#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r92 n THR 3 N 0.00 0.00 -0.18 12.58 -1.04 -1.26 -4.80 114.28 119.58 2r92 n THR 3 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.79 2r92 n THR 3 Cb 0.00 0.00 0.21 0.00 -1.82 0.00 0.00 70.33 68.72 2r92 n THR 3 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 2r92 n PHE 4 N -0.35 -3.25 -4.21 -1.42 1.16 -1.26 -5.06 117.46 103.06 2r92 n PHE 4 Ca 0.00 -0.56 -0.12 0.00 -1.87 0.00 0.00 57.45 54.89 2r92 n PHE 4 Cb 0.00 -0.93 -0.10 0.00 -1.61 0.00 0.00 39.48 36.84 2r92 n PHE 4 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 2r92 s ARG 5 N -4.42 1.13 0.43 3.97 3.52 -1.26 -5.16 118.95 117.16 2r92 s ARG 5 Ca 0.48 -1.58 0.06 0.00 -0.13 0.00 0.00 55.73 54.57 2r92 s ARG 5 Cb -0.08 0.05 -0.06 0.00 -1.56 0.00 0.00 34.95 33.30 2r92 s ARG 5 CO 0.40 -0.28 0.07 -0.06 -0.81 0.00 0.00 175.30 174.62 2r92 s PHE 6 N -3.95 2.45 0.67 5.12 2.99 -1.26 -3.87 117.98 120.13 2r92 s PHE 6 Ca 0.31 -0.68 0.03 0.00 0.00 0.00 0.00 56.93 56.59 2r92 s PHE 6 Cb 0.07 -1.82 0.13 0.00 0.00 0.00 0.00 43.02 41.40 2r92 s PHE 6 CO 0.07 0.32 0.91 0.00 -0.00 0.00 0.00 175.22 176.53 2r92 n ARG 8 N -2.61 2.57 0.00 0.00 1.74 -1.26 -3.89 116.66 113.20 2r92 n ARG 8 Ca 0.16 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 2r92 n ARG 8 Cb 0.58 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.02 2r92 n ARG 8 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2r92 n ASP 9 N -0.27 0.00 -2.75 0.55 8.00 -1.26 -2.94 116.55 117.87 2r92 n ASP 9 Ca 0.00 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.20 2r92 n ASP 9 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2r92 n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2r92 n ASN 11 N -0.41 0.00 0.00 0.00 5.15 -1.15 -4.88 115.26 113.97 2r92 n ASN 11 Ca 0.41 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.39 2r92 n ASN 11 Cb 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.74 2r92 n ASN 11 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2r92 n ASN 12 N 0.00 0.00 -4.92 1.20 5.03 -1.26 -4.92 115.26 110.39 2r92 n ASN 12 Ca 0.00 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.15 2r92 n ASN 12 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 2r92 n ASN 12 CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 2r92 s MET 13 N 3.04 3.47 -0.25 3.52 -2.45 -1.26 -4.10 119.30 121.28 2r92 s MET 13 Ca 0.00 -0.41 -0.02 0.00 -1.25 0.00 0.00 55.69 54.01 2r92 s MET 13 Cb 0.00 -2.99 0.02 0.00 1.25 0.00 0.00 34.83 33.11 2r92 s MET 13 CO 0.00 0.56 -0.06 -0.51 1.05 0.00 0.00 175.02 176.06 2r92 s LEU 14 N -2.70 3.17 -0.12 4.11 1.43 -1.25 -4.60 118.68 118.71 2r92 s LEU 14 Ca 0.36 -0.84 -0.14 0.00 -1.03 0.00 0.00 54.13 52.48 2r92 s LEU 14 Cb -0.12 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 2r92 s LEU 14 CO 0.28 -0.12 0.32 -0.31 0.23 0.00 0.00 176.35 176.74 2r92 s TYR 15 N 1.33 3.53 0.44 0.29 1.51 -1.18 -4.68 117.35 118.60 2r92 s TYR 15 Ca 0.01 0.69 -0.18 0.00 -1.01 0.00 0.00 57.07 56.57 2r92 s TYR 15 Cb -0.16 -2.31 -0.10 0.00 -0.11 0.00 0.00 41.96 39.28 2r92 s TYR 15 CO -0.04 0.36 0.93 -1.25 -1.11 0.00 0.00 175.55 174.44 2r92 s PRO 16 N 0.02 4.09 0.20 -1.71 0.04 -1.26 -1.40 135.00 134.98 2r92 s PRO 16 Ca 0.19 0.99 -0.08 0.00 0.04 0.00 0.00 61.00 62.14 2r92 s PRO 16 Cb -0.14 -2.20 -0.02 0.00 0.04 0.00 0.00 34.50 32.18 2r92 s PRO 16 CO 0.06 -0.09 0.29 1.03 0.04 0.00 0.00 177.00 178.33 2r92 s ARG 17 N -3.48 1.27 -0.03 4.56 0.52 0.97 -4.95 118.95 117.80 2r92 s ARG 17 Ca 0.60 -1.33 0.04 0.00 -0.52 0.00 0.00 55.73 54.52 2r92 s ARG 17 Cb -0.09 0.37 -0.03 0.00 0.52 0.00 0.00 34.95 35.72 2r92 s ARG 17 CO 0.20 -0.47 -0.14 -2.00 0.02 0.00 0.00 175.30 172.92 2r92 