#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rbi s ILE 3 N 0.00 3.40 0.00 2.52 1.01 -1.26 -4.93 121.20 121.93 2rbi s ILE 3 Ca 0.00 -1.77 0.16 0.00 0.00 0.00 0.00 60.65 59.04 2rbi s ILE 3 Cb 0.00 -3.20 0.26 0.00 0.01 0.00 0.00 42.46 39.54 2rbi s ILE 3 CO 0.00 -0.52 1.08 -0.46 0.00 0.00 0.00 174.94 175.04 2rbi n ASN 4 N 4.66 0.51 -4.88 3.58 6.94 -1.26 -4.74 115.26 120.08 2rbi n ASN 4 Ca -0.06 -1.96 -0.28 0.00 -0.02 0.00 0.00 54.58 52.26 2rbi n ASN 4 Cb 0.42 -0.20 -0.04 0.00 -2.36 0.00 0.00 39.78 37.60 2rbi n ASN 4 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2rbi s THR 5 N 0.00 5.01 0.14 5.53 -4.23 -1.26 -0.04 115.64 120.79 2rbi s THR 5 Ca 0.21 -0.73 -0.23 0.00 -1.18 0.00 0.00 61.69 59.76 2rbi s THR 5 Cb 0.24 -3.52 0.01 0.00 1.34 0.00 0.00 72.50 70.57 2rbi s THR 5 CO -0.10 -0.01 1.63 -0.26 -0.54 0.00 0.00 174.62 175.34 2rbi h PHE 6 N 2.60 -0.67 -0.01 3.99 0.04 -1.98 0.51 116.94 121.42 2rbi h PHE 6 Ca -0.47 0.03 -0.20 0.00 2.80 0.00 0.00 57.97 60.13 2rbi h PHE 6 Cb 1.18 0.32 -0.01 0.00 2.20 0.00 0.00 35.95 39.65 2rbi h PHE 6 CO 0.57 -0.33 -0.85 -0.44 -0.60 0.00 0.00 178.31 176.66 2rbi h ASP 7 N -0.29 0.36 -0.10 2.17 3.32 -1.98 -1.99 116.42 117.90 2rbi h ASP 7 Ca 0.12 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 2rbi h ASP 7 Cb 0.47 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2rbi h ASP 7 CO -0.35 1.05 0.05 1.23 -1.72 0.00 0.00 179.24 179.51 2rbi h GLY 8 N 1.59 0.14 0.86 2.75 0.00 -1.86 -1.79 103.07 104.77 2rbi h GLY 8 Ca -0.05 -0.06 -0.08 0.00 0.00 0.00 0.00 47.33 47.13 2rbi h GLY 8 CO 0.14 0.06 -0.18 -2.08 0.00 0.00 0.00 176.54 174.48 2rbi h VAL 9 N 0.07 1.31 -0.88 4.60 2.07 -0.05 -2.46 116.25 120.92 2rbi h VAL 9 Ca 0.03 -1.32 0.07 0.00 0.82 0.00 0.00 66.70 66.31 2rbi h VAL 9 Cb 0.07 1.65 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 2rbi h VAL 9 CO -0.01 0.41 0.57 0.00 0.02 0.00 0.00 177.57 178.57 2rbi h ALA 10 N 0.69 1.56 -0.04 1.67 0.00 -1.36 0.17 119.26 121.93 2rbi h ALA 10 Ca 0.04 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.70 2rbi h ALA 10 Cb 0.72 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.27 2rbi h ALA 10 CO 0.05 0.30 -0.92 -0.44 0.00 0.00 0.00 179.25 178.24 2rbi h ASP 11 N 0.97 0.77 -0.39 0.00 3.32 -1.36 -2.07 116.42 117.66 2rbi h ASP 11 Ca 0.38 -0.57 -0.02 0.00 0.02 0.00 0.00 57.03 56.84 2rbi h ASP 11 Cb 0.24 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2rbi h ASP 11 CO -0.15 1.37 0.18 0.22 -1.72 0.00 0.00 179.24 179.14 2rbi h TYR 12 N 0.37 0.57 -0.80 4.55 5.03 -0.86 -1.61 116.97 124.22 2rbi h TYR 12 Ca -0.09 -0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.19 2rbi h TYR 12 Cb 1.55 -0.17 -0.04 0.00 1.55 0.00 0.00 36.73 39.62 2rbi h TYR 12 CO 0.08 0.48 0.49 -0.07 -1.32 0.00 0.00 178.16 177.82 2rbi h LEU 13 N 0.48 0.95 -0.07 2.82 3.38 -0.71 0.42 115.31 122.59 2rbi h LEU 13 Ca 0.13 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2rbi h LEU 13 Cb 0.14 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2rbi h LEU 13 CO -0.02 0.73 0.03 0.40 0.09 0.00 0.00 178.44 179.67 2rbi h ILE 14 N 1.09 1.13 0.11 1.22 1.08 -1.23 0.26 117.51 121.17 2rbi h ILE 14 Ca 0.29 -0.37 -0.01 0.00 -0.39 0.00 0.00 64.86 64.38 2rbi h ILE 14 Cb -0.06 1.25 0.00 0.00 -3.07 0.00 0.00 36.82 34.95 2rbi h ILE 14 CO -0.06 0.11 -0.05 -0.09 -0.69 0.00 0.00 178.15 177.37 2rbi h ARG 15 N -0.04 -0.15 0.00 2.37 2.43 -1.10 -3.36 114.38 114.54 2rbi h ARG 15 Ca 0.02 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2rbi h ARG 15 Cb 0.14 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2rbi h ARG 15 CO -0.00 0.21 -1.14 0.66 -1.51 0.00 0.00 179.97 178.18 