#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rv6 s VAL 22 N 0.00 4.21 0.02 6.31 1.01 -1.26 -4.96 120.40 125.73 1rv6 s VAL 22 Ca 0.00 1.46 -0.30 0.00 0.00 0.00 0.00 61.98 63.14 1rv6 s VAL 22 Cb 0.00 -3.96 -0.08 0.00 0.00 0.00 0.00 36.38 32.34 1rv6 s VAL 22 CO 0.00 -0.15 1.93 -0.69 0.00 0.00 0.00 175.10 176.19 1rv6 s VAL 23 N 3.61 3.09 0.56 2.92 1.01 -1.26 -4.95 120.40 125.38 1rv6 s VAL 23 Ca 0.56 0.11 -0.19 0.00 0.00 0.00 0.00 61.98 62.46 1rv6 s VAL 23 Cb -0.22 -3.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 1rv6 s VAL 23 CO 0.16 -0.01 1.17 -2.84 0.00 0.00 0.00 175.10 173.58 1rv6 s PRO 24 N 4.42 3.20 0.25 2.72 0.02 -1.26 -4.77 135.00 139.58 1rv6 s PRO 24 Ca 0.87 1.72 -0.03 0.00 0.02 0.00 0.00 61.00 63.58 1rv6 s PRO 24 Cb -0.41 -1.99 0.48 0.00 0.02 0.00 0.00 34.50 32.60 1rv6 s PRO 24 CO 0.40 -1.00 1.75 0.35 -0.33 0.00 0.00 177.00 178.17 1rv6 h PHE 25 N 1.09 0.63 -0.16 6.54 3.57 -1.99 -1.13 116.94 125.49 1rv6 h PHE 25 Ca -0.50 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 60.93 1rv6 h PHE 25 Cb 1.28 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 1rv6 h PHE 25 CO 0.49 0.13 -0.37 1.96 -2.23 0.00 0.00 178.31 178.29 1rv6 h GLN 26 N 0.53 0.35 -0.54 1.11 4.20 -1.98 0.23 115.11 119.01 1rv6 h GLN 26 Ca 0.43 -0.16 -0.10 0.00 0.06 0.00 0.00 58.65 58.89 1rv6 h GLN 26 Cb 0.62 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1rv6 h GLN 26 CO -0.37 0.67 -0.04 1.49 -0.67 0.00 0.00 178.83 179.91 1rv6 h GLU 27 N 0.30 0.98 -0.03 1.46 4.81 -1.71 0.18 114.58 120.57 1rv6 h GLU 27 Ca 0.03 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1rv6 h GLU 27 Cb 0.79 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.08 1rv6 h GLU 27 CO 0.06 1.00 -0.00 0.28 -0.73 0.00 0.00 179.01 179.62 1rv6 h VAL 28 N 0.85 0.98 0.22 0.32 2.07 -0.55 -1.71 116.25 118.43 1rv6 h VAL 28 Ca 0.15 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.67 1rv6 h VAL 28 Cb 0.58 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1rv6 h VAL 28 CO 0.03 0.00 -0.24 -0.25 0.02 0.00 0.00 177.57 177.14 1rv6 h TRP 29 N 0.01 -0.62 -0.06 1.57 2.91 -0.48 -3.09 115.95 116.18 1rv6 h TRP 29 Ca 0.01 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.02 1rv6 h TRP 29 Cb 0.02 0.25 -0.01 0.00 -0.51 0.00 0.00 29.16 28.91 1rv6 h TRP 29 CO -0.10 -0.35 -0.06 0.78 -1.03 0.00 0.00 178.44 177.68 1rv6 h GLY 30 N -0.50 0.10 2.00 2.65 0.00 -0.55 -2.45 103.07 104.32 1rv6 h GLY 30 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1rv6 h GLY 30 CO -0.06 0.05 0.00 3.21 0.00 0.00 0.00 176.54 179.73 1rv6 h ARG 31 N 0.09 0.00 0.00 4.80 3.08 -1.23 -3.32 114.38 117.80 1rv6 h ARG 31 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1rv6 h ARG 31 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1rv6 h