0.00 0.00 52.86 52.84 3gbh s ASN 161 Cb 0.07 0.26 -0.10 0.00 -1.54 0.00 0.00 41.25 39.94 3gbh s ASN 161 CO 0.11 -0.31 1.15 -2.16 -3.04 0.00 0.00 177.10 172.85 3gbh s PRO 162 N 2.29 4.50 -0.03 0.43 0.04 -1.26 -1.45 135.00 139.52 3gbh s PRO 162 Ca 0.05 1.90 0.00 0.00 0.04 0.00 0.00 61.00 62.99 3gbh s PRO 162 Cb -0.15 -3.09 0.03 0.00 0.04 0.00 0.00 34.50 31.33 3gbh s PRO 162 CO -0.10 0.06 0.00 0.42 0.04 0.00 0.00 177.00 177.42 3gbh s ILE 163 N -1.20 0.18 0.00 0.56 1.01 0.10 -4.96 121.20 116.89 3gbh s ILE 163 Ca 0.47 0.10 0.00 0.00 0.00 0.00 0.00 60.65 61.22 3gbh s ILE 163 Cb -0.33 -0.28 0.00 0.00 0.01 0.00 0.00 42.46 41.85 3gbh s ILE 163 CO 0.43 0.15 0.00 0.61 0.00 0.00 0.00 174.94 176.13 3gbh n GLY 164 N 4.23 0.67 2.50 6.18 0.00 -1.26 -1.08 105.19 116.43 3gbh n GLY 164 Ca -0.25 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 3gbh n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gbh n GLY 165 N 1.48 4.69 3.22 -0.02 0.00 -1.26 -4.87 105.19 108.44 3gbh n GLY 165 Ca 0.00 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.10 3gbh n GLY 165 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3gbh s PHE 166 N 0.86 1.13 -1.00 1.61 -0.71 -1.26 -4.52 117.98 114.08 3gbh s PHE 166 Ca 0.57 -0.94 -0.23 0.00 -1.04 0.00 0.00 56.93 55.29 3gbh s PHE 166 Cb 0.17 -0.63 -0.03 0.00 -1.21 0.00 0.00 43.02 41.31 3gbh s PHE 166 CO -0.07 -0.13 1.83 0.34 -1.34 0.00 0.00 175.22 175.85 3gbh s ASP 167 N -3.14 5.51 0.50 1.98 -1.08 0.65 -4.81 116.67 116.29 3gbh s ASP 167 Ca 0.19 -1.12 0.29 0.00 -0.52 0.00 0.00 52.55 51.40 3gbh s ASP 167 Cb 0.05 -2.57 1.10 0.00 -1.46 0.00 0.00 42.92 40.04 3gbh s ASP 167 CO 0.01 -2.45 1.89 0.11 0.52 0.00 0.00 175.17 175.25 3gbh h LYS 168 N 10.47 0.00 -0.41 4.34 1.57 -1.92 -1.30 116.57 129.33 3gbh h LYS 168 Ca 0.16 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.87 3gbh h LYS 168 Cb 0.99 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 3gbh h LYS 168 CO 1.27 0.07 -0.04 0.93 -0.57 0.00 0.00 179.45 181.11 3gbh h GLU 169 N 0.00 0.68 -0.00 3.15 3.07 -2.00 -3.35 114.58 116.12 3gbh h GLU 169 Ca -0.00 -0.19 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 3gbh h GLU 169 Cb 0.65 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 3gbh h GLU 169 CO 0.01 0.73 -0.27 0.09 -1.40 0.00 0.00 179.01 178.16 3gbh n ASN 170 N -4.21 0.52 -0.26 1.42 3.02 -1.09 -4.78 115.26 109.88 3gbh n ASN 170 Ca 0.02 -0.76 -0.07 0.00 -0.03 0.00 0.00 54.58 53.74 3gbh n ASN 170 Cb 0.31 0.85 0.05 0.00 -0.61 0.00 0.00 39.78 40.38 3gbh n ASN 170 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3gbh h ILE 171 N 0.22 1.25 -0.09 2.41 6.09 -1.38 -0.75 117.51 125.27 3gbh h ILE 171 Ca 0.00 -0.80 0.01 0.00 -1.37 0.00 0.00 64.86 62.70 3gbh h ILE 171 Cb 0.19 0.44 -0.01 0.00 0.47 0.00 0.00 36.82 37.90 3gbh h ILE 171 CO 