s GLU 18 N -4.04 2.46 -0.91 3.54 2.12 -1.26 -1.51 118.70 119.10 2r92 s GLU 18 Ca 0.25 -0.73 -0.19 0.00 0.36 0.00 0.00 54.97 54.66 2r92 s GLU 18 Cb 0.03 -2.37 0.13 0.00 0.26 0.00 0.00 34.13 32.18 2r92 s GLU 18 CO 0.06 0.61 1.10 0.34 -0.54 0.00 0.00 175.26 176.83 2r92 s ASP 19 N -0.89 6.60 0.12 -1.70 -1.08 -0.89 -4.90 116.67 113.93 2r92 s ASP 19 Ca 0.12 -2.00 -0.25 0.00 -0.52 0.00 0.00 52.55 49.90 2r92 s ASP 19 Cb -0.11 -2.39 -0.07 0.00 -1.46 0.00 0.00 42.92 38.89 2r92 s ASP 19 CO 0.02 -1.07 1.65 0.11 0.52 0.00 0.00 175.17 176.40 2r92 h LYS 20 N 8.85 -0.35 0.00 4.34 1.57 -1.97 0.40 116.57 129.41 2r92 h LYS 20 Ca 0.13 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2r92 h LYS 20 Cb 1.03 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2r92 h LYS 20 CO 1.10 -0.23 0.00 -1.91 -0.57 0.00 0.00 179.45 177.84 2r92 n GLU 21 N -5.34 0.06 0.00 3.15 2.13 -1.26 -3.73 120.64 115.65 2r92 n GLU 21 Ca -0.06 0.21 0.00 0.00 0.66 0.00 0.00 57.16 57.97 2r92 n GLU 21 Cb 0.25 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.46 2r92 n GLU 21 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2r92 n ASN 22 N -1.44 0.27 -2.67 4.31 3.02 -0.97 -5.08 115.26 112.70 2r92 n ASN 22 Ca 0.05 -0.61 -0.04 0.00 -0.03 0.00 0.00 54.58 53.94 2r92 n ASN 22 Cb 0.16 0.39 0.01 0.00 -0.61 0.00 0.00 39.78 39.73 2r92 n ASN 22 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2r92 n ASN 23 N -0.39 -6.90 -3.61 6.41 4.13 0.09 -5.06 115.26 109.93 2r92 n ASN 23 Ca 0.00 0.28 -0.06 0.00 1.68 0.00 0.00 54.58 56.49 2r92 n ASN 23 Cb 0.03 -4.63 -0.04 0.00 -1.54 0.00 0.00 39.78 33.60 2r92 n ASN 23 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2r92 s ARG 24 N -2.55 0.30 -0.08 3.52 1.70 -1.24 -5.02 118.95 115.58 2r92 s ARG 24 Ca 0.14 0.07 -0.22 0.00 -0.47 0.00 0.00 55.73 55.24 2r92 s ARG 24 Cb -0.04 0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.44 2r92 s ARG 24 CO 0.63 -0.09 0.65 -1.17 -1.08 0.00 0.00 175.30 174.24 2r92 s LEU 25 N -1.09 4.31 -0.12 -1.89 2.96 -1.26 -2.08 118.68 119.51 2r92 s LEU 25 Ca 0.04 1.11 0.00 0.00 -0.22 0.00 0.00 54.13 55.07 2r92 s LEU 25 Cb -0.01 -3.00 0.02 0.00 0.50 0.00 0.00 46.19 43.71 2r92 s LEU 25 CO -0.04 -0.09 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.04 2r92 s LEU 26 N 0.74 1.43 0.79 -0.68 1.43 -0.57 -0.02 118.68 121.80 2r92 s LEU 26 Ca 0.35 -0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 52.97 2r92 s LEU 26 Cb -0.17 -0.98 0.10 0.00 0.03 0.00 0.00 46.19 45.17 2r92 s LEU 26 CO 0.16 -0.08 1.13 -0.36 0.23 0.00 0.00 176.35 177.43 2r92 s PHE 27 N 1.52 2.54 0.00 0.29 2.99 -0.01 -0.02 117.98 125.29 2r92 s PHE 27 Ca 0.03 0.45 0.00 0.00 0.00 0.00 0.00 56.93 57.41 2r92 s PHE 27 Cb -0.13 -3.46 0.00 0.00 0.00 0.00 0.00 43.02 39.43 2r92 s PHE 27 CO -0.08 -1.81 0.00 -0.85 -0.00 0.00 0.00 175.22 172.48 2r92 n GLU 28 N -3.21 0.00 -3.75 0.44 0.28 -0.49 -2.32 120.64 111.59 2r92 n GLU 28 Ca 0.10 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.99 2r92 n GLU 28 Cb 0.60 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.41 2r92 n GLU 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2r92 n ARG 30 N 0.32 3.11 0.12 0.00 1.74 -1.26 -4.69 116.66 116.00 2r92 n ARG 30 Ca -0.17 -4.06 0.00 0.00 -0.77 0.00 0.00 57.85 52.85 2r92 n ARG 30 Cb 0.61 -2.10 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2r92 n ARG 30 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2r92 n THR 31 N -0.62 0.27 0.00 0.55 -1.04 -1.26 -5.09 114.28 107.09 2r92 n THR 31 Ca 0.35 0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.44 2r92 n THR 31 Cb 0.88 -0.74 0.00 0.00 -1.82 0.00 0.00 70.33 68.64 2r92 n THR 31 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r92 