#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rk9 s LEU 5 N 0.00 4.53 0.20 3.22 1.43 -1.26 -5.04 118.68 121.76 2rk9 s LEU 5 Ca 0.00 1.94 -0.09 0.00 -1.03 0.00 0.00 54.13 54.95 2rk9 s LEU 5 Cb 0.00 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.61 2rk9 s LEU 5 CO 0.00 -0.07 0.32 -0.13 0.23 0.00 0.00 176.35 176.70 2rk9 s ARG 6 N -0.43 1.29 -0.14 1.70 1.81 -1.26 -5.01 118.95 116.91 2rk9 s ARG 6 Ca 0.46 -1.28 0.00 0.00 -1.72 0.00 0.00 55.73 53.20 2rk9 s ARG 6 Cb -0.26 0.39 -0.01 0.00 -0.45 0.00 0.00 34.95 34.62 2rk9 s ARG 6 CO 0.32 -0.49 -0.15 0.54 -0.68 0.00 0.00 175.30 174.85 2rk9 s VAL 7 N -4.02 2.82 -0.27 3.52 0.11 -1.26 -1.35 120.40 119.95 2rk9 s VAL 7 Ca 0.23 -0.73 0.01 0.00 -2.93 0.00 0.00 61.98 58.55 2rk9 s VAL 7 Cb 0.03 -2.18 0.05 0.00 -1.53 0.00 0.00 36.38 32.75 2rk9 s VAL 7 CO 0.05 0.52 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.59 2rk9 s VAL 8 N 0.57 2.57 0.34 2.04 1.01 0.12 -4.93 120.40 122.11 2rk9 s VAL 8 Ca -0.09 -1.45 -0.28 0.00 0.00 0.00 0.00 61.98 60.16 2rk9 s VAL 8 Cb -0.16 -2.47 -0.10 0.00 0.00 0.00 0.00 36.38 33.66 2rk9 s VAL 8 CO 0.04 -0.02 1.24 -2.84 0.00 0.00 0.00 175.10 173.51 2rk9 s PRO 9 N 1.19 4.34 -0.23 2.72 0.02 -1.26 -1.78 135.00 140.00 2rk9 s PRO 9 Ca -0.06 2.06 -0.02 0.00 0.02 0.00 0.00 61.00 62.99 2rk9 s PRO 9 Cb -0.19 -3.01 0.01 0.00 0.02 0.00 0.00 34.50 31.33 2rk9 s PRO 9 CO -0.04 -0.14 -0.06 -2.00 -0.33 0.00 0.00 177.00 174.43 2rk9 s GLU 10 N -1.83 3.07 -0.17 5.54 2.12 -0.19 -4.60 118.70 122.64 2rk9 s GLU 10 Ca 0.50 -0.82 -0.05 0.00 0.36 0.00 0.00 54.97 54.96 2rk9 s GLU 10 Cb -0.36 -2.97 -0.03 0.00 0.26 0.00 0.00 34.13 31.03 2rk9 s GLU 10 CO 0.48 -0.31 -0.01 -0.51 -0.54 0.00 0.00 175.26 174.37 2rk9 s LEU 11 N 1.39 3.37 0.12 2.70 1.43 -1.26 -1.44 118.68 125.00 2rk9 s LEU 11 Ca 0.03 -0.10 -0.26 0.00 -1.03 0.00 0.00 54.13 52.77 2rk9 s LEU 11 Cb -0.15 -1.83 -0.07 0.00 0.03 0.00 0.00 46.19 44.16 2rk9 s LEU 11 CO -0.05 0.14 0.81 -0.31 0.23 0.00 0.00 176.35 177.17 2rk9 s TYR 12 N 0.53 3.85 -0.01 0.29 1.51 0.03 -0.76 117.35 122.79 2rk9 s TYR 12 Ca -0.01 1.62 0.07 0.00 -1.01 0.00 0.00 57.07 57.74 2rk9 s TYR 12 Cb -0.14 -2.84 -0.02 0.00 -0.11 0.00 0.00 41.96 38.86 2rk9 s TYR 12 CO 0.02 0.39 -0.23 0.00 -1.11 0.00 0.00 175.55 174.62 2rk9 h PHE 14 N 5.43 0.47 -3.23 0.00 0.04 -1.93 -1.07 116.94 116.65 2rk9 h PHE 14 Ca -0.42 -0.14 -0.62 0.00 2.80 0.00 0.00 57.97 59.60 2rk9 h PHE 14 Cb 1.13 -0.10 -0.40 0.00 2.20 0.00 0.00 35.95 38.78 2rk9 h PHE 14 CO 0.41 0.77 -0.72 0.34 -0.60 0.00 0.00 178.31 178.50 2rk9 s ASP 15 N -6.16 4.08 0.29 2.17 -1.08 -1.26 -4.46 116.67 110.25 2rk9 s ASP 15 Ca -0.14 -2.34 0.04 0.00 -0.52 0.00 0.00 52.55 49.59 2rk9 s ASP 15 Cb 0.06 -1.21 0.70 0.00 -1.46 0.00 0.00 42.92 41.01 2rk9 s ASP 15 CO 0.76 -0.32 1.76 -0.29 0.52 0.00 0.00 175.17 177.60 2rk9 h ILE 16 N 5.88 0.68 -0.21 4.11 6.09 -1.94 -0.48 117.51 131.65 2rk9 h ILE 16 Ca -0.06 -0.24 -0.10 0.00 -1.37 0.00 0.00 64.86 63.09 2rk9 h ILE 16 Cb 0.96 -0.07 -0.01 0.00 0.47 0.00 0.00 36.82 38.17 2rk9 h ILE 16 CO 0.52 0.13 -0.31 0.78 -3.07 0.00 0.00 178.15 176.19 2rk9 h ASN 17 N 0.69 0.43 -0.35 2.19 2.35 -1.98 0.19 115.58 119.10 2rk9 h ASN 17 Ca 0.55 -0.16 -0.10 0.00 -0.55 0.00 0.00 56.30 56.05 2rk9 h ASN 17 Cb 0.87 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.12 2rk9 h ASN 17 CO -0.40 0.72 -0.17 0.58 -1.65 0.00 0.00 177.43 176.51 2rk9 h VAL 18 N 0.36 1.29 -0.28 2.81 2.07 -1.57 -1.68 116.25 119.24 2rk9 h VAL 18 Ca 0.05 -1.29 -0.14 0.00 0.82 0.00 0.00 66.70 66.14 2rk9 h VAL 18 Cb 0.73 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2rk9 h VAL 18 CO 0.06 0.42 -0.36 0.28 0.02 0.00 0.00 177.57 177.99 2rk9 h SER 19 N 0.51 0.81 -0.56 0.57 0.02 -1.03 -2.33 113.55 111.54 2rk9 h SER 19 Ca 0.08 -0.50 -0.03 0.00 -0.84 0.00 0.00 61.79 60.50 2rk9 h SER 19 Cb 0.71 