2rbi n TYR 16 N -4.99 0.01 -1.69 2.20 4.01 0.14 -4.99 117.16 111.86 2rbi n TYR 16 Ca -0.09 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.51 2rbi n TYR 16 Cb 0.22 -0.10 -0.04 0.00 -0.31 0.00 0.00 39.34 39.11 2rbi n TYR 16 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2rbi n LYS 17 N -1.63 -1.05 -3.66 -0.72 4.76 0.90 -4.95 118.16 111.80 2rbi n LYS 17 Ca 0.03 0.91 -0.08 0.00 -2.87 0.00 0.00 58.31 56.30 2rbi n LYS 17 Cb 0.37 -5.09 -0.02 0.00 -1.84 0.00 0.00 35.03 28.45 2rbi n LYS 17 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2rbi s ARG 18 N -3.70 1.36 0.61 1.97 1.70 -1.25 -5.04 118.95 114.60 2rbi s ARG 18 Ca 0.00 -0.66 -0.18 0.00 -0.47 0.00 0.00 55.73 54.42 2rbi s ARG 18 Cb 0.00 0.52 -0.03 0.00 -0.57 0.00 0.00 34.95 34.88 2rbi s ARG 18 CO 0.00 -0.61 1.15 -0.51 -1.08 0.00 0.00 175.30 174.24 2rbi s LEU 19 N -2.81 3.58 1.17 -1.89 1.43 -1.26 -3.96 118.68 114.94 2rbi s LEU 19 Ca 0.08 2.19 -0.13 0.00 -1.03 0.00 0.00 54.13 55.23 2rbi s LEU 19 Cb -0.03 -4.58 0.29 0.00 0.03 0.00 0.00 46.19 41.90 2rbi s LEU 19 CO -0.02 -1.53 1.03 -2.84 0.23 0.00 0.00 176.35 173.22 2rbi s PRO 20 N -3.60 -0.98 0.57 1.29 0.02 -1.26 -4.91 135.00 126.12 2rbi s PRO 20 Ca 0.72 0.89 0.38 0.00 0.02 0.00 0.00 61.00 63.01 2rbi s PRO 20 Cb -0.25 -1.54 1.94 0.00 0.02 0.00 0.00 34.50 34.67 2rbi s PRO 20 CO 0.34 -3.78 2.14 -0.44 -0.33 0.00 0.00 177.00 174.94 2rbi h ASP 21 N -2.67 0.00 -0.05 2.53 3.32 -1.95 -2.89 116.42 114.71 2rbi h ASP 21 Ca -0.61 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.44 2rbi h ASP 21 Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 2rbi h ASP 21 CO 0.49 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.55 2rbi n ASN 22 N -2.90 0.51 -4.74 6.45 6.94 -1.26 -4.85 115.26 115.41 2rbi n ASN 22 Ca -0.02 -1.52 -0.35 0.00 -0.02 0.00 0.00 54.58 52.66 2rbi n ASN 22 Cb 0.12 -0.03 -0.08 0.00 -2.36 0.00 0.00 39.78 37.43 2rbi n ASN 22 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 2rbi s TYR 23 N -1.93 3.29 0.01 -2.53 2.02 -1.09 -0.90 117.35 116.20 2rbi s TYR 23 Ca 0.28 0.29 0.02 0.00 -0.37 0.00 0.00 57.07 57.29 2rbi s TYR 23 Cb 0.14 -1.83 -0.01 0.00 -0.40 0.00 0.00 41.96 39.86 2rbi s TYR 23 CO 0.22 0.55 -0.05 0.96 -1.57 0.00 0.00 175.55 175.66 2rbi s ILE 24 N -0.93 0.41 0.98 2.71 -4.36 -0.90 -4.92 121.20 114.19 2rbi s ILE 24 Ca 0.14 -0.42 -0.12 0.00 -0.26 0.00 0.00 60.65 59.98 2rbi s ILE 24 Cb -0.12 -0.39 0.18 0.00 1.25 0.00 0.00 42.46 43.39 2rbi s ILE 24 CO 0.03 -0.02 1.10 0.42 0.24 0.00 0.00 174.94 176.71 2rbi s THR 25 N -0.44 2.10 0.36 8.37 -4.23 -1.22 -1.81 115.64 118.77 2rbi s THR 25 Ca -0.01 0.03 0.06 0.00 -1.18 0.00 0.00 61.69 60.59 2rbi s THR 25 Cb -0.04 -2.57 0.16 0.00 1.34 0.00 0.00 72.50 71.39 2rbi s THR 25 CO -0.00 -0.04 1.89 0.11 -0.54 0.00 0.00 174.62 176.03 2rbi h LYS 26 N -1.81 0.41 -0.15 3.99 1.57 -1.97 -1.01 116.57 117.59 2rbi h LYS 26 Ca -0.54 -0.09 -0.16 0.00 -1.87 0.00 0.00 60.65 57.99 2rbi h LYS 26 Cb 1.33 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.57 2rbi h LYS 26 CO 0.58 0.48 -0.59 0.66 -0.57 0.00 0.00 179.45 180.02 2rbi h SER 27 N 0.39 0.54 -0.43 0.86 4.64 -1.98 0.11 113.55 117.67 2rbi h SER 27 Ca 0.08 -0.30 -0.13 0.00 -0.47 0.00 0.00 61.79 60.97 2rbi h SER 27 Cb 0.35 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2rbi h SER 27 CO 0.02 1.00 -0.24 -0.61 -0.87 0.00 0.00 176.83 176.12 2rbi h GLN 28 N 0.36 0.92 -0.47 4.77 5.75 -1.82 -0.08 115.11 124.54 2rbi h GLN 28 Ca -0.00 -0.42 -0.08 0.00 -0.15 0.00 0.00 58.65 58.00 2rbi h GLN 28 Cb 1.12 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.64 2rbi h GLN 28 CO 0.11 1.08 -0.03 0.00 -2.65 0.00 0.00 