ARG 31 CO 0.01 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.78 1rv6 n SER 32 N -2.61 1.83 0.11 7.04 3.41 -1.05 -4.89 113.62 117.46 1rv6 n SER 32 Ca 0.05 -1.87 -0.05 0.00 -0.26 0.00 0.00 58.87 56.73 1rv6 n SER 32 Cb 0.47 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.40 1rv6 n SER 32 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1rv6 h TYR 33 N 0.00 -0.32 -0.34 7.33 3.20 -1.55 -2.00 116.97 123.29 1rv6 h TYR 33 Ca 0.00 -0.01 0.23 0.00 3.14 0.00 0.00 58.73 62.09 1rv6 h TYR 33 Cb 0.48 0.10 -0.21 0.00 1.54 0.00 0.00 36.73 38.64 1rv6 h TYR 33 CO 0.00 -0.20 0.08 0.00 -1.64 0.00 0.00 178.16 176.41 1rv6 s ARG 35 N 2.95 0.80 -0.35 0.00 0.52 -0.23 -4.88 118.95 117.77 1rv6 s ARG 35 Ca 0.05 0.02 -0.24 0.00 -0.52 0.00 0.00 55.73 55.04 1rv6 s ARG 35 Cb -0.09 0.37 0.01 0.00 0.52 0.00 0.00 34.95 35.76 1rv6 s ARG 35 CO -0.14 -0.23 0.84 0.00 0.02 0.00 0.00 175.30 175.79 1rv6 s ALA 36 N -1.19 3.45 0.13 2.13 0.00 -1.26 -0.05 121.76 124.97 1rv6 s ALA 36 Ca -0.12 -0.51 0.11 0.00 0.00 0.00 0.00 51.96 51.44 1rv6 s ALA 36 Cb -0.03 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 1rv6 s ALA 36 CO 0.06 -1.44 -0.27 -0.51 0.00 0.00 0.00 175.76 173.60 1rv6 s LEU 37 N 3.19 2.32 0.18 0.00 1.43 -0.16 -4.80 118.68 120.84 1rv6 s LEU 37 Ca 0.34 -0.74 -0.32 0.00 -1.03 0.00 0.00 54.13 52.38 1rv6 s LEU 37 Cb -0.13 -1.23 -0.11 0.00 0.03 0.00 0.00 46.19 44.75 1rv6 s LEU 37 CO 0.16 0.18 1.67 -1.61 0.23 0.00 0.00 176.35 176.99 1rv6 s GLU 38 N -2.04 4.16 0.03 1.70 2.02 -1.26 -0.52 118.70 122.81 1rv6 s GLU 38 Ca 0.14 2.51 -0.02 0.00 0.02 0.00 0.00 54.97 57.62 1rv6 s GLU 38 Cb -0.10 -3.16 -0.02 0.00 0.10 0.00 0.00 34.13 30.94 1rv6 s GLU 38 CO 0.06 -0.71 0.00 -0.98 0.02 0.00 0.00 175.26 173.65 1rv6 s ARG 39 N 1.34 0.48 -0.08 1.61 1.70 -0.65 -4.93 118.95 118.42 1rv6 s ARG 39 Ca 0.74 -0.86 -0.26 0.00 -0.47 0.00 0.00 55.73 54.87 1rv6 s ARG 39 Cb -0.47 0.18 -0.03 0.00 -0.57 0.00 0.00 34.95 34.06 1rv6 s ARG 39 CO 0.32 -0.10 0.84 -0.51 -1.08 0.00 0.00 175.30 174.77 1rv6 s LEU 40 N -2.14 4.29 -0.05 -1.89 1.43 -1.26 -1.88 118.68 117.18 1rv6 s LEU 40 Ca -0.05 1.34 0.05 0.00 -1.03 0.00 0.00 54.13 54.44 1rv6 s LEU 40 Cb -0.01 -3.30 -0.01 0.00 0.03 0.00 0.00 46.19 42.90 1rv6 s LEU 40 CO -0.05 -0.26 -0.21 -0.69 0.23 0.00 0.00 176.35 175.37 1rv6 s VAL 41 N 1.33 1.70 0.12 -1.59 1.01 0.03 -4.93 120.40 118.07 1rv6 s VAL 41 Ca 0.43 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 61.40 1rv6 s VAL 41 Cb -0.18 -1.44 -0.07 0.00 0.00 0.00 0.00 36.38 34.69 1rv6 s VAL 41 CO 0.19 0.48 0.52 1.51 0.00 0.00 0.00 175.10 177.80 1rv6 s ASP 42 N -0.09 6.81 0.08 3.32 1.47 -1.26 -0.01 116.67 126.98 1rv6 s ASP 42 Ca -0.03 1.03 -0.22 0.00 1.18 0.00 0.00 52.55 54.52 1rv6 s ASP 42 Cb -0.12 -2.27 -0.13 0.00 -0.34 0.00 