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 2rk9 h SER 19 CO 0.05 1.15 0.24 -0.61 -1.14 0.00 0.00 176.83 176.52 2rk9 h GLN 20 N 0.50 0.83 -0.80 3.45 4.15 -0.61 -2.13 115.11 120.49 2rk9 h GLN 20 Ca 0.04 -0.14 -0.04 0.00 0.77 0.00 0.00 58.65 59.28 2rk9 h GLN 20 Cb 0.95 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 28.46 2rk9 h GLN 20 CO 0.09 0.70 0.36 0.77 -1.93 0.00 0.00 178.83 178.82 2rk9 h SER 21 N 0.77 1.06 0.23 -0.69 0.02 -1.28 0.35 113.55 114.01 2rk9 h SER 21 Ca 0.19 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2rk9 h SER 21 Cb 0.17 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.44 2rk9 h SER 21 CO -0.02 0.91 -0.11 0.15 -1.14 0.00 0.00 176.83 176.63 2rk9 h PHE 22 N 1.15 -0.28 -0.69 3.45 3.57 -1.15 0.47 116.94 123.45 2rk9 h PHE 22 Ca 0.27 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 2rk9 h PHE 22 Cb 0.15 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 2rk9 h PHE 22 CO 0.02 -0.13 0.42 0.74 -2.23 0.00 0.00 178.31 177.13 2rk9 h PHE 23 N -0.36 0.91 0.02 0.41 0.04 -1.18 -0.16 116.94 116.61 2rk9 h PHE 23 Ca -0.03 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 2rk9 h PHE 23 Cb 0.28 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.13 2rk9 h PHE 23 CO -0.04 0.61 -0.01 0.28 -0.60 0.00 0.00 178.31 178.54 2rk9 h VAL 24 N 0.94 0.67 -0.08 -0.55 2.07 -0.81 0.18 116.25 118.67 2rk9 h VAL 24 Ca 0.25 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 66.24 2rk9 h VAL 24 Cb -0.04 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2rk9 h VAL 24 CO -0.05 0.22 -0.20 0.44 0.02 0.00 0.00 177.57 178.01 2rk9 h ASP 25 N -1.00 0.31 0.00 0.57 3.32 -0.17 -1.99 116.42 117.47 2rk9 h ASP 25 Ca -0.00 -0.59 -0.03 0.00 0.02 0.00 0.00 57.03 56.43 2rk9 h ASP 25 Cb 0.38 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2rk9 h ASP 25 CO 0.00 0.84 -0.15 0.58 -1.72 0.00 0.00 179.24 178.79 2rk9 h VAL 26 N -0.22 1.26 0.00 -1.35 2.07 -1.03 -3.38 116.25 113.61 2rk9 h VAL 26 Ca -0.00 -2.00 0.00 0.00 0.82 0.00 0.00 66.70 65.52 2rk9 h VAL 26 Cb 0.80 2.44 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 2rk9 h VAL 26 CO 0.04 0.43 -0.38 0.18 0.02 0.00 0.00 177.57 177.86 2rk9 n LEU 27 N -4.63 0.50 -0.23 2.57 4.77 -0.41 -4.96 117.00 114.61 2rk9 n LEU 27 Ca -0.10 0.24 -0.03 0.00 -0.03 0.00 0.00 56.01 56.09 2rk9 n LEU 27 Cb 0.39 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 2rk9 n LEU 27 CO 0.24 0.01 -0.03 0.61 -1.33 0.00 0.00 177.39 176.89 2rk9 n GLY 28 N 1.43 0.58 3.79 -0.72 0.00 -0.74 -4.96 105.19 104.56 2rk9 n GLY 28 Ca 0.05 -0.93 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 2rk9 n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2rk9 s PHE 29 N -2.11 2.83 -0.05 1.61 2.99 0.55 -4.95 117.98 118.84 2rk9 s PHE 29 Ca 0.00 1.51 0.03 0.00 0.00 0.00 0.00 56.93 58.47 2rk9 s PHE 29 Cb 0.00 -3.02 -0.03 0.00 0.00 0.00 0.00 43.02 39.97 2rk9 s PHE 29 CO 0.00 -1.45 -0.14 -2.00 -0.00 0.00 0.00 175.22 171.63 2rk9 s GLU 30 N -4.53 2.56 -0.11 0.44 2.12 -0.30 -4.34 118.70 114.53 2rk9 s GLU 30 Ca 0.62 -0.69 -0.30 0.00 0.36 0.00 0.00 54.97 54.97 2rk9 s GLU 30 Cb -0.17 -2.40 -0.01 0.00 0.26 0.00 0.00 34.13 31.81 2rk9 s GLU 30 CO 0.47 0.60 1.01 0.08 -0.54 0.00 0.00 175.26 176.89 2rk9 s VAL 31 N -0.68 4.76 -0.10 3.70 1.01 -1.26 -1.75 120.40 126.08 2rk9 s VAL 31 Ca 0.10 2.03 -0.08 0.00 0.00 0.00 0.00 61.98 64.04 2rk9 s VAL 31 Cb -0.11 -4.31 -0.27 0.00 0.00 0.00 0.00 36.38 31.69 2rk9 s VAL 31 CO 0.01 -0.01 0.44 0.11 0.00 0.00 0.00 175.10 175.65 2rk9 h LYS 32 N 7.13 0.30 -2.16 2.72 1.57 -1.29 -3.49 116.57 121.36 2rk9 h LYS 32 Ca -0.30 -0.51 0.21 0.00 -1.87 0.00 0.00 60.65 58.18 2rk9 h LYS 32 Cb 1.14 0.19 -0.08 0.00 0.08 0.00 0.00 32.23 33.56 2rk9 h LYS 32 CO 0.86 1.24 0.57 1.52 -0.57 0.00 0.00 179.45 183.08 2rk9 s TYR 33 N -2.56 -0.09 0.30 -1.35 -0.85 -1.21 -5.05 117.35 106.54 