#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rjx s GLU 14 N 0.00 2.52 0.10 1.96 0.41 -1.26 -5.13 118.70 117.30 2rjx s GLU 14 Ca 0.00 -0.95 0.07 0.00 -0.41 0.00 0.00 54.97 53.68 2rjx s GLU 14 Cb 0.00 -2.47 -0.04 0.00 -1.78 0.00 0.00 34.13 29.84 2rjx s GLU 14 CO 0.00 0.50 -0.13 0.95 -0.49 0.00 0.00 175.26 176.09 2rjx s THR 15 N -1.52 3.20 0.11 3.63 -4.23 -1.26 -4.65 115.64 110.92 2rjx s THR 15 Ca 0.27 -1.31 0.02 0.00 -1.18 0.00 0.00 61.69 59.50 2rjx s THR 15 Cb -0.11 -2.48 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 2rjx s THR 15 CO 0.19 0.13 -0.07 -0.36 -0.54 0.00 0.00 174.62 173.97 2rjx s PHE 16 N -1.17 0.98 0.72 3.99 0.40 0.23 -4.97 117.98 118.15 2rjx s PHE 16 Ca 0.20 -0.87 -0.14 0.00 -0.60 0.00 0.00 56.93 55.52 2rjx s PHE 16 Cb -0.11 -0.54 0.03 0.00 0.51 0.00 0.00 43.02 42.91 2rjx s PHE 16 CO 0.12 -0.09 1.16 -2.14 0.70 0.00 0.00 175.22 174.97 2rjx s PRO 17 N -3.76 2.32 0.30 0.24 0.02 -1.26 -4.57 135.00 128.29 2rjx s PRO 17 Ca 0.12 1.57 0.05 0.00 0.02 0.00 0.00 61.00 62.77 2rjx s PRO 17 Cb 0.04 -1.87 0.71 0.00 0.02 0.00 0.00 34.50 33.39 2rjx s PRO 17 CO -0.03 -1.65 1.77 1.25 -0.33 0.00 0.00 177.00 178.00 2rjx h LEU 18 N -0.31 0.72 -1.66 -5.54 5.85 -1.96 -1.16 115.31 111.26 2rjx h LEU 18 Ca -0.47 0.10 0.22 0.00 0.84 0.00 0.00 57.88 58.58 2rjx h LEU 18 Cb 1.27 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 42.22 2rjx h LEU 18 CO 0.51 0.25 0.61 -0.78 -0.34 0.00 0.00 178.44 178.69 2rjx h ASP 19 N 0.72 0.28 1.27 1.25 3.58 -1.93 0.71 116.42 122.30 2rjx h ASP 19 Ca 0.56 0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.95 2rjx h ASP 19 Cb 0.87 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 2rjx h ASP 19 CO -0.39 0.10 -0.47 0.58 -2.88 0.00 0.00 179.24 176.19 2rjx h VAL 20 N 0.27 0.87 0.00 2.25 2.07 -1.55 -3.37 116.25 116.80 2rjx h VAL 20 Ca 0.46 -2.00 -0.24 0.00 0.82 0.00 0.00 66.70 65.74 2rjx h VAL 20 Cb 1.35 2.26 -0.05 0.00 -1.52 0.00 0.00 31.29 33.33 2rjx h VAL 20 CO -0.13 0.46 -1.91 0.18 0.02 0.00 0.00 177.57 176.19 2rjx n LEU 21 N -3.32 0.00 -4.76 2.57 4.77 -0.36 -4.77 117.00 111.13 2rjx n LEU 21 Ca 0.01 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.59 2rjx n LEU 21 Cb 0.66 0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 42.05 2rjx n LEU 21 CO 0.39 0.32 0.93 0.54 -1.33 0.00 0.00 177.39 178.25 2rjx s VAL 22 N -2.33 3.01 -1.46 4.08 0.11 0.10 -3.63 120.40 120.28 2rjx s VAL 22 Ca -0.07 0.98 -0.00 0.00 -2.93 0.00 0.00 61.98 59.96 2rjx s VAL 22 Cb 0.04 -3.62 0.00 0.00 -1.53 0.00 0.00 36.38 31.27 2rjx s VAL 22 CO 0.54 0.22 0.24 0.59 -3.33 0.00 0.00 175.10 173.36 2rjx n ASN 23 N 1.26 0.19 -4.27 3.54 3.02 -0.52 -4.95 115.26 113.54 2rjx n ASN 23 Ca 0.01 -1.12 -0.32 0.00 -0.03 0.00 0.00 54.58 53.11 2rjx n ASN 23 Cb 0.43 -2.43 -0.16 0.00 -0.61 0.00 0.00 39.78 37.01 2rjx n ASN 23 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2rjx s THR 24 N -4.14 2.31 0.59 3.41 2.01 -1.24 -5.12 115.64 113.46 2rjx s THR 24 Ca 0.01 -0.94 -0.19 0.00 0.31 0.00 0.00 61.69 60.87 2rjx s THR 24 Cb -0.00 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 2rjx s THR 24 CO 0.94 0.56 1.20 0.00 -0.69 0.00 0.00 174.62 176.62 2rjx s ALA 25 N 0.18 2.57 0.30 7.40 0.00 -1.26 -4.88 121.76 126.06 2rjx s ALA 25 Ca -0.12 0.99 0.05 0.00 0.00 0.00 0.00 51.96 52.87 2rjx s ALA 25 Cb -0.16 -3.44 0.73 0.00 0.00 0.00 0.00 23.12 20.25 2rjx s ALA 25 CO 0.07 -1.11 1.75 0.00 0.00 0.00 0.00 175.76 176.47 2rjx h ALA 26 N 0.94 1.57 0.00 0.00 0.00 -1.99 0.15 119.26 119.93 2rjx h ALA 26 Ca -0.50 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2rjx h ALA 26 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2rjx h ALA 26 CO 0.55 -0.17 0.00 -0.85 0.00 0.00 0.00 179.25 178.78 2rjx n GLU 27 N -4.87 0.10 -0.10 0.00 0.28 -1.26 -3.28 120.64 111.50 2rjx n GLU 27 Ca 0.23 0.09 0.08 0.00 -0.16 0.00 0.00 57.16 57.39 2rjx n GLU 27 Cb 0.60 -1.50 0.12 0.00 1.43 0.00 0.00 31.44 32.10 2rjx n GLU 27 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2rjx n ASP 28 N -1.44 2.68 -4.83 -1.84 8.00 0.03 -5.00 116.55 114.15 2rjx n ASP 28 Ca 0.07 -1.78 -0.31 0.00 0.71 0.00 0.00 54.79 53.48 2rjx n ASP 28 Cb 0.25 -0.13 0.04 0.00 -0.02 0.00 0.00 41.12 41.26 2rjx n ASP 28 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2rjx s LEU 29 N -1.16 3.13 0.72 0.64 1.43 -1.15 -4.91 118.68 117.38 2rjx s LEU 29 Ca 0.23 1.55 -0.15 0.00 -1.03 0.00 0.00 54.13 54.73 2rjx s LEU 29 Cb 0.14 -4.45 0.03 0.00 0.03 0.00 0.00 46.19 41.94 2rjx s LEU 29 CO 0.20 -1.33 1.19 -2.84 0.23 0.00 0.00 176.35 173.80 2rjx s PRO 30 N -5.09 2.25 0.44 1.29 0.02 -1.26 -4.93 135.00 127.72 2rjx s PRO 30 Ca 0.57 1.70 -0.25 0.00 0.02 0.00 0.00 61.00 63.04 2rjx s PRO 30 Cb -0.13 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.45 2rjx s PRO 30 CO 0.55 -1.74 1.36 -2.13 -0.33 0.00 0.00 177.00 174.71 2rjx n ARG 31 N -2.66 2.10 -0.98 5.54 0.63 -1.26 -2.72 116.66 117.31 2rjx n ARG 31 Ca 0.13 0.75 0.00 0.00 -0.92 0.00 0.00 57.85 57.81 2rjx n ARG 31 Cb 0.50 -2.53 0.00 0.00 0.45 0.00 0.00 32.46 30.89 2rjx n ARG 31 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2rjx n GLY 32 N 0.68 0.66 3.75 5.14 0.00 -1.26 -5.03 105.19 109.14 2rjx n GLY 32 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2rjx n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rjx s VAL 33 N -2.62 5.13 -0.39 1.61 1.01 -1.10 -4.96 120.40 119.08 2rjx s VAL 33 Ca 0.00 0.94 -0.26 0.00 0.00 0.00 0.00 61.98 62.66 2rjx s VAL 33 Cb 0.00 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.60 2rjx s VAL 33 CO 0.00 0.39 0.95 -0.62 0.00 0.00 0.00 175.10 175.83 2rjx s ASP 34 N 0.16 6.67 0.64 3.32 -1.08 -1.26 -4.91 116.67 120.21 2rjx s ASP 34 Ca 0.25 0.54 0.42 0.00 -0.52 0.00 0.00 52.55 53.25 2rjx s ASP 34 Cb -0.16 -2.47 2.22 0.00 -1.46 0.00 0.00 42.92 41.05 2rjx s ASP 34 