178.83 177.33 2rbi h ALA 29 N 0.82 0.63 -0.25 3.38 0.00 -0.76 -2.58 119.26 120.50 2rbi h ALA 29 Ca 0.09 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 2rbi h ALA 29 Cb 0.82 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2rbi h ALA 29 CO 0.07 0.46 -0.38 0.66 0.00 0.00 0.00 179.25 180.06 2rbi h SER 30 N 0.69 0.60 -0.13 0.00 4.64 -0.69 0.61 113.55 119.26 2rbi h SER 30 Ca 0.13 -0.26 -0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2rbi h SER 30 Cb 0.54 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2rbi h SER 30 CO 0.03 0.92 0.08 0.00 -0.87 0.00 0.00 176.83 176.99 2rbi h ALA 31 N 1.11 1.84 -0.00 5.18 0.00 -0.83 -0.70 119.26 125.86 2rbi h ALA 31 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2rbi h ALA 31 Cb 0.87 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2rbi h ALA 31 CO 0.07 0.13 -0.14 1.28 0.00 0.00 0.00 179.25 180.60 2rbi n LEU 32 N -4.49 0.16 0.00 0.00 4.77 -0.94 -4.91 117.00 111.60 2rbi n LEU 32 Ca -0.01 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 2rbi n LEU 32 Cb 0.10 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 2rbi n LEU 32 CO 0.35 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2rbi n GLY 33 N 1.48 0.89 3.75 -0.72 0.00 -0.27 -4.87 105.19 105.44 2rbi n GLY 33 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 2rbi n GLY 33 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2rbi s TRP 34 N -2.00 3.06 -0.13 1.61 -0.00 0.16 -4.97 118.94 116.67 2rbi s TRP 34 Ca 0.00 1.10 -0.00 0.00 -0.00 0.00 0.00 56.10 57.19 2rbi s TRP 34 Cb 0.00 -3.77 0.03 0.00 -0.00 0.00 0.00 33.47 29.73 2rbi s TRP 34 CO 0.00 -2.46 -0.08 0.08 -0.00 0.00 0.00 176.95 174.49 2rbi s VAL 35 N -0.10 1.12 0.13 5.86 1.01 -1.26 -4.41 120.40 122.75 2rbi s VAL 35 Ca 0.58 -0.43 -0.33 0.00 0.00 0.00 0.00 61.98 61.80 2rbi s VAL 35 Cb -0.41 -1.17 -0.10 0.00 0.00 0.00 0.00 36.38 34.70 2rbi s VAL 35 CO 0.43 0.31 1.55 0.00 0.00 0.00 0.00 175.10 177.39 2rbi h ALA 36 N 8.14 -0.76 0.00 5.51 0.00 -1.99 0.79 119.26 130.95 2rbi h ALA 36 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2rbi h ALA 36 Cb 1.13 1.12 0.00 0.00 0.00 0.00 0.00 17.79 20.04 2rbi h ALA 36 CO 0.42 -1.04 0.12 0.66 0.00 0.00 0.00 179.25 179.40 2rbi h SER 37 N -0.39 0.00 0.30 0.00 4.64 -2.03 0.43 113.55 116.50 2rbi h SER 37 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2rbi h SER 37 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2rbi h SER 37 CO -0.61 0.00 -1.58 0.29 -0.87 0.00 0.00 176.83 174.06 2rbi n LYS 38 N -2.53 0.56 -3.87 4.77 5.02 0.18 -4.96 118.16 117.34 2rbi n LYS 38 Ca -0.02 -0.08 -0.27 0.00 -2.02 0.00 0.00 58.31 55.92 2rbi n LYS 38 Cb 0.16 -1.60 0.02 0.00 -0.02 0.00 0.00 35.03 33.58 2rbi n LYS 38 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rbi n GLY 39 N 1.27 -0.37 1.04 0.72 0.00 0.15 -4.86 105.19 103.15 2rbi n GLY 39 Ca -0.02 0.16 0.10 0.00 0.00 0.00 0.00 46.02 46.25 2rbi n GLY 39 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2rbi n ASN 40 N -2.93 3.39 -0.30 1.61 6.94 -1.25 -4.03 115.26 118.70 2rbi n ASN 40 Ca -0.15 -1.96 0.12 0.00 -0.02 0.00 0.00 54.58 52.58 2rbi n ASN 40 Cb 0.61 -0.31 0.29 0.00 -2.36 0.00 0.00 39.78 38.01 2rbi n ASN 40 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2rbi h LEU 41 N 3.63 0.27 -1.32 -4.53 5.85 -1.85 0.15 115.31 117.51 2rbi h LEU 41 Ca 0.00 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2rbi h LEU 41 Cb 0.89 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 2rbi h LEU 41 CO 0.00 -0.02 -0.08 0.00 -0.34 0.00 0.00 178.44 178.00 2rbi h ALA 42 N 1.71 1.02 0.03 1.25 0.00 -1.82 -1.29 119.26 120.15 2rbi h ALA 42 Ca 0.55 -0.07 -0.27 0.00 