n SER 33 N 0.00 0.00 -4.30 0.00 7.64 -1.26 -4.96 113.62 110.74 2r92 n SER 33 Ca 0.00 -1.00 -0.36 0.00 1.01 0.00 0.00 58.87 58.52 2r92 n SER 33 Cb 0.00 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.25 2r92 n SER 33 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2r92 n TYR 34 N 0.00 -2.38 -3.52 1.43 -0.00 -1.26 -4.88 117.16 106.55 2r92 n TYR 34 Ca 0.00 0.27 0.00 0.00 -0.00 0.00 0.00 57.90 58.17 2r92 n TYR 34 Cb 0.28 -1.74 -0.03 0.00 -0.00 0.00 0.00 39.34 37.85 2r92 n TYR 34 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 2r92 s VAL 35 N -2.00 -0.96 0.12 2.97 1.01 -1.26 -3.61 120.40 116.67 2r92 s VAL 35 Ca 0.57 0.00 0.10 0.00 0.00 0.00 0.00 61.98 62.65 2r92 s VAL 35 Cb -0.33 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2r92 s VAL 35 CO 0.67 0.00 -0.23 -1.83 0.00 0.00 0.00 175.10 173.71 2r92 s GLU 36 N 2.86 1.60 1.20 2.72 -1.05 -0.98 -4.97 118.70 120.08 2r92 s GLU 36 Ca 0.00 -1.26 -0.13 0.00 -0.15 0.00 0.00 54.97 53.43 2r92 s GLU 36 Cb -0.12 -2.00 0.30 0.00 -0.44 0.00 0.00 34.13 31.86 2r92 s GLU 36 CO -0.19 0.47 0.95 -0.85 0.95 0.00 0.00 175.26 176.59 2r92 n GLU 37 N 0.91 -2.66 -2.40 -4.83 0.28 -1.26 -0.83 120.64 109.86 2r92 n GLU 37 Ca -0.17 -0.75 -0.41 0.00 -0.16 0.00 0.00 57.16 55.67 2r92 n GLU 37 Cb 0.53 -2.12 -0.04 0.00 1.43 0.00 0.00 31.44 31.24 2r92 n GLU 37 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2r92 s ALA 38 N -2.37 3.43 -0.04 -1.84 0.00 0.97 -4.47 121.76 117.43 2r92 s ALA 38 Ca 0.68 0.94 -0.26 0.00 0.00 0.00 0.00 51.96 53.33 2r92 s ALA 38 Cb -0.25 -3.39 -0.21 0.00 0.00 0.00 0.00 23.12 19.26 2r92 s ALA 38 CO 0.66 -0.32 1.15 0.78 0.00 0.00 0.00 175.76 178.03 2r92 h GLY 39 N 4.82 0.06 -3.35 0.00 0.00 -1.92 -3.47 103.07 99.21 2r92 h GLY 39 Ca -0.45 -0.08 -0.06 0.00 0.00 0.00 0.00 47.33 46.73 2r92 h GLY 39 CO 0.72 0.07 -0.11 -1.35 0.00 0.00 0.00 176.54 175.87 2r92 s SER 40 N -5.91 -0.23 0.08 0.19 1.04 -1.26 -5.05 113.70 102.56 2r92 s SER 40 Ca -0.16 -0.22 0.12 0.00 0.48 0.00 0.00 55.95 56.17 2r92 s SER 40 Cb 0.01 0.44 0.54 0.00 0.10 0.00 0.00 66.02 67.11 2r92 s SER 40 CO 0.69 -0.77 1.37 -0.81 0.98 0.00 0.00 173.24 174.71 2r92 n PRO 41 N 0.08 0.05 -2.49 4.02 -0.04 -1.26 -4.68 135.00 130.68 2r92 n PRO 41 Ca -0.17 0.40 -0.43 0.00 -0.04 0.00 0.00 63.50 63.27 2r92 n PRO 41 Cb 0.62 -1.61 -0.02 0.00 -0.04 0.00 0.00 33.50 32.45 2r92 n PRO 41 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2r92 s LEU 42 N -3.40 3.78 -0.26 1.53 2.96 -1.26 -4.91 118.68 117.11 2r92 s LEU 42 Ca 0.03 0.94 -0.12 0.00 -0.22 0.00 0.00 54.13 54.77 2r92 s LEU 42 Cb 0.06 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 43.07 2r92 s LEU 42 CO 0.19 -1.14 -0.26 0.52 -1.32 0.00 0.00 176.35 174.34 2r92 n VAL 43 N 6.44 1.53 -4.13 1.68 0.31 -1.26 -4.95 118.33 117.95 2r92 n VAL 43 Ca 0.14 -0.39 -0.15 0.00 -0.01 0.00 0.00 64.34 63.93 2r92 n VAL 43 Cb 0.47 -1.81 -0.12 0.00 -0.91 0.00 0.00 33.84 31.47 2r92 n VAL 43 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 2r92 s TYR 44 N -2.50 0.72 -0.06 3.52 5.04 -1.26 -5.03 117.35 117.79 2r92 s TYR 44 Ca -0.37 -0.37 -0.04 0.00 -2.44 0.00 0.00 57.07 53.85 2r92 s TYR 44 Cb 0.13 -0.44 0.02 0.00 0.35 0.00 0.00 41.96 42.02 2r92 s TYR 44 CO 0.53 -0.04 0.14 0.50 -1.34 0.00 0.00 175.55 175.34 2r92 s ARG 45 N -1.15 0.14 -0.21 4.97 3.52 -1.26 -5.08 118.95 119.88 2r92 s ARG 45 Ca -0.05 0.26 -0.15 0.00 -0.13 0.00 0.00 55.73 55.66 2r92 s ARG 45 Cb -0.08 -0.01 -0.09 0.00 -1.56 0.00 0.00 34.95 33.22 2r92 s ARG 45 CO 0.00 -0.07 -0.33 1.58 -0.81 0.00 0.00 175.30 175.68 2r92 n HIS 46 N 3.41 0.00 -2.54 5.12 -0.00 -1.26 -5.11 115.22 114.85 2r92 n HIS 46 Ca -0.17 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.51 