CO 0.11 -0.92 2.30 1.55 0.52 0.00 0.00 175.17 178.74 2rjx h PRO 35 N 8.59 0.00 -0.01 4.34 0.13 -1.98 -0.70 132.00 142.37 2rjx h PRO 35 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2rjx h PRO 35 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2rjx h PRO 35 CO 1.00 0.00 -0.10 -1.13 -0.23 0.00 0.00 178.00 177.55 2rjx n SER 36 N -3.15 0.81 -2.70 1.44 3.41 -1.26 -4.04 113.62 108.13 2rjx n SER 36 Ca -0.02 -0.94 -0.07 0.00 -0.26 0.00 0.00 58.87 57.57 2rjx n SER 36 Cb 0.11 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.10 2rjx n SER 36 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2rjx n ARG 37 N -0.59 1.63 -0.09 4.33 5.12 -0.28 -4.92 116.66 121.87 2rjx n ARG 37 Ca 0.16 -3.47 0.13 0.00 -1.93 0.00 0.00 57.85 52.75 2rjx n ARG 37 Cb 0.29 -1.50 0.52 0.00 -1.16 0.00 0.00 32.46 30.61 2rjx n ARG 37 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 2rjx h LYS 38 N 2.77 0.35 0.00 5.56 1.57 -1.68 -0.21 116.57 124.94 2rjx h LYS 38 Ca -0.07 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2rjx h LYS 38 Cb 1.22 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 2rjx h LYS 38 CO 0.39 0.23 -0.01 1.05 -0.57 0.00 0.00 179.45 180.55 2rjx h GLU 39 N 0.37 0.00 0.00 3.15 9.09 -1.91 -0.72 114.58 124.55 2rjx h GLU 39 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 2rjx h GLU 39 Cb 0.64 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.74 2rjx h GLU 39 CO -0.08 0.01 0.00 -0.91 0.05 0.00 0.00 179.01 178.09 2rjx h ASN 40 N 0.00 0.00 -0.70 3.06 4.21 -1.42 -2.81 115.58 117.92 2rjx h ASN 40 Ca -0.00 0.00 -0.21 0.00 1.21 0.00 0.00 56.30 57.30 2rjx h ASN 40 Cb 0.22 0.00 -0.12 0.00 -1.12 0.00 0.00 38.32 37.30 2rjx h ASN 40 CO 0.00 0.00 0.25 1.41 -1.29 0.00 0.00 177.43 177.80 2rjx n HIS 41 N -2.35 2.32 -4.51 1.19 8.25 -0.28 -4.91 115.22 114.94 2rjx n HIS 41 Ca 0.02 -1.22 -0.33 0.00 -0.26 0.00 0.00 57.72 55.93 2rjx n HIS 41 Cb 0.27 -0.67 -0.11 0.00 1.12 0.00 0.00 29.99 30.61 2rjx n HIS 41 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2rjx s LEU 42 N -3.01 3.24 0.90 2.41 1.43 -1.06 -0.60 118.68 121.99 2rjx s LEU 42 Ca 0.54 -0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.48 2rjx s LEU 42 Cb 0.44 -1.78 0.13 0.00 0.03 0.00 0.00 46.19 45.01 2rjx s LEU 42 CO 0.13 0.33 1.09 -0.94 0.23 0.00 0.00 176.35 177.19 2rjx s SER 43 N -1.10 3.38 0.28 2.29 1.04 -1.26 -4.72 113.70 113.60 2rjx s SER 43 Ca 0.15 1.69 -0.02 0.00 0.48 0.00 0.00 55.95 58.25 2rjx s SER 43 Cb -0.11 -2.34 0.43 0.00 0.10 0.00 0.00 66.02 64.11 2rjx s SER 43 CO 0.05 -2.73 1.90 0.44 0.98 0.00 0.00 173.24 173.88 2rjx h ASP 44 N -1.61 1.01 0.04 7.02 3.45 -1.99 -0.22 116.42 124.12 2rjx h ASP 44 Ca -0.48 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 56.98 2rjx h ASP 44 Cb 1.27 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 39.83 2rjx h ASP 44 CO 0.51 0.66 -0.02 -0.33 -1.57 0.00 0.00 179.24 178.49 2rjx