0.00 0.00 0.00 54.91 55.12 2rbi h ALA 42 Cb 1.03 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.83 2rbi h ALA 42 CO -0.54 0.10 -1.07 0.93 0.00 0.00 0.00 179.25 178.67 2rbi h GLU 43 N 0.00 0.61 0.00 0.00 5.08 -1.06 -3.07 114.58 116.13 2rbi h GLU 43 Ca -0.00 -0.69 -0.07 0.00 -1.00 0.00 0.00 59.36 57.60 2rbi h GLU 43 Cb 0.60 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2rbi h GLU 43 CO 0.01 1.29 -0.98 -0.39 -1.00 0.00 0.00 179.01 177.93 2rbi h VAL 44 N 0.32 0.26 -1.15 3.13 -1.51 -1.42 -3.41 116.25 112.46 2rbi h VAL 44 Ca -0.13 -1.46 -0.41 0.00 -1.23 0.00 0.00 66.70 63.47 2rbi h VAL 44 Cb 1.73 1.83 -0.29 0.00 -2.13 0.00 0.00 31.29 32.43 2rbi h VAL 44 CO 0.20 0.15 -0.85 0.00 -1.23 0.00 0.00 177.57 175.84 2rbi n ALA 45 N -2.25 0.80 -1.67 5.19 0.00 -0.49 -4.92 120.51 117.17 2rbi n ALA 45 Ca -0.03 -2.56 -0.46 0.00 0.00 0.00 0.00 53.44 50.39 2rbi n ALA 45 Cb 0.67 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.04 2rbi n ALA 45 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2rbi n PRO 46 N 1.43 2.14 -0.82 0.00 -0.04 -1.16 -1.86 135.00 134.68 2rbi n PRO 46 Ca 0.16 0.77 0.00 0.00 -0.04 0.00 0.00 63.50 64.39 2rbi n PRO 46 Cb 0.58 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 2rbi n PRO 46 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rbi n GLY 47 N 3.49 0.74 3.80 0.55 0.00 -1.26 -5.03 105.19 107.47 2rbi n GLY 47 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 2rbi n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rbi s LYS 48 N -0.18 2.86 0.06 1.61 -0.14 -0.78 -4.77 119.74 118.41 2rbi s LYS 48 Ca 0.00 -1.00 0.04 0.00 -1.36 0.00 0.00 55.97 53.65 2rbi s LYS 48 Cb 0.00 -2.57 -0.03 0.00 -1.68 0.00 0.00 37.83 33.55 2rbi s LYS 48 CO 0.00 0.44 -0.11 -1.12 -0.76 0.00 0.00 175.35 173.80 2rbi s SER 49 N -3.48 1.26 0.20 2.83 0.01 -0.08 -4.84 113.70 109.60 2rbi s SER 49 Ca 0.32 -0.61 -0.28 0.00 1.31 0.00 0.00 55.95 56.68 2rbi s SER 49 Cb -0.09 -0.00 -0.08 0.00 0.21 0.00 0.00 66.02 66.06 2rbi s SER 49 CO 0.24 -0.16 0.88 -0.63 0.41 0.00 0.00 173.24 173.97 2rbi s ILE 50 N -1.49 4.23 -0.28 1.44 1.01 -1.26 -2.11 121.20 122.74 2rbi s ILE 50 Ca -0.05 1.94 -0.35 0.00 0.00 0.00 0.00 60.65 62.19 2rbi s ILE 50 Cb -0.09 -4.26 0.17 0.00 0.01 0.00 0.00 42.46 38.29 2rbi s ILE 50 CO 0.01 0.49 1.36 -0.83 0.00 0.00 0.00 174.94 175.97 2rbi s GLY 51 N -1.02 -0.11 0.00 6.18 0.00 -0.75 -1.67 107.32 109.95 2rbi s GLY 51 Ca 0.40 2.21 0.00 0.00 0.00 0.00 0.00 44.72 47.33 2rbi s GLY 51 CO 0.30 0.79 0.00 0.61 0.00 0.00 0.00 173.10 174.80 2rbi n GLY 52 N 0.16 0.85 3.85 0.20 0.00 0.96 -3.37 105.19 107.84 2rbi n GLY 52 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2rbi n GLY 52 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2rbi s ASP 53 N -1.63 6.56 0.34 1.61 1.01 -1.23 -4.79 116.67 118.53 2rbi s ASP 53 Ca 0.00 1.54 -0.28 0.00 0.71 0.00 0.00 52.55 54.52 2rbi s ASP 53 Cb 0.00 -2.50 -0.10 0.00 1.01 0.00 0.00 42.92 41.33 2rbi s ASP 53 CO 0.00 -0.63 1.29 -0.69 0.21 0.00 0.00 175.17 175.35 2rbi s VAL 54 N -2.71 2.78 -0.23 -1.27 1.01 -1.26 -1.48 120.40 117.24 2rbi s VAL 54 Ca 0.58 0.77 -0.05 0.00 0.00 0.00 0.00 61.98 63.28 2rbi s VAL 54 Cb -0.10 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 2rbi s VAL 54 CO 0.35 0.18 0.00 0.12 0.00 0.00 0.00 175.10 175.75 2rbi s PHE 55 N -1.16 3.01 0.29 5.22 5.36 0.63 -4.80 117.98 126.52 2rbi s PHE 55 Ca 0.49 -0.70 0.12 0.00 -0.96 0.00 0.00 56.93 55.88 2rbi s PHE 55 Cb -0.39 -2.15 0.47 0.00 -0.34 0.00 0.00 43.02 40.62 2rbi s PHE 55 CO 0.51 -0.45 1.67 0.66 -1.46 0.00 0.00 175.22 176.16 2rbi h SER 56 N 8.08 0.00 -2.41 6.13 4.64 -1.96 -3.38 113.55 124.65 2rbi