#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rrp n PHE 18 N 0.00 -2.81 -4.81 1.57 3.72 -1.26 -5.12 117.46 108.74 1rrp n PHE 18 Ca 0.00 -0.05 -0.33 0.00 -0.05 0.00 0.00 57.45 57.02 1rrp n PHE 18 Cb 0.00 -0.01 -0.14 0.00 -0.94 0.00 0.00 39.48 38.38 1rrp n PHE 18 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1rrp s GLU 19 N -2.06 3.33 1.02 -1.08 2.56 -1.26 -5.11 118.70 116.10 1rrp s GLU 19 Ca 0.01 -0.70 -0.14 0.00 0.00 0.00 0.00 54.97 54.14 1rrp s GLU 19 Cb -0.00 -2.60 0.10 0.00 2.00 0.00 0.00 34.13 33.63 1rrp s GLU 19 CO 0.01 0.23 0.44 -2.30 -0.56 0.00 0.00 175.26 173.08 1rrp n PRO 20 N 3.48 -0.93 -2.63 4.30 -0.02 -1.26 -4.95 135.00 132.98 1rrp n PRO 20 Ca -0.18 -0.24 -0.12 0.00 -2.02 0.00 0.00 63.50 60.94 1rrp n PRO 20 Cb 0.53 -1.91 0.02 0.00 -0.02 0.00 0.00 33.50 32.12 1rrp n PRO 20 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1rrp n VAL 21 N -4.07 1.23 0.00 -1.45 0.24 -1.26 -5.07 118.33 107.94 1rrp n VAL 21 Ca 0.05 -3.41 0.00 0.00 -2.04 0.00 0.00 64.34 58.94 1rrp n VAL 21 Cb 0.56 0.31 0.00 0.00 -1.47 0.00 0.00 33.84 33.24 1rrp n VAL 21 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 1rrp n VAL 22 N -0.13 0.00 -2.16 3.34 3.14 -1.26 -5.12 118.33 116.13 1rrp n VAL 22 Ca 0.15 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.10 1rrp n VAL 22 Cb 0.79 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.54 1rrp n VAL 22 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1rrp s PRO 23 N -2.00 4.29 -0.29 1.45 0.04 -1.26 -4.90 135.00 132.33 1rrp s PRO 23 Ca 0.00 2.06 -0.33 0.00 0.04 0.00 0.00 61.00 62.77 1rrp s PRO 23 Cb 0.00 -3.44 -0.09 0.00 0.04 0.00 0.00 34.50 31.01 1rrp s PRO 23 CO 0.00 -0.54 2.18 -0.11 0.04 0.00 0.00 177.00 178.58 1rrp n LEU 24 N 4.79 2.58 -4.76 -3.56 7.94 -1.26 -4.93 117.00 117.80 1rrp n LEU 24 Ca 0.13 0.37 -0.36 0.00 -1.11 0.00 0.00 56.01 55.04 1rrp n LEU 24 Cb 0.43 -1.37 0.03 0.00 0.53 0.00 0.00 43.42 43.04 1rrp n LEU 24 CO 0.59 -0.68 0.84 -2.84 -1.11 0.00 0.00 177.39 174.18 1rrp s PRO 25 N 6.14 3.03 0.46 1.96 0.02 -1.26 -4.98 135.00 140.36 1rrp s PRO 25 Ca 1.06 1.80 -0.21 0.00 0.02 0.00 0.00 61.00 63.67 1rrp s PRO 25 Cb -0.68 -1.94 -0.09 0.00 0.02 0.00 0.00 34.50 31.81 1rrp s PRO 25 CO 0.45 -1.16 1.01 -0.51 -0.33 0.00 0.00 177.00 176.46 1rrp s ASP 26 N -1.61 6.59 1.11 2.53 1.11 -1.26 -5.01 116.67 120.14 1rrp s ASP 26 Ca 0.77 1.86 -0.12 0.00 0.18 0.00 0.00 52.55 55.23 1rrp s ASP 26 Cb -0.30 -2.56 0.25 0.00 1.07 0.00 0.00 42.92 41.38 1rrp s ASP 26 CO 0.32 -0.60 1.00 0.29 1.18 0.00 0.00 175.17 177.35 1rrp n LYS 27 N -0.75 -1.95 -4.58 8.23 5.02 -1.26 -5.03 118.16 117.85 1rrp n LYS 27 Ca 0.08 -0.53 -0.27 0.00 -2.02 0.00 0.00 58.31 55.57 1rrp n LYS 27 Cb 0.53 -2.19 -0.09 0.00 -0.02 0.00 0.00 35.03 33.26 1rrp n LYS 27 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1rrp s ILE 28 N -2.45 1.01 -0.47 -0.18 -1.09 -1.26 -5.09 121.20 111.67 1rrp s ILE 28 Ca 0.68 -2.00 -0.21 0.00 -2.23 0.00 0.00 60.65 56.89 1rrp s ILE 28 Cb -0.24 -2.46 0.03 0.00 -1.58 0.00 0.00 42.46 38.22 1rrp s ILE 28 CO 0.64 0.00 0.66 -0.70 -1.23 0.00 0.00 174.94 174.31 1rrp s GLU 29 N -3.79 3.23 -0.84 2.79 2.12 -1.26 -4.93 118.70 116.02 1rrp s GLU 29 Ca 0.23 -0.51 -0.21 0.00 0.36 0.00 0.00 54.97 54.84 1rrp s GLU 29 Cb 0.04 -4.00 -0.19 0.00 0.26 0.00 0.00 34.13 30.24 1rrp s GLU 29 CO 0.12 -1.11 2.26 1.33 -0.54 0.00 0.00 175.26 177.32 1rrp n VAL 30 N 5.81 0.00 0.00 3.70 0.24 -1.26 -4.83 118.33 121.99 1rrp n VAL 30 Ca -0.03 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 1rrp n VAL 30 Cb 0.47 -1.42 0.00 0.00 -1.47 0.00 0.00 33.84 31.42 1rrp n VAL 30 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1rrp n LYS 31 N 7.73 0.00 0.00 7.34 3.00 -1.26 -4.99 118.16 129.98 1rrp n LYS 31 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.80 1rrp n LYS 31 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.40 1rrp n LYS 31 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1rrp n THR 32 N 0.00 0.00 -0.32 3.15 5.66 -1.26 -4.81 114.28 116.69 1rrp n THR 32 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1rrp n THR 32 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1rrp n THR 32 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rrp n GLY 33 N 0.00 0.00 0.00 1.09 0.00 -1.26 -4.76 105.19 100.26 1rrp n GLY 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1rrp n GLY 33 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rrp n GLU 34 N -0.15 0.00 0.00 1.61 -0.58 -1.26 -4.92 120.64 115.33 1rrp n GLU 34 