h GLU 45 N 1.15 -0.06 -0.11 3.56 3.07 -2.00 -2.02 114.58 118.18 2rjx h GLU 45 Ca 0.41 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.19 2rjx h GLU 45 Cb 0.13 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 2rjx h GLU 45 CO -0.15 0.08 -0.30 -0.44 -1.40 0.00 0.00 179.01 176.80 2rjx h ASP 46 N -0.18 0.19 -0.06 1.42 3.45 -1.84 -1.54 116.42 117.86 2rjx h ASP 46 Ca -0.01 -0.06 -0.01 0.00 0.43 0.00 0.00 57.03 57.39 2rjx h ASP 46 Cb 0.16 -0.05 -0.00 0.00 -0.56 0.00 0.00 39.33 38.88 2rjx h ASP 46 CO 0.01 0.49 0.01 0.15 -1.57 0.00 0.00 179.24 178.34 2rjx h PHE 47 N 0.17 0.10 -0.55 4.55 3.57 -0.88 -1.47 116.94 122.44 2rjx h PHE 47 Ca 0.03 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 2rjx h PHE 47 Cb 0.62 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 2rjx h PHE 47 CO 0.01 0.29 0.08 -0.22 -2.23 0.00 0.00 178.31 176.25 2rjx h LYS 48 N -0.12 0.87 0.00 1.11 3.64 -1.25 0.11 116.57 120.93 2rjx h LYS 48 Ca 0.02 -0.21 -0.05 0.00 -1.27 0.00 0.00 60.65 59.14 2rjx h LYS 48 Cb 0.24 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2rjx h LYS 48 CO 0.00 0.81 -0.23 0.00 -2.27 0.00 0.00 179.45 177.76 2rjx h ALA 49 N 1.26 1.40 0.05 5.00 0.00 -1.08 0.18 119.26 126.07 2rjx h ALA 49 Ca 0.17 -0.21 -0.37 0.00 0.00 0.00 0.00 54.91 54.50 2rjx h ALA 49 Cb 0.37 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2rjx h ALA 49 CO 0.01 0.29 -2.12 0.28 0.00 0.00 0.00 179.25 177.71 2rjx n VAL 50 N -3.95 1.62 0.65 0.00 0.31 -0.57 -4.56 118.33 111.83 2rjx n VAL 50 Ca -0.02 -0.50 0.11 0.00 -0.01 0.00 0.00 64.34 63.93 2rjx n VAL 50 Cb 0.31 -1.70 0.06 0.00 -0.91 0.00 0.00 33.84 31.61 2rjx n VAL 50 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2rjx n PHE 51 N -3.66 0.25 -1.43 3.52 3.72 0.35 -4.96 117.46 115.25 2rjx n PHE 51 Ca -0.40 0.07 -0.09 0.00 -0.05 0.00 0.00 57.45 56.98 2rjx n PHE 51 Cb 0.95 -0.41 -0.03 0.00 -0.94 0.00 0.00 39.48 39.05 2rjx n PHE 51 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2rjx n GLY 52 N 1.39 0.92 3.69 1.37 0.00 0.62 -4.97 105.19 108.20 2rjx n GLY 52 Ca 0.03 -0.58 -0.09 0.00 0.00 0.00 0.00 46.02 45.38 2rjx n GLY 52 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2rjx s MET 53 N -3.09 1.53 0.79 1.61 0.23 -1.25 -5.07 119.30 114.06 2rjx s MET 53 Ca 0.00 -0.76 -0.11 0.00 -1.03 0.00 0.00 55.69 53.79 2rjx s MET 53 Cb 0.00 0.58 0.08 0.00 -1.53 0.00 0.00 34.83 33.96 2rjx s MET 53 CO 0.00 -0.69 1.14 0.95 -2.03 0.00 0.00 175.02 174.39 2rjx s THR 54 N -3.79 2.06 0.26 3.16 -4.23 -1.26 -3.85 115.64 108.00 2rjx s THR 54 Ca 0.07 -0.06 -0.03 0.00 -1.18 0.00 0.00 61.69 60.50 2rjx s THR 54 Cb -0.04 -3.00 0.14 0.00 1.34 0.00 0.00 72.50 70.94 2rjx s THR 54 CO -0.01 0.00 1.80 -0.09 -0.54 0.00 0.00 174.62 175.78 2rjx h ARG 55 N -0.96 0.88 -0.53 3.99 2.43 -1.95 -0.62 114.38 117.62 2rjx h ARG 55 Ca -0.46 -0.19 -0.10 0.00 -0.81 0.00 0.00 59.98 58.42 2rjx h ARG 55 Cb 1.33 