#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 4.51 -0.03 1.55 1.01 -1.26 -4.90 121.20 122.08 2rbi s ILE 3 Ca 0.00 -1.88 0.13 0.00 0.00 0.00 0.00 60.65 58.90 2rbi s ILE 3 Cb 0.00 -3.93 0.23 0.00 0.01 0.00 0.00 42.46 38.77 2rbi s ILE 3 CO 0.00 -0.83 1.10 -0.46 0.00 0.00 0.00 174.94 174.75 2rbi n ASN 4 N 4.78 0.74 -4.89 3.58 6.94 -1.26 -4.72 115.26 120.43 2rbi n ASN 4 Ca -0.06 -2.24 -0.21 0.00 -0.02 0.00 0.00 54.58 52.05 2rbi n ASN 4 Cb 0.41 -0.29 -0.03 0.00 -2.36 0.00 0.00 39.78 37.51 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 -0.49 4.49 0.18 5.53 -4.23 -1.26 0.07 115.64 119.94 2rbi s THR 5 Ca 0.20 -1.24 -0.13 0.00 -1.18 0.00 0.00 61.69 59.34 2rbi s THR 5 Cb 0.21 -3.50 0.09 0.00 1.34 0.00 0.00 72.50 70.64 2rbi s THR 5 CO -0.07 -0.30 1.75 -0.26 -0.54 0.00 0.00 174.62 175.20 2rbi h PHE 6 N 1.30 0.33 -0.11 3.99 0.04 -1.98 -0.46 116.94 120.04 2rbi h PHE 6 Ca -0.49 0.02 -0.15 0.00 2.80 0.00 0.00 57.97 60.15 2rbi h PHE 6 Cb 1.24 -0.07 0.01 0.00 2.20 0.00 0.00 35.95 39.32 2rbi h PHE 6 CO 0.51 0.11 -0.53 -0.44 -0.60 0.00 0.00 178.31 177.36 2rbi h ASP 7 N 0.37 0.66 -0.22 2.17 3.32 -1.98 -1.24 116.42 119.49 2rbi h ASP 7 Ca 0.24 -0.64 0.02 0.00 0.02 0.00 0.00 57.03 56.66 2rbi h ASP 7 Cb 0.24 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2rbi h ASP 7 CO -0.23 1.19 0.10 1.23 -1.72 0.00 0.00 179.24 179.81 2rbi h GLY 8 N 0.16 0.29 0.73 2.75 0.00 -1.91 -1.44 103.07 103.65 2rbi h GLY 8 Ca -0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 2rbi h GLY 8 CO 0.11 0.05 -0.07 -2.08 0.00 0.00 0.00 176.54 174.56 2rbi h VAL 9 N 0.22 1.32 -0.70 4.60 2.07 -1.18 -1.84 116.25 120.73 2rbi h VAL 9 Ca 0.09 -1.11 0.09 0.00 0.82 0.00 0.00 66.70 66.60 2rbi h VAL 9 Cb 0.04 1.78 -0.07 0.00 -1.52 0.00 0.00 31.29 31.51 2rbi h VAL 9 CO -0.07 0.32 0.35 0.00 0.02 0.00 0.00 177.57 178.19 2rbi h ALA 10 N 0.65 0.97 -0.16 1.67 0.00 -1.15 0.27 119.26 121.52 2rbi h ALA 10 Ca 0.03 0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 2rbi h ALA 10 Cb 0.53 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2rbi h ALA 10 CO 0.02 -0.05 -0.58 -0.44 0.00 0.00 0.00 179.25 178.21 2rbi h ASP 11 N 0.60 0.56 -0.54 0.00 3.32 -1.26 -2.01 116.42 117.09 2rbi h ASP 11 Ca 0.35 -0.31 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 2rbi h ASP 11 Cb 0.36 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2rbi h ASP 11 CO -0.26 1.01 0.08 0.22 -1.72 0.00 0.00 179.24 178.57 2rbi h TYR 12 N 0.38 0.95 -0.21 4.55 5.03 -0.84 -1.44 116.97 125.38 2rbi h TYR 12 Ca 0.00 -0.14 0.04 0.00 2.58 0.00 0.00 58.73 61.21 2rbi h TYR 12 Cb 1.12 -0.26 -0.04 0.00 1.55 0.00 0.00 36.73 39.10 2rbi h TYR 12 CO 0.04 0.85 -0.02 -0.07 -1.32 0.00 0.00 178.16 177.64 2rbi h LEU 13 N 0.78 -0.13 -0.33 2.82 3.38 -0.89 0.43 115.31 121.37 2rbi h LEU 13 Ca 0.16 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 2rbi h LEU 13 Cb 0.42 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2rbi h LEU 13 CO 0.01 -0.04 0.19 0.40 0.09 0.00 0.00 178.44 179.10 2rbi h ILE 14 N 0.04 1.13 -0.07 1.22 1.08 -1.21 0.34 117.51 120.03 2rbi h ILE 14 Ca 0.10 -0.31 -0.07 0.00 -0.39 0.00 0.00 64.86 64.19 2rbi h ILE 14 Cb 0.14 0.74 0.00 0.00 -3.07 0.00 0.00 36.82 34.63 2rbi h ILE 14 CO -0.19 0.13 -0.23 -0.09 -0.69 0.00 0.00 178.15 177.08 2rbi h ARG 15 N 0.42 0.28 0.00 2.37 2.43 -0.91 -3.38 114.38 115.59 2rbi h ARG 15 Ca 0.12 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 2rbi h ARG 15 Cb 0.04 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2rbi h ARG 15 CO -0.02 