2r92 n HIS 46 Cb 0.57 -0.71 -0.03 0.00 -0.00 0.00 0.00 29.99 29.81 2r92 n HIS 46 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 2r92 n GLU 47 N -4.27 -3.99 -0.02 1.57 2.13 -1.26 -5.01 120.64 109.78 2r92 n GLU 47 Ca -0.33 3.08 -0.00 0.00 0.66 0.00 0.00 57.16 60.57 2r92 n GLU 47 Cb 0.69 -4.85 -0.00 0.00 0.27 0.00 0.00 31.44 27.55 2r92 n GLU 47 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2r92 h LEU 48 N 3.51 0.00 -8.29 4.31 3.38 -2.08 -3.41 115.31 112.73 2r92 h LEU 48 Ca -0.39 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.00 2r92 h LEU 48 Cb 0.87 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.52 2r92 h LEU 48 CO 0.03 0.21 0.90 -0.63 0.09 0.00 0.00 178.44 179.05 2r92 s ILE 49 N -1.24 3.98 0.73 1.22 1.01 -1.26 -5.00 121.20 120.64 2r92 s ILE 49 Ca -0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 60.65 60.54 2r92 s ILE 49 Cb 0.00 -4.84 0.05 0.00 0.01 0.00 0.00 42.46 37.68 2r92 s ILE 49 CO 0.00 -1.71 1.07 -0.89 0.00 0.00 0.00 174.94 173.41 2r92 s THR 50 N 4.99 2.55 0.00 2.92 2.01 -1.26 -5.01 115.64 121.84 2r92 s THR 50 Ca 0.31 -0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.29 2r92 s THR 50 Cb -0.10 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.27 2r92 s THR 50 CO 0.11 -0.16 0.00 0.59 -0.69 0.00 0.00 174.62 174.47 2r92 n ASN 51 N -3.03 0.00 -4.56 3.53 4.13 -1.26 -5.07 115.26 108.99 2r92 n ASN 51 Ca 0.07 -0.58 -0.43 0.00 1.68 0.00 0.00 54.58 55.32 2r92 n ASN 51 Cb 0.60 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.79 2r92 n ASN 51 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2r92 s ILE 52 N 0.00 4.52 0.00 2.41 -4.36 -1.26 -3.33 121.20 119.18 2r92 s ILE 52 Ca 0.00 0.73 0.00 0.00 -0.26 0.00 0.00 60.65 61.12 2r92 s ILE 52 Cb 0.00 -4.40 0.00 0.00 1.25 0.00 0.00 42.46 39.31 2r92 s ILE 52 CO 0.00 -0.78 0.00 0.61 0.24 0.00 0.00 174.94 175.01 2r92 n GLY 53 N 4.89 0.54 0.02 6.27 0.00 -1.26 -4.95 105.19 110.70 2r92 n GLY 53 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.08 2r92 n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2r92 n GLU 54 N 0.00 0.01 -2.68 1.61 1.02 -1.21 -1.74 120.64 117.64 2r92 n GLU 54 Ca 0.00 0.27 -0.06 0.00 -0.02 0.00 0.00 57.16 57.35 2r92 n GLU 54 Cb 0.00 -1.82 0.09 0.00 -0.02 0.00 0.00 31.44 29.69 2r92 n GLU 54 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2r92 n THR 55 N -1.33 0.00 -1.58 2.62 -1.04 -1.26 -3.88 114.28 107.80 2r92 n THR 55 Ca -0.00 -1.29 -0.40 0.00 -2.04 0.00 0.00 64.05 60.31 2r92 n THR 55 Cb 0.29 0.90 0.02 0.00 -1.82 0.00 0.00 70.33 69.72 2r92 n THR 55 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r92 n ALA 56 N -0.60 -0.12 -1.17 2.41 0.00 -0.71 -4.39 120.51 115.93 2r92 n ALA 56 Ca -0.09 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2r92 n ALA 56 Cb 0.80 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 18.22 2r92 n ALA 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r92 n GLY 57 N 1.32 0.00 2.58 0.00 0.00 -1.26 -4.93 105.19 102.91 2r92 n GLY 57 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 2r92 n GLY 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2r92 n VAL 58 N 1.74 1.75 -0.99 1.61 0.31 -1.26 -5.09 118.33 116.39 2r92 n VAL 58 Ca 0.00 -4.54 -0.32 0.00 -0.01 0.00 0.00 64.34 59.47 2r92 n VAL 58 Cb 0.00 -0.63 0.02 0.00 -0.91 0.00 0.00 33.84 32.32 2r92 n VAL 58 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2r92 n VAL 59 N -0.19 0.00 0.34 2.52 0.31 -1.26 -4.72 118.33 115.33 2r92 n VAL 59 Ca 0.27 -0.43 0.04 0.00 -0.01 0.00 0.00 64.34 64.22 2r92 n VAL 59 Cb 0.64 0.00 0.20 0.00 -0.91 0.00 0.00 33.84 33.77 2r92 n VAL 59 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2r92 n GLN 