2rk9 s TYR 33 Ca -0.21 -0.18 -0.06 0.00 -0.52 0.00 0.00 57.07 56.10 2rk9 s TYR 33 Cb 0.06 0.62 -0.00 0.00 0.38 0.00 0.00 41.96 43.03 2rk9 s TYR 33 CO 0.79 -0.71 0.45 -1.21 -1.52 0.00 0.00 175.55 173.35 2rk9 s GLU 34 N -2.99 1.74 -0.44 -3.49 2.02 -1.26 -1.71 118.70 112.57 2rk9 s GLU 34 Ca 0.14 -1.58 0.05 0.00 0.02 0.00 0.00 54.97 53.60 2rk9 s GLU 34 Cb -0.00 0.44 0.18 0.00 0.10 0.00 0.00 34.13 34.85 2rk9 s GLU 34 CO 0.01 -0.72 0.45 0.54 0.02 0.00 0.00 175.26 175.57 2rk9 n ARG 35 N -0.48 0.30 -0.28 1.61 1.74 -0.86 -5.01 116.66 113.68 2rk9 n ARG 35 Ca -0.00 -2.87 0.07 0.00 -0.77 0.00 0.00 57.85 54.28 2rk9 n ARG 35 Cb 0.62 -1.60 0.19 0.00 -1.02 0.00 0.00 32.46 30.65 2rk9 n ARG 35 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2rk9 h PRO 36 N 5.37 0.08 0.00 5.56 0.11 -1.96 -0.82 132.00 140.34 2rk9 h PRO 36 Ca 0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.31 2rk9 h PRO 36 Cb 0.96 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.05 2rk9 h PRO 36 CO 0.29 0.06 0.00 0.38 -0.21 0.00 0.00 178.00 178.51 2rk9 h ASP 37 N 0.09 0.00 -0.02 -2.05 2.03 -1.96 0.32 116.42 114.82 2rk9 h ASP 37 Ca 0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.76 2rk9 h ASP 37 Cb 0.85 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.35 2rk9 h ASP 37 CO -0.74 0.00 -0.11 -0.62 -1.03 0.00 0.00 179.24 176.74 2rk9 n GLU 38 N -2.95 1.61 -3.63 4.15 1.02 -0.35 -4.96 120.64 115.53 2rk9 n GLU 38 Ca -0.02 -1.41 -0.26 0.00 -0.02 0.00 0.00 57.16 55.45 2rk9 n GLU 38 Cb 0.10 -1.35 0.05 0.00 -0.02 0.00 0.00 31.44 30.21 2rk9 n GLU 38 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2rk9 n GLU 39 N 0.73 -6.53 -4.11 3.49 1.02 0.10 -4.38 120.64 110.96 2rk9 n GLU 39 Ca 0.10 0.74 -0.35 0.00 -0.02 0.00 0.00 57.16 57.63 2rk9 n GLU 39 Cb 0.45 -5.70 -0.08 0.00 -0.02 0.00 0.00 31.44 26.08 2rk9 n GLU 39 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2rk9 s PHE 40 N -3.28 3.33 -0.03 -0.32 5.36 -1.00 -1.01 117.98 121.03 2rk9 s PHE 40 Ca 0.57 0.27 -0.01 0.00 -0.96 0.00 0.00 56.93 56.81 2rk9 s PHE 40 Cb -0.27 -1.92 0.03 0.00 -0.34 0.00 0.00 43.02 40.53 2rk9 s PHE 40 CO 0.71 0.48 0.04 0.08 -1.46 0.00 0.00 175.22 175.06 2rk9 s VAL 41 N -0.60 -0.04 -0.26 3.12 1.01 0.15 -2.03 120.40 121.75 2rk9 s VAL 41 Ca 0.11 0.29 -0.09 0.00 0.00 0.00 0.00 61.98 62.29 2rk9 s VAL 41 Cb -0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.08 2rk9 s VAL 41 CO 0.02 0.14 0.11 -0.47 0.00 0.00 0.00 175.10 174.91 2rk9 s TYR 42 N 1.57 3.13 0.35 5.22 5.04 -0.69 -0.68 117.35 131.29 2rk9 s TYR 42 Ca -0.03 -0.27 0.09 0.00 -2.44 0.00 0.00 57.07 54.43 2rk9 s TYR 42 Cb -0.13 -2.29 -0.06 0.00 0.35 0.00 0.00 41.96 39.83 2rk9 s TYR 42 CO -0.03 -0.31 -0.08 -0.51 -1.34 0.00 0.00 175.55 173.29 2rk9 s LEU 43 N 1.66 2.77 -0.01 6.97 1.02 0.06 -0.75 118.68 130.40 2rk9 s LEU 43 Ca 0.06 -1.19 -0.17 0.00 0.02 0.00 0.00 54.13 52.86 2rk9 s LEU 43 Cb -0.16 -1.03 0.03 0.00 0.02 0.00 0.00 46.19 45.05 2rk9 s LEU 43 CO 0.06 -0.22 0.37 0.28 0.02 0.00 0.00 176.35 176.86 2rk9 s THR 44 N -2.61 0.05 -0.34 5.49 -1.32 -0.71 -1.38 115.64 114.83 2rk9 s THR 44 Ca 0.33 -0.43 -0.00 0.00 -1.21 0.00 0.00 61.69 60.38 2rk9 s THR 44 Cb 0.03 -0.72 0.11 0.00 -1.51 0.00 0.00 72.50 70.40 2rk9 s THR 44 CO 0.17 -0.23 0.13 -0.22 -2.21 0.00 0.00 174.62 172.25 2rk9 s LEU 45 N -1.42 2.33 -1.58 9.08 2.96 -0.08 -1.15 118.68 128.83 2rk9 s LEU 45 Ca -0.12 -1.86 -0.04 0.00 -0.22 0.00 0.00 54.13 51.90 2rk9 s LEU 45 Cb -0.04 -0.90 0.01 0.00 0.50 0.00 0.00 46.19 45.77 2rk9 s LEU 45 CO 0.04 -0.38 0.41 0.47 -1.32 0.00 0.00 176.35 175.56 2rk9 n ASP 46 N 4.56 -5.78 0.00 3.68 8.00 -1.26 -2.35 116.55 123.40 2rk9 n ASP 46 Ca 0.01 -0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.31 2rk9 n ASP 46 Cb 0.40 -4.72 0.00 0.00 -0.02 0.00 0.00 41.12 36.78 2rk9 n ASP 46 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rk9 