0.83 -1.61 0.66 -1.51 0.00 0.00 179.97 178.32 2rbi n TYR 16 N -4.51 0.13 -2.45 2.20 4.01 0.15 -5.00 117.16 111.69 2rbi n TYR 16 Ca -0.08 0.04 -0.17 0.00 -0.16 0.00 0.00 57.90 57.53 2rbi n TYR 16 Cb 0.44 -0.46 0.00 0.00 -0.31 0.00 0.00 39.34 39.02 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 -2.14 -1.94 -3.63 -0.72 5.02 0.12 -4.97 118.16 109.89 2rbi n LYS 17 Ca -0.02 0.77 -0.05 0.00 -2.02 0.00 0.00 58.31 56.99 2rbi n LYS 17 Cb 0.51 -5.18 -0.02 0.00 -0.02 0.00 0.00 35.03 30.33 2rbi n LYS 17 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2rbi s ARG 18 N -4.97 0.90 0.59 1.97 1.70 -1.25 -5.06 118.95 112.83 2rbi s ARG 18 Ca 0.06 -0.43 -0.16 0.00 -0.47 0.00 0.00 55.73 54.73 2rbi s ARG 18 Cb -0.03 0.35 -0.04 0.00 -0.57 0.00 0.00 34.95 34.66 2rbi s ARG 18 CO 0.07 -0.40 1.05 -0.51 -1.08 0.00 0.00 175.30 174.43 2rbi s LEU 19 N -2.71 3.50 0.97 -1.89 1.43 -1.26 -4.05 118.68 114.67 2rbi s LEU 19 Ca 0.09 1.80 -0.11 0.00 -1.03 0.00 0.00 54.13 54.88 2rbi s LEU 19 Cb -0.01 -4.53 0.17 0.00 0.03 0.00 0.00 46.19 41.86 2rbi s LEU 19 CO -0.03 -1.13 1.09 -2.84 0.23 0.00 0.00 176.35 173.67 2rbi s PRO 20 N -4.08 0.63 0.64 1.29 0.02 -1.26 -4.92 135.00 127.32 2rbi s PRO 20 Ca 0.63 1.07 0.33 0.00 0.02 0.00 0.00 61.00 63.05 2rbi s PRO 20 Cb -0.16 -1.72 1.83 0.00 0.02 0.00 0.00 34.50 34.47 2rbi s PRO 20 CO 0.37 -2.74 2.09 -0.44 -0.33 0.00 0.00 177.00 175.94 2rbi h ASP 21 N -1.93 0.00 -0.01 2.53 3.32 -1.95 -2.43 116.42 115.95 2rbi h ASP 21 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 2rbi h ASP 21 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 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 -3.30 0.17 -4.80 6.45 6.94 -1.26 -4.87 115.26 114.58 2rbi n ASN 22 Ca -0.00 -1.34 -0.32 0.00 -0.02 0.00 0.00 54.58 52.90 2rbi n ASN 22 Cb 0.31 -0.01 -0.06 0.00 -2.36 0.00 0.00 39.78 37.66 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 -1.98 3.29 0.01 -2.53 2.02 -0.92 -0.79 117.35 116.44 2rbi s TYR 23 Ca 0.34 0.16 -0.02 0.00 -0.37 0.00 0.00 57.07 57.18 2rbi s TYR 23 Cb 0.16 -1.70 -0.01 0.00 -0.40 0.00 0.00 41.96 40.01 2rbi s TYR 23 CO 0.26 0.55 0.03 0.96 -1.57 0.00 0.00 175.55 175.78 2rbi s ILE 24 N -1.32 0.08 1.02 2.71 -4.36 -0.28 -4.89 121.20 114.17 2rbi s ILE 24 Ca 0.27 -0.65 -0.12 0.00 -0.26 0.00 0.00 60.65 59.89 2rbi s ILE 24 Cb -0.12 -0.27 0.20 0.00 1.25 0.00 0.00 42.46 43.52 2rbi s ILE 24 CO 0.19 -0.36 1.07 0.42 0.24 0.00 0.00 174.94 176.51 2rbi s THR 25 N -1.10 2.21 0.32 8.37 -4.23 -1.16 -1.62 115.64 118.42 2rbi s THR 25 Ca -0.12 0.07 0.05 0.00 -1.18 0.00 0.00 61.69 60.51 2rbi s THR 25 Cb -0.07 -2.37 0.11 0.00 1.34 0.00 0.00 72.50 71.50 2rbi s THR 25 CO -0.00 -0.09 1.80 0.11 -0.54 0.00 0.00 174.62 175.90 2rbi h LYS 26 N -2.06 0.40 -0.34 3.99 1.57 -1.98 -1.81 116.57 116.35 2rbi h LYS 26 Ca -0.55 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.01 2rbi h LYS 26 Cb 1.31 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.58 2rbi h LYS 26 CO 0.53 0.58 -0.19 0.66 -0.57 0.00 0.00 179.45 180.46 2rbi h SER 27 N 0.37 0.75 -0.39 0.86 4.64 -1.99 -1.88 113.55 115.91 2rbi h SER 27 Ca 0.06 -0.42 0.01 0.00 -0.47 0.00 0.00 61.79 60.97 2rbi h SER 27 Cb 0.54 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 2rbi h SER 27 CO 0.04 1.00 0.25 -0.61 -0.87 0.00 0.00 176.83 176.64 2rbi h GLN 28 N 0.49 0.49 -0.08 4.77 5.75 -1.85 -1.34 115.11 123.35 2rbi h GLN 28 Ca 0.07 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2rbi h GLN 28 Cb 0.73 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.17 