h SER 56 Ca -0.40 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 60.61 2rbi h SER 56 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2rbi h SER 56 CO 0.59 0.54 -0.41 -3.20 -0.87 0.00 0.00 176.83 173.49 2rbi n ASN 57 N -3.84 -4.73 -0.20 4.97 5.15 -1.26 -4.88 115.26 110.47 2rbi n ASN 57 Ca -0.01 -0.04 0.04 0.00 -0.60 0.00 0.00 54.58 53.96 2rbi n ASN 57 Cb 0.56 -3.82 0.30 0.00 -0.53 0.00 0.00 39.78 36.29 2rbi n ASN 57 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 2rbi h ARG 58 N -0.16 0.86 0.00 1.20 2.43 -1.99 -1.66 114.38 115.06 2rbi h ARG 58 Ca -0.38 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 2rbi h ARG 58 Cb 1.27 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2rbi h ARG 58 CO 0.44 0.57 0.00 0.39 -1.51 0.00 0.00 179.97 179.85 2rbi n GLU 59 N -4.46 0.01 -1.13 0.20 4.71 -1.26 -4.95 120.64 113.77 2rbi n GLU 59 Ca 0.10 0.12 -0.04 0.00 -0.01 0.00 0.00 57.16 57.32 2rbi n GLU 59 Cb 0.13 -1.52 -0.02 0.00 -1.01 0.00 0.00 31.44 29.03 2rbi n GLU 59 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2rbi n GLY 60 N 0.82 0.66 0.09 0.62 0.00 -0.63 -4.92 105.19 101.82 2rbi n GLY 60 Ca 0.05 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 45.91 2rbi n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rbi n ARG 61 N -1.91 0.16 -4.30 1.61 1.74 -1.26 -4.70 116.66 108.01 2rbi n ARG 61 Ca -0.04 0.27 -0.26 0.00 -0.77 0.00 0.00 57.85 57.05 2rbi n ARG 61 Cb 0.26 -1.75 -0.09 0.00 -1.02 0.00 0.00 32.46 29.87 2rbi n ARG 61 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2rbi s LEU 62 N -4.09 2.98 0.20 0.55 1.43 -1.26 -4.93 118.68 113.55 2rbi s LEU 62 Ca 0.08 -0.60 -0.32 0.00 -1.03 0.00 0.00 54.13 52.26 2rbi s LEU 62 Cb 0.12 -1.64 -0.12 0.00 0.03 0.00 0.00 46.19 44.58 2rbi s LEU 62 CO 0.46 0.09 1.71 -2.16 0.23 0.00 0.00 176.35 176.68 2rbi s PRO 63 N -2.93 4.13 0.05 1.29 0.04 -1.26 -5.00 135.00 131.32 2rbi s PRO 63 Ca 0.26 2.58 0.01 0.00 0.04 0.00 0.00 61.00 63.89 2rbi s PRO 63 Cb -0.08 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.30 2rbi s PRO 63 CO 0.16 -0.74 0.11 -1.12 0.04 0.00 0.00 177.00 175.44 2rbi s SER 64 N 1.28 5.75 0.23 6.66 0.01 -1.26 -5.05 113.70 121.32 2rbi s SER 64 Ca 0.75 0.10 -0.22 0.00 1.31 0.00 0.00 55.95 57.89 2rbi s SER 64 Cb -0.49 -1.63 0.04 0.00 0.21 0.00 0.00 66.02 64.15 2rbi s SER 64 CO 0.32 0.21 0.74 0.00 0.41 0.00 0.00 173.24 174.92 2rbi s ALA 65 N -1.34 -1.37 -0.11 1.44 0.00 -1.26 -5.08 121.76 114.03 2rbi s ALA 65 Ca 0.28 -0.07 -0.30 0.00 0.00 0.00 0.00 51.96 51.88 2rbi s ALA 65 Cb -0.12 0.81 -0.01 0.00 0.00 0.00 0.00 23.12 23.79 2rbi s ALA 65 CO 0.20 -0.98 1.04 0.45 0.00 0.00 0.00 175.76 176.47 2rbi s SER 66 N -2.88 7.20 0.00 0.00 0.15 -1.26 -2.33 113.70 114.58 2rbi s SER 66 Ca 0.09 1.56 0.00 0.00 0.70 0.00 0.00 55.95 58.30 2rbi s SER 66 Cb -0.04 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2rbi s SER 66 CO 0.02 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 174.59 2rbi n GLY 67 N 3.15 1.14 3.66 9.45 0.00 -1.26 -4.98 105.19 116.35 2rbi n GLY 67 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2rbi n GLY 67 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2rbi s ARG 68 N -0.09 4.25 -0.05 1.61 3.52 -0.99 -4.87 118.95 122.33 2rbi s ARG 68 Ca 0.00 0.99 0.04 0.00 -0.13 0.00 0.00 55.73 56.64 2rbi s ARG 68 Cb 0.00 -3.60 -0.02 0.00 -1.56 0.00 0.00 34.95 29.76 2rbi s ARG 68 CO 0.00 -0.41 -0.18 0.99 -0.81 0.00 0.00 175.30 174.89 2rbi s THR 69 N 2.46 2.76 -0.03 4.11 2.01 -1.26 -4.71 115.64 120.99 2rbi s THR 69 Ca 0.37 -0.83 0.02 0.00 0.31 0.00 0.00 61.69 61.57 2rbi s THR 69 Cb -0.16 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 