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1rrp n GLU 34 Cb 0.08 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.95 1rrp n GLU 34 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 1rrp n GLU 35 N 0.00 0.00 -0.41 3.49 0.00 -1.26 -4.17 120.64 118.29 1rrp n GLU 35 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1rrp n GLU 35 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1rrp n GLU 35 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1rrp n ASP 36 N 0.00 0.00 -3.80 -1.84 9.92 -1.26 -4.60 116.55 114.98 1rrp n ASP 36 Ca 0.00 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.17 1rrp n ASP 36 Cb 0.00 -0.31 -0.04 0.00 -0.64 0.00 0.00 41.12 40.13 1rrp n ASP 36 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1rrp s GLU 37 N -0.81 1.44 -0.01 -1.24 2.02 -1.26 -0.37 118.70 118.47 1rrp s GLU 37 Ca 0.00 -0.94 0.02 0.00 0.02 0.00 0.00 54.97 54.06 1rrp s GLU 37 Cb 0.00 0.52 -0.00 0.00 0.10 0.00 0.00 34.13 34.75 1rrp s GLU 37 CO 0.00 -0.61 -0.06 -1.83 0.02 0.00 0.00 175.26 172.78 1rrp s GLU 38 N -3.90 0.50 -0.92 1.61 -1.05 -1.01 -4.87 118.70 109.05 1rrp s GLU 38 Ca 0.12 -0.20 -0.25 0.00 -0.15 0.00 0.00 54.97 54.49 1rrp s GLU 38 Cb -0.01 -0.49 -0.11 0.00 -0.44 0.00 0.00 34.13 33.08 1rrp s GLU 38 CO -0.00 0.11 2.14 -1.21 0.95 0.00 0.00 175.26 177.25 1rrp s GLU 39 N -0.05 2.00 0.00 -4.83 2.02 -1.26 -3.40 118.70 113.18 1rrp s GLU 39 Ca 0.01 -0.12 0.04 0.00 0.02 0.00 0.00 54.97 54.92 1rrp s GLU 39 Cb -0.03 -4.97 0.20 0.00 0.10 0.00 0.00 34.13 29.42 1rrp s GLU 39 CO -0.00 -4.15 1.12 0.34 0.02 0.00 0.00 175.26 172.58 1rrp n PHE 40 N 16.59 0.00 0.00 1.61 -0.00 0.29 -4.70 117.46 131.25 1rrp n PHE 40 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.88 1rrp n PHE 40 Cb 0.45 -0.47 0.00 0.00 -0.00 0.00 0.00 39.48 39.47 1rrp n PHE 40 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1rrp n PHE 41 N -1.47 0.00 -3.15 -5.13 -0.00 -1.24 -4.91 117.46 101.57 1rrp n PHE 41 Ca 0.01 0.00 0.05 0.00 -0.00 0.00 0.00 57.45 57.51 1rrp n PHE 41 Cb 0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 39.48 39.53 1rrp n PHE 41 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1rrp s ASN 43 N 2.89 1.10 0.17 0.00 3.84 -0.96 -4.97 114.94 117.01 1rrp s ASN 43 Ca 0.16 -0.71 -0.17 0.00 0.21 0.00 0.00 52.86 52.36 1rrp s ASN 43 Cb -0.08 0.04 -0.07 0.00 -0.55 0.00 0.00 41.25 40.59 1rrp s ASN 43 CO -0.23 -0.26 0.62 0.00 -2.79 0.00 0.00 177.10 174.44 1rrp s ARG 44 N -2.33 4.11 0.28 0.43 1.04 -1.25 0.48 118.95 121.70 1rrp s ARG 44 Ca -0.01 0.66 -0.08 0.00 -1.04 0.00 0.00 55.73 55.26 1rrp s ARG 44 Cb -0.05 -2.94 0.03 0.00 -2.04 0.00 0.00 34.95 29.95 1rrp s ARG 44 CO -0.01 0.46 0.52 0.00 -0.04 0.00 0.00 175.30 176.23 1rrp n ALA 45 N 0.87 -1.03 -2.83 7.88 0.00 0.44 -4.78 120.51 121.04 1rrp n ALA 45 Ca -0.05 -0.98 -0.32 0.00 0.00 0.00 0.00 53.44 52.10 1rrp n ALA 45 Cb 0.51 0.78 -0.15 0.00 0.00 0.00 0.00 19.45 20.59 1rrp n ALA 45 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1rrp s LYS 46 N -2.19 2.86 -0.05 0.00 2.20 -0.97 -1.39 119.74 120.21 1rrp s LYS 46 Ca 0.14 -0.78 -0.01 0.00 -0.36 0.00 0.00 55.97 54.96 1rrp s LYS 46 Cb -0.03 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.87 1rrp s LYS 46 CO 0.10 0.37 0.03 -1.17 -0.36 0.00 0.00 175.35 174.32 1rrp s LEU 47 N -0.08 3.71 -0.03 5.43 2.96 0.38 -1.24 118.68 129.81 1rrp s LEU 47 Ca -0.04 0.13 0.03 0.00 -0.22 0.00 0.00 54.13 54.03 1rrp s LEU 47 Cb -0.14 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.55 1rrp s LEU 47 CO 0.04 0.33 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.94 1rrp s PHE 48 N -1.03 1.09 -0.07 5.38 0.40 0.22 0.15 117.98 124.13 1rrp s PHE 48 Ca 0.17 -0.29 0.02 0.00 -0.60 0.00 0.00 56.93 56.24 1rrp s PHE 48 Cb -0.12 -0.77 -0.03 0.00 0.51 0.00 0.00 43.02 42.62 1rrp s PHE 48 CO 0.07 -0.12 -0.12 0.50 0.70 0.00 0.00 175.22 176.26 1rrp s ARG 49 N 0.19 2.70 0.66 0.44 3.00 -0.26 -0.54 118.95 125.13 1rrp s ARG 49 Ca -0.04 -0.66 -0.11 0.00 -1.00 0.00 0.00 55.73 53.93 1rrp s ARG 49 Cb -0.09 -2.47 -0.02 0.00 0.00 0.00 0.00 34.95 32.37 1rrp s ARG 49 CO 0.01 0.57 1.05 0.12 0.00 0.00 0.00 175.30 177.05 1rrp s PHE 50 N -0.59 3.40 -0.26 5.12 5.36 -0.91 -0.94 117.98 129.17 1rrp s PHE 50 Ca 0.08 1.33 -0.11 0.00 -0.96 0.00 0.00 56.93 57.27 1rrp s PHE 50 Cb -0.11 -2.80 -0.12 0.00 -0.34 0.00 0.00 43.02 39.64 1rrp s PHE 50 CO 0.01 -0.94 -0.32 -3.47 -1.46 0.00 0.00 175.22 169.04 1rrp n ASP 51 N -2.92 1.88 0.00 6.13 2.03 -1.02 -4.83 116.55 117.82 1rrp n ASP 51 Ca 0.07 