2rbi h GLN 28 CO 0.05 0.32 0.04 0.00 -2.65 0.00 0.00 178.83 176.60 2rbi h ALA 29 N 1.15 0.10 -0.92 3.38 0.00 -1.21 -2.28 119.26 119.47 2rbi h ALA 29 Ca 0.15 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.06 2rbi h ALA 29 Cb -0.04 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2rbi h ALA 29 CO -0.04 -0.38 0.61 0.77 0.00 0.00 0.00 179.25 180.20 2rbi h SER 30 N 0.06 0.99 -0.22 0.00 0.02 -1.21 -0.89 113.55 112.30 2rbi h SER 30 Ca 0.03 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 2rbi h SER 30 Cb 0.04 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 2rbi h SER 30 CO -0.00 0.68 0.07 0.00 -1.14 0.00 0.00 176.83 176.43 2rbi h ALA 31 N 1.46 1.56 -0.00 3.77 0.00 -0.78 -1.56 119.26 123.71 2rbi h ALA 31 Ca 0.37 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2rbi h ALA 31 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2rbi h ALA 31 CO -0.12 0.33 -0.22 1.28 0.00 0.00 0.00 179.25 180.52 2rbi n LEU 32 N -4.36 0.52 0.00 0.00 4.77 -0.90 -4.93 117.00 112.10 2rbi n LEU 32 Ca 0.01 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2rbi n LEU 32 Cb 0.17 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2rbi n LEU 32 CO 0.37 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 2rbi n GLY 33 N 1.38 1.29 3.74 -0.72 0.00 -0.59 -4.87 105.19 105.42 2rbi n GLY 33 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 3.48 -0.16 1.61 -0.00 -0.38 -4.96 118.94 116.53 2rbi s TRP 34 Ca 0.00 1.50 -0.01 0.00 -0.00 0.00 0.00 56.10 57.59 2rbi s TRP 34 Cb 0.00 -3.38 0.04 0.00 -0.00 0.00 0.00 33.47 30.13 2rbi s TRP 34 CO 0.00 -0.98 -0.03 0.08 -0.00 0.00 0.00 176.95 176.01 2rbi s VAL 35 N -0.28 0.92 0.23 5.86 1.01 -1.26 -4.39 120.40 122.49 2rbi s VAL 35 Ca 0.51 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 2rbi s VAL 35 Cb -0.32 -1.14 0.21 0.00 0.00 0.00 0.00 36.38 35.14 2rbi s VAL 35 CO 0.37 0.10 1.69 0.00 0.00 0.00 0.00 175.10 177.26 2rbi h ALA 36 N 8.17 0.87 0.00 5.51 0.00 -2.00 -0.51 119.26 131.30 2rbi h ALA 36 Ca -0.22 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2rbi h ALA 36 Cb 1.11 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2rbi h ALA 36 CO 0.37 -0.33 0.00 -1.13 0.00 0.00 0.00 179.25 178.16 2rbi n SER 37 N -5.16 0.00 -0.00 0.00 3.41 -1.26 -1.60 113.62 109.01 2rbi n SER 37 Ca 0.12 0.48 0.08 0.00 -0.26 0.00 0.00 58.87 59.30 2rbi n SER 37 Cb 0.42 -0.49 -0.11 0.00 -0.26 0.00 0.00 64.21 63.77 2rbi n SER 37 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2rbi n LYS 38 N -1.49 1.08 -3.72 4.33 5.02 -0.23 -4.99 118.16 118.16 2rbi n LYS 38 Ca 0.04 -0.03 -0.24 0.00 -2.02 0.00 0.00 58.31 56.06 2rbi n LYS 38 Cb 0.19 -1.35 0.05 0.00 -0.02 0.00 0.00 35.03 33.90 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 1.43 -0.42 1.03 0.72 0.00 -0.63 -4.92 105.19 102.39 2rbi n GLY 39 Ca 0.02 0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.33 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 -2.98 3.20 -0.28 1.61 6.94 -1.26 -3.94 115.26 118.54 2rbi n ASN 40 Ca -0.12 -1.96 0.04 0.00 -0.02 0.00 0.00 54.58 52.51 2rbi n ASN 40 Cb 0.60 -0.14 0.12 0.00 -2.36 0.00 0.00 39.78 38.00 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 4.36 -0.66 -2.17 -4.53 5.85 -1.88 0.52 115.31 116.80 2rbi h LEU 41 Ca 0.00 0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 2rbi h LEU 41 Cb 0.95 0.47 -0.00 0.00 0.37 0.00 0.00 40.66 42.45 2rbi h LEU 41 CO 0.00 -0.26 -0.01 0.00 -0.34 0.00 0.00 178.44 177.83 2rbi h ALA 42 N 1.79 1.02 0.12 1.25 0.00 -1.84 0.13 119.26 121.73 2rbi h ALA 