0.00 42.92 40.06 1rv6 s ASP 42 CO 0.02 0.14 1.63 0.58 0.68 0.00 0.00 175.17 178.23 1rv6 h VAL 43 N 2.92 1.12 -0.07 2.11 2.07 -0.55 -1.33 116.25 122.53 1rv6 h VAL 43 Ca -0.49 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 66.69 1rv6 h VAL 43 Cb 1.20 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1rv6 h VAL 43 CO 0.65 0.11 0.11 0.58 0.02 0.00 0.00 177.57 179.04 1rv6 h VAL 44 N 0.00 0.33 -0.05 2.57 2.07 -1.84 0.23 116.25 119.56 1rv6 h VAL 44 Ca 0.03 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.36 1rv6 h VAL 44 Cb 0.13 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1rv6 h VAL 44 CO -0.00 0.00 -0.79 0.77 0.02 0.00 0.00 177.57 177.57 1rv6 h SER 45 N 0.00 0.44 0.24 0.57 4.64 -1.61 -2.24 113.55 115.58 1rv6 h SER 45 Ca 0.03 -0.31 -0.14 0.00 -0.47 0.00 0.00 61.79 60.91 1rv6 h SER 45 Cb 0.26 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 1rv6 h SER 45 CO -0.00 1.06 -0.53 -0.33 -0.87 0.00 0.00 176.83 176.16 1rv6 h GLU 46 N 0.23 0.32 -2.19 4.77 4.39 -0.71 -3.38 114.58 118.02 1rv6 h GLU 46 Ca -0.04 -0.20 -0.59 0.00 0.34 0.00 0.00 59.36 58.87 1rv6 h GLU 46 Cb 1.38 0.02 -0.42 0.00 -0.10 0.00 0.00 28.75 29.63 1rv6 h GLU 46 CO 0.13 0.78 -0.65 0.66 -1.16 0.00 0.00 179.01 178.77 1rv6 n TYR 47 N -3.94 3.36 0.21 4.33 4.02 0.55 -4.96 117.16 120.73 1rv6 n TYR 47 Ca -0.02 -4.08 0.18 0.00 -0.01 0.00 0.00 57.90 53.97 1rv6 n TYR 47 Cb 0.57 -0.53 0.82 0.00 -0.02 0.00 0.00 39.34 40.18 1rv6 n TYR 47 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1rv6 h PRO 48 N 3.93 0.00 0.00 -0.72 0.13 -1.60 0.21 132.00 133.95 1rv6 h PRO 48 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1rv6 h PRO 48 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1rv6 h PRO 48 CO 0.80 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.44 1rv6 n SER 49 N -3.47 0.30 -1.54 1.44 3.41 -1.26 -2.82 113.62 109.68 1rv6 n SER 49 Ca 0.03 0.57 0.08 0.00 -0.26 0.00 0.00 58.87 59.28 1rv6 n SER 49 Cb 0.44 -0.63 0.33 0.00 -0.26 0.00 0.00 64.21 64.09 1rv6 n SER 49 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1rv6 n GLU 50 N -1.83 3.75 -0.31 4.33 -0.58 0.72 -4.72 120.64 122.01 1rv6 n GLU 50 Ca 0.03 -2.60 0.03 0.00 -0.42 0.00 0.00 57.16 54.20 1rv6 n GLU 50 Cb 0.21 -1.94 0.17 0.00 -0.57 0.00 0.00 31.44 29.31 1rv6 n GLU 50 CO 0.00 0.00 0.00 -0.39 -0.48 0.00 0.00 177.13 176.26 1rv6 h VAL 51 N 3.58 0.97 0.00 2.62 -1.51 -1.68 -1.30 116.25 118.92 1rv6 h VAL 51 Ca 0.00 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 65.16 1rv6 h VAL 51 Cb 1.47 -0.