0.25 0.00 0.00 0.52 0.00 0.00 54.79 55.63 1rrp n ASP 51 Cb 0.54 -0.72 0.00 0.00 -0.72 0.00 0.00 41.12 40.22 1rrp n ASP 51 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1rrp n VAL 52 N -4.04 0.00 -0.29 5.18 0.31 -1.26 -4.34 118.33 113.89 1rrp n VAL 52 Ca -0.51 0.00 0.34 0.00 -0.01 0.00 0.00 64.34 64.17 1rrp n VAL 52 Cb 0.88 0.00 0.74 0.00 -0.91 0.00 0.00 33.84 34.55 1rrp n VAL 52 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1rrp h GLU 53 N 0.00 0.00 0.00 5.55 4.57 -1.94 -3.37 114.58 119.39 1rrp h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1rrp h GLU 53 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1rrp h GLU 53 CO 0.00 0.00 0.00 -1.13 -1.18 0.00 0.00 179.01 176.70 1rrp n SER 54 N -4.13 0.00 0.00 1.04 3.41 -1.26 -5.07 113.62 107.61 1rrp n SER 54 Ca 0.24 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 1rrp n SER 54 Cb 1.21 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1rrp n SER 54 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1rrp n LYS 55 N 0.00 0.00 -3.01 4.33 4.81 -1.26 -5.03 118.16 118.00 1rrp n LYS 55 Ca 0.00 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.10 1rrp n LYS 55 Cb 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 34.99 1rrp n LYS 55 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1rrp s GLU 56 N 0.00 4.17 0.07 1.64 -1.05 -1.26 -4.81 118.70 117.46 1rrp s GLU 56 Ca 0.00 0.90 -0.22 0.00 -0.15 0.00 0.00 54.97 55.50 1rrp s GLU 56 Cb 0.00 -2.48 -0.06 0.00 -0.44 0.00 0.00 34.13 31.14 1rrp s GLU 56 CO 0.00 0.16 0.66 -1.58 0.95 0.00 0.00 175.26 175.45 1rrp s TRP 57 N -1.91 3.79 -0.02 4.83 0.52 -1.26 -2.45 118.94 122.44 1rrp s TRP 57 Ca 0.54 1.37 0.06 0.00 0.02 0.00 0.00 56.10 58.09 1rrp s TRP 57 Cb -0.12 -2.65 -0.03 0.00 -1.15 0.00 0.00 33.47 29.53 1rrp s TRP 57 CO 0.18 0.46 -0.19 0.15 0.02 0.00 0.00 176.95 177.56 1rrp s LYS 58 N -0.70 2.26 -0.05 4.98 1.02 -0.12 -4.96 119.74 122.17 1rrp s LYS 58 Ca 0.33 -0.85 -0.30 0.00 0.02 0.00 0.00 55.97 55.17 1rrp s LYS 58 Cb -0.20 -2.22 -0.06 0.00 -0.52 0.00 0.00 37.83 34.83 1rrp s LYS 58 CO 0.21 0.58 1.71 -2.00 -0.92 0.00 0.00 175.35 174.93 1rrp s GLU 59 N -0.88 4.15 -0.16 1.68 2.12 -1.26 -1.10 118.70 123.25 1rrp s GLU 59 Ca 0.12 2.23 0.18 0.00 0.36 0.00 0.00 54.97 57.86 1rrp s GLU 59 Cb -0.10 -4.02 -0.25 0.00 0.26 0.00 0.00 34.13 30.01 1rrp s GLU 59 CO 0.01 -0.90 0.19 -2.13 -0.54 0.00 0.00 175.26 171.89 1rrp n ARG 60 N 7.24 0.68 0.00 4.30 3.00 0.40 -4.85 116.66 127.42 1rrp n ARG 60 Ca 0.18 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 58.03 1rrp n ARG 60 Cb 0.43 -1.55 0.00 0.00 0.00 0.00 0.00 32.46 31.33 1rrp n ARG 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1rrp n GLY 61 N 1.67 1.36 2.85 5.14 0.00 -0.82 -4.94 105.19 110.46 1rrp n GLY 61 Ca -0.28 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 1rrp n GLY 61 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1rrp s ILE 62 N -2.00 0.67 -2.47 -0.61 1.10 -1.26 0.15 121.20 116.77 1rrp s ILE 62 Ca 0.00 -0.10 0.00 0.00 -0.51 0.00 0.00 60.65 60.04 1rrp s ILE 62 Cb 0.00 -0.74 0.00 0.00 0.15 0.00 0.00 42.46 41.87 1rrp s ILE 62 CO 0.00 0.29 0.00 0.61 -2.11 0.00 0.00 174.94 173.73 1rrp n GLY 63 N 4.77 -0.61 3.56 1.50 0.00 -0.48 -1.68 105.19 112.25 1rrp n GLY 63 Ca -0.13 -0.52 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 1rrp n GLY 63 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rrp s ASN 64 N -4.00 5.99 -0.17 1.61 0.01 -1.19 0.17 114.94 117.36 1rrp s ASN 64 Ca 0.00 -0.19 -0.26 0.00 -0.71 0.00 0.00 52.86 51.70 1rrp s ASN 64 Cb 0.00 -2.12 -0.01 0.00 0.41 0.00 0.00 41.25 39.53 1rrp s ASN 64 CO 0.00 -0.12 0.85 0.68 -1.51 0.00 0.00 177.10 177.00 1rrp s VAL 65 N 1.74 4.86 0.30 1.60 -7.23 0.18 -3.32 120.40 118.52 1rrp s VAL 65 Ca 0.07 1.68 0.09 0.00 -1.81 0.00 0.00 61.98 62.01 1rrp s VAL 65 Cb -0.17 -4.16 -0.05 0.00 0.56 0.00 0.00 36.38 32.57 1rrp s VAL 65 CO 0.10 0.01 -0.00 -0.54 -0.31 0.00 0.00 175.10 174.37 1rrp s LYS 66 N 2.19 2.17 -0.36 4.82 1.02 -0.16 -2.28 119.74 127.15 1rrp s LYS 66 Ca 0.39 -1.57 0.01 0.00 0.02 0.00 0.00 55.97 54.82 1rrp s LYS 66 Cb -0.17 -2.05 0.12 0.00 -0.52 0.00 0.00 37.83 35.21 1rrp s LYS 66 CO 0.12 0.26 0.15 0.42 -0.92 0.00 0.00 175.35 175.39 1rrp s ILE 67 N -2.41 1.08 -0.17 2.17 1.01 -0.58 -2.54 121.20 119.77 1rrp s ILE 67 Ca 0.33 -1.87 -0.08 0.00 0.00 0.00 0.00 60.65 59.03 1rrp s ILE 67 Cb -0.04 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 1rrp s ILE 67 CO 0.20 -0.77 0.09 -0.76 0.00 0.00 0.00 174.94 173.69 