42 Ca 0.40 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.98 2rbi h ALA 42 Cb 0.65 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2rbi h ALA 42 CO -0.80 0.01 -1.62 0.93 0.00 0.00 0.00 179.25 177.77 2rbi h GLU 43 N 0.00 0.25 0.00 0.00 3.07 -0.34 -3.08 114.58 114.48 2rbi h GLU 43 Ca -0.00 -0.42 0.00 0.00 -0.50 0.00 0.00 59.36 58.44 2rbi h GLU 43 Cb 0.27 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2rbi h GLU 43 CO 0.00 1.10 -0.87 1.33 -1.40 0.00 0.00 179.01 179.17 2rbi n VAL 44 N -3.44 0.43 -3.03 3.13 0.24 -0.65 -4.54 118.33 110.46 2rbi n VAL 44 Ca -0.19 -0.39 -0.18 0.00 -2.04 0.00 0.00 64.34 61.54 2rbi n VAL 44 Cb 1.05 -0.16 -0.02 0.00 -1.47 0.00 0.00 33.84 33.24 2rbi n VAL 44 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2rbi n ALA 45 N -1.98 1.06 -1.67 2.33 0.00 0.42 -4.88 120.51 115.80 2rbi n ALA 45 Ca 0.02 -2.69 -0.47 0.00 0.00 0.00 0.00 53.44 50.29 2rbi n ALA 45 Cb 0.49 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 2rbi n ALA 45 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2rbi n PRO 46 N 1.42 2.09 -1.04 0.00 -0.02 -1.16 -2.21 135.00 134.08 2rbi n PRO 46 Ca 0.17 0.76 -0.01 0.00 -2.02 0.00 0.00 63.50 62.39 2rbi n PRO 46 Cb 0.57 -2.53 -0.01 0.00 -0.02 0.00 0.00 33.50 31.52 2rbi n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rbi n GLY 47 N 3.52 0.49 3.80 -1.23 0.00 -1.26 -5.02 105.19 105.48 2rbi n GLY 47 Ca 0.18 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.02 2.97 0.07 1.61 3.01 -0.94 -4.80 119.74 120.65 2rbi s LYS 48 Ca 0.00 -0.65 0.05 0.00 -1.01 0.00 0.00 55.97 54.36 2rbi s LYS 48 Cb 0.00 -2.78 -0.03 0.00 -1.01 0.00 0.00 37.83 34.01 2rbi s LYS 48 CO 0.00 0.57 -0.15 -1.12 0.51 0.00 0.00 175.35 175.17 2rbi s SER 49 N -2.40 1.73 0.22 2.83 0.01 0.03 -4.76 113.70 111.35 2rbi s SER 49 Ca 0.30 -0.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.68 2rbi s SER 49 Cb -0.12 -0.07 -0.08 0.00 0.21 0.00 0.00 66.02 65.96 2rbi s SER 49 CO 0.23 -0.04 1.06 -0.63 0.41 0.00 0.00 173.24 174.27 2rbi s ILE 50 N -1.18 3.82 0.00 1.44 1.01 -1.26 -1.12 121.20 123.91 2rbi s ILE 50 Ca -0.01 1.69 0.00 0.00 0.00 0.00 0.00 60.65 62.33 2rbi s ILE 50 Cb -0.10 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.30 2rbi s ILE 50 CO 0.02 0.34 0.00 0.61 0.00 0.00 0.00 174.94 175.92 2rbi n GLY 51 N 1.69 0.78 0.00 6.18 0.00 -0.64 -1.34 105.19 111.86 2rbi n GLY 51 Ca 0.01 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2rbi n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rbi n GLY 52 N -0.03 0.64 3.81 -0.02 0.00 0.21 -2.96 105.19 106.83 2rbi n GLY 52 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.95 6.19 0.25 1.61 1.01 -1.24 -4.76 116.67 117.77 2rbi s ASP 53 Ca 0.00 1.84 -0.30 0.00 0.71 0.00 0.00 52.55 54.79 2rbi s ASP 53 Cb 0.00 -2.54 -0.10 0.00 1.01 0.00 0.00 42.92 41.28 2rbi s ASP 53 CO 0.00 -0.88 1.47 -0.69 0.21 0.00 0.00 175.17 175.27 2rbi s VAL 54 N -2.24 2.59 -0.24 -1.27 1.01 -1.26 -1.51 120.40 117.48 2rbi s VAL 54 Ca 0.65 0.49 -0.04 0.00 0.00 0.00 0.00 61.98 63.07 2rbi s VAL 54 Cb -0.15 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.92 2rbi s VAL 54 CO 0.27 0.07 -0.01 0.12 0.00 0.00 0.00 175.10 175.56 2rbi s PHE 55 N 0.10 3.03 0.28 5.22 2.19 -0.23 -4.84 117.98 123.73 2rbi s PHE 55 Ca 0.61 -1.02 0.05 0.00 0.33 0.00 0.00 56.93 56.90 2rbi s PHE 55 Cb -0.43 -2.14 0.39 0.00 -1.31 0.00 0.00 43.02 39.54 2rbi s PHE 55 CO 0.43 -0.57 1.66 0.66 1.83 0.00 0.00 175.22 179.23 2rbi h SER 56 N 8.13 0.28 -4.82 6.13 4.64 -1.94 -3.37 113.55 122.60 