0.00 0.32 0.03 0.00 -3.07 0.00 0.00 178.15 175.43 3gbh h ALA 172 N 1.13 0.10 -0.45 0.18 0.00 -1.86 -1.71 119.26 116.65 3gbh h ALA 172 Ca 0.24 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.17 3gbh h ALA 172 Cb 0.23 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3gbh h ALA 172 CO -0.02 -0.43 0.27 -0.44 0.00 0.00 0.00 179.25 178.63 3gbh h ASP 173 N 0.08 0.44 -0.62 0.00 3.32 -1.59 0.99 116.42 119.05 3gbh h ASP 173 Ca 0.04 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.13 3gbh h ASP 173 Cb 0.02 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.43 3gbh h ASP 173 CO -0.03 0.32 0.36 0.40 -1.72 0.00 0.00 179.24 178.56 3gbh h ILE 174 N 0.54 1.02 -0.00 0.35 2.04 -0.83 -1.80 117.51 118.83 3gbh h ILE 174 Ca 0.18 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.80 3gbh h ILE 174 Cb 0.00 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 3gbh h ILE 174 CO -0.08 0.12 -0.12 2.30 0.00 0.00 0.00 178.15 180.38 3gbh n ILE 175 N -4.77 0.00 -0.27 -0.67 -5.35 -0.67 -4.93 119.36 102.70 3gbh n ILE 175 Ca 0.07 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.52 3gbh n ILE 175 Cb 0.12 -0.22 0.00 0.00 -1.74 0.00 0.00 39.64 37.80 3gbh n ILE 175 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3gbh n GLY 176 N 1.37 0.83 3.87 3.28 0.00 -0.38 -5.09 105.19 109.07 3gbh n GLY 176 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 3gbh n GLY 176 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gbh s TYR 177 N -2.08 3.43 -0.42 1.61 1.51 0.20 -4.97 117.35 116.63 3gbh s TYR 177 Ca 0.00 1.02 -0.29 0.00 -1.01 0.00 0.00 57.07 56.79 3gbh s TYR 177 Cb 0.00 -2.40 0.01 0.00 -0.11 0.00 0.00 41.96 39.46 3gbh s TYR 177 CO 0.00 0.08 1.44 0.34 -1.11 0.00 0.00 175.55 176.30 3gbh s ASP 178 N -2.68 6.28 0.16 2.29 -1.08 -1.26 -3.83 116.67 116.55 3gbh s ASP 178 Ca 0.51 0.81 0.20 0.00 -0.52 0.00 0.00 52.55 53.55 3gbh s ASP 178 Cb -0.10 -2.54 0.85 0.00 -1.46 0.00 0.00 42.92 39.67 3gbh s ASP 178 CO 0.24 -1.49 1.62 -1.54 0.52 0.00 0.00 175.17 174.53 3gbh n SER 179 N 9.03 0.42 0.10 -0.34 3.41 -1.26 -1.51 113.62 123.47 3gbh n SER 179 Ca 0.17 0.60 -0.05 0.00 -0.26 0.00 0.00 58.87 59.33 3gbh n SER 179 Cb 0.48 -0.69 0.03 0.00 -0.26 0.00 0.00 64.21 63.77 3gbh n SER 179 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 3gbh h ASP 180 N 0.00 0.09 0.12 4.04 3.58 -2.02 -3.37 116.42 118.86 3gbh h ASP 180 Ca 0.00 -0.07 -0.36 0.00 0.42 0.00 0.00 57.03 57.01 3gbh h ASP 180 Cb 0.33 -0.03 -0.05 0.00 1.72 0.00 0.00 39.33 41.30 3gbh h ASP 180 CO 0.00 0.86 -2.20 -1.14 -2.88 0.00 0.00 179.24 173.88 3gbh n ARG 181 N -3.63 0.69 -4.19 0.28 0.63 -0.82 -4.92 116.66 104.70 3gbh n ARG 181 Ca -0.02 0.17 -0.34 0.00 -0.92 0.00 0.00 57.85 56.74 3gbh n ARG 181 Cb 0.77 -1.62 -0.14 0.00 0.45 0.00 0.00 32.46 31.92 3gbh n ARG 181 