60 N 1.59 0.03 -0.11 5.55 -0.06 -1.26 -1.06 117.38 122.06 2r92 n GLN 60 Ca 0.04 0.31 0.11 0.00 -2.00 0.00 0.00 57.00 55.46 2r92 n GLN 60 Cb 0.43 -1.50 0.29 0.00 -4.06 0.00 0.00 30.24 25.40 2r92 n GLN 60 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 2r92 n ASP 61 N -1.45 2.48 -0.27 1.69 8.00 -1.26 -4.33 116.55 121.41 2r92 n ASP 61 Ca 0.03 -1.84 0.00 0.00 0.71 0.00 0.00 54.79 53.69 2r92 n ASP 61 Cb 0.10 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 2r92 n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2r92 n ILE 62 N 0.87 0.00 -0.01 0.53 3.06 -0.23 -0.34 119.36 123.24 2r92 n ILE 62 Ca 0.17 0.00 -0.00 0.00 -2.50 0.00 0.00 62.75 60.42 2r92 n ILE 62 Cb 0.46 -0.24 -0.02 0.00 0.54 0.00 0.00 39.64 40.39 2r92 n ILE 62 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2r92 n GLY 63 N 0.10 -0.11 0.00 4.50 0.00 -1.26 -4.59 105.19 103.83 2r92 n GLY 63 Ca 0.00 -0.04 0.16 0.00 0.00 0.00 0.00 46.02 46.13 2r92 n GLY 63 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2r92 n SER 64 N -1.94 0.00 -4.38 1.61 3.41 0.54 -4.61 113.62 108.25 2r92 n SER 64 Ca -0.03 -0.92 -0.45 0.00 -0.26 0.00 0.00 58.87 57.22 2r92 n SER 64 Cb 0.43 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.32 2r92 n SER 64 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2r92 s ASP 65 N -2.04 6.18 0.48 4.04 -1.08 -1.22 -4.93 116.67 118.10 2r92 s ASP 65 Ca 0.46 -1.42 0.17 0.00 -0.52 0.00 0.00 52.55 51.24 2r92 s ASP 65 Cb 0.21 -2.31 1.18 0.00 -1.46 0.00 0.00 42.92 40.55 2r92 s ASP 65 CO 0.37 -1.13 2.03 1.55 0.52 0.00 0.00 175.17 178.51 2r92 h PRO 66 N 9.20 0.20 0.00 4.34 0.13 -1.96 -2.94 132.00 140.97 2r92 h PRO 66 Ca -0.29 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2r92 h PRO 66 Cb 1.09 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2r92 h PRO 66 CO 1.10 0.13 0.18 1.79 -0.23 0.00 0.00 178.00 180.97 2r92 h THR 67 N 0.21 0.00 -3.38 1.56 1.35 -1.97 -3.42 112.91 107.25 2r92 h THR 67 Ca 0.19 0.00 -0.49 0.00 -0.55 0.00 0.00 66.41 65.57 2r92 h THR 67 Cb 0.50 0.41 0.03 0.00 -1.73 0.00 0.00 68.15 67.36 2r92 h THR 67 CO -0.03 0.00 0.04 -0.76 -0.25 0.00 0.00 175.52 174.52 2r92 s LEU 68 N -4.43 3.69 0.16 3.87 1.43 -1.11 -5.10 118.68 117.19 2r92 s LEU 68 Ca -0.02 0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 53.83 2r92 s LEU 68 Cb 0.05 -3.72 -0.05 0.00 0.03 0.00 0.00 46.19 42.50 2r92 s LEU 68 CO 0.17 -0.55 0.38 -2.16 0.23 0.00 0.00 176.35 174.42 2r92 s PRO 69 N -4.66 3.60 0.17 1.29 0.04 -1.26 -5.04 135.00 129.13 2r92 s PRO 69 Ca 0.46 -0.14 0.07 0.00 0.04 0.00 0.00 61.00 61.43 2r92 s PRO 69 Cb -0.10 -2.84 -0.04 0.00 0.04 0.00 0.00 34.50 31.56 2r92 s PRO 69 CO 0.43 0.44 0.03 1.03 0.04 0.00 0.00 177.00 178.97 2r92 s ARG 70 N -2.82 2.52 0.08 4.56 1.81 -1.26 -2.99 118.95 120.85 2r92 s ARG 70 Ca 0.41 -1.05 0.03 0.00 -1.72 0.00 0.00 55.73 53.40 2r92 s ARG 70 Cb -0.12 -2.43 -0.03 0.00 -0.45 0.00 0.00 34.95 31.92 2r92 s ARG 70 CO 0.26 0.46 -0.10 -1.54 -0.68 0.00 0.00 175.30 173.70 2r92 s SER 71 N -2.96 1.30 -0.60 0.23 1.04 -0.57 -4.98 113.70 107.17 2r92 s SER 71 Ca 0.28 -0.74 -0.00 0.00 0.48 0.00 0.00 55.95 55.97 2r92 s SER 71 Cb -0.10 0.02 0.47 0.00 0.10 0.00 0.00 66.02 66.51 2r92 s SER 71 CO 0.20 -0.24 1.91 -0.90 0.98 0.00 0.00 173.24 175.19 2r92 n ASP 72 N 0.84 7.01 -4.20 7.02 5.75 -1.26 -3.36 116.55 128.34 2r92 n ASP 72 Ca -0.18 -3.77 -0.17 0.00 -0.01 0.00 0.00 54.79 50.65 2r92 n ASP 72 Cb 0.57 -0.88 0.08 0.00 -1.03 0.00 0.00 41.12 39.85 2r92 n ASP 72 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2r92 n ARG 73 N -0.91 0.32 -4.84 0.11 1.74 -1.26 -4.98 116.66 106.84 2r92 n ARG 73 Ca 0.60 -2.34 -0.27 0.00 -0.77 0.00 0.00 57.85 55.07 2r92 n ARG 73 Cb 