2rbi h SER 56 Ca -0.37 -0.13 -0.29 0.00 -0.47 0.00 0.00 61.79 60.53 2rbi h SER 56 Cb 1.14 -0.08 0.12 0.00 -0.31 0.00 0.00 62.40 63.27 2rbi h SER 56 CO 0.60 0.70 -0.56 -3.20 -0.87 0.00 0.00 176.83 173.49 2rbi n ASN 57 N -3.99 -3.98 0.09 4.97 5.15 -1.26 -4.92 115.26 111.32 2rbi n ASN 57 Ca -0.02 -0.45 -0.02 0.00 -0.60 0.00 0.00 54.58 53.49 2rbi n ASN 57 Cb 0.51 -4.08 0.21 0.00 -0.53 0.00 0.00 39.78 35.89 2rbi n ASN 57 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 2rbi h ARG 58 N -1.85 0.24 0.00 1.20 3.08 -1.99 -2.99 114.38 112.06 2rbi h ARG 58 Ca -0.45 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.48 2rbi h ARG 58 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2rbi h ARG 58 CO 0.42 0.63 -0.08 0.39 -1.07 0.00 0.00 179.97 180.26 2rbi n GLU 59 N -4.01 0.07 -2.59 0.04 1.02 -1.26 -4.95 120.64 108.96 2rbi n GLU 59 Ca -0.02 0.05 -0.14 0.00 -0.02 0.00 0.00 57.16 57.03 2rbi n GLU 59 Cb 0.50 -1.57 0.01 0.00 -0.02 0.00 0.00 31.44 30.36 2rbi n GLU 59 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rbi n GLY 60 N 1.45 -0.12 0.20 0.62 0.00 -1.13 -4.94 105.19 101.26 2rbi n GLY 60 Ca 0.06 -0.23 0.13 0.00 0.00 0.00 0.00 46.02 45.98 2rbi n GLY 60 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2rbi h ARG 61 N -0.62 0.00 -6.42 1.61 3.08 -1.93 -3.44 114.38 106.66 2rbi h ARG 61 Ca -0.34 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.08 2rbi h ARG 61 Cb 1.24 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.16 2rbi h ARG 61 CO 0.37 0.00 -0.70 -0.51 -1.07 0.00 0.00 179.97 178.06 2rbi s LEU 62 N -5.66 3.17 0.16 3.04 1.43 -1.26 -4.93 118.68 114.63 2rbi s LEU 62 Ca 0.07 -0.42 -0.32 0.00 -1.03 0.00 0.00 54.13 52.43 2rbi s LEU 62 Cb 0.08 -1.87 -0.10 0.00 0.03 0.00 0.00 46.19 44.33 2rbi s LEU 62 CO 0.61 0.12 1.56 -2.16 0.23 0.00 0.00 176.35 176.70 2rbi s PRO 63 N -2.68 4.22 -0.17 1.29 0.04 -1.26 -5.00 135.00 131.44 2rbi s PRO 63 Ca 0.25 2.34 -0.10 0.00 0.04 0.00 0.00 61.00 63.53 2rbi s PRO 63 Cb -0.10 -3.16 -0.05 0.00 0.04 0.00 0.00 34.50 31.23 2rbi s PRO 63 CO 0.16 -0.59 0.17 -1.12 0.04 0.00 0.00 177.00 175.66 2rbi s SER 64 N 1.13 6.30 0.02 6.66 0.01 -1.26 -5.08 113.70 121.49 2rbi s SER 64 Ca 0.70 0.35 -0.00 0.00 1.31 0.00 0.00 55.95 58.30 2rbi s SER 64 Cb -0.43 -2.11 -0.02 0.00 0.21 0.00 0.00 66.02 63.67 2rbi s SER 64 CO 0.31 0.22 -0.03 0.00 0.41 0.00 0.00 173.24 174.15 2rbi s ALA 65 N 0.05 0.17 0.09 1.44 0.00 -1.26 -5.08 121.76 117.16 2rbi s ALA 65 Ca 0.11 -0.66 -0.31 0.00 0.00 0.00 0.00 51.96 51.10 2rbi s ALA 65 Cb -0.12 0.16 -0.10 0.00 0.00 0.00 0.00 23.12 23.07 2rbi s ALA 65 CO 0.01 -0.18 1.90 0.45 0.00 0.00 0.00 175.76 177.93 2rbi n SER 66 N 1.43 4.11 0.00 0.00 2.88 -1.26 -1.39 113.62 119.38 2rbi n SER 66 Ca -0.23 0.95 0.00 0.00 -1.33 0.00 0.00 58.87 58.26 2rbi n SER 66 Cb 0.56 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 2rbi n SER 66 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2rbi n GLY 67 N 4.38 0.73 3.70 0.46 0.00 -1.26 -5.03 105.19 108.17 2rbi n GLY 67 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.04 4.20 0.15 1.61 3.52 -0.49 -4.95 118.95 122.96 2rbi s ARG 68 Ca 0.00 0.08 0.10 0.00 -0.13 0.00 0.00 55.73 55.78 2rbi s ARG 68 Cb 0.00 -3.49 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 2rbi s ARG 68 CO 0.00 0.11 -0.23 0.95 -0.81 0.00 0.00 175.30 175.32 2rbi s THR 69 N 0.88 2.05 0.14 4.11 -4.23 -1.26 -4.74 115.64 112.59 2rbi s THR 69 Ca 0.16 -1.82 0.08 0.00 -1.18 0.00 0.00 61.69 58.93 2rbi s THR 69 Cb -0.14 -1.89 -0.04 0.00 1.34 0.00 