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 1rv6 h VAL 51 CO 0.28 0.16 0.00 -0.08 -1.23 0.00 0.00 177.57 176.71 1rv6 h GLU 52 N 0.90 0.00 -6.18 5.19 4.22 -1.89 -3.44 114.58 113.38 1rv6 h GLU 52 Ca 0.41 0.00 -0.52 0.00 0.08 0.00 0.00 59.36 59.33 1rv6 h GLU 52 Cb 0.30 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 1rv6 h GLU 52 CO -0.22 0.00 -0.31 -1.01 -2.18 0.00 0.00 179.01 175.29 1rv6 s HIS 53 N -3.86 2.19 0.04 0.92 3.76 -0.49 -4.74 115.29 113.11 1rv6 s HIS 53 Ca -0.03 -0.63 0.06 0.00 -0.15 0.00 0.00 55.06 54.31 1rv6 s HIS 53 Cb 0.10 -2.11 -0.02 0.00 1.11 0.00 0.00 32.58 31.66 1rv6 s HIS 53 CO 0.33 -0.39 -0.18 -1.64 -0.85 0.00 0.00 174.74 172.00 1rv6 s MET 54 N -4.26 1.22 0.13 1.40 -1.94 -0.55 -5.01 119.30 110.28 1rv6 s MET 54 Ca 0.46 -0.88 0.11 0.00 -1.71 0.00 0.00 55.69 53.67 1rv6 s MET 54 Cb -0.03 -1.30 -0.04 0.00 2.01 0.00 0.00 34.83 35.47 1rv6 s MET 54 CO 0.28 0.33 -0.27 -0.06 -0.01 0.00 0.00 175.02 175.29 1rv6 s PHE 55 N -0.82 2.32 -0.15 -0.03 0.08 -1.26 0.50 117.98 118.62 1rv6 s PHE 55 Ca 0.05 -0.38 -0.01 0.00 0.12 0.00 0.00 56.93 56.72 1rv6 s PHE 55 Cb -0.08 -1.26 0.04 0.00 -0.57 0.00 0.00 43.02 41.14 1rv6 s PHE 55 CO 0.02 0.33 -0.05 0.45 -0.10 0.00 0.00 175.22 175.87 1rv6 s SER 56 N -2.03 2.61 0.85 1.36 0.15 0.96 -2.65 113.70 114.96 1rv6 s SER 56 Ca 0.14 -0.56 -0.12 0.00 0.70 0.00 0.00 55.95 56.12 1rv6 s SER 56 Cb -0.10 -0.84 0.11 0.00 -1.71 0.00 0.00 66.02 63.47 1rv6 s SER 56 CO 0.06 -0.18 1.14 -2.16 1.20 0.00 0.00 173.24 173.31 1rv6 s PRO 57 N 1.69 1.60 0.09 5.44 0.04 -1.26 -2.00 135.00 140.59 1rv6 s PRO 57 Ca 0.02 0.28 0.25 0.00 0.04 0.00 0.00 61.00 61.59 1rv6 s PRO 57 Cb -0.15 -1.89 0.48 0.00 0.04 0.00 0.00 34.50 32.98 1rv6 s PRO 57 CO -0.08 -1.88 1.42 -1.13 0.04 0.00 0.00 177.00 175.37 1rv6 n SER 58 N -3.54 0.60 -4.27 6.66 3.41 -1.08 -4.80 113.62 110.59 1rv6 n SER 58 Ca 0.07 0.09 -0.20 0.00 -0.26 0.00 0.00 58.87 58.57 1rv6 n SER 58 Cb 0.59 0.07 -0.11 0.00 -0.26 0.00 0.00 64.21 64.50 1rv6 n SER 58 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rv6 s VAL 60 N -1.92 1.27 -0.30 0.00 -7.23 0.98 -4.89 120.40 108.32 1rv6 s VAL 60 Ca 0.10 -1.73 -0.25 0.00 -1.81 0.00 0.00 61.98 58.29 1rv6 s VAL 60 Cb -0.06 -1.53 0.00 0.00 0.56 0.00 0.00 36.38 35.35 1rv6 s VAL 60 CO 0.04 -0.46 0.84 -0.55 -0.31 0.00 0.00 175.10 174.67 1rv6 s SER 61 N -2.51 6.73 0.13 4.85 0.15 -1.26 -0.79 113.70 121.01 1rv6 s SER 61 Ca 0.09 0.78 0.11 0.00 0.70 0.00 0.00 55.95 57.63 1rv6 s SER 61 Cb -0.04 -2.43 -0.04 0.00 -1.71 0.00 0.00 66.02 61.80 1rv6 s SER 61 CO 0.03 -0.64 -0.25 -0.76 1.20 0.00 0.00 173.24 172.81 1rv6 s LEU 62 N 3.05 2.33 -0.06 3.45 1.43 -0.79 -4.92 118.68 123.18 1rv6 s LEU 62 Ca 0.35 -0.76 -0.30 0.00 -1.03 0.00 0.00 54.13 52.39 1rv6 s LEU 62 Cb -0.14 -1.