0.77 -0.38 -0.16 0.00 -1.02 0.00 0.00 32.46 31.66 2r92 n ARG 73 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2r92 s GLU 74 N -4.38 2.04 1.06 5.56 -1.05 -1.25 -4.01 118.70 116.68 2r92 s GLU 74 Ca 0.52 -0.60 -0.16 0.00 -0.15 0.00 0.00 54.97 54.57 2r92 s GLU 74 Cb -0.03 -1.67 0.09 0.00 -0.44 0.00 0.00 34.13 32.07 2r92 s GLU 74 CO 0.34 0.16 0.20 0.00 0.95 0.00 0.00 175.26 176.90 2r92 h PRO 76 N -1.93 0.00 0.00 0.00 0.11 -1.98 -3.36 132.00 124.84 2r92 h PRO 76 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2r92 h PRO 76 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2r92 h PRO 76 CO 0.37 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.79 2r92 n LYS 77 N -2.31 0.00 0.00 1.05 5.02 -1.26 -4.89 118.16 115.77 2r92 n LYS 77 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2r92 n LYS 77 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.20 2r92 n LYS 77 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2r92 n HIS 79 N -0.85 -1.06 -0.53 0.00 8.25 -1.26 -4.94 115.22 114.83 2r92 n HIS 79 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.44 2r92 n HIS 79 Cb 0.00 -1.45 0.02 0.00 1.12 0.00 0.00 29.99 29.67 2r92 n HIS 79 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2r92 n SER 80 N 0.08 -1.08 -2.04 0.41 7.64 -1.26 -4.71 113.62 112.66 2r92 n SER 80 Ca -0.04 -0.54 0.02 0.00 1.01 0.00 0.00 58.87 59.32 2r92 n SER 80 Cb 0.22 -0.07 0.03 0.00 -1.01 0.00 0.00 64.21 63.38 2r92 n SER 80 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2r92 n ARG 81 N -1.72 0.71 -3.85 1.43 1.74 -1.26 -3.79 116.66 109.92 2r92 n ARG 81 Ca 0.01 -2.57 -0.30 0.00 -0.77 0.00 0.00 57.85 54.21 2r92 n ARG 81 Cb 0.04 -0.63 -0.15 0.00 -1.02 0.00 0.00 32.46 30.70 2r92 n ARG 81 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2r92 s GLU 82 N -1.52 1.04 0.02 5.56 2.02 -1.26 -4.66 118.70 119.90 2r92 s GLU 82 Ca 0.30 -1.33 0.05 0.00 0.02 0.00 0.00 54.97 54.01 2r92 s GLU 82 Cb 0.36 -2.45 -0.02 0.00 0.10 0.00 0.00 34.13 32.11 2r92 s GLU 82 CO -0.11 -0.94 -0.16 -0.80 0.02 0.00 0.00 175.26 173.27 2r92 s ASN 83 N 1.36 1.93 -0.38 -0.19 0.01 -1.21 -2.68 114.94 113.76 2r92 s ASN 83 Ca 0.09 -0.40 0.02 0.00 -0.71 0.00 0.00 52.86 51.86 2r92 s ASN 83 Cb -0.18 -0.17 0.11 0.00 0.41 0.00 0.00 41.25 41.42 2r92 s ASN 83 CO -0.18 0.13 0.15 0.54 -1.51 0.00 0.00 177.10 176.23 2r92 s VAL 84 N -0.64 1.51 0.45 1.60 0.11 -1.11 -1.51 120.40 120.82 2r92 s VAL 84 Ca 0.05 -2.17 0.01 0.00 -2.93 0.00 0.00 61.98 56.94 2r92 s VAL 84 Cb -0.07 -2.09 0.00 0.00 -1.53 0.00 0.00 36.38 32.69 2r92 s VAL 84 CO 0.01 -0.75 0.67 0.72 -3.33 0.00 0.00 175.10 172.42 2r92 s PHE 85 N 0.86 3.16 0.00 1.54 -0.00 -1.16 -3.66 117.98 118.72 2r92 s PHE 85 Ca 0.13 0.15 0.00 0.00 -0.00 0.00 0.00 56.93 57.22 2r92 s PHE 85 Cb -0.21 -2.35 0.00 0.00 -0.00 0.00 0.00 43.02 40.46 2r92 s PHE 85 CO -0.11 -0.40 0.00 1.97 -0.00 0.00 0.00 175.22 176.68 2r92 n PHE 86 N -2.08 -0.16 -4.52 3.49 1.16 -0.91 -4.33 117.46 110.12 2r92 n PHE 86 Ca 0.02 0.00 -0.25 0.00 -1.87 0.00 0.00 57.45 55.35 2r92 n PHE 86 Cb 0.58 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.34 2r92 n PHE 86 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 2r92 s GLN 87 N 0.38 1.76 -0.34 3.97 -0.21 -1.26 -2.28 119.66 121.69 2r92 s GLN 87 Ca 0.00 -1.92 -0.39 0.00 0.02 0.00 0.00 55.36 53.07 2r92 s GLN 87 Cb 0.00 -1.51 -0.14 0.00 1.00 0.00 0.00 33.01 32.36 2r92 s GLN 87 CO 0.00 0.07 1.98 0.45 -2.12 0.00 0.00 175.29 175.67 2r92 n SER 88 N -0.76 2.07 0.00 5.90 2.88 -1.26 -4.80 113.62 117.66 2r92 n SER 88 Ca -0.05 0.75 0.08 0.00 -1.33 0.00 0.00 58.87 58.33 2r92 n SER 88 Cb 0.64 -1.16 0.40 0.00 -0.75 0.00 0.00 64.21 63.34 2r92 n SER 88 