0.00 72.50 71.77 2rbi s THR 69 CO 0.05 -0.10 -0.11 0.26 -0.54 0.00 0.00 174.62 174.18 2rbi s TRP 70 N -1.49 2.65 0.17 3.99 0.52 -1.26 0.44 118.94 123.96 2rbi s TRP 70 Ca 0.14 -0.21 0.03 0.00 0.02 0.00 0.00 56.10 56.09 2rbi s TRP 70 Cb -0.08 -1.35 -0.05 0.00 -1.15 0.00 0.00 33.47 30.84 2rbi s TRP 70 CO 0.07 0.46 -0.03 1.03 0.02 0.00 0.00 176.95 178.49 2rbi s ARG 71 N -2.49 1.10 0.15 4.98 0.52 0.55 -1.07 118.95 122.69 2rbi s ARG 71 Ca 0.22 -1.51 0.02 0.00 -0.52 0.00 0.00 55.73 53.94 2rbi s ARG 71 Cb -0.10 -0.41 -0.04 0.00 0.52 0.00 0.00 34.95 34.92 2rbi s ARG 71 CO 0.14 -0.06 -0.02 -1.83 0.02 0.00 0.00 175.30 173.55 2rbi s GLU 72 N -3.85 1.03 -0.12 3.54 -1.05 -0.57 -0.84 118.70 116.85 2rbi s GLU 72 Ca 0.21 -1.47 -0.16 0.00 -0.15 0.00 0.00 54.97 53.39 2rbi s GLU 72 Cb 0.05 -0.27 0.04 0.00 -0.44 0.00 0.00 34.13 33.51 2rbi s GLU 72 CO 0.03 -0.09 0.43 0.00 0.95 0.00 0.00 175.26 176.57 2rbi s ALA 73 N -3.63 -1.07 0.22 -0.84 0.00 0.09 -0.62 121.76 115.92 2rbi s ALA 73 Ca 0.20 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 2rbi s ALA 73 Cb 0.06 -0.45 -0.09 0.00 0.00 0.00 0.00 23.12 22.64 2rbi s ALA 73 CO 0.01 -0.23 0.94 -0.51 0.00 0.00 0.00 175.76 175.97 2rbi s ASP 74 N -0.29 7.63 0.06 0.00 1.11 -0.45 -0.78 116.67 123.94 2rbi s ASP 74 Ca -0.04 1.92 0.09 0.00 0.18 0.00 0.00 52.55 54.70 2rbi s ASP 74 Cb -0.03 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.32 2rbi s ASP 74 CO 0.02 0.14 -0.25 -0.63 1.18 0.00 0.00 175.17 175.63 2rbi s ILE 75 N -1.06 2.03 -1.21 0.77 -1.09 0.30 -4.68 121.20 116.26 2rbi s ILE 75 Ca 0.41 -1.41 0.00 0.00 -2.23 0.00 0.00 60.65 57.42 2rbi s ILE 75 Cb -0.26 -1.76 0.00 0.00 -1.58 0.00 0.00 42.46 38.87 2rbi s ILE 75 CO 0.32 0.27 0.00 0.59 -1.23 0.00 0.00 174.94 174.88 2rbi n ASN 76 N 1.63 -4.72 -4.76 3.58 3.02 0.11 -4.55 115.26 109.57 2rbi n ASN 76 Ca -0.17 0.28 -0.40 0.00 -0.03 0.00 0.00 54.58 54.26 2rbi n ASN 76 Cb 0.52 -3.22 -0.06 0.00 -0.61 0.00 0.00 39.78 36.41 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 -2.31 3.97 0.12 3.10 5.04 -1.26 -4.94 117.35 121.07 2rbi s TYR 77 Ca 0.00 1.84 0.00 0.00 -2.44 0.00 0.00 57.07 56.47 2rbi s TYR 77 Cb 0.00 -2.92 0.00 0.00 0.35 0.00 0.00 41.96 39.39 2rbi s TYR 77 CO 0.00 0.48 0.00 0.28 -1.34 0.00 0.00 175.55 174.97 2rbi n VAL 78 N 1.52 0.71 -3.62 3.14 0.31 -1.26 -4.96 118.33 114.17 2rbi n VAL 78 Ca -0.03 0.23 -0.04 0.00 -0.01 0.00 0.00 64.34 64.49 2rbi n VAL 78 Cb 0.47 -1.27 -0.02 0.00 -0.91 0.00 0.00 33.84 32.12 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 -5.57 -0.21 0.00 4.52 1.04 -1.26 -4.76 113.70 107.46 2rbi s SER 79 Ca 0.00 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2rbi s SER 79 Cb 0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 2rbi s SER 79 CO 0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 2rbi n GLY 80 N -0.34 -0.48 3.75 7.32 0.00 -1.25 -4.89 105.19 109.31 2rbi n GLY 80 Ca -0.06 -1.28 -0.38 0.00 0.00 0.00 0.00 46.02 44.30 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 2.33 0.43 1.61 0.08 -1.25 -4.56 117.98 116.63 2rbi s PHE 81 Ca 0.00 1.43 -0.25 0.00 0.12 0.00 0.00 56.93 58.23 2rbi s PHE 81 Cb 0.00 -3.69 -0.08 0.00 -0.57 0.00 0.00 43.02 38.68 2rbi s PHE 81 CO 0.00 -2.64 1.34 1.03 -0.10 0.00 0.00 175.22 174.85 2rbi s ARG 82 N -3.03 3.80 0.00 0.44 0.52 -1.26 -5.00 118.95 114.43 2rbi s ARG 82 Ca 0.73 2.24 0.00 0.00 -0.52 0.00 0.00 55.73 58.18 2rbi s ARG 82 Cb -0.37 -2.67 0.00 0.00 0.52 0.00 0.00 34.95 32.43 2rbi s ARG 82 CO 0.43 -0.66 0.00 0.27 0.02 0.00 0.00 175.30 175.36 