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 3gbh s TYR 182 N -2.54 2.89 -0.11 -0.14 2.02 -0.57 -0.54 117.35 118.37 3gbh s TYR 182 Ca -0.21 -0.96 -0.02 0.00 -0.37 0.00 0.00 57.07 55.51 3gbh s TYR 182 Cb 0.08 -2.00 -0.03 0.00 -0.40 0.00 0.00 41.96 39.60 3gbh s TYR 182 CO 0.73 -0.49 -0.03 0.14 -1.57 0.00 0.00 175.55 174.33 3gbh s VAL 183 N 1.12 3.99 0.21 0.71 -7.23 -0.46 -4.55 120.40 114.18 3gbh s VAL 183 Ca 0.01 -0.35 -0.30 0.00 -1.81 0.00 0.00 61.98 59.53 3gbh s VAL 183 Cb -0.14 -2.70 -0.08 0.00 0.56 0.00 0.00 36.38 34.02 3gbh s VAL 183 CO -0.02 0.55 1.15 -2.16 -0.31 0.00 0.00 175.10 174.31 3gbh s PRO 184 N -0.33 4.55 -0.12 4.82 0.04 -1.26 -0.17 135.00 142.52 3gbh s PRO 184 Ca 0.06 1.83 -0.14 0.00 0.04 0.00 0.00 61.00 62.78 3gbh s PRO 184 Cb -0.12 -3.23 -0.05 0.00 0.04 0.00 0.00 34.50 31.13 3gbh s PRO 184 CO 0.02 0.02 -0.27 0.28 0.04 0.00 0.00 177.00 177.09 3gbh n VAL 185 N 2.14 1.44 -3.67 -0.36 0.31 0.33 -4.88 118.33 113.63 3gbh n VAL 185 Ca 0.03 0.19 -0.09 0.00 -0.01 0.00 0.00 64.34 64.46 3gbh n VAL 185 Cb 0.45 -2.17 -0.02 0.00 -0.91 0.00 0.00 33.84 31.18 3gbh n VAL 185 CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 3gbh s LEU 186 N -7.70 -0.37 0.21 7.52 2.34 -1.20 -5.00 118.68 114.47 3gbh s LEU 186 Ca -0.23 -0.35 0.08 0.00 0.06 0.00 0.00 54.13 53.70 3gbh s LEU 186 Cb 0.03 2.64 -0.04 0.00 -0.56 0.00 0.00 46.19 48.26 3gbh s LEU 186 CO 0.34 -1.18 -0.03 0.00 -1.06 0.00 0.00 176.35 174.42 3gbh s ALA 187 N -3.85 3.11 -0.16 1.48 0.00 -0.24 -1.20 121.76 120.91 3gbh s ALA 187 Ca 0.07 -1.49 -0.03 0.00 0.00 0.00 0.00 51.96 50.51 3gbh s ALA 187 Cb -0.04 -0.85 0.05 0.00 0.00 0.00 0.00 23.12 22.29 3gbh s ALA 187 CO -0.02 0.41 0.05 0.42 0.00 0.00 0.00 175.76 176.62 3gbh s ILE 188 N -1.91 0.26 0.19 0.00 1.01 0.10 0.01 121.20 120.85 3gbh s ILE 188 Ca 0.28 -0.27 -0.30 0.00 0.00 0.00 0.00 60.65 60.36 3gbh s ILE 188 Cb -0.08 -0.75 -0.08 0.00 0.01 0.00 0.00 42.46 41.56 3gbh s ILE 188 CO 0.18 -0.14 1.01 0.00 0.00 0.00 0.00 174.94 175.99 3gbh s ALA 189 N 1.99 3.33 -0.01 9.38 0.00 -0.53 -0.31 121.76 135.61 3gbh s ALA 189 Ca 0.01 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.68 3gbh s ALA 189 Cb -0.16 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.68 3gbh s ALA 189 CO -0.08 -0.02 -0.05 -1.50 0.00 0.00 0.00 175.76 174.11 3gbh s ILE 190 N -0.57 0.41 -0.29 0.00 2.07 -0.59 -1.25 121.20 120.98 3gbh s ILE 190 Ca 0.46 -0.19 0.00 0.00 -1.41 0.00 0.00 60.65 59.50 3gbh s ILE 190 Cb -0.27 -0.36 0.00 0.00 0.13 0.00 0.00 42.46 41.96 3gbh s ILE 190 CO 0.33 0.13 0.00 0.61 -1.91 0.00 0.00 174.94 174.10 3gbh n GLY 191 N 3.12 -1.00 3.69 1.50 0.00 -0.70 -0.96 105.19 110.84 3gbh n GLY 191 Ca -0.15 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.72 3gbh n GLY 191 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gbh