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2r92 n GLN 89 N 6.83 0.14 -2.20 -1.46 1.13 -1.24 -4.54 117.38 116.04 2r92 n GLN 89 Ca 0.36 0.16 -0.36 0.00 -1.94 0.00 0.00 57.00 55.23 2r92 n GLN 89 Cb 0.15 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.96 2r92 n GLN 89 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 2r92 s GLN 90 N -2.76 2.83 -1.11 -1.09 0.74 -1.25 -4.87 119.66 112.13 2r92 s GLN 90 Ca 0.13 -0.03 -0.26 0.00 0.05 0.00 0.00 55.36 55.25 2r92 s GLN 90 Cb 0.11 -4.68 -0.20 0.00 1.10 0.00 0.00 33.01 29.35 2r92 s GLN 90 CO 0.28 -2.76 2.08 1.03 -0.55 0.00 0.00 175.29 175.37 2r92 s ARG 91 N 6.54 1.43 0.04 1.67 1.81 -1.26 -4.86 118.95 124.32 2r92 s ARG 91 Ca 0.60 -0.60 0.04 0.00 -1.72 0.00 0.00 55.73 54.04 2r92 s ARG 91 Cb -0.08 -5.04 -0.02 0.00 -0.45 0.00 0.00 34.95 29.36 2r92 s ARG 91 CO 0.09 -5.23 -0.13 0.50 -0.68 0.00 0.00 175.30 169.86 2r92 s ARG 92 N 8.04 0.84 0.05 3.54 3.52 -1.26 -5.08 118.95 128.60 2r92 s ARG 92 Ca 0.79 -0.71 -0.31 0.00 -0.13 0.00 0.00 55.73 55.37 2r92 s ARG 92 Cb -0.04 -0.81 -0.17 0.00 -1.56 0.00 0.00 34.95 32.37 2r92 s ARG 92 CO 0.17 0.20 1.45 0.87 -0.81 0.00 0.00 175.30 177.19 2r92 h LYS 93 N 4.96 -1.06 -0.09 5.12 1.57 -2.04 -3.15 116.57 121.89 2r92 h LYS 93 Ca -0.37 0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.51 2r92 h LYS 93 Cb 1.18 0.24 -0.00 0.00 0.08 0.00 0.00 32.23 33.73 2r92 h LYS 93 CO 0.44 -0.71 0.21 0.38 -0.57 0.00 0.00 179.45 179.20 2r92 h ASP 94 N -1.11 0.00 -1.56 0.86 2.03 -1.98 -3.45 116.42 111.21 2r92 h ASP 94 Ca -0.11 0.00 -0.46 0.00 -0.73 0.00 0.00 57.03 55.72 2r92 h ASP 94 Cb 0.84 0.00 0.15 0.00 -0.83 0.00 0.00 39.33 39.49 2r92 h ASP 94 CO 0.19 0.00 -0.97 0.41 -1.03 0.00 0.00 179.24 177.83 2r92 n THR 95 N -3.29 0.00 -2.58 1.15 -1.04 -1.19 -4.99 114.28 102.34 2r92 n THR 95 Ca -0.00 -0.39 -0.24 0.00 -2.04 0.00 0.00 64.05 61.37 2r92 n THR 95 Cb 0.30 0.00 0.12 0.00 -1.82 0.00 0.00 70.33 68.93 2r92 n THR 95 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2r92 s SER 96 N -0.78 4.16 -0.42 8.00 1.04 -1.26 -5.06 113.70 119.39 2r92 s SER 96 Ca 0.43 -0.44 0.05 0.00 0.48 0.00 0.00 55.95 56.47 2r92 s SER 96 Cb -0.36 0.15 0.43 0.00 0.10 0.00 0.00 66.02 66.35 2r92 s SER 96 CO 0.53 -2.00 1.24 0.23 0.98 0.00 0.00 173.24 174.22 2r92 n MET 97 N -2.93 3.43 -3.14 4.02 2.81 -1.26 -4.80 117.12 115.25 2r92 n MET 97 Ca 0.16 -4.26 -0.30 0.00 -1.81 0.00 0.00 57.70 51.50 2r92 n MET 97 Cb 0.61 -2.27 -0.03 0.00 -0.71 0.00 0.00 33.22 30.82 2r92 n MET 97 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2r92 s VAL 98 N -5.10 4.90 -0.00 2.03 1.01 -1.26 -5.07 120.40 116.90 2r92 s VAL 98 Ca 0.50 0.37 -0.09 0.00 0.00 0.00 0.00 61.98 62.77 2r92 s VAL 98 Cb 0.41 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 2r92 s VAL 98 CO -0.10 -0.37 0.29 -0.76 0.00 0.00 0.00 175.10 174.16 2r92 s LEU 99 N -3.58 4.39 -0.24 3.92 1.43 -1.26 -4.40 118.68 118.94 2r92 s LEU 99 Ca 0.48 0.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.23 2r92 s LEU 99 Cb -0.11 -2.61 0.03 0.00 0.03 0.00 0.00 46.19 43.54 2r92 s LEU 99 CO 0.29 0.28 -0.10 -0.36 0.23 0.00 0.00 176.35 176.69 2r92 s PHE 100 N -1.23 3.07 0.38 0.29 0.40 -0.96 -1.83 117.98 118.10 2r92 s PHE 100 Ca 0.26 -1.79 0.07 0.00 -0.60 0.00 0.00 56.93 54.86 2r92 s PHE 100 Cb -0.14 -2.00 0.00 0.00 0.51 0.00 0.00 43.02 41.39 2r92 s PHE 100 CO 0.14 -0.79 0.53 -0.06 0.70 0.00 0.00 175.22 175.74 2r92 s PHE 101 N 1.26 2.99 -0.12 0.36 0.40 -0.73 -2.15 117.98 119.98 2r92 s PHE 101 Ca -0.02 -0.26 -0.07 0.00 -0.60 0.00 0.00 56.93 55.98 2r92 s PHE 101 Cb -0.17 -2.19 0.05 0.00 0.51 0.00 0.00 43.02 41.21 2r92 s PHE 101 CO -0.06 -0.22 0.30 0.08 0.70 0.00 0.00 175.22 176.01 2r92 s VAL 102 N -2.28 -0.03 0.27 -0.44 1.01 -1.24 -3.45 120.40 114.24 2r92 s VAL 102 Ca 0.50 0.11 -0.27 0.00 0.00 0.00 0.00 61.98 62.31 2r92 s VAL 102 Cb -0.10 -0.45 -0.09 0.00 0.00 0.00 0.00 36.38 35.74 2r92 s VAL 102 CO 0.32 0.04 0.91 0.00 0.00 0.00 0.00 175.10 176.38 2r92 n LEU 104 N 1.02 0.68 -2.60 0.00 4.77 -1.09 -2.64 117.00 117.14 2r92 n LEU 104 Ca -0.01 -0.08 -0.24 0.00 -0.03 0.00 0.00 56.01 55.66 2r92 n LEU 104 Cb 0.49 -0.21 -0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2r92 n LEU 104 CO 0.47 0.14 0.12 -1.20 -1.33 0.00 0.00 177.39 175.58 2r92 n SER 105 N -1.12 3.98 0.00 -1.43 7.64 -1.26 -4.83 113.62 116.60 2r92 n SER 105 Ca 0.09 -3.52 0.00 0.00 1.01 0.00 0.00 58.87 56.45 2r92 n SER 105 Cb 0.34 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 2r92 n SER 105 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2r92 n SER 107 N 0.00 -1.71 -4.89 0.00 7.64 -1.08 -5.03 113.62 108.55 2r92 n SER 107 Ca 0.00 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.65 2r92 n SER 107 Cb 0.00 -0.43 -0.03 0.00 -1.01 0.00 0.00 64.21 62.74 2r92 n SER 107 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2r92 s HIS 108 N -2.78 3.30 -0.79 1.43 5.65 -1.26 -4.89 115.29 115.95 2r92 s HIS 108 Ca 0.00 -0.03 0.03 0.00 0.25 0.00 0.00 55.06 55.31 2r92 s HIS 108 Cb 0.00 -1.52 0.27 0.00 -1.18 0.00 0.00 32.58 30.15 2r92 s HIS 108 CO 0.00 0.49 1.01 -0.89 -0.65 0.00 0.00 174.74 174.70 2r92 n ILE 109 N -1.05 3.42 -3.18 0.89 5.41 -1.26 -3.33 119.36 120.26 2r92 n ILE 109 Ca -0.08 -5.48 -0.37 0.00 1.00 0.00 0.00 62.75 57.81 2r92 n ILE 109 Cb 0.56 -2.09 -0.06 0.00 -0.71 0.00 0.00 39.64 37.35 2r92 n ILE 109 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 2r92 s PHE 110 N -2.61 3.74 0.46 1.39 -0.12 -1.22 -4.87 117.98 114.74 2r92 s PHE 110 Ca 0.37 1.34 0.07 0.00 -0.05 0.00 0.00 56.93 58.67 2r92 s PHE 110 Cb 0.12 -2.57 0.02 0.00 -0.63 0.00 0.00 43.02 39.96 2r92 s PHE 110 CO 0.03 0.47 0.63 0.99 -0.05 0.00 0.00 175.22 177.28 2r92 s THR 111 N -1.31 2.85 -0.37 -4.49 2.01 -1.26 -1.77 115.64 111.29 2r92 s THR 111 Ca 0.36 -0.95 0.07 0.00 0.31 0.00 0.00 61.69 61.48 2r92 s THR 111 Cb -0.18 -2.90 0.60 0.00 0.01 0.00 0.00 72.50 70.03 2r92 s THR 111 CO 0.21 0.00 1.71 -0.24 -0.69 0.00 0.00 174.62 175.61 2r92 n SER 112 N -1.97 3.29 -4.56 3.53 2.88 -0.76 -4.91 113.62 111.12 2r92 n SER 112 Ca 0.09 -3.64 -0.22 0.00 -1.33 0.00 0.00 58.87 53.77 2r92 n SER 112 Cb 0.59 -0.74 -0.06 0.00 -0.75 0.00 0.00 64.21 63.26 2r92 n SER 112 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2r92 s ASP 113 N -1.82 4.69 -0.00 -3.46 1.01 -1.26 -4.76 116.67 111.06 2r92 s ASP 113 Ca 0.51 -0.43 0.00 0.00 0.71 0.00 0.00 52.55 53.35 2r92 s ASP 113 Cb 0.44 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.83 2r92 s ASP 113 CO 0.06 -3.16 0.64 0.00 0.21 0.00 0.00 175.17 172.91 2r92 n GLN 114 N 8.84 1.04 0.00 8.23 6.02 -1.26 -1.02 117.38 139.22 2r92 n GLN 114 Ca 0.43 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.38 2r92 n GLN 114 Cb 0.46 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 30.33 2r92 n GLN 114 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2r92 n LYS 115 N 0.12 0.05 -4.28 -1.09 5.02 -1.26 -5.01 118.16 111.71 2r92 n LYS 115 Ca 0.00 -0.32 -0.38 0.00 -2.02 0.00 0.00 58.31 55.60 2r92 n LYS 115 Cb 0.32 -0.80 -0.05 0.00 -0.02 0.00 0.00 35.03 34.48 2r92 n LYS 115 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2r92 n ASN 116 N -0.10 -2.62 0.00 4.39 3.02 -0.19 -5.28 115.26 114.48 2r92 n ASN 116 Ca 0.00 -1.04 0.16 0.00 -0.03 0.00 0.00 54.58 53.66 2r92 n ASN 116 Cb 0.06 -2.20 0.94 0.00 -0.61 0.00 0.00 39.78 37.97 2r92 n ASN 116 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93