2rbi n ASN 83 N -0.09 0.00 -0.84 0.23 0.23 -1.26 -5.03 115.26 108.50 2rbi n ASN 83 Ca 0.05 -0.94 0.08 0.00 -0.53 0.00 0.00 54.58 53.24 2rbi n ASN 83 Cb 0.43 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 38.29 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 2.36 -2.64 -2.53 0.00 -1.26 -4.94 120.51 108.49 2rbi n ALA 84 Ca 0.00 -0.96 -0.40 0.00 0.00 0.00 0.00 53.44 52.08 2rbi n ALA 84 Cb 0.00 -0.62 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 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 6.59 0.02 0.00 1.01 -1.26 -0.23 116.67 121.62 2rbi s ASP 85 Ca 0.28 0.71 -0.02 0.00 0.71 0.00 0.00 52.55 54.24 2rbi s ASP 85 Cb 0.16 -2.32 -0.02 0.00 1.01 0.00 0.00 42.92 41.75 2rbi s ASP 85 CO 0.23 -0.28 0.00 -0.13 0.21 0.00 0.00 175.17 175.20 2rbi s ARG 86 N 2.07 0.41 -0.20 8.23 1.81 -0.89 -0.54 118.95 129.84 2rbi s ARG 86 Ca 0.26 -0.69 -0.07 0.00 -1.72 0.00 0.00 55.73 53.50 2rbi s ARG 86 Cb -0.16 0.15 -0.04 0.00 -0.45 0.00 0.00 34.95 34.46 2rbi s ARG 86 CO 0.09 -0.08 0.06 -1.17 -0.68 0.00 0.00 175.30 173.53 2rbi s LEU 87 N -1.75 3.66 -0.18 2.53 0.20 0.04 -1.40 118.68 121.79 2rbi s LEU 87 Ca -0.11 -0.02 -0.00 0.00 0.69 0.00 0.00 54.13 54.68 2rbi s LEU 87 Cb -0.06 -1.94 0.01 0.00 -0.43 0.00 0.00 46.19 43.76 2rbi s LEU 87 CO -0.02 0.11 -0.15 -0.69 -0.29 0.00 0.00 176.35 175.30 2rbi s VAL 88 N 0.77 2.56 0.02 1.68 1.01 -0.39 -0.73 120.40 125.33 2rbi s VAL 88 Ca 0.03 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 61.27 2rbi s VAL 88 Cb -0.14 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 2rbi s VAL 88 CO 0.02 0.51 -0.13 -0.72 0.00 0.00 0.00 175.10 174.78 2rbi s TYR 89 N 1.13 1.16 0.41 5.22 1.13 -0.02 -1.39 117.35 124.99 2rbi s TYR 89 Ca 0.01 -0.31 0.08 0.00 -1.41 0.00 0.00 57.07 55.44 2rbi s TYR 89 Cb -0.14 -0.71 0.00 0.00 -1.10 0.00 0.00 41.96 40.01 2rbi s TYR 89 CO -0.05 0.01 0.54 -1.54 -2.51 0.00 0.00 175.55 172.00 2rbi s SER 90 N -0.86 5.65 0.48 -0.18 1.04 -0.71 -0.33 113.70 118.79 2rbi s SER 90 Ca 0.02 -0.42 0.15 0.00 0.48 0.00 0.00 55.95 56.19 2rbi s SER 90 Cb -0.07 -0.73 1.14 0.00 0.10 0.00 0.00 66.02 66.46 2rbi s SER 90 CO 0.01 -0.70 2.07 0.77 0.98 0.00 0.00 173.24 176.36 2rbi h SER 91 N 0.71 0.00 -0.31 7.02 4.64 -0.36 -0.85 113.55 124.40 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 0.47 0.09 0.00 -0.90 -0.87 0.00 0.00 176.83 175.63 2rbi n ASP 92 N -4.41 2.62 -0.69 4.97 5.75 -1.26 -4.98 116.55 118.55 2rbi n ASP 92 Ca -0.03 -1.88 -0.05 0.00 -0.01 0.00 0.00 54.79 52.82 2rbi n ASP 92 Cb 0.17 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 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 0.95 -0.32 -2.74 2.11 7.02 -0.32 -5.06 117.44 119.08 2rbi n TRP 93 Ca 0.18 0.04 -0.36 0.00 -1.02 0.00 0.00 57.50 56.33 2rbi n TRP 93 Cb 0.47 -1.78 -0.06 0.00 -2.42 0.00 0.00 31.31 27.52 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 -1.65 4.21 -0.06 -0.99 1.43 -1.26 -4.84 118.68 115.52 2rbi s LEU 94 Ca 0.02 1.85 -0.01 0.00 -1.03 0.00 0.00 54.13 54.96 2rbi s LEU 94 Cb -0.01 -4.16 0.03 0.00 0.03 0.00 0.00 46.19 42.08 2rbi s LEU 94 CO 0.03 -0.22 0.01 -0.63 0.23 0.00 0.00 176.35 175.77 2rbi s ILE 95 N -1.74 0.28 0.19 -0.59 1.01 -0.52 -1.74 121.20 118.08 2rbi s ILE 95 Ca 0.54 0.17 0.09 0.00 0.00 0.00 0.00 60.65 61.44 2rbi s ILE 95 Cb -0.17 -0.44 -0.04 0.00 0.01 0.00 0.00 42.46 41.81 2rbi s ILE 95 CO 0.22 0.24 -0.07 -0.31 0.00 0.00 0.00 174.94 175.02 2rbi s TYR 96 N 1.89 2.68 0.11 3.97 1.51 -0.48 0.42 117.35 127.43 2rbi s TYR 96 Ca 0.03 -0.21 0.07 0.00 -1.01 