s LYS 192 N -0.12 4.32 0.22 1.61 2.20 -1.26 -1.04 119.74 125.68 3gbh s LYS 192 Ca 0.00 0.71 -0.32 0.00 -0.36 0.00 0.00 55.97 56.00 3gbh s LYS 192 Cb 0.00 -3.50 -0.14 0.00 -1.51 0.00 0.00 37.83 32.68 3gbh s LYS 192 CO 0.00 -0.06 1.43 1.17 -0.36 0.00 0.00 175.35 177.53 3gbh n LYS 193 N 4.35 2.00 -0.00 4.03 4.81 -1.26 -0.18 118.16 131.91 3gbh n LYS 193 Ca -0.02 0.71 0.05 0.00 -0.87 0.00 0.00 58.31 58.18 3gbh n LYS 193 Cb 0.51 -2.38 -0.06 0.00 0.02 0.00 0.00 35.03 33.11 3gbh n LYS 193 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3gbh n ALA 194 N 2.19 2.81 -3.03 3.14 0.00 -0.16 -4.49 120.51 120.98 3gbh n ALA 194 Ca 0.13 -0.25 -0.12 0.00 0.00 0.00 0.00 53.44 53.20 3gbh n ALA 194 Cb 0.30 -0.33 -0.13 0.00 0.00 0.00 0.00 19.45 19.30 3gbh n ALA 194 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3gbh s GLN 195 N -2.24 0.17 0.49 0.00 0.74 -1.13 -4.98 119.66 112.73 3gbh s GLN 195 Ca 0.00 0.21 -0.23 0.00 0.05 0.00 0.00 55.36 55.39 3gbh s GLN 195 Cb 0.07 0.08 -0.06 0.00 1.10 0.00 0.00 33.01 34.20 3gbh s GLN 195 CO 0.39 -0.02 1.26 -0.51 -0.55 0.00 0.00 175.29 175.85 3gbh s ASP 196 N 0.08 5.79 0.53 6.67 1.01 -1.26 -4.65 116.67 124.84 3gbh s ASP 196 Ca -0.00 2.52 -0.21 0.00 0.71 0.00 0.00 52.55 55.58 3gbh s ASP 196 Cb -0.01 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 3gbh s ASP 196 CO 0.00 -1.20 1.20 0.00 0.21 0.00 0.00 175.17 175.39 3gbh s ALA 197 N -1.42 2.76 0.29 5.23 0.00 -1.26 -4.90 121.76 122.45 3gbh s ALA 197 Ca 0.67 1.00 -0.29 0.00 0.00 0.00 0.00 51.96 53.34 3gbh s ALA 197 Cb -0.34 -3.43 -0.10 0.00 0.00 0.00 0.00 23.12 19.25 3gbh s ALA 197 CO 0.41 -0.95 1.11 -1.01 0.00 0.00 0.00 175.76 175.32 3gbh s HIS 198 N -1.56 3.52 0.67 0.00 3.76 -1.26 -5.04 115.29 115.38 3gbh s HIS 198 Ca 0.71 1.68 -0.15 0.00 -0.15 0.00 0.00 55.06 57.15 3gbh s HIS 198 Cb -0.30 -3.30 0.01 0.00 1.11 0.00 0.00 32.58 30.10 3gbh s HIS 198 CO 0.35 -0.64 1.14 -0.51 -0.85 0.00 0.00 174.74 174.23 3gbh s ASP 199 N -0.91 4.87 0.07 1.40 1.01 -1.26 -4.83 116.67 117.01 3gbh s ASP 199 Ca 0.46 2.12 -0.01 0.00 0.71 0.00 0.00 52.55 55.83 3gbh s ASP 199 Cb -0.32 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.01 3gbh s ASP 199 CO 0.41 -1.80 -0.02 -0.94 0.21 0.00 0.00 175.17 173.03 3gbh s SER 200 N -2.36 0.50 0.32 0.27 1.04 -1.26 -5.17 113.70 107.04 3gbh s SER 200 Ca 0.70 -1.04 0.03 0.00 0.48 0.00 0.00 55.95 56.11 3gbh s SER 200 Cb -0.23 0.21 -0.02 0.00 0.10 0.00 0.00 66.02 66.07 3gbh s SER 200 CO 0.42 -0.62 0.49 0.68 0.98 0.00 0.00 173.24 175.19 3gbh s VAL 201 N -3.92 4.88 0.11 5.02 -7.23 -1.26 -5.12 120.40 112.86 3gbh s VAL 201 Ca 0.11 -0.73 0.07 0.00 -1.81 0.00 0.00 61.98 59.61 3gbh s VAL 201 Cb 0.08 -3.75 -0.04 0.00 0.56 0.00 0.00 36.38 33.23 3gbh s VAL 201 CO -0.07 -0.39 -0.17 -0.13 -0.31 0.00 0.00 175.10 174.03 3gbh s ARG 