n GLY 47 N -1.33 1.21 3.61 0.44 0.00 -1.26 -5.05 105.19 102.81 2rk9 n GLY 47 Ca -0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 2rk9 n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rk9 s VAL 48 N -2.28 5.20 0.15 1.61 1.01 -0.99 -5.06 120.40 120.03 2rk9 s VAL 48 Ca 0.00 0.52 0.02 0.00 0.00 0.00 0.00 61.98 62.52 2rk9 s VAL 48 Cb 0.00 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 2rk9 s VAL 48 CO 0.00 0.18 0.28 -1.81 0.00 0.00 0.00 175.10 173.75 2rk9 s ASP 49 N 1.62 6.33 0.00 3.32 1.01 -1.26 -0.90 116.67 126.79 2rk9 s ASP 49 Ca 0.14 0.17 0.00 0.00 0.71 0.00 0.00 52.55 53.57 2rk9 s ASP 49 Cb -0.16 -1.91 0.00 0.00 1.01 0.00 0.00 42.92 41.86 2rk9 s ASP 49 CO 0.10 0.06 0.00 0.55 0.21 0.00 0.00 175.17 176.08 2rk9 n VAL 50 N -0.52 0.00 -3.64 -1.27 3.14 -0.48 -4.38 118.33 111.18 2rk9 n VAL 50 Ca -0.07 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.26 2rk9 n VAL 50 Cb 0.54 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 33.25 2rk9 n VAL 50 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2rk9 s LEU 52 N 0.00 -0.50 -0.13 6.55 1.43 0.15 -0.76 118.68 125.42 2rk9 s LEU 52 Ca 0.00 0.85 -0.02 0.00 -1.03 0.00 0.00 54.13 53.94 2rk9 s LEU 52 Cb 0.00 1.81 0.04 0.00 0.03 0.00 0.00 46.19 48.07 2rk9 s LEU 52 CO 0.00 -0.14 0.00 -0.70 0.23 0.00 0.00 176.35 175.74 2rk9 s GLU 53 N 0.90 0.79 0.65 1.70 2.56 0.06 -0.67 118.70 124.69 2rk9 s GLU 53 Ca -0.04 -0.18 -0.15 0.00 0.00 0.00 0.00 54.97 54.61 2rk9 s GLU 53 Cb -0.04 -1.54 -0.01 0.00 2.00 0.00 0.00 34.13 34.54 2rk9 s GLU 53 CO -0.12 -0.43 1.09 0.20 -0.56 0.00 0.00 175.26 175.43 2rk9 s GLY 54 N 1.87 2.08 0.00 -1.50 0.00 -0.18 -0.83 107.32 108.76 2rk9 s GLY 54 Ca 0.02 0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.19 2rk9 s GLY 54 CO -0.07 0.78 0.00 1.39 0.00 0.00 0.00 173.10 175.20 2rk9 n ILE 55 N -2.41 0.00 -2.84 0.90 5.41 -0.40 -4.80 119.36 115.21 2rk9 n ILE 55 Ca 0.09 0.00 -0.44 0.00 1.00 0.00 0.00 62.75 63.41 2rk9 n ILE 55 Cb 0.52 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.45 2rk9 n ILE 55 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2rk9 s LEU 67 N 0.00 4.69 -0.01 1.39 1.43 -1.26 -4.96 118.68 119.96 2rk9 s LEU 67 Ca 0.00 -2.57 0.03 0.00 -1.03 0.00 0.00 54.13 50.57 2rk9 s LEU 67 Cb 0.00 -2.45 -0.01 0.00 0.03 0.00 0.00 46.19 43.76 2rk9 s LEU 67 CO 0.00 -0.96 -0.12 -1.61 0.23 0.00 0.00 176.35 173.90 2rk9 s GLU 68 N 2.60 1.02 0.28 1.70 2.02 -1.26 -5.09 118.70 119.97 2rk9 s GLU 68 Ca 0.43 -0.41 -0.30 0.00 0.02 0.00 0.00 54.97 54.71 2rk9 s GLU 68 Cb -0.02 -0.97 -0.11 0.00 0.10 0.00 0.00 34.13 33.14 2rk9 s GLU 68 CO -0.01 0.23 1.52 0.12 0.02 0.00 0.00 175.26 177.14 2rk9 s PHE 69 N -0.16 2.86 0.10 1.61 5.36 -1.26 -3.54 117.98 122.94 2rk9 s PHE 69 Ca 0.03 0.90 -0.17 0.00 -0.96 0.00 0.00 56.93 56.72 2rk9 s PHE 69 Cb -0.06 -3.96 -0.07 0.00 -0.34 0.00 0.00 43.02 38.59 2rk9 s PHE 69 CO -0.00 -3.17 0.55 -1.25 -1.46 0.00 0.00 175.22 169.89 2rk9 s PRO 70 N -0.50 4.10 0.62 10.12 0.04 -1.26 -5.15 135.00 142.97 2rk9 s PRO 70 Ca 0.61 0.63 -0.09 0.00 0.04 0.00 0.00 61.00 62.19 2rk9 s PRO 70 Cb -0.45 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 30.95 2rk9 s PRO 70 CO 0.46 0.58 0.98 -0.51 0.04 0.00 0.00 177.00 178.56 2rk9 s LEU 71 N -1.42 3.20 -0.59 -3.56 1.43 -0.81 -4.22 118.68 112.70 2rk9 s LEU 71 Ca 0.32 1.08 0.00 0.00 -1.03 0.00 0.00 54.13 54.50 2rk9 s LEU 71 Cb -0.18 -3.98 0.00 0.00 0.03 0.00 0.00 46.19 42.06 2rk9 s LEU 71 CO 0.19 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.36 2rk9 n GLY 72 N -2.71 0.80 3.64 -3.19 0.00 -1.26 -3.67 105.19 98.80 2rk9 n GLY 72 Ca 0.05 -0.80 -0.46 0.00 0.00 0.00 0.00 46.02 44.81 2rk9 n GLY 72 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rk9 n SER 73 N 1.09 2.16 0.00 1.61 3.41 -1.26 -1.39 113.62 119.23 2rk9 n SER 73 Ca -0.06 