1rrp s LEU 68 N 1.10 3.99 -0.15 2.97 1.43 -0.75 -0.55 118.68 126.73 1rrp s LEU 68 Ca 0.13 0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.38 1rrp s LEU 68 Cb -0.20 -2.00 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 1rrp s LEU 68 CO -0.14 0.23 -0.04 0.00 0.23 0.00 0.00 176.35 176.63 1rrp s ARG 69 N 0.05 3.64 0.49 1.70 1.04 -1.22 0.12 118.95 124.78 1rrp s ARG 69 Ca 0.07 -0.52 -0.24 0.00 -1.04 0.00 0.00 55.73 54.00 1rrp s ARG 69 Cb -0.12 -2.90 -0.07 0.00 -2.04 0.00 0.00 34.95 29.82 1rrp s ARG 69 CO 0.00 0.26 1.41 -1.58 -0.04 0.00 0.00 175.30 175.36 1rrp s HIS 70 N 0.30 2.35 0.08 5.89 5.65 -1.15 -2.41 115.29 126.01 1rrp s HIS 70 Ca -0.04 1.29 -0.17 0.00 0.25 0.00 0.00 55.06 56.40 1rrp s HIS 70 Cb -0.14 -3.90 -0.09 0.00 -1.18 0.00 0.00 32.58 27.27 1rrp s HIS 70 CO 0.03 -3.02 1.43 0.87 -0.65 0.00 0.00 174.74 173.40 1rrp h LYS 71 N 1.95 0.57 0.00 2.88 1.57 -1.04 -2.95 116.57 119.54 1rrp h LYS 71 Ca -0.51 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.01 1rrp h LYS 71 Cb 1.28 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1rrp h LYS 71 CO 0.59 0.84 0.00 2.41 -0.57 0.00 0.00 179.45 182.72 1rrp n THR 72 N -4.42 0.00 -0.42 -0.16 -1.04 -1.26 -4.50 114.28 102.48 1rrp n THR 72 Ca -0.04 0.00 0.34 0.00 -2.04 0.00 0.00 64.05 62.31 1rrp n THR 72 Cb 0.38 -0.23 0.62 0.00 -1.82 0.00 0.00 70.33 69.28 1rrp n THR 72 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1rrp h SER 73 N 0.00 0.29 -0.09 8.00 4.64 -1.93 -3.44 113.55 121.02 1rrp h SER 73 Ca 0.00 0.14 -0.04 0.00 -0.47 0.00 0.00 61.79 61.43 1rrp h SER 73 Cb 0.00 0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1rrp h SER 73 CO 0.00 -0.17 -0.03 0.61 -0.87 0.00 0.00 176.83 176.36 1rrp n GLY 74 N -1.48 0.54 3.57 -0.77 0.00 -1.11 -4.94 105.19 100.99 1rrp n GLY 74 Ca 0.36 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 1rrp n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rrp s LYS 75 N -1.77 3.55 -0.05 1.61 1.02 -1.26 -4.39 119.74 118.45 1rrp s LYS 75 Ca 0.00 0.21 -0.30 0.00 0.02 0.00 0.00 55.97 55.90 1rrp s LYS 75 Cb 0.00 -3.93 -0.03 0.00 -0.52 0.00 0.00 37.83 33.35 1rrp s LYS 75 CO 0.00 -1.27 1.09 0.42 -0.92 0.00 0.00 175.35 174.67 1rrp s ILE 76 N 3.90 4.54 0.38 2.17 1.01 -1.25 -2.93 121.20 129.03 1rrp s ILE 76 Ca 0.39 1.83 0.04 0.00 0.00 0.00 0.00 60.65 62.91 1rrp s ILE 76 Cb -0.10 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.15 1rrp s ILE 76 CO 0.27 0.04 0.06 0.00 0.00 0.00 0.00 174.94 175.31 1rrp s ARG 77 N 1.78 1.84 -0.32 2.79 1.70 0.12 -1.74 118.95 125.11 1rrp s ARG 77 Ca 0.53 -2.08 0.03 0.00 -0.47 0.00 0.00 55.73 53.74 1rrp s ARG 77 Cb -0.22 -1.02 0.09 0.00 -0.57 0.00 0.00 34.95 33.24 1rrp s ARG 77 CO 0.22 -0.26 0.03 -1.17 -1.08 0.00 0.00 175.30 173.05 1rrp s LEU 78 N -3.60 4.25 -0.23 -1.89 0.20 0.44 -1.81 118.68 116.03 1rrp s LEU 78 Ca 0.29 -1.98 -0.07 0.00 0.69 0.00 0.00 54.13 53.06 1rrp s LEU 78 Cb 0.06 -1.52 -0.03 0.00 -0.43 0.00 0.00 46.19 44.28 1rrp s LEU 78 CO 0.14 -0.36 0.07 -0.22 -0.29 0.00 0.00 176.35 175.69 1rrp s LEU 79 N 1.02 3.51 0.07 -0.68 2.96 -1.05 -2.83 118.68 121.68 1rrp s LEU 79 Ca 0.08 -0.15 0.09 0.00 -0.22 0.00 0.00 54.13 53.93 1rrp s LEU 79 Cb -0.19 -1.93 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 1rrp s LEU 79 CO -0.10 0.01 -0.24 -0.32 -1.32 0.00 0.00 176.35 174.38 1rrp s MET 80 N 1.35 1.78 0.09 1.98 -2.45 -0.87 -0.99 119.30 120.19 1rrp s MET 80 Ca 0.05 -1.14 0.02 0.00 -1.25 0.00 0.00 55.69 53.37 1rrp s MET 80 Cb -0.15 -2.02 -0.04 0.00 1.25 0.00 0.00 34.83 33.87 1rrp s MET 80 CO 0.04 0.50 -0.06 0.50 1.05 0.00 0.00 175.02 177.04 1rrp s ARG 81 N -1.52 0.77 -0.14 4.11 3.52 -1.21 -0.73 118.95 123.75 1rrp s ARG 81 Ca 0.13 -1.23 -0.09 0.00 -0.13 0.00 0.00 55.73 54.41 1rrp s ARG 81 Cb -0.10 -0.19 -0.04 0.00 -1.56 0.00 0.00 34.95 33.06 1rrp s ARG 81 CO 0.04 -0.01 0.16 1.03 -0.81 0.00 0.00 175.30 175.71 1rrp s ARG 82 N -3.48 3.74 1.15 5.12 0.52 -0.31 -3.16 118.95 122.53 1rrp s ARG 82 Ca 0.08 -0.11 -0.15 0.00 -0.52 0.00 0.00 55.73 55.03 1rrp s ARG 82 Cb 0.03 -3.28 0.26 0.00 0.52 0.00 0.00 34.95 32.49 1rrp s ARG 82 CO -0.04 0.60 1.05 -1.83 0.02 0.00 0.00 175.30 175.10 1rrp s GLU 83 N -0.53 -0.77 0.00 3.54 -1.05 -0.67 0.35 118.70 119.57 1rrp s GLU 83 Ca 0.14 0.44 0.00 0.00 -0.15 0.00 0.00 54.97 55.39 1rrp s GLU 83 Cb -0.12 -1.60 0.00 0.00 -0.44 0.00 0.00 34.13 31.97 1rrp s GLU 83 CO 0.03 -3.52 0.00 1.04 0.95 0.00 0.00 175.26 173.75 1rrp n GLN 84 N -4.72 0.00 -0.01 -4.83 6.02 -1.26 -3.34 117.38 109.24 1rrp n GLN 