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.89 1rv6 s LEU 62 CO 0.12 0.15 1.41 -0.76 0.23 0.00 0.00 176.35 177.50 1rv6 s LEU 63 N -2.12 4.28 -0.03 1.79 1.43 -1.26 -1.64 118.68 121.14 1rv6 s LEU 63 Ca 0.14 2.02 0.03 0.00 -1.03 0.00 0.00 54.13 55.29 1rv6 s LEU 63 Cb -0.10 -3.55 -0.00 0.00 0.03 0.00 0.00 46.19 42.57 1rv6 s LEU 63 CO 0.06 -0.77 -0.12 -0.13 0.23 0.00 0.00 176.35 175.62 1rv6 s ARG 64 N 3.02 1.18 0.21 1.70 1.81 0.33 -0.86 118.95 126.34 1rv6 s ARG 64 Ca 0.63 -0.42 -0.31 0.00 -1.72 0.00 0.00 55.73 53.92 1rv6 s ARG 64 Cb -0.29 -1.09 -0.10 0.00 -0.45 0.00 0.00 34.95 33.02 1rv6 s ARG 64 CO 0.24 0.19 1.53 0.00 -0.68 0.00 0.00 175.30 176.58 1rv6 s THR 66 N 0.59 0.05 0.00 0.00 -1.32 0.93 -4.87 115.64 111.02 1rv6 s THR 66 Ca 0.65 -0.43 0.00 0.00 -1.21 0.00 0.00 61.69 60.70 1rv6 s THR 66 Cb -0.44 -0.77 0.00 0.00 -1.51 0.00 0.00 72.50 69.79 1rv6 s THR 66 CO 0.38 -0.24 0.00 0.61 -2.21 0.00 0.00 174.62 173.16 1rv6 n GLY 67 N 1.00 3.40 0.00 6.08 0.00 -1.26 -1.06 105.19 113.35 1rv6 n GLY 67 Ca -0.20 -0.98 0.10 0.00 0.00 0.00 0.00 46.02 44.94 1rv6 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rv6 n GLY 70 N -1.29 0.41 3.64 0.00 0.00 -1.26 -4.94 105.19 101.74 1rv6 n GLY 70 Ca 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 46.02 45.90 1rv6 n GLY 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rv6 s ASP 71 N -2.08 -0.65 0.60 1.61 -1.08 -1.07 -5.03 116.67 108.97 1rv6 s ASP 71 Ca 0.00 1.06 0.37 0.00 -0.52 0.00 0.00 52.55 53.46 1rv6 s ASP 71 Cb 0.00 1.24 1.88 0.00 -1.46 0.00 0.00 42.92 44.59 1rv6 s ASP 71 CO 0.00 -0.17 2.20 1.05 0.52 0.00 0.00 175.17 178.77 1rv6 h GLU 72 N 6.16 0.00 -0.55 4.34 4.11 -1.93 -2.64 114.58 124.06 1rv6 h GLU 72 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.14 1rv6 h GLU 72 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1rv6 h GLU 72 CO 0.17 0.03 0.00 0.09 0.07 0.00 0.00 179.01 179.37 1rv6 n ASN 73 N -3.28 4.63 -4.55 3.06 5.03 -1.26 -4.92 115.26 113.96 1rv6 n ASN 73 Ca -0.02 -2.58 -0.27 0.00 0.87 0.00 0.00 54.58 52.58 1rv6 n ASN 73 Cb 0.17 -0.56 -0.10 0.00 -1.02 0.00 0.00 39.78 38.28 1rv6 n ASN 73 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1rv6 s LEU 74 N -2.08 2.92 0.08 3.41 1.43 -1.00 -2.46 118.68 120.98 1rv6 s LEU 74 Ca 0.48 -0.59 0.01 0.00 -1.03 0.00 0.00 54.13 53.00 1rv6 s LEU 74 Cb 0.33 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.89 1rv6 s LEU 74 CO 0.20 0.11 -0.06 -1.38 0.23 0.00 0.00 176.35 175.45 1rv6 s HIS 75 N -1.66 0.75 -0.26 0.29 -3.43 0.20 -4.81 115.29 106.37 1rv6 s HIS 75 Ca 0.24 -0.86 -0.17 0.00 -0.80 0.00 0.00 55.06 53.47 1rv6 s HIS 75 Cb -0.09 -0.46 -0.03 0.00 -1.43 0.00 0.00 32.58 30.58 1rv6 s HIS 75 CO 0.14 -0.19 0.47 0.00 -2.00 0.00 0.00 174.74 173.17 1rv6 s VAL 77 N 2.20 1.47 0.22 0.00 -7.23 -0.33 -4.54 120.40 112.19 1rv6 s VAL 77 Ca 0.19 -1.60 -0.30 0.00 -1.81 0.00 0.00 61.98 58.46 1rv6 s VAL 77 Cb -0.16 -1.48 -0.10 0.00 0.56 0.00 0.00 36.38 35.21 1rv6 s VAL 77 CO 0.09 -0.25 1.42 -2.16 -0.31 