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.70 2rk9 n SER 73 Cb 0.19 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 62.79 2rk9 n SER 73 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2rk9 n GLY 74 N 1.91 1.94 3.66 5.00 0.00 -1.26 -4.97 105.19 111.46 2rk9 n GLY 74 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2rk9 n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rk9 s VAL 75 N -2.55 4.41 -0.16 1.61 1.01 -0.49 -0.79 120.40 123.44 2rk9 s VAL 75 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 2rk9 s VAL 75 Cb 0.00 -2.90 0.05 0.00 0.00 0.00 0.00 36.38 33.53 2rk9 s VAL 75 CO 0.00 0.57 -0.00 0.21 0.00 0.00 0.00 175.10 175.87 2rk9 s ASN 76 N -0.49 2.69 -0.69 3.32 2.47 -0.52 -4.46 114.94 117.26 2rk9 s ASN 76 Ca 0.09 -0.65 -0.26 0.00 0.42 0.00 0.00 52.86 52.45 2rk9 s ASN 76 Cb -0.12 -0.70 0.04 0.00 -1.45 0.00 0.00 41.25 39.02 2rk9 s ASN 76 CO 0.02 -0.24 1.19 -0.36 -3.72 0.00 0.00 177.10 173.99 2rk9 s PHE 77 N 1.78 2.44 -0.51 0.43 0.08 -0.81 -1.02 117.98 120.37 2rk9 s PHE 77 Ca 0.00 -0.06 -0.28 0.00 0.12 0.00 0.00 56.93 56.71 2rk9 s PHE 77 Cb -0.16 -4.51 0.02 0.00 -0.57 0.00 0.00 43.02 37.80 2rk9 s PHE 77 CO -0.07 -1.87 1.32 -1.14 -0.10 0.00 0.00 175.22 173.35 2rk9 s GLN 78 N 5.20 3.49 -0.29 0.44 0.74 -0.73 -0.58 119.66 127.93 2rk9 s GLN 78 Ca 0.34 0.56 -0.04 0.00 0.05 0.00 0.00 55.36 56.27 2rk9 s GLN 78 Cb -0.10 -4.04 0.03 0.00 1.10 0.00 0.00 33.01 30.00 2rk9 s GLN 78 CO 0.16 -1.69 0.02 -0.46 -0.55 0.00 0.00 175.29 172.77 2rk9 s TRP 79 N 5.38 3.16 0.17 1.67 -0.11 0.47 0.11 118.94 129.79 2rk9 s TRP 79 Ca 0.52 -1.41 -0.31 0.00 1.22 0.00 0.00 56.10 56.12 2rk9 s TRP 79 Cb -0.10 -2.16 -0.09 0.00 -1.50 0.00 0.00 33.47 29.61 2rk9 s TRP 79 CO 0.28 -0.70 1.43 -0.51 -4.62 0.00 0.00 176.95 172.84 2rk9 s ASP 80 N 1.38 6.75 0.19 5.86 1.01 -0.46 -1.06 116.67 130.35 2rk9 s ASP 80 Ca -0.00 2.48 0.04 0.00 0.71 0.00 0.00 52.55 55.78 2rk9 s ASP 80 Cb -0.18 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.10 2rk9 s ASP 80 CO -0.00 -0.68 -0.06 0.68 0.21 0.00 0.00 175.17 175.32 2rk9 s VAL 81 N 0.69 1.17 -0.46 -1.27 -7.23 -0.23 -4.66 120.40 108.41 2rk9 s VAL 81 Ca 0.63 -2.06 0.19 0.00 -1.81 0.00 0.00 61.98 58.93 2rk9 s VAL 81 Cb -0.39 -2.11 -0.25 0.00 0.56 0.00 0.00 36.38 34.18 2rk9 s VAL 81 CO 0.35 -0.53 0.61 2.30 -0.31 0.00 0.00 175.10 177.53 2rk9 n ILE 82 N -0.33 0.00 -3.30 -0.62 -5.35 -1.26 -4.59 119.36 103.91 2rk9 n ILE 82 Ca -0.07 -0.25 -0.25 0.00 -0.27 0.00 0.00 62.75 61.91 2rk9 n ILE 82 Cb 0.62 0.54 -0.08 0.00 -1.74 0.00 0.00 39.64 38.98 2rk9 n ILE 82 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2rk9 n ASP 83 N -1.80 1.12 -0.26 7.28 5.75 -1.26 -4.99 116.55 122.40 2rk9 n ASP 83 Ca 0.00 -2.87 -0.03 0.00 -0.01 0.00 0.00 54.79 51.89 2rk9 n ASP 83 Cb 0.40 -0.64 0.09 0.00 -1.03 0.00 0.00 41.12 39.93 2rk9 n ASP 83 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 2rk9 h ILE 84 N 2.65 1.08 -0.03 2.12 6.09 -1.93 -1.75 117.51 125.74 2rk9 h ILE 84 Ca 0.13 -0.30 -0.01 0.00 -1.37 0.00 0.00 64.86 63.30 2rk9 h ILE 84 Cb 0.82 0.13 -0.00 0.00 0.47 0.00 0.00 36.82 38.24 2rk9 h ILE 84 CO 0.56 0.16 -0.03 -0.08 -3.07 0.00 0.00 178.15 175.68 2rk9 h GLU 85 N 0.88 0.07 -0.99 2.19 4.57 -1.99 -1.69 114.58 117.62 2rk9 h GLU 85 Ca 0.30 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.47 2rk9 h GLU 85 Cb 0.05 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.59 2rk9 h GLU 85 CO -0.12 0.57 0.65 -1.35 -1.18 0.00 0.00 179.01 177.58 2rk9 h PRO 86 N -0.43 1.25 -0.47 0.92 0.11 -1.97 -0.93 132.00 130.48 2rk9 h PRO 86 Ca 0.00 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 2rk9 h PRO 86 Cb 0.56 -0.28 -0.02 0.00 0.11 0.00 0.00 31.00 31.37 2rk9 h PRO 86 CO 0.01 0.82 0.09 1.25 -0.21 0.00 0.00 178.00 179.97 2rk9 h LEU 87 N 1.28 0.73 -0.87 2.35 5.85 -1.33 -0.11 115.31 123.21 2rk9 h