70.26 2rbi s THR 69 CO 0.10 0.58 -0.08 0.26 -0.69 0.00 0.00 174.62 174.79 2rbi s TRP 70 N -0.56 2.88 0.29 4.92 0.52 -1.26 0.61 118.94 126.35 2rbi s TRP 70 Ca 0.08 -0.03 0.05 0.00 0.02 0.00 0.00 56.10 56.22 2rbi s TRP 70 Cb -0.11 -1.65 -0.06 0.00 -1.15 0.00 0.00 33.47 30.50 2rbi s TRP 70 CO 0.01 0.34 0.00 1.03 0.02 0.00 0.00 176.95 178.35 2rbi s ARG 71 N -1.11 1.56 0.10 4.98 0.52 -0.37 -0.27 118.95 124.36 2rbi s ARG 71 Ca 0.15 -1.82 -0.05 0.00 -0.52 0.00 0.00 55.73 53.49 2rbi s ARG 71 Cb -0.11 -0.95 -0.02 0.00 0.52 0.00 0.00 34.95 34.39 2rbi s ARG 71 CO 0.04 -0.08 0.11 -1.83 0.02 0.00 0.00 175.30 173.56 2rbi s GLU 72 N -3.82 0.84 -0.15 3.54 -1.05 -0.55 -1.33 118.70 116.18 2rbi s GLU 72 Ca 0.32 -1.17 -0.14 0.00 -0.15 0.00 0.00 54.97 53.83 2rbi s GLU 72 Cb 0.06 0.29 0.04 0.00 -0.44 0.00 0.00 34.13 34.08 2rbi s GLU 72 CO 0.13 -0.24 0.40 0.00 0.95 0.00 0.00 175.26 176.50 2rbi s ALA 73 N -3.93 -0.99 0.15 -0.84 0.00 -0.38 -0.03 121.76 115.74 2rbi s ALA 73 Ca 0.11 1.12 -0.30 0.00 0.00 0.00 0.00 51.96 52.90 2rbi s ALA 73 Cb 0.06 -0.65 -0.07 0.00 0.00 0.00 0.00 23.12 22.46 2rbi s ALA 73 CO -0.06 -0.19 1.14 -0.51 0.00 0.00 0.00 175.76 176.14 2rbi s ASP 74 N 0.21 7.19 0.03 0.00 1.11 -0.67 -1.33 116.67 123.21 2rbi s ASP 74 Ca -0.00 2.10 0.06 0.00 0.18 0.00 0.00 52.55 54.90 2rbi s ASP 74 Cb -0.03 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.33 2rbi s ASP 74 CO 0.01 -0.30 -0.16 -0.63 1.18 0.00 0.00 175.17 175.26 2rbi s ILE 75 N 0.07 2.93 -1.20 0.77 -1.09 -0.55 -4.66 121.20 117.47 2rbi s ILE 75 Ca 0.52 -1.09 0.00 0.00 -2.23 0.00 0.00 60.65 57.85 2rbi s ILE 75 Cb -0.30 -2.23 0.00 0.00 -1.58 0.00 0.00 42.46 38.35 2rbi s ILE 75 CO 0.34 0.37 0.00 0.59 -1.23 0.00 0.00 174.94 175.01 2rbi n ASN 76 N 1.61 -5.04 -4.74 3.58 3.02 0.94 -4.52 115.26 110.11 2rbi n ASN 76 Ca -0.16 0.28 -0.41 0.00 -0.03 0.00 0.00 54.58 54.26 2rbi n ASN 76 Cb 0.52 -3.53 -0.04 0.00 -0.61 0.00 0.00 39.78 36.12 2rbi n ASN 76 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2rbi s TYR 77 N -2.19 3.58 0.04 3.10 6.14 -1.26 -4.89 117.35 121.87 2rbi s TYR 77 Ca 0.00 1.62 0.00 0.00 0.64 0.00 0.00 57.07 59.33 2rbi s TYR 77 Cb 0.00 -3.29 0.00 0.00 0.42 0.00 0.00 41.96 39.09 2rbi s TYR 77 CO 0.00 -0.62 0.00 0.28 0.64 0.00 0.00 175.55 175.85 2rbi n VAL 78 N 2.03 0.22 -3.63 3.14 0.31 -1.26 -4.93 118.33 114.21 2rbi n VAL 78 Ca 0.02 0.07 -0.04 0.00 -0.01 0.00 0.00 64.34 64.38 2rbi n VAL 78 Cb 0.46 -1.24 -0.01 0.00 -0.91 0.00 0.00 33.84 32.13 2rbi n VAL 78 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2rbi s SER 79 N -5.18 -0.19 0.00 4.52 1.04 -1.26 -4.79 113.70 107.85 2rbi s SER 79 Ca 0.00 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.26 2rbi s SER 79 Cb 0.00 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.44 2rbi s SER 79 CO 0.00 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.26 2rbi n GLY 80 N -0.35 -1.65 3.65 7.32 0.00 -1.26 -4.92 105.19 107.98 2rbi n GLY 80 Ca -0.06 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.03 2rbi n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2rbi s PHE 81 N 0.00 1.73 0.45 1.61 0.40 -1.26 -4.53 117.98 116.38 2rbi s PHE 81 Ca 0.00 1.62 -0.22 0.00 -0.60 0.00 0.00 56.93 57.73 2rbi s PHE 81 Cb 0.00 -3.25 -0.09 0.00 0.51 0.00 0.00 43.02 40.19 2rbi s PHE 81 CO 0.00 -2.86 1.04 1.03 0.70 0.00 0.00 175.22 175.13 2rbi s ARG 82 N -4.67 3.95 0.00 0.44 0.52 -1.26 -4.97 118.95 112.96 2rbi s ARG 82 Ca 0.66 1.42 0.00 0.00 -0.52 0.00 0.00 55.73 57.29 2rbi s ARG 82 Cb -0.22 -2.27 0.00 0.00 0.52 0.00 0.00 34.95 32.98 2rbi s ARG 82 CO 0.59 -0.31 0.00 0.27 0.02 0.00 0.00 175.30 175.87 2rbi n ASN 83 N -0.61 0.00 -0.77 0.23 0.23 -1.26 -5.05 115.26 108.04 2rbi n ASN 83 Ca 0.08 -0.66 0.08 0.00 -0.53 0.00 0.00 54.58 53.54 2rbi n ASN 83 Cb 0.51 0.00 0.14 0.00 -2.08 0.00 0.00 39.78 38.35 2rbi n ASN 83 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2rbi n ALA 84 N -3.00 2.37 -2.67 -2.53 0.00 -1.26 -4.97 120.51 108.44 2rbi n ALA 84 Ca 0.00 -0.90 -0.40 0.00 0.00 0.00 0.00 53.44 52.14 2rbi n ALA 84 Cb 0.00 -0.58 -0.06 0.00 0.00 0.00 0.00 19.45 18.82 2rbi n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2rbi s ASP 85 N -1.17 6.74 0.06 0.00 1.01 -1.26 -2.91 116.67 119.14 2rbi s ASP 85 Ca 0.25 0.90 0.01 0.00 0.71 0.00 0.00 52.55 54.42 2rbi s ASP 85 Cb 0.15 -2.36 -0.03 0.00 1.01 0.00 0.00 42.92 41.69 2rbi s ASP 85 CO 0.21 -0.23 -0.05 -0.13 0.21 0.00 0.00 175.17 175.17 2rbi s ARG 86 N 1.65 0.62 -0.18 8.23 1.81 -0.07 -1.48 118.95 129.53 2rbi s ARG 86 Ca 0.30 -1.06 -0.01 0.00 -1.72 0.00 0.00 55.73 53.24 2rbi s ARG 86 Cb -0.16 -0.06 -0.00 0.00 -0.45 0.00 0.00 34.95 34.28 2rbi s ARG 86 CO 0.11 -0.03 -0.12 -1.17 -0.68 0.00 0.00 175.30 173.41 2rbi s LEU 87 N -2.44 2.59 -0.23 2.53 0.20 -0.44 -1.64 118.68 119.25 2rbi s LEU 87 Ca 0.01 -0.46 -0.01 0.00 0.69 0.00 0.00 54.13 54.36 2rbi s LEU 87 Cb 0.00 -1.62 0.02 0.00 -0.43 0.00 0.00 46.19 44.17 2rbi s LEU 87 CO -0.05 0.03 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.26 2rbi s VAL 88 N 1.14 2.64 0.05 1.68 1.01 -0.48 -1.25 120.40 125.19 2rbi s VAL 88 Ca 0.01 -1.00 0.08 0.00 0.00 0.00 0.00 61.98 61.07 2rbi s VAL 88 Cb -0.14 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 2rbi s VAL 88 CO -0.04 0.29 -0.24 -0.72 0.00 0.00 0.00 175.10 174.40 2rbi s TYR 89 N 1.31 2.06 0.46 5.22 1.13 -0.44 -1.63 117.35 125.46 2rbi s TYR 89 Ca 0.01 -0.39 0.05 0.00 -1.41 0.00 0.00 57.07 55.33 2rbi s TYR 89 Cb -0.16 -1.22 0.02 0.00 -1.10 0.00 0.00 41.96 39.50 2rbi s TYR 89 CO -0.07 0.13 0.64 -1.54 -2.51 0.00 0.00 175.55 172.20 2rbi s SER 90 N -1.30 5.54 0.50 -0.18 1.04 0.06 -1.24 113.70 118.13 2rbi s SER 90 Ca 0.10 -0.24 0.20 0.00 0.48 0.00 0.00 55.95 56.49 2rbi s SER 90 Cb -0.09 -0.79 1.29 0.00 0.10 0.00 0.00 66.02 66.53 2rbi s SER 90 CO 0.02 -0.88 2.08 0.77 0.98 0.00 0.00 173.24 176.22 2rbi h SER 91 N 0.44 0.00 -0.55 7.02 4.64 -0.16 -2.23 113.55 122.71 2rbi h SER 91 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2rbi h SER 91 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2rbi h SER 91 CO 0.48 0.10 0.00 -0.90 -0.87 0.00 0.00 176.83 175.65 2rbi n ASP 92 N -4.13 4.62 -1.53 4.97 5.75 -1.26 -4.96 116.55 120.02 2rbi n ASP 92 Ca -0.03 -2.56 -0.15 0.00 -0.01 0.00 0.00 54.79 52.05 2rbi n ASP 92 Cb 0.19 -0.59 -0.02 0.00 -1.03 0.00 0.00 41.12 39.66 2rbi n ASP 92 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2rbi n TRP 93 N 0.81 -0.51 -2.69 2.11 7.02 -0.84 -5.03 117.44 118.32 2rbi n TRP 93 Ca 0.23 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.29 2rbi n TRP 93 Cb 0.91 -2.96 -0.03 0.00 -2.42 0.00 0.00 31.31 26.82 2rbi n TRP 93 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2rbi s LEU 94 N -3.98 4.34 -0.15 -0.99 1.43 -1.26 -4.83 118.68 113.24 2rbi s LEU 94 Ca 0.00 1.65 0.01 0.00 -1.03 0.00 0.00 54.13 54.76 2rbi s LEU 94 Cb 0.00 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.67 2rbi s LEU 94 CO 0.00 -0.31 -0.16 -0.63 0.23 0.00 0.00 176.35 175.48 2rbi s ILE 95 N 1.24 1.68 0.20 -0.59 1.01 -1.26 -0.76 121.20 122.72 2rbi s ILE 95 Ca 0.52 -0.72 0.11 0.00 0.00 0.00 0.00 60.65 60.56 2rbi s ILE 95 Cb -0.21 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 2rbi s ILE 95 CO 0.26 0.48 -0.21 -0.31 0.00 0.00 0.00 174.94 175.15 2rbi s TYR 96 N 1.31 2.36 0.24 