0.00 0.00 175.10 173.90 1rv6 s PRO 78 N -2.23 4.29 -0.01 4.82 0.04 -1.26 -1.59 135.00 139.06 1rv6 s PRO 78 Ca 0.07 2.24 0.10 0.00 0.04 0.00 0.00 61.00 63.45 1rv6 s PRO 78 Cb -0.08 -3.14 -0.13 0.00 0.04 0.00 0.00 34.50 31.19 1rv6 s PRO 78 CO 0.04 -0.41 0.36 1.55 0.04 0.00 0.00 177.00 178.58 1rv6 n VAL 79 N 2.67 0.00 -3.74 -0.36 3.14 0.25 -4.87 118.33 115.40 1rv6 n VAL 79 Ca 0.08 -0.25 -0.13 0.00 -2.96 0.00 0.00 64.34 61.07 1rv6 n VAL 79 Cb 0.41 0.71 -0.10 0.00 -1.06 0.00 0.00 33.84 33.80 1rv6 n VAL 79 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1rv6 s GLU 80 N -2.27 0.43 0.31 1.45 2.12 -1.06 -4.96 118.70 114.73 1rv6 s GLU 80 Ca 0.01 0.52 0.06 0.00 0.36 0.00 0.00 54.97 55.92 1rv6 s GLU 80 Cb 0.07 0.21 -0.06 0.00 0.26 0.00 0.00 34.13 34.61 1rv6 s GLU 80 CO 0.43 -0.05 -0.02 0.95 -0.54 0.00 0.00 175.26 176.03 1rv6 s THR 81 N 0.22 1.55 -0.01 -1.70 -4.23 -1.26 -0.87 115.64 109.33 1rv6 s THR 81 Ca -0.00 -2.07 -0.25 0.00 -1.18 0.00 0.00 61.69 58.19 1rv6 s THR 81 Cb -0.03 -2.61 0.05 0.00 1.34 0.00 0.00 72.50 71.25 1rv6 s THR 81 CO 0.00 -0.18 0.55 0.00 -0.54 0.00 0.00 174.62 174.45 1rv6 s ALA 82 N -3.06 -1.41 0.20 3.99 0.00 -0.84 -4.86 121.76 115.77 1rv6 s ALA 82 Ca 0.32 0.88 -0.24 0.00 0.00 0.00 0.00 51.96 52.92 1rv6 s ALA 82 Cb 0.06 0.13 -0.08 0.00 0.00 0.00 0.00 23.12 23.23 1rv6 s ALA 82 CO 0.14 -0.38 0.78 -0.80 0.00 0.00 0.00 175.76 175.49 1rv6 s ASN 83 N -1.45 7.29 -0.03 0.00 0.01 -1.26 0.13 114.94 119.63 1rv6 s ASN 83 Ca -0.10 1.60 0.07 0.00 -0.71 0.00 0.00 52.86 53.72 1rv6 s ASN 83 Cb -0.01 -2.48 -0.01 0.00 0.41 0.00 0.00 41.25 39.15 1rv6 s ASN 83 CO 0.05 0.13 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.85 1rv6 s VAL 84 N -1.31 1.88 -0.18 1.60 1.01 0.05 -4.91 120.40 118.54 1rv6 s VAL 84 Ca 0.39 -1.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.30 1rv6 s VAL 84 Cb -0.21 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1rv6 s VAL 84 CO 0.24 0.53 0.07 -0.89 0.00 0.00 0.00 175.10 175.06 1rv6 s THR 85 N -0.38 4.91 -0.00 3.92 2.01 -1.26 -0.44 115.64 124.39 1rv6 s THR 85 Ca 0.04 0.01 0.06 0.00 0.31 0.00 0.00 61.69 62.11 1rv6 s THR 85 Cb -0.11 -3.21 -0.02 0.00 0.01 0.00 0.00 72.50 69.17 1rv6 s THR 85 CO 0.01 0.47 -0.20 -0.04 -0.69 0.00 0.00 174.62 174.16 1rv6 s MET 86 N 0.29 1.58 -0.14 4.92 -1.94 0.14 -4.94 119.30 119.20 1rv6 s MET 86 Ca 0.04 -0.76 -0.24 0.00 -1.71 0.00 0.00 55.69 53.02 1rv6 s MET 86 Cb -0.12 -1.56 -0.02 0.00 2.01 0.00 0.00 34.83 35.14 1rv6 s MET 86 CO -0.00 0.42 0.77 -0.65 -0.01 0.00 0.00 175.02 175.55 1rv6 s GLN 87 N -0.61 4.33 0.28 2.03 -0.21 -1.26 -1.20 119.66 123.02 1rv6 s GLN 87 Ca 0.08 0.92 0.02 0.00 0.02 0.00 0.00 55.36 56.40 1rv6 s GLN 87 Cb -0.08 -3.54 -0.04 0.00 1.00 0.00 0.00 33.01 30.35 1rv6 s GLN 87 CO -0.00 -0.20 