LEU 87 Ca 0.38 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.86 2rk9 h LEU 87 Cb -0.05 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.74 2rk9 h LEU 87 CO -0.11 0.79 0.56 0.22 -0.34 0.00 0.00 178.44 179.56 2rk9 h TYR 88 N 0.63 1.11 -0.10 1.25 3.20 -0.76 -1.00 116.97 121.30 2rk9 h TYR 88 Ca 0.14 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.91 2rk9 h TYR 88 Cb 0.36 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 2rk9 h TYR 88 CO 0.02 0.71 -0.46 1.96 -1.64 0.00 0.00 178.16 178.75 2rk9 h GLN 89 N 1.18 0.25 -0.50 1.82 4.20 -0.86 -1.26 115.11 119.94 2rk9 h GLN 89 Ca 0.32 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.80 2rk9 h GLN 89 Cb -0.11 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2rk9 h GLN 89 CO -0.07 0.67 -0.03 -0.09 -0.67 0.00 0.00 178.83 178.65 2rk9 h ARG 90 N 0.21 0.91 -0.31 1.46 2.43 -0.32 -1.23 114.38 117.52 2rk9 h ARG 90 Ca 0.01 -0.30 -0.16 0.00 -0.81 0.00 0.00 59.98 58.72 2rk9 h ARG 90 Cb 0.90 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2rk9 h ARG 90 CO 0.07 0.95 -0.44 0.28 -1.51 0.00 0.00 179.97 179.32 2rk9 h VAL 91 N 0.77 1.28 -0.23 0.20 2.07 -1.05 -2.01 116.25 117.28 2rk9 h VAL 91 Ca 0.14 -1.63 -0.07 0.00 0.82 0.00 0.00 66.70 65.96 2rk9 h VAL 91 Cb 0.56 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2rk9 h VAL 91 CO 0.03 0.53 -0.16 0.78 0.02 0.00 0.00 177.57 178.77 2rk9 h ASN 92 N 0.64 0.38 1.09 0.57 4.21 -1.10 0.15 115.58 121.52 2rk9 h ASN 92 Ca 0.04 -0.10 -0.13 0.00 1.21 0.00 0.00 56.30 57.32 2rk9 h ASN 92 Cb 1.01 -0.10 -0.02 0.00 -1.12 0.00 0.00 38.32 38.09 2rk9 h ASN 92 CO 0.10 0.57 -0.61 -0.33 -1.29 0.00 0.00 177.43 175.87 2rk9 h GLU 93 N 0.37 0.00 0.00 0.81 5.08 -1.06 -3.29 114.58 116.48 2rk9 h GLU 93 Ca 0.07 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.19 2rk9 h GLU 93 Cb 0.50 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2rk9 h GLU 93 CO 0.03 0.61 -1.89 -1.13 -1.00 0.00 0.00 179.01 175.63 2rk9 n SER 94 N -3.41 1.88 -2.77 1.42 3.41 -0.77 -4.88 113.62 108.51 2rk9 n SER 94 Ca 0.00 -0.01 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 2rk9 n SER 94 Cb 0.71 0.74 0.06 0.00 -0.26 0.00 0.00 64.21 65.46 2rk9 n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rk9 n ALA 95 N -2.51 -1.01 -0.15 7.33 0.00 0.49 -4.99 120.51 119.67 2rk9 n ALA 95 Ca -0.22 -1.52 0.15 0.00 0.00 0.00 0.00 53.44 51.85 2rk9 n ALA 95 Cb 0.91 -1.25 0.52 0.00 0.00 0.00 0.00 19.45 19.63 2rk9 n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rk9 h ALA 96 N 3.63 2.13 0.00 0.00 0.00 -1.57 0.16 119.26 123.62 2rk9 h ALA 96 Ca -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2rk9 h ALA 96 Cb 1.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2rk9 h ALA 96 CO 0.27 -0.33 0.00 -0.25 0.00 0.00 0.00 179.25 178.94 2rk9 n ASP 97 N -4.47 0.00 -0.15 0.00 8.00 -1.26 -1.82 116.55 116.85 2rk9 n ASP 97 Ca 0.14 0.33 0.13 0.00 0.71 0.00 0.00 54.79 56.09 2rk9 n ASP 97 Cb 0.52 -0.41 0.33 0.00 -0.02 0.00 0.00 41.12 41.55 2rk9 n ASP 97 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2rk9 n SER 98 N -1.41 0.81 -4.67 -2.24 7.64 0.04 -4.83 113.62 108.96 2rk9 n SER 98 Ca 0.05 -0.64 -0.43 0.00 1.01 0.00 0.00 58.87 58.86 2rk9 n SER 98 Cb 0.13 0.17 -0.02 0.00 -1.01 0.00 0.00 64.21 63.49 2rk9 n SER 98 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2rk9 s ILE 99 N -2.69 4.35 -0.14 0.44 1.01 -0.76 -0.95 121.20 122.46 2rk9 s ILE 99 Ca 0.19 1.65 -0.03 0.00 0.00 0.00 0.00 60.65 62.46 2rk9 s ILE 99 Cb 0.19 -4.06 -0.24 0.00 0.01 0.00 0.00 42.46 38.35 2rk9 s ILE 99 CO 0.59 -0.10 0.26 0.00 0.00 0.00 0.00 174.94 175.69 2rk9 n TYR 100 N 6.12 0.98 -3.99 3.97 9.36 -1.26 -4.89 117.16 127.44 2rk9 n TYR 100 Ca 0.13 0.22 -0.20 0.00 3.32 0.00 0.00 57.90 61.36 2rk9 n TYR 100 Cb 0.46 -1.13 -0.17 0.00 -0.63 0.00 0.00 39.34 37.87 2rk9 n TYR 100 CO 0.00 