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 2rjx h ARG 55 CO 0.65 0.80 -0.07 0.66 -1.51 0.00 0.00 179.97 180.49 2rjx h SER 56 N 0.84 0.95 -0.16 -3.80 4.64 -1.99 -1.20 113.55 112.83 2rjx h SER 56 Ca 0.18 -0.29 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 2rjx h SER 56 Cb 0.33 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 2rjx h SER 56 CO 0.00 1.05 -0.01 0.00 -0.87 0.00 0.00 176.83 177.00 2rjx h ALA 57 N 1.04 0.22 -0.72 5.18 0.00 -1.84 -2.95 119.26 120.19 2rjx h ALA 57 Ca 0.14 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.92 2rjx h ALA 57 Cb 0.61 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2rjx h ALA 57 CO 0.04 -0.07 0.47 0.35 0.00 0.00 0.00 179.25 180.04 2rjx h PHE 58 N 0.02 0.75 0.00 0.00 3.57 -0.93 0.39 116.94 120.74 2rjx h PHE 58 Ca 0.04 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2rjx h PHE 58 Cb 0.39 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.89 2rjx h PHE 58 CO 0.04 0.39 0.00 0.00 -2.23 0.00 0.00 178.31 176.51 2rjx h ALA 59 N 1.61 1.00 -0.01 2.41 0.00 -1.05 -2.14 119.26 121.08 2rjx h ALA 59 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2rjx h ALA 59 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2rjx h ALA 59 CO -0.10 0.00 -0.26 0.09 0.00 0.00 0.00 179.25 178.97 2rjx n ASN 60 N -2.81 1.30 -4.81 0.00 3.02 0.12 -4.91 115.26 107.18 2rjx n ASN 60 Ca -0.01 -1.09 -0.33 0.00 -0.03 0.00 0.00 54.58 53.12 2rjx n ASN 60 Cb 0.17 0.18 -0.02 0.00 -0.61 0.00 0.00 39.78 39.51 2rjx n ASN 60 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2rjx s LEU 61 N -2.43 3.66 0.62 3.41 1.43 -0.81 -5.00 118.68 119.56 2rjx s LEU 61 Ca 0.25 1.82 -0.18 0.00 -1.03 0.00 0.00 54.13 54.99 2rjx s LEU 61 Cb 0.19 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.85 2rjx s LEU 61 CO 0.50 -0.92 1.20 -2.84 0.23 0.00 0.00 176.35 174.53 2rjx s PRO 62 N -3.73 2.83 0.19 1.29 0.02 -1.26 -4.78 135.00 129.55 2rjx s PRO 62 Ca 0.64 1.78 -0.13 0.00 0.02 0.00 0.00 61.00 63.31 2rjx s PRO 62 Cb -0.15 -1.92 0.20 0.00 0.02 0.00 0.00 34.50 32.65 2rjx s PRO 62 CO 0.29 -1.31 1.69 1.25 -0.33 0.00 0.00 177.00 178.59 2rjx h LEU 63 N 0.63 -0.15 -1.57 -5.54 5.85 -1.96 -1.46 115.31 111.11 2rjx h LEU 63 Ca -0.50 0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.45 2rjx h LEU 63 Cb 1.29 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.47 2rjx h LEU 63 CO 0.54 -0.05 0.46 4.11 -0.34 0.00 0.00 178.44 183.17 2rjx h TRP 64 N 0.15 0.51 -0.07 1.25 5.08 -1.99 0.12 115.95 121.00 2rjx h TRP 64 Ca 0.25 0.01 -0.23 0.00 1.08 0.00 0.00 58.89 60.01 2rjx h TRP 64 Cb 0.38 -0.17 0.01 0.00 -3.00 0.00 0.00 29.16 26.38 2rjx h TRP 64 CO -0.29 0.23 -0.87 -0.22 -1.28 0.00 0.00 178.44 176.01 2rjx h LYS 65 N 0.47 0.62 -0.34 0.12 1.63 -1.65 -0.50 116.57 116.92 2rjx h LYS 65 Ca 0.33 -0.57 0.00 0.00 -0.85 0.00 0.00 60.65 59.56 2rjx h LYS 65 Cb 0.64 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.39 