0.13 -0.51 -2.12 0.00 0.00 175.29 172.59 1rv6 s LEU 88 N 1.70 1.63 -0.11 2.90 2.01 -0.26 -4.94 118.68 121.62 1rv6 s LEU 88 Ca 0.37 -1.48 -0.01 0.00 0.01 0.00 0.00 54.13 53.03 1rv6 s LEU 88 Cb -0.17 0.13 -0.02 0.00 0.01 0.00 0.00 46.19 46.13 1rv6 s LEU 88 CO 0.14 -0.82 -0.09 -0.76 1.01 0.00 0.00 176.35 175.83 1rv6 s LEU 89 N -3.34 2.96 -0.20 1.79 1.02 -0.85 -1.02 118.68 119.05 1rv6 s LEU 89 Ca 0.37 -0.19 -0.04 0.00 0.02 0.00 0.00 54.13 54.29 1rv6 s LEU 89 Cb 0.06 -1.67 -0.01 0.00 0.02 0.00 0.00 46.19 44.59 1rv6 s LEU 89 CO 0.15 0.23 -0.05 -0.75 0.02 0.00 0.00 176.35 175.96 1rv6 s LYS 90 N -0.02 3.44 -0.15 1.70 2.20 0.35 -0.02 119.74 127.24 1rv6 s LYS 90 Ca -0.02 -0.61 -0.05 0.00 -0.36 0.00 0.00 55.97 54.94 1rv6 s LYS 90 Cb -0.14 -2.97 -0.03 0.00 -1.51 0.00 0.00 37.83 33.18 1rv6 s LYS 90 CO 0.03 -0.08 0.00 0.42 -0.36 0.00 0.00 175.35 175.37 1rv6 s ILE 91 N 1.18 4.28 0.05 5.43 1.01 0.18 -1.42 121.20 131.90 1rv6 s ILE 91 Ca 0.02 -0.23 0.08 0.00 0.00 0.00 0.00 60.65 60.53 1rv6 s ILE 91 Cb -0.14 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.42 1rv6 s ILE 91 CO -0.01 0.51 -0.23 -0.13 0.00 0.00 0.00 174.94 175.08 1rv6 s ARG 92 N 0.10 1.56 -0.60 2.79 0.52 -1.26 -1.48 118.95 120.57 1rv6 s ARG 92 Ca 0.02 -1.02 -0.26 0.00 -0.52 0.00 0.00 55.73 53.94 1rv6 s ARG 92 Cb -0.13 -1.71 0.04 0.00 0.52 0.00 0.00 34.95 33.67 1rv6 s ARG 92 CO 0.02 0.44 1.11 0.45 0.02 0.00 0.00 175.30 177.34 1rv6 s SER 93 N -1.22 6.34 0.00 0.23 0.15 -1.26 -3.70 113.70 114.24 1rv6 s SER 93 Ca 0.09 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1rv6 s SER 93 Cb -0.09 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 1rv6 s SER 93 CO 0.02 -1.45 0.00 0.61 1.20 0.00 0.00 173.24 173.62 1rv6 n GLY 94 N 5.15 3.42 3.86 9.45 0.00 -1.26 -5.06 105.19 120.75 1rv6 n GLY 94 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1rv6 n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rv6 s ASP 95 N -0.76 5.09 0.57 1.61 1.01 -1.24 -5.10 116.67 117.85 1rv6 s ASP 95 Ca 0.00 -0.67 -0.19 0.00 0.71 0.00 0.00 52.55 52.40 1rv6 s ASP 95 Cb 0.00 -0.71 -0.04 0.00 1.01 0.00 0.00 42.92 43.18 1rv6 s ASP 95 CO 0.00 -0.53 1.20 -0.13 0.21 0.00 0.00 175.17 175.92 1rv6 s ARG 96 N -4.07 3.09 0.83 8.23 0.52 -1.26 -4.50 118.95 121.79 1rv6 s ARG 96 Ca 0.45 1.81 -0.11 0.00 -0.52 0.00 0.00 55.73 57.35 1rv6 s ARG 96 Cb -0.04 -1.98 0.09 0.00 0.52 0.00 0.00 34.95 33.53 1rv6 s ARG 96 CO 0.27 -1.11 1.10 -1.25 0.02 0.00 0.00 175.30 174.33 1rv6 s PRO 97 N -3.26 1.84 -0.01 3.54 0.04 -1.26 -4.61 135.00 131.28 1rv6 s PRO 97 Ca 0.76 0.70 -0.04 0.00 0.04 0.00 0.00 61.00 62.46 1rv6 s PRO 97 Cb -0.30 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1rv6 s PRO 97 CO 0.33 -1.80 0.08 -1.12 0.04 0.00 0.00 177.00 174.52 1rv6 s SER 98 N -3.76 