0.00 0.00 -1.17 0.22 0.00 0.00 176.86 175.91 2rk9 s LEU 101 N -6.85 1.06 0.73 2.98 2.96 -1.26 -5.00 118.68 113.30 2rk9 s LEU 101 Ca -0.23 -0.09 -0.14 0.00 -0.22 0.00 0.00 54.13 53.44 2rk9 s LEU 101 Cb 0.07 -0.39 0.04 0.00 0.50 0.00 0.00 46.19 46.41 2rk9 s LEU 101 CO 0.74 -0.11 1.16 0.00 -1.32 0.00 0.00 176.35 176.82 2rk9 s ALA 102 N 1.26 2.19 0.27 5.97 0.00 -1.26 -4.57 121.76 125.62 2rk9 s ALA 102 Ca -0.06 0.68 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 2rk9 s ALA 102 Cb -0.13 -3.40 -0.13 0.00 0.00 0.00 0.00 23.12 19.46 2rk9 s ALA 102 CO -0.02 -1.74 1.49 -0.11 0.00 0.00 0.00 175.76 175.38 2rk9 n LEU 103 N -2.83 3.71 -3.85 0.00 7.94 -1.26 -4.61 117.00 116.10 2rk9 n LEU 103 Ca 0.12 1.15 -0.09 0.00 -1.11 0.00 0.00 56.01 56.08 2rk9 n LEU 103 Cb 0.51 -1.51 -0.07 0.00 0.53 0.00 0.00 43.42 42.89 2rk9 n LEU 103 CO 0.48 -0.19 -0.06 -1.83 -1.11 0.00 0.00 177.39 174.68 2rk9 s GLU 104 N -0.54 0.91 -0.36 1.96 -1.05 -0.37 -4.98 118.70 114.27 2rk9 s GLU 104 Ca 0.65 -0.97 -0.05 0.00 -0.15 0.00 0.00 54.97 54.46 2rk9 s GLU 104 Cb -0.57 0.36 0.06 0.00 -0.44 0.00 0.00 34.13 33.54 2rk9 s GLU 104 CO 0.50 -0.30 0.12 -1.12 0.95 0.00 0.00 175.26 175.41 2rk9 s SER 105 N -2.87 5.23 -0.25 0.83 0.01 -1.26 -1.34 113.70 114.04 2rk9 s SER 105 Ca 0.06 -1.44 -0.11 0.00 1.31 0.00 0.00 55.95 55.77 2rk9 s SER 105 Cb 0.04 -1.83 -0.05 0.00 0.21 0.00 0.00 66.02 64.39 2rk9 s SER 105 CO -0.10 -0.39 0.20 -0.75 0.41 0.00 0.00 173.24 172.62 2rk9 s LYS 106 N 1.30 4.04 0.20 12.44 2.20 -0.51 -4.89 119.74 134.52 2rk9 s LYS 106 Ca 0.00 -0.22 0.09 0.00 -0.36 0.00 0.00 55.97 55.47 2rk9 s LYS 106 Cb -0.21 -3.59 -0.04 0.00 -1.51 0.00 0.00 37.83 32.48 2rk9 s LYS 106 CO -0.00 -0.05 -0.17 -1.12 -0.36 0.00 0.00 175.35 173.65 2rk9 s SER 107 N 1.33 2.75 0.00 1.43 0.01 -1.26 -0.47 113.70 117.48 2rk9 s SER 107 Ca 0.09 -0.95 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2rk9 s SER 107 Cb -0.15 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 65.92 2rk9 s SER 107 CO 0.07 -0.09 0.04 -1.22 0.41 0.00 0.00 173.24 172.46 2rk9 n TYR 108 N -0.12 0.00 -4.66 2.43 4.01 -1.26 -5.00 117.16 112.56 2rk9 n TYR 108 Ca -0.10 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.40 2rk9 n TYR 108 Cb 0.59 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.47 2rk9 n TYR 108 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2rk9 s ILE 114 N -0.09 1.38 -0.19 -0.72 1.09 -1.26 -4.78 121.20 116.63 2rk9 s ILE 114 Ca 0.00 -0.91 -0.09 0.00 -1.10 0.00 0.00 60.65 58.55 2rk9 s ILE 114 Cb 0.00 -1.18 -0.04 0.00 -1.06 0.00 0.00 42.46 40.17 2rk9 s ILE 114 CO 0.00 0.25 0.10 0.00 -0.10 0.00 0.00 174.94 175.18 2rk9 s ALA 115 N -0.61 3.53 0.09 9.38 0.00 -1.26 -5.10 121.76 127.80 2rk9 s ALA 115 Ca 0.06 -0.74 0.08 0.00 0.00 0.00 0.00 51.96 51.36 2rk9 s ALA 115 Cb -0.07 -2.05 -0.03 0.00 0.00 0.00 0.00 23.12 20.96 2rk9 s ALA 115 CO 0.00 0.13 -0.22 0.99 0.00 0.00 0.00 175.76 176.67 2rk9 s THR 116 N 0.44 1.77 -0.13 0.00 2.01 -1.26 -4.26 115.64 114.20 2rk9 s THR 116 Ca 0.05 -1.48 -0.03 0.00 0.31 0.00 0.00 61.69 60.55 2rk9 s THR 116 Cb -0.12 -1.58 0.05 0.00 0.01 0.00 0.00 72.50 70.86 2rk9 s THR 116 CO -0.00 0.03 0.05 -1.58 -0.69 0.00 0.00 174.62 172.43 2rk9 s GLN 117 N -1.73 0.28 0.26 4.92 0.74 0.38 -4.51 119.66 120.01 2rk9 s GLN 117 Ca 0.08 -0.01 -0.25 0.00 0.05 0.00 0.00 55.36 55.22 2rk9 s GLN 117 Cb -0.10 -1.42 -0.09 0.00 1.10 0.00 0.00 33.01 32.51 2rk9 s GLN 117 CO 0.04 -0.51 0.87 0.15 -0.55 0.00 0.00 175.29 175.28 2rk9 s LYS 118 N 2.05 4.55 0.01 1.67 1.02 -0.42 -1.42 119.74 127.20 2rk9 s LYS 118 Ca 0.03 1.22 -0.28 0.00 0.02 0.00 0.00 55.97 56.96 2rk9 s LYS 118 Cb -0.15 -2.97 0.10 0.00 -0.52 0.00 0.00 37.83 34.29 2rk9 s LYS 118 CO -0.07 0.39 0.84 1.14 -0.92 0.00 0.00 175.35 176.74 2rk9 s GLN 119 N -1.75 0.89 0.00 1.68 -2.07 -0.45 -1.74 119.66 116.21 2rk9 s