2rjx h LYS 65 CO -0.10 1.19 0.22 1.96 -3.45 0.00 0.00 179.45 179.27 2rjx h GLN 66 N 0.39 0.45 -0.43 1.90 4.20 -0.42 0.30 115.11 121.49 2rjx h GLN 66 Ca -0.07 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 2rjx h GLN 66 Cb 1.49 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 29.15 2rjx h GLN 66 CO 0.17 0.31 0.07 1.96 -0.67 0.00 0.00 178.83 180.66 2rjx h GLN 67 N 0.46 0.72 -0.71 1.46 4.20 -0.77 -1.90 115.11 118.56 2rjx h GLN 67 Ca 0.12 -0.19 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 2rjx h GLN 67 Cb -0.04 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 2rjx h GLN 67 CO -0.03 0.75 0.25 -0.91 -0.67 0.00 0.00 178.83 178.23 2rjx h ASN 68 N 0.57 1.00 -0.72 1.46 2.35 -0.81 -1.26 115.58 118.18 2rjx h ASN 68 Ca 0.13 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.62 2rjx h ASN 68 Cb 0.38 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 2rjx h ASN 68 CO 0.01 0.92 0.18 -0.07 -1.65 0.00 0.00 177.43 176.82 2rjx h LEU 69 N 1.02 1.09 -0.38 1.61 3.38 -0.83 -0.42 115.31 120.78 2rjx h LEU 69 Ca 0.23 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2rjx h LEU 69 Cb 0.26 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2rjx h LEU 69 CO -0.01 1.04 0.20 0.11 0.09 0.00 0.00 178.44 179.86 2rjx h LYS 70 N 1.09 0.54 -0.69 1.13 1.57 -1.03 -1.40 116.57 117.78 2rjx h LYS 70 Ca 0.23 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2rjx h LYS 70 Cb 0.37 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 2rjx h LYS 70 CO 0.00 0.46 0.43 0.87 -0.57 0.00 0.00 179.45 180.65 2rjx h LYS 71 N 0.48 0.92 -0.02 3.15 1.57 -0.94 0.15 116.57 121.89 2rjx h LYS 71 Ca 0.13 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2rjx h LYS 71 Cb 0.09 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2rjx h LYS 71 CO -0.02 0.63 -0.14 0.93 -0.57 0.00 0.00 179.45 180.28 2rjx h GLU 72 N 0.93 0.03 -0.47 3.15 5.08 -0.76 -2.50 114.58 120.04 2rjx h GLU 72 Ca 0.25 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2rjx h GLU 72 Cb -0.07 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 2rjx h GLU 72 CO -0.05 0.17 0.00 1.63 -1.00 0.00 0.00 179.01 179.76 2rjx n LYS 73 N -4.36 2.45 -1.46 2.33 4.76 -0.56 -4.94 118.16 116.39 2rjx n LYS 73 Ca -0.02 -2.21 -0.08 0.00 -2.87 0.00 0.00 58.31 53.12 2rjx n LYS 73 Cb 0.22 -1.51 -0.03 0.00 -1.84 0.00 0.00 35.03 31.88 2rjx n LYS 73 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2rjx n GLY 74 N 1.49 0.74 0.47 0.72 0.00 -0.50 -4.76 105.19 103.35 2rjx n GLY 74 Ca 0.20 -0.66 0.07 0.00 0.00 0.00 0.00 46.02 45.63 2rjx n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rjx n LEU 75 N -0.94 2.93 -0.04 0.99 4.77 0.43 -1.44 117.00 123.69 2rjx n LEU 75 Ca -0.08 -2.58 0.16 0.00 -0.03 0.00 0.00 56.01 53.47 2rjx n LEU 75 Cb 0.34 -0.34 0.91 0.00 -2.33 0.00 0.00 43.42 42.00 2rjx n LEU 75 CO 0.12 0.66 1.09 0.33 -1.33 0.00 0.00 177.39 178.26