0.00 0.00 57.07 55.96 2rbi s TYR 96 Cb -0.12 -1.29 -0.03 0.00 -0.11 0.00 0.00 41.96 40.40 2rbi s TYR 96 CO -0.04 0.53 -0.18 -1.59 -1.11 0.00 0.00 175.55 173.15 2rbi s LYS 97 N -2.93 1.06 -0.01 -0.62 -2.85 -0.71 -1.26 119.74 112.42 2rbi s LYS 97 Ca 0.26 -1.16 0.02 0.00 -1.00 0.00 0.00 55.97 54.10 2rbi s LYS 97 Cb -0.09 -1.19 -0.00 0.00 -2.06 0.00 0.00 37.83 34.49 2rbi s LYS 97 CO 0.16 0.26 -0.08 -0.08 0.10 0.00 0.00 175.35 175.71 2rbi s THR 98 N -1.43 0.66 0.00 3.79 -1.32 -0.49 -1.40 115.64 115.45 2rbi s THR 98 Ca 0.06 -0.35 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 2rbi s THR 98 Cb -0.09 -0.56 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 2rbi s THR 98 CO 0.04 0.19 0.74 0.35 -2.21 0.00 0.00 174.62 173.74 2rbi n THR 99 N 2.95 0.54 -2.22 5.08 -2.24 -1.26 -2.08 114.28 115.05 2rbi n THR 99 Ca -0.14 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 2rbi n THR 99 Cb 0.57 0.78 0.08 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.27 1.81 -3.29 3.42 5.68 -1.23 -4.62 116.55 118.05 2rbi n ASP 100 Ca 0.00 -2.81 -0.13 0.00 -0.50 0.00 0.00 54.79 51.36 2rbi n ASP 100 Cb 0.20 -0.41 0.03 0.00 -1.14 0.00 0.00 41.12 39.80 2rbi n ASP 100 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2rbi n ASN 101 N -0.33 -6.76 0.00 -1.12 5.15 0.68 -2.83 115.26 110.04 2rbi n ASN 101 Ca 0.15 -0.53 0.00 0.00 -0.60 0.00 0.00 54.58 53.60 2rbi n ASN 101 Cb 0.93 -4.70 0.00 0.00 -0.53 0.00 0.00 39.78 35.48 2rbi n ASN 101 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2rbi n TYR 102 N -2.77 0.00 0.02 1.20 4.01 -1.26 -4.89 117.16 113.47 2rbi n TYR 102 Ca -0.06 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.55 2rbi n TYR 102 Cb 0.57 -1.73 -0.09 0.00 -0.31 0.00 0.00 39.34 37.79 2rbi n TYR 102 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2rbi h ALA 103 N 0.00 -0.03 -3.50 -0.72 0.00 -1.93 -3.45 119.26 109.64 2rbi h ALA 103 Ca 0.00 -0.14 -0.35 0.00 0.00 0.00 0.00 54.91 54.41 2rbi h ALA 103 Cb 0.77 0.01 -0.23 0.00 0.00 0.00 0.00 17.79 18.34 2rbi h ALA 103 CO 0.00 -0.38 -0.76 0.95 0.00 0.00 0.00 179.25 179.06 2rbi s THR 104 N -5.08 0.78 0.22 0.00 -4.23 -1.26 -5.11 115.64 100.96 2rbi s THR 104 Ca -0.15 -0.96 0.10 0.00 -1.18 0.00 0.00 61.69 59.51 2rbi s THR 104 Cb 0.03 -0.76 -0.04 0.00 1.34 0.00 0.00 72.50 73.07 2rbi s THR 104 CO 0.66 -0.16 -0.14 -0.36 -0.54 0.00 0.00 174.62 174.08 2rbi s PHE 105 N -1.01 2.49 -0.11 3.99 0.08 -1.26 -4.26 117.98 117.91 2rbi s PHE 105 Ca -0.03 -0.28 -0.03 0.00 0.12 0.00 0.00 56.93 56.70 2rbi s PHE 105 Cb -0.08 -1.18 0.05 0.00 -0.57 0.00 0.00 43.02 41.24 2rbi s PHE 105 CO 0.01 0.57 0.11 0.99 -0.10 0.00 0.00 175.22 176.80 2rbi s THR 106 N -1.96 -0.16 0.31 0.64 2.01 -0.50 -4.93 115.64 111.05 2rbi s THR 106 Ca 0.26 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 62.13 2rbi s THR 106 Cb -0.07 -0.38 -0.10 0.00 0.01 0.00 0.00 72.50 71.95 2rbi s THR 106 CO 0.15 -0.02 1.44 -0.60 -0.69 0.00 0.00 174.62 174.89 2rbi s ARG 107 N 2.20 4.24 0.00 4.92 3.52 -1.26 -1.73 118.95 130.83 2rbi s ARG 107 Ca 0.04 2.38 0.00 0.00 -0.13 0.00 0.00 55.73 58.02 2rbi s ARG 107 Cb -0.14 -3.05 0.00 0.00 -1.56 0.00 0.00 34.95 30.20 2rbi s ARG 107 CO -0.07 -0.41 0.00 0.44 -0.81 0.00 0.00 175.30 174.45 2rbi n ILE 108 N 1.47 0.00 -1.58 4.11 -5.35 0.17 -4.91 119.36 113.26 2rbi n ILE 108 Ca 0.04 -0.23 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 2rbi n ILE 108 Cb 0.40 0.87 0.00 0.00 -1.74 0.00 0.00 39.64 39.17 2rbi n ILE 108 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33