GLN 119 Ca 0.45 -0.29 0.00 0.00 -1.82 0.00 0.00 55.36 53.70 2rk9 s GLN 119 Cb -0.20 0.41 0.00 0.00 -1.09 0.00 0.00 33.01 32.13 2rk9 s GLN 119 CO 0.25 -0.38 0.00 1.97 -1.32 0.00 0.00 175.29 175.81 2rk9 n PHE 120 N -0.17 0.00 -3.64 9.60 1.16 -0.91 -1.24 117.46 122.25 2rk9 n PHE 120 Ca -0.10 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.45 2rk9 n PHE 120 Cb 0.62 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.43 2rk9 n PHE 120 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 2rk9 s VAL 122 N -0.71 0.00 -0.18 1.97 1.01 -0.02 -1.23 120.40 121.24 2rk9 s VAL 122 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 2rk9 s VAL 122 Cb 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 2rk9 s VAL 122 CO 0.00 0.00 -0.08 -1.58 0.00 0.00 0.00 175.10 173.44 2rk9 s GLN 123 N -0.41 3.41 0.81 2.72 0.74 -0.13 -0.88 119.66 125.93 2rk9 s GLN 123 Ca 0.08 -0.64 -0.12 0.00 0.05 0.00 0.00 55.36 54.73 2rk9 s GLN 123 Cb -0.03 -2.84 0.08 0.00 1.10 0.00 0.00 33.01 31.32 2rk9 s GLN 123 CO -0.12 0.02 1.16 0.95 -0.55 0.00 0.00 175.29 176.74 2rk9 s THR 124 N 0.89 2.27 0.60 -0.34 -4.23 -0.19 -4.80 115.64 109.83 2rk9 s THR 124 Ca -0.02 0.09 0.30 0.00 -1.18 0.00 0.00 61.69 60.88 2rk9 s THR 124 Cb -0.15 -3.03 0.36 0.00 1.34 0.00 0.00 72.50 71.03 2rk9 s THR 124 CO 0.01 -0.12 2.15 -0.65 -0.54 0.00 0.00 174.62 175.47 2rk9 h PRO 125 N -1.09 0.00 0.00 3.99 0.11 -2.00 -0.15 132.00 132.87 2rk9 h PRO 125 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2rk9 h PRO 125 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2rk9 h PRO 125 CO 0.65 0.00 -0.41 -0.25 -0.21 0.00 0.00 178.00 177.77 2rk9 n ASP 126 N -3.75 0.61 0.00 -2.05 8.00 -1.26 -4.95 116.55 113.15 2rk9 n ASP 126 Ca 0.00 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.68 2rk9 n ASP 126 Cb 0.25 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 2rk9 n ASP 126 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rk9 n GLY 127 N 1.38 1.29 3.77 0.44 0.00 -0.07 -1.92 105.19 110.07 2rk9 n GLY 127 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2rk9 n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2rk9 s TYR 128 N -2.09 2.83 -0.18 1.61 2.02 -1.24 -4.59 117.35 115.70 2rk9 s TYR 128 Ca 0.00 1.20 -0.05 0.00 -0.37 0.00 0.00 57.07 57.85 2rk9 s TYR 128 Cb 0.00 -3.88 -0.03 0.00 -0.40 0.00 0.00 41.96 37.65 2rk9 s TYR 128 CO 0.00 -2.59 0.01 -0.51 -1.57 0.00 0.00 175.55 170.88 2rk9 s LEU 129 N -1.60 3.40 -0.10 -1.29 1.43 -1.26 -1.02 118.68 118.24 2rk9 s LEU 129 Ca 0.53 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 2rk9 s LEU 129 Cb -0.44 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 43.92 2rk9 s LEU 129 CO 0.55 0.12 -0.18 -0.36 0.23 0.00 0.00 176.35 176.72 2rk9 s PHE 130 N 0.66 2.68 -0.47 0.29 0.08 -0.06 -1.93 117.98 119.23 2rk9 s PHE 130 Ca 0.00 -0.66 -0.03 0.00 0.12 0.00 0.00 56.93 56.36 2rk9 s PHE 130 Cb -0.14 -1.74 0.13 0.00 -0.57 0.00 0.00 43.02 40.70 2rk9 s PHE 130 CO 0.02 -0.19 0.28 0.50 -0.10 0.00 0.00 175.22 175.73 2rk9 s ARG 131 N 0.08 2.19 -0.05 0.44 3.52 0.25 -0.84 118.95 124.55 2rk9 s ARG 131 Ca -0.08 -2.02 -0.30 0.00 -0.13 0.00 0.00 55.73 53.21 2rk9 s ARG 131 Cb -0.15 -3.65 -0.03 0.00 -1.56 0.00 0.00 34.95 29.56 2rk9 s ARG 131 CO 0.05 -1.11 1.10 -0.06 -0.81 0.00 0.00 175.30 174.47 2rk9 s PHE 132 N 0.82 3.41 0.14 5.12 0.08 -0.36 -0.40 117.98 126.79 2rk9 s PHE 132 Ca 0.10 1.43 0.05 0.00 0.12 0.00 0.00 56.93 58.64 2rk9 s PHE 132 Cb -0.22 -3.29 -0.04 0.00 -0.57 0.00 0.00 43.02 38.89 2rk9 s PHE 132 CO -0.04 -0.73 -0.12 0.00 -0.10 0.00 0.00 175.22 174.23 2rk9 s GLN 134 N -3.17 0.57 0.00 0.00 0.74 -0.71 -1.06 119.66 116.02 2rk9 s GLN 134 Ca 0.13 1.08 0.30 0.00 0.05 0.00 0.00 55.36 56.92 2rk9 s GLN 134 Cb -0.02 0.14 1.52 0.00 1.10 0.00 0.00 33.01 35.76 2rk9 s GLN 134 CO 0.02 -0.16 2.01 -0.25 -0.55 0.00 0.00 175.29 176.36