202 N -4.21 1.04 0.65 4.82 1.81 -1.26 -5.14 118.95 116.66 3gbh s ARG 202 Ca 0.40 -1.17 -0.18 0.00 -1.72 0.00 0.00 55.73 53.06 3gbh s ARG 202 Cb -0.09 -1.10 -0.02 0.00 -0.45 0.00 0.00 34.95 33.29 3gbh s ARG 202 CO 0.33 0.24 1.18 1.28 -0.68 0.00 0.00 175.30 177.65 3gbh n LEU 203 N 0.86 5.23 -4.77 2.53 4.77 -1.26 -4.96 117.00 119.40 3gbh n LEU 203 Ca -0.18 0.80 -0.40 0.00 -0.03 0.00 0.00 56.01 56.20 3gbh n LEU 203 Cb 0.55 -1.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.15 3gbh n LEU 203 CO 0.24 -1.32 1.06 -2.16 -1.33 0.00 0.00 177.39 173.88 3gbh s PRO 204 N -3.24 3.83 0.51 3.23 0.04 -1.26 -4.90 135.00 133.22 3gbh s PRO 204 Ca 0.80 2.39 0.33 0.00 0.04 0.00 0.00 61.00 64.56 3gbh s PRO 204 Cb -0.38 -2.74 1.44 0.00 0.04 0.00 0.00 34.50 32.85 3gbh s PRO 204 CO 0.43 -0.69 1.98 -0.84 0.04 0.00 0.00 177.00 177.92 3gbh h ILE 205 N 2.47 0.00 0.00 0.56 3.07 -1.97 0.92 117.51 122.56 3gbh h ILE 205 Ca -0.51 -0.39 0.00 0.00 1.55 0.00 0.00 64.86 65.52 3gbh h ILE 205 Cb 1.26 1.33 0.00 0.00 -0.27 0.00 0.00 36.82 39.13 3gbh h ILE 205 CO 0.62 0.00 0.00 0.44 -1.05 0.00 0.00 178.15 178.16 3gbh h ASP 206 N 0.00 0.00 0.14 2.16 3.32 -1.91 -1.45 116.42 118.68 3gbh h ASP 206 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gbh h ASP 206 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3gbh h ASP 206 CO 0.00 0.00 -0.17 0.47 -1.72 0.00 0.00 179.24 177.82 3gbh n ASP 207 N -3.03 1.26 0.00 6.45 8.00 0.32 -4.44 116.55 125.11 3gbh n ASP 207 Ca -0.02 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.34 3gbh n ASP 207 Cb 0.14 0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 3gbh n ASP 207 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3gbh n VAL 208 N -0.30 0.00 -4.02 2.53 0.24 -0.80 -5.04 118.33 110.94 3gbh n VAL 208 Ca 0.15 -0.06 -0.09 0.00 -2.04 0.00 0.00 64.34 62.30 3gbh n VAL 208 Cb 0.36 0.50 -0.11 0.00 -1.47 0.00 0.00 33.84 33.12 3gbh n VAL 208 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gbh s ARG 209 N -1.53 0.42 0.08 7.34 1.04 -0.61 -5.11 118.95 120.57 3gbh s ARG 209 Ca 0.00 -0.81 -0.06 0.00 -1.04 0.00 0.00 55.73 53.83 3gbh s ARG 209 Cb 0.00 0.09 -0.02 0.00 -2.04 0.00 0.00 34.95 32.99 3gbh s ARG 209 CO 0.00 -0.06 0.11 -1.83 -0.04 0.00 0.00 175.30 173.49 3gbh s GLU 210 N -2.19 0.77 -0.19 3.89 -1.05 -1.26 -4.67 118.70 114.00 3gbh s GLU 210 Ca -0.09 -1.06 -0.07 0.00 -0.15 0.00 0.00 54.97 53.60 3gbh s GLU 210 Cb -0.05 0.29 -0.04 0.00 -0.44 0.00 0.00 34.13 33.90 3gbh s GLU 210 CO -0.03 -0.21 0.06 -0.06 0.95 0.00 0.00 175.26 175.97 3gbh s PHE 211 N -3.89 3.24 0.00 4.83 0.08 -1.26 -5.25 117.98 115.73 3gbh s PHE 211 Ca 0.06 0.04 0.00 0.00 0.12 0.00 0.00 56.93 57.15 3gbh s PHE 211 Cb 0.06 -2.10 0.00 0.00 -0.57 0.00 0.00 43.02 40.41 3gbh s PHE 211 CO -0.10 0.11 0.45 1.28 -0.10 0.00 0.00 175.22 176.86