84 Ca 0.06 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 57.04 1rrp n GLN 84 Cb 0.57 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.72 1rrp n GLN 84 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 1rrp n VAL 85 N 0.00 1.14 -2.74 5.09 3.14 -1.26 -5.05 118.33 118.64 1rrp n VAL 85 Ca 0.00 -0.71 -0.01 0.00 -2.96 0.00 0.00 64.34 60.65 1rrp n VAL 85 Cb 0.00 -0.63 -0.01 0.00 -1.06 0.00 0.00 33.84 32.14 1rrp n VAL 85 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1rrp n LEU 86 N -2.80 -7.35 -3.77 6.55 4.77 0.16 -5.02 117.00 109.53 1rrp n LEU 86 Ca -0.15 1.53 -0.13 0.00 -0.03 0.00 0.00 56.01 57.23 1rrp n LEU 86 Cb 0.90 -3.20 -0.12 0.00 -2.33 0.00 0.00 43.42 38.67 1rrp n LEU 86 CO 0.43 -3.26 -0.08 -0.54 -1.33 0.00 0.00 177.39 172.61 1rrp s LYS 87 N -1.40 0.28 0.68 3.23 -0.14 -1.22 -4.87 119.74 116.31 1rrp s LYS 87 Ca -0.05 0.42 -0.17 0.00 -1.36 0.00 0.00 55.97 54.81 1rrp s LYS 87 Cb 0.00 0.08 0.01 0.00 -1.68 0.00 0.00 37.83 36.24 1rrp s LYS 87 CO 0.72 -0.07 1.27 0.42 -0.76 0.00 0.00 175.35 176.93 1rrp s ILE 88 N 0.46 2.08 0.00 2.17 1.01 -1.26 -1.16 121.20 124.50 1rrp s ILE 88 Ca -0.03 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.67 1rrp s ILE 88 Cb -0.04 -2.89 0.00 0.00 0.01 0.00 0.00 42.46 39.54 1rrp s ILE 88 CO -0.02 -0.02 0.74 0.00 0.00 0.00 0.00 174.94 175.64 1rrp s ALA 90 N 0.00 -2.30 0.00 0.00 0.00 -1.21 -4.84 121.76 113.42 1rrp s ALA 90 Ca 0.00 1.83 0.00 0.00 0.00 0.00 0.00 51.96 53.80 1rrp s ALA 90 Cb 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.35 1rrp s ALA 90 CO -0.00 -0.20 0.00 -1.71 0.00 0.00 0.00 175.76 173.85 1rrp n ASN 91 N 2.25 0.00 -4.49 0.00 4.05 -1.13 -2.05 115.26 113.89 1rrp n ASN 91 Ca -0.13 0.00 -0.32 0.00 0.45 0.00 0.00 54.58 54.58 1rrp n ASN 91 Cb 0.57 0.00 0.15 0.00 1.23 0.00 0.00 39.78 41.73 1rrp n ASN 91 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1rrp n HIS 92 N 0.00 -0.70 -3.38 1.20 1.44 -1.25 -4.50 115.22 108.03 1rrp n HIS 92 Ca 0.00 0.24 -0.38 0.00 -2.01 0.00 0.00 57.72 55.57 1rrp n HIS 92 Cb 0.00 -1.82 -0.06 0.00 0.12 0.00 0.00 29.99 28.23 1rrp n HIS 92 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 1rrp s TYR 93 N -2.46 3.64 0.23 -1.40 2.02 -1.26 -0.42 117.35 117.70 1rrp s TYR 93 Ca 0.61 0.99 -0.30 0.00 -0.37 0.00 0.00 57.07 57.99 1rrp s TYR 93 Cb -0.21 -2.44 -0.10 0.00 -0.40 0.00 0.00 41.96 38.81 1rrp s TYR 93 CO 0.64 0.42 1.40 0.42 -1.57 0.00 0.00 175.55 176.86 1rrp s ILE 94 N -0.31 2.85 0.25 2.71 1.01 -0.71 -4.89 121.20 122.12 1rrp s ILE 94 Ca 0.25 0.71 0.09 0.00 0.00 0.00 0.00 60.65 61.70 1rrp s ILE 94 Cb -0.16 -3.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.80 1rrp s ILE 94 CO 0.13 0.11 -0.13 -0.55 0.00 0.00 0.00 174.94 174.49 1rrp s SER 95 N 0.39 2.94 0.00 3.58 0.15 -1.26 -4.89 113.70 114.61 1rrp s SER 95 Ca 0.59 -1.07 0.22 0.00 0.70 0.00 0.00 55.95 56.39 1rrp s SER 95 Cb -0.40 -0.20 1.02 0.00 -1.71 0.00 0.00 66.02 64.73 1rrp s SER 95 CO 0.41 -0.16 1.72 -2.65 1.20 0.00 0.00 173.24 173.75 1rrp n PRO 96 N -0.51 0.13 0.05 5.44 -0.02 -1.26 -2.61 135.00 136.21 1rrp n PRO 96 Ca -0.06 0.10 -0.10 0.00 -2.02 0.00 0.00 63.50 61.42 1rrp n PRO 96 Cb 0.61 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.46 1rrp n PRO 96 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1rrp h ASP 97 N 0.00 0.10 -2.87 2.55 5.19 -2.00 -3.45 116.42 115.94 1rrp h ASP 97 Ca 0.00 -0.12 -0.53 0.00 -0.62 0.00 0.00 57.03 55.75 1rrp h ASP 97 Cb 0.31 -0.03 0.02 0.00 0.18 0.00 0.00 39.33 39.81 1rrp h ASP 97 CO 0.00 1.10 0.84 -0.04 -3.12 0.00 0.00 179.24 178.02 1rrp s MET 98 N -2.67 4.26 -0.24 3.56 -1.94 -1.07 -5.01 119.30 116.20 1rrp s MET 98 Ca -0.02 2.17 0.00 0.00 -1.71 0.00 0.00 55.69 56.13 1rrp s MET 98 Cb 0.09 -3.38 0.06 0.00 2.01 0.00 0.00 34.83 33.61 1rrp s MET 98 CO 0.83 -0.57 -0.03 0.21 -0.01 0.00 0.00 175.02 175.45 1rrp s LYS 99 N 1.76 1.43 -0.97 2.03 2.20 -1.26 -4.91 119.74 120.01 1rrp s LYS 99 Ca 0.68 -0.95 -0.24 0.00 -0.36 0.00 0.00 55.97 55.10 1rrp s LYS 99 Cb -0.38 -2.51 -0.04 0.00 -1.51 0.00 0.00 37.83 33.39 1rrp s LYS 99 CO 0.30 -0.64 1.89 -0.51 -0.36 0.00 0.00 175.35 176.03 1rrp s LEU 100 N 1.45 3.19 0.43 5.43 1.43 -1.26 -4.61 118.68 124.74 1rrp s LEU 100 Ca -0.04 -0.96 -0.19 0.00 -1.03 0.00 0.00 54.13 51.91 1rrp s LEU 100 Cb -0.19 -2.57 -0.10 0.00 0.03 0.00 0.00 46.19 43.37 1rrp s LEU 100 CO -0.08 -2.65 0.92 0.42 0.23 0.00 0.00 176.35 175.20 1rrp s THR 101 N 9.63 4.46 0.00 5.49 -4.23 -1.09 -4.86 115.64 125.04 1rrp s THR 101 Ca 0.67 1.36 0.00 0.00 -1.18 0.00 0.00 61.69 62.54 1rrp s THR 101 Cb -0.05 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.17 1rrp s THR 101 CO 0.01 -0.36 0.00 -2.65 -0.54 0.00 0.00 174.62 171.08 1rrp n PRO 102 N -0.75 0.00 0.00 3.99 -0.02 -1.26 -1.61 135.00 135.35 1rrp n PRO 102 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1rrp n PRO 102 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.02 1rrp n PRO 102 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1rrp n ASN 103 N 0.00 0.00 -2.59 2.55 5.15 -1.26 -2.91 115.26 116.21 1rrp n ASN 103 Ca 0.00 0.00 -0.19 0.00 -0.60 0.00 0.00 54.58 53.79 1rrp n ASN 103 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1rrp n ASN 103 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1rrp n ALA 104 N 0.00 -0.75 -0.48 5.20 0.00 -1.26 -0.29 120.51 122.92 1rrp n ALA 104 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1rrp n ALA 104 Cb 0.00 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.04 1rrp n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rrp n GLY 105 N -1.08 1.30 3.56 0.00 0.00 -1.26 -4.90 105.19 102.81 1rrp n GLY 105 Ca -0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 1rrp n GLY 105 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1rrp n SER 106 N 0.00 1.66 -0.67 1.61 2.88 0.60 -4.74 113.62 114.96 1rrp n SER 106 Ca 0.00 -1.64 0.00 0.00 -1.33 0.00 0.00 58.87 55.90 1rrp n SER 106 Cb 0.00 -1.66 0.00 0.00 -0.75 0.00 0.00 64.21 61.80 1rrp n SER 106 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1rrp n ASP 107 N 18.72 0.88 0.00 -3.46 5.68 -1.26 -1.74 116.55 135.38 1rrp n ASP 107 Ca 0.46 -1.06 0.00 0.00 -0.50 0.00 0.00 54.79 53.69 1rrp n ASP 107 Cb 0.43 -0.27 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 1rrp n ASP 107 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1rrp n ARG 108 N 0.40 -0.44 -3.68 0.11 1.74 -1.26 -4.43 116.66 109.09 1rrp n ARG 108 Ca 0.00 -0.34 -0.14 0.00 -0.77 0.00 0.00 57.85 56.60 1rrp n ARG 108 Cb 0.18 -0.79 -0.08 0.00 -1.02 0.00 0.00 32.46 30.75 1rrp n ARG 108 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1rrp s SER 109 N -0.03 -0.33 0.18 0.55 1.04 -0.71 0.23 113.70 114.62 1rrp s SER 109 Ca 0.00 0.23 0.02 0.00 0.48 0.00 0.00 55.95 56.68 1rrp s SER 109 Cb 0.00 0.39 -0.05 0.00 0.10 0.00 0.00 66.02 66.46 1rrp s SER 109 CO 0.00 -0.53 0.01 -0.36 0.98 0.00 0.00 173.24 173.34 1rrp s PHE 110 N -1.50 1.21 -0.02 5.02 0.08 -0.03 -4.15 117.98 118.59 1rrp s PHE 110 Ca -0.11 -1.05 0.03 0.00 0.12 0.00 0.00 56.93 55.92 1rrp s PHE 110 Cb -0.03 -0.69 -0.00 0.00 -0.57 0.00 0.00 43.02 41.73 1rrp s PHE 110 CO 0.05 -0.24 -0.11 0.54 -0.10 0.00 0.00 175.22 175.35 1rrp s VAL 111 N -3.70 0.90 0.08 -0.44 0.11 -0.63 -0.25 120.40 116.47 1rrp s VAL 111 Ca 0.25 -0.45 -0.14 0.00 -2.93 0.00 0.00 61.98 58.71 1rrp s VAL 111 Cb 0.06 -0.78 0.02 0.00 -1.53 0.00 0.00 36.38 34.16 1rrp s VAL 111 CO 0.05 0.27 0.33 -1.66 -3.33 0.00 0.00 175.10 170.75 1rrp s TRP 112 N -0.01 -0.12 -0.00 1.54 -2.14 -0.78 -2.65 118.94 114.78 1rrp s TRP 112 Ca -0.00 -0.11 -0.06 0.00 2.66 0.00 0.00 56.10 58.59 1rrp s TRP 112 Cb -0.07 0.14 -0.05 0.00 -3.10 0.00 0.00 33.47 30.39 1rrp s TRP 112 CO 0.00 -0.59 0.24 -1.58 -2.66 0.00 0.00 176.95 172.37 1rrp s HIS 113 N -3.18 3.57 -0.22 1.66 5.65 -1.26 -0.02 115.29 121.50 1rrp s HIS 113 Ca -0.01 0.53 -0.21 0.00 0.25 0.00 0.00 55.06 55.62 1rrp s HIS 113 Cb 0.01 -1.96 0.06 0.00 -1.18 0.00 0.00 32.58 29.51 1rrp s HIS 113 CO -0.07 0.63 0.60 0.00 -0.65 0.00 0.00 174.74 175.24 1rrp s ALA 114 N -1.29 -1.48 -1.44 1.58 0.00 -0.75 -4.82 121.76 113.55 1rrp s ALA 114 Ca 0.27 1.68 -0.12 0.00 0.00 0.00 0.00 51.96 53.79 1rrp s ALA 114 Cb -0.13 -0.97 0.05 0.00 0.00 0.00 0.00 23.12 22.07 1rrp s ALA 114 CO 0.16 -0.28 2.28 -0.11 0.00 0.00 0.00 175.76 177.81 1rrp n LEU 115 N 2.74 7.18 -4.63 0.00 -0.00 -1.26 -2.08 117.00 118.95 1rrp n LEU 115 Ca -0.14 -4.31 -0.31 0.00 -0.00 0.00 0.00 56.01 51.25 1rrp n LEU 115 Cb 0.56 -1.59 0.17 0.00 -0.00 0.00 0.00 43.42 42.55 1rrp n LEU 115 CO 0.07 1.36 0.59 -0.67 -0.00 0.00 0.00 177.39 178.74 1rrp n ASP 116 N 5.07 -0.02 -0.42 1.96 2.03 -0.72 -4.56 116.55 119.90 1rrp n ASP 116 Ca 0.54 0.37 0.02 0.00 0.52 0.00 0.00 54.79 56.25 1rrp n ASP 116 Cb 0.35 -1.44 0.03 0.00 -0.72 0.00 0.00 41.12 39.34 1rrp n ASP 116 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rrp n TYR 117 N -4.26 0.00 -0.31 -0.67 9.36 -1.26 -1.11 117.16 118.92 1rrp n TYR 117 Ca 0.11 -0.21 0.31 0.00 3.32 0.00 0.00 57.90 61.43 1rrp n TYR 117 Cb 0.52 -0.07 0.68 