3.97 1.51 -0.65 -0.32 117.35 125.77 2rbi s TYR 96 Ca 0.02 -0.33 0.11 0.00 -1.01 0.00 0.00 57.07 55.85 2rbi s TYR 96 Cb -0.13 -1.15 -0.05 0.00 -0.11 0.00 0.00 41.96 40.52 2rbi s TYR 96 CO -0.09 0.52 -0.20 -1.59 -1.11 0.00 0.00 175.55 173.09 2rbi s LYS 97 N -2.76 1.56 -0.08 -0.62 -2.85 -0.52 -1.38 119.74 113.09 2rbi s LYS 97 Ca 0.22 -1.67 -0.06 0.00 -1.00 0.00 0.00 55.97 53.46 2rbi s LYS 97 Cb -0.08 -1.64 0.03 0.00 -2.06 0.00 0.00 37.83 34.08 2rbi s LYS 97 CO 0.11 0.31 0.19 -0.08 0.10 0.00 0.00 175.35 175.99 2rbi s THR 98 N -2.41 -0.01 -0.03 3.79 -1.32 -0.65 -1.16 115.64 113.84 2rbi s THR 98 Ca 0.26 0.05 0.04 0.00 -1.21 0.00 0.00 61.69 60.83 2rbi s THR 98 Cb -0.05 -0.28 0.06 0.00 -1.51 0.00 0.00 72.50 70.72 2rbi s THR 98 CO 0.12 0.02 0.91 0.35 -2.21 0.00 0.00 174.62 173.81 2rbi n THR 99 N 3.33 0.83 -2.46 5.08 -2.24 -1.25 -0.89 114.28 116.68 2rbi n THR 99 Ca -0.16 -0.91 0.00 0.00 -2.27 0.00 0.00 64.05 60.71 2rbi n THR 99 Cb 0.57 0.46 0.05 0.00 -2.10 0.00 0.00 70.33 69.32 2rbi n THR 99 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2rbi n ASP 100 N -0.52 1.64 -3.40 3.42 5.75 -1.22 -4.65 116.55 117.57 2rbi n ASP 100 Ca 0.03 -2.40 -0.19 0.00 -0.01 0.00 0.00 54.79 52.22 2rbi n ASP 100 Cb 0.45 -0.39 0.07 0.00 -1.03 0.00 0.00 41.12 40.21 2rbi n ASP 100 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2rbi n ASN 101 N -0.18 -5.13 -1.17 -1.12 4.05 -1.15 -2.92 115.26 107.65 2rbi n ASN 101 Ca 0.11 -0.76 -0.13 0.00 0.45 0.00 0.00 54.58 54.26 2rbi n ASN 101 Cb 0.96 -4.77 -0.05 0.00 1.23 0.00 0.00 39.78 37.14 2rbi n ASN 101 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 2rbi n TYR 102 N -3.64 -0.20 0.16 1.20 4.02 -1.26 -4.86 117.16 112.57 2rbi n TYR 102 Ca -0.13 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.64 2rbi n TYR 102 Cb 0.63 -2.62 -0.07 0.00 -0.02 0.00 0.00 39.34 37.26 2rbi n TYR 102 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2rbi h ALA 103 N 0.41 -0.45 -3.70 -0.72 0.00 -1.96 -3.46 119.26 109.38 2rbi h ALA 103 Ca -0.26 -0.19 -0.52 0.00 0.00 0.00 0.00 54.91 53.94 2rbi h ALA 103 Cb 0.97 0.17 -0.23 0.00 0.00 0.00 0.00 17.79 18.70 2rbi h ALA 103 CO 0.38 -0.52 -0.82 0.95 0.00 0.00 0.00 179.25 179.24 2rbi s THR 104 N -4.11 1.52 0.07 0.00 -4.23 -1.26 -5.10 115.64 102.53 2rbi s THR 104 Ca -0.13 -1.37 0.07 0.00 -1.18 0.00 0.00 61.69 59.07 2rbi s THR 104 Cb 0.01 -1.38 -0.03 0.00 1.34 0.00 0.00 72.50 72.44 2rbi s THR 104 CO 0.46 -0.04 -0.18 -0.36 -0.54 0.00 0.00 174.62 173.97 2rbi s PHE 105 N -1.08 1.55 -0.12 3.99 0.40 -1.26 -4.43 117.98 117.03 2rbi s PHE 105 Ca 0.04 -0.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.98 2rbi s PHE 105 Cb -0.10 -0.89 0.02 0.00 0.51 0.00 0.00 43.02 42.57 2rbi s PHE 105 CO 0.03 0.11 -0.12 0.99 0.70 0.00 0.00 175.22 176.93 2rbi s THR 106 N -1.03 1.33 0.28 0.64 2.01 -0.31 -4.94 115.64 113.61 2rbi s THR 106 Ca 0.04 -0.50 -0.30 0.00 0.31 0.00 0.00 61.69 61.24 2rbi s THR 106 Cb -0.09 -1.27 -0.10 0.00 0.01 0.00 0.00 72.50 71.05 2rbi s THR 106 CO 0.03 0.41 1.47 -0.60 -0.69 0.00 0.00 174.62 175.24 2rbi s ARG 107 N 1.41 4.23 0.00 4.92 3.52 -1.26 -1.44 118.95 130.33 2rbi s ARG 107 Ca 0.01 2.38 0.00 0.00 -0.13 0.00 0.00 55.73 57.99 2rbi s ARG 107 Cb -0.13 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.18 2rbi s ARG 107 CO -0.07 -0.46 0.00 0.44 -0.81 0.00 0.00 175.30 174.40 2rbi n ILE 108 N 2.02 0.00 -1.69 4.11 -5.35 0.56 -4.90 119.36 114.11 2rbi n ILE 108 Ca 0.06 -0.15 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 2rbi n ILE 108 Cb 0.40 0.63 0.00 0.00 -1.74 0.00 0.00 39.64 38.93 2rbi n ILE 108 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33