0.00 -0.63 0.00 0.00 39.34 39.84 1rrp n TYR 117 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1rrp h ALA 118 N 0.00 2.85 -0.31 2.98 0.00 -1.85 0.52 119.26 123.45 1rrp h ALA 118 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rrp h ALA 118 Cb 1.32 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1rrp h ALA 118 CO 0.00 -1.20 0.00 -0.25 0.00 0.00 0.00 179.25 177.80 1rrp n ASP 119 N -4.32 2.73 -1.37 0.00 8.00 -1.26 -4.67 116.55 115.65 1rrp n ASP 119 Ca 0.25 -1.89 -0.11 0.00 0.71 0.00 0.00 54.79 53.75 1rrp n ASP 119 Cb 1.12 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 42.02 1rrp n ASP 119 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1rrp n GLU 120 N 1.02 -1.41 -3.68 -1.24 1.02 0.18 -5.00 120.64 111.54 1rrp n GLU 120 Ca 0.18 0.50 -0.09 0.00 -0.02 0.00 0.00 57.16 57.73 1rrp n GLU 120 Cb 0.49 -4.55 -0.10 0.00 -0.02 0.00 0.00 31.44 27.26 1rrp n GLU 120 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1rrp s LEU 121 N -3.28 -0.42 -0.00 -4.62 1.43 -1.26 -5.11 118.68 105.42 1rrp s LEU 121 Ca 0.05 1.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.89 1rrp s LEU 121 Cb -0.02 1.54 -0.06 0.00 0.03 0.00 0.00 46.19 47.68 1rrp s LEU 121 CO 0.06 -0.21 1.57 -2.16 0.23 0.00 0.00 176.35 175.84 1rrp s PRO 122 N 1.83 4.22 -0.04 1.29 0.04 -1.26 -4.44 135.00 136.64 1rrp s PRO 122 Ca -0.07 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.12 1rrp s PRO 122 Cb -0.09 -3.73 0.03 0.00 0.04 0.00 0.00 34.50 30.74 1rrp s PRO 122 CO -0.14 -0.73 -0.01 0.15 0.04 0.00 0.00 177.00 176.31 1rrp s LYS 123 N 3.10 0.44 -1.29 4.56 1.02 -0.26 -4.99 119.74 122.31 1rrp s LYS 123 Ca 0.70 0.04 -0.17 0.00 0.02 0.00 0.00 55.97 56.56 1rrp s LYS 123 Cb -0.34 -0.60 0.08 0.00 -0.52 0.00 0.00 37.83 36.45 1rrp s LYS 123 CO 0.29 -0.13 1.71 -0.35 -0.92 0.00 0.00 175.35 175.94 1rrp n PRO 124 N 4.20 3.22 -3.50 -1.68 -0.04 -1.26 -1.75 135.00 134.18 1rrp n PRO 124 Ca -0.24 -3.34 -0.34 0.00 -0.04 0.00 0.00 63.50 59.53 1rrp n PRO 124 Cb 0.50 -3.43 -0.05 0.00 -0.04 0.00 0.00 33.50 30.48 1rrp n PRO 124 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1rrp s GLU 125 N 3.84 3.81 -0.14 0.54 2.02 -0.88 -4.87 118.70 123.01 1rrp s GLU 125 Ca 0.52 0.24 -0.15 0.00 0.02 0.00 0.00 54.97 55.61 1rrp s GLU 125 Cb 0.03 -2.89 -0.05 0.00 0.10 0.00 0.00 34.13 31.32 1rrp s GLU 125 CO 0.07 0.48 0.34 -0.65 0.02 0.00 0.00 175.26 175.51 1rrp s GLN 126 N -2.19 4.25 0.37 1.61 -0.21 -1.26 -1.80 119.66 120.42 1rrp s GLN 126 Ca 0.38 0.18 0.08 0.00 0.02 0.00 0.00 55.36 56.02 1rrp s GLN 126 Cb -0.13 -3.42 -0.05 0.00 1.00 0.00 0.00 33.01 30.41 1rrp s GLN 126 CO 0.20 0.25 0.09 -0.51 -2.12 0.00 0.00 175.29 173.19 1rrp s LEU 127 N 0.41 3.05 -0.11 2.90 1.43 0.98 -2.14 118.68 125.20 1rrp s LEU 127 Ca 0.19 -1.03 -0.08 0.00 -1.03 0.00 0.00 54.13 52.18 1rrp s LEU 127 Cb -0.14 -1.38 0.04 0.00 0.03 0.00 0.00 46.19 44.74 1rrp s LEU 127 CO 0.06 -0.37 0.27 0.00 0.23 0.00 0.00 176.35 176.53 1rrp s ALA 128 N -2.55 -0.65 -0.05 4.21 0.00 0.29 -1.86 121.76 121.15 1rrp s ALA 128 Ca 0.37 0.89 0.03 0.00 0.00 0.00 0.00 51.96 53.26 1rrp s ALA 128 Cb 0.02 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1rrp s ALA 128 CO 0.21 -0.16 -0.13 -1.50 0.00 0.00 0.00 175.76 174.18 1rrp s ILE 129 N 0.63 1.14 -0.03 0.00 1.10 0.65 0.71 121.20 125.40 1rrp s ILE 129 Ca -0.04 -0.52 0.05 0.00 -0.51 0.00 0.00 60.65 59.64 1rrp s ILE 129 Cb -0.05 -1.02 -0.01 0.00 0.15 0.00 0.00 42.46 41.53 1rrp s ILE 129 CO -0.04 0.35 -0.19 -0.60 -2.11 0.00 0.00 174.94 172.35 1rrp s ARG 130 N 0.41 1.72 0.06 3.50 3.52 -0.37 -0.85 118.95 126.93 1rrp s ARG 130 Ca -0.10 -0.67 0.05 0.00 -0.13 0.00 0.00 55.73 54.89 1rrp s ARG 130 Cb -0.13 -1.57 -0.04 0.00 -1.56 0.00 0.00 34.95 31.65 1rrp s ARG 130 CO 0.03 0.34 -0.06 -0.06 -0.81 0.00 0.00 175.30 174.73 1rrp s PHE 131 N -0.23 2.86 0.21 5.12 0.08 0.61 -2.30 117.98 124.33 1rrp s PHE 131 Ca 0.02 -0.08 -0.11 0.00 0.12 0.00 0.00 56.93 56.89 1rrp s PHE 131 Cb -0.10 -1.53 0.29 0.00 -0.57 0.00 0.00 43.02 41.12 1rrp s PHE 131 CO 0.01 0.42 1.67 -0.22 -0.10 0.00 0.00 175.22 177.00 1rrp h LYS 132 N 3.94 0.14 -5.31 0.44 1.63 -1.86 -3.44 116.57 112.10 1rrp h LYS 132 Ca -0.48 -0.01 -0.56 0.00 -0.85 0.00 0.00 60.65 58.75 1rrp h LYS 132 Cb 1.17 -0.03 -0.13 0.00 -0.60 0.00 0.00 32.23 32.63 1rrp h LYS 132 CO 0.55 0.09 -0.58 0.95 -3.45 0.00 0.00 179.45 177.01 1rrp s THR 133 N -6.14 1.32 0.05 1.00 -4.23 -1.26 -5.06 115.64 101.32 1rrp s THR 133 Ca -0.13 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.25 1rrp s THR 133 Cb 0.19 -2.68 -0.32 0.00 1.34 0.00 0.00 72.50 71.03 1rrp s THR 133 CO 0.74 0.00 1.07 1.55 -0.54 0.00 0.00 174.62 177.44 1rrp h PRO 134 N 1.84 0.51 -0.76 3.99 0.13 -1.85 -3.01 132.00 132.86 1rrp h PRO 134 Ca -0.41 -0.79 0.15 0.00 -0.87 0.00 0.00 66.00 64.07 1rrp h PRO 134 Cb 1.26 0.28 -0.10 0.00 0.13 0.00 0.00 31.00 32.57 1rrp h PRO 134 CO 0.72 1.37 0.29 0.93 -0.23 0.00 0.00 178.00 181.07 1rrp h GLU 135 N 0.18 0.41 -0.68 0.86 3.07 -1.97 0.65 114.58 117.10 1rrp h GLU 135 Ca -0.20 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 58.56 1rrp h GLU 135 Cb 2.03 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 29.82 1rrp h GLU 135 CO 0.25 0.27 0.13 0.93 -1.40 0.00 0.00 179.01 179.19 1rrp h GLU 136 N 0.42 1.10 0.12 2.33 5.08 -1.96 0.16 114.58 121.82 1rrp h GLU 136 Ca 0.42 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1rrp h GLU 136 Cb 0.65 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1rrp h GLU 136 CO -0.42 0.99 -0.06 0.00 -1.00 0.00 0.00 179.01 178.52 1rrp h ALA 137 N 1.09 -0.16 -0.60 3.43 0.00 -0.76 -1.38 119.26 120.89 1rrp h ALA 137 Ca 0.21 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1rrp h ALA 137 Cb 0.41 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.17 1rrp h ALA 137 CO 0.01 -0.43 0.03 0.00 0.00 0.00 0.00 179.25 178.86 1rrp h ALA 138 N 0.34 0.61 -0.60 0.00 0.00 0.37 0.51 119.26 120.48 1rrp h ALA 138 Ca -0.02 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1rrp h ALA 138 Cb 0.39 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1rrp h ALA 138 CO 0.03 -0.37 0.31 1.25 0.00 0.00 0.00 179.25 180.47 1rrp h LEU 139 N 0.15 0.77 -0.36 0.00 5.85 -0.88 0.13 115.31 120.97 1rrp h LEU 139 Ca 0.31 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1rrp h LEU 139 Cb 0.49 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1rrp h LEU 139 CO -0.48 0.66 0.24 0.15 -0.34 0.00 0.00 178.44 178.67 1rrp h PHE 140 N 0.82 0.45 0.37 1.25 3.57 0.20 -0.61 116.94 122.99 1rrp h PHE 140 Ca 0.21 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.71 1rrp h PHE 140 Cb 0.08 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 1rrp h PHE 140 CO -0.01 0.28 -0.48 -0.22 -2.23 0.00 0.00 178.31 175.66 1rrp h LYS 141 N 0.48 -0.84 0.00 1.11 3.64 0.51 0.18 116.57 121.66 1rrp h LYS 141 Ca 0.13 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1rrp h LYS 141 Cb -0.05 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1rrp h LYS 141 CO -0.03 -0.56 0.00 0.00 -2.27 0.00 0.00 179.45 176.59 1rrp n LYS 143 N -1.27 -0.07 0.17 0.00 4.76 -0.26 0.59 118.16 122.08 1rrp n LYS 143 Ca 0.00 1.44 -0.14 0.00 -2.87 0.00 0.00 58.31 56.74 1rrp n LYS 143 Cb 0.00 -2.43 -0.07 0.00 -1.84 0.00 0.00 35.03 30.70 1rrp n LYS 143 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1rrp h PHE 144 N 0.00 -0.73 -0.51 2.13 3.57 -0.12 -0.21 116.94 121.07 1rrp h PHE 144 Ca 0.73 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 62.14 1rrp h PHE 144 Cb 1.75 0.29 -0.02 0.00 2.79 0.00 0.00 35.95 40.76 1rrp h PHE 144 CO -0.26 -0.39 -0.07 0.93 -2.23 0.00 0.00 178.31 176.29 1rrp h GLU 145 N -0.56 0.92 -0.19 1.11 5.08 0.18 -1.68 114.58 119.44 1rrp h GLU 145 Ca -0.00 -0.30 0.05 0.00 -1.00 0.00 0.00 59.36 58.11 1rrp h GLU 145 Cb 0.53 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1rrp h GLU 145 CO -0.08 0.95 0.15 1.49 -1.00 0.00 0.00 179.01 180.53 1rrp h GLU 146 N 0.84 0.00 -0.00 2.33 4.81 0.47 0.73 114.58 123.75 1rrp h GLU 146 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1rrp h GLU 146 Cb 0.59 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1rrp h GLU 146 CO 0.04 0.00 -0.01 0.00 -0.73 0.00 0.00 179.01 178.31 1rrp n ALA 147 N -2.51 2.59 -0.05 2.92 0.00 -0.12 -2.35 120.51 120.99 1rrp n ALA 147 Ca 0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 53.44 53.27 1rrp n ALA 147 Cb 0.28 -1.49 -0.14 0.00 0.00 0.00 0.00 19.45 18.11 1rrp n ALA 147 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1rrp n GLN 148 N -1.12 0.91 0.00 0.00 6.02 0.23 -4.12 117.38 119.31 1rrp n GLN 148 Ca 0.18 -0.08 0.05 0.00 -0.01 0.00 0.00 57.00 57.14 1rrp n GLN 148 Cb 0.19 -1.44 0.27 0.00 1.02 0.00 0.00 30.24 30.28 1rrp n GLN 148 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1rrp n SER 149 N -2.43 0.00 -0.19 1.08 7.64 -0.01 -4.97 113.62 114.74 1rrp n SER 149 Ca -0.18 -0.13 0.02 0.00 1.01 0.00 0.00 58.87 59.60 1rrp n SER 149 Cb 0.82 -0.11 0.02 0.00 -1.01 0.00 0.00 64.21 63.93 1rrp n SER 149 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65