0.01 0.20 6.66 0.01 -0.51 -4.98 113.70 111.33 1rv6 s SER 98 Ca 0.62 -0.07 -0.30 0.00 1.31 0.00 0.00 55.95 57.50 1rv6 s SER 98 Cb -0.15 0.18 -0.09 0.00 0.21 0.00 0.00 66.02 66.16 1rv6 s SER 98 CO 0.55 -0.18 1.40 -0.47 0.41 0.00 0.00 173.24 174.94 1rv6 s TYR 99 N -0.67 3.15 0.03 2.43 5.04 -1.26 -0.49 117.35 125.58 1rv6 s TYR 99 Ca -0.07 1.04 -0.00 0.00 -2.44 0.00 0.00 57.07 55.60 1rv6 s TYR 99 Cb -0.05 -3.73 -0.03 0.00 0.35 0.00 0.00 41.96 38.51 1rv6 s TYR 99 CO 0.00 -2.41 -0.03 0.54 -1.34 0.00 0.00 175.55 172.31 1rv6 s VAL 100 N 0.35 0.17 -0.16 3.14 0.11 -0.19 -4.93 120.40 118.89 1rv6 s VAL 100 Ca 0.60 -1.14 0.00 0.00 -2.93 0.00 0.00 61.98 58.52 1rv6 s VAL 100 Cb -0.39 -0.59 0.03 0.00 -1.53 0.00 0.00 36.38 33.90 1rv6 s VAL 100 CO 0.38 -0.61 -0.10 -1.61 -3.33 0.00 0.00 175.10 169.83 1rv6 s GLU 101 N -2.06 1.94 0.01 1.54 2.02 -1.26 -1.10 118.70 119.80 1rv6 s GLU 101 Ca -0.10 -0.59 0.04 0.00 0.02 0.00 0.00 54.97 54.34 1rv6 s GLU 101 Cb -0.06 -2.11 -0.03 0.00 0.10 0.00 0.00 34.13 32.03 1rv6 s GLU 101 CO -0.03 -0.34 -0.11 -0.51 0.02 0.00 0.00 175.26 174.29 1rv6 s LEU 102 N 1.52 2.95 -0.02 1.80 1.43 -0.34 -4.90 118.68 121.11 1rv6 s LEU 102 Ca 0.02 -0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 52.88 1rv6 s LEU 102 Cb -0.14 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 1rv6 s LEU 102 CO -0.09 0.29 0.10 0.42 0.23 0.00 0.00 176.35 177.30 1rv6 s THR 103 N -0.93 4.91 0.11 5.49 -4.23 -1.26 0.25 115.64 119.97 1rv6 s THR 103 Ca 0.15 -0.29 0.03 0.00 -1.18 0.00 0.00 61.69 60.40 1rv6 s THR 103 Cb -0.11 -3.23 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 1rv6 s THR 103 CO 0.06 0.39 -0.08 -0.36 -0.54 0.00 0.00 174.62 174.08 1rv6 s PHE 104 N -1.18 1.01 -0.22 3.99 0.08 0.41 -4.97 117.98 117.10 1rv6 s PHE 104 Ca 0.22 -0.81 -0.15 0.00 0.12 0.00 0.00 56.93 56.31 1rv6 s PHE 104 Cb -0.12 -0.56 -0.04 0.00 -0.57 0.00 0.00 43.02 41.74 1rv6 s PHE 104 CO 0.13 -0.06 0.38 0.45 -0.10 0.00 0.00 175.22 176.02 1rv6 s SER 105 N -2.90 6.37 0.12 1.36 0.15 -1.26 -0.77 113.70 116.77 1rv6 s SER 105 Ca 0.11 0.43 -0.03 0.00 0.70 0.00 0.00 55.95 57.16 1rv6 s SER 105 Cb 0.02 -2.22 -0.05 0.00 -1.71 0.00 0.00 66.02 62.07 1rv6 s SER 105 CO -0.02 -0.10 0.32 -1.10 1.20 0.00 0.00 173.24 173.54 1rv6 s GLN 106 N 1.52 3.55 -0.14 5.44 -1.52 0.12 -4.89 119.66 123.74 1rv6 s GLN 106 Ca 0.17 -0.23 -0.27 0.00 -1.95 0.00 0.00 55.36 53.08 1rv6 s GLN 106 Cb -0.15 -2.91 -0.01 0.00 -0.22 0.00 0.00 33.01 29.71 1rv6 s GLN 106 CO 0.08 0.51 0.90 -1.01 -0.25 0.00 0.00 175.29 175.52 1rv6 s HIS 107 N -1.62 3.47 -0.13 0.91 3.76 -0.04 -1.99 115.29 119.64 1rv6 s HIS 107 Ca 0.39 1.39 0.10 0.00 -0.15 0.00 0.00 55.06 56.79 1rv6 s HIS 107 Cb -0.12 -3.07 -0.15 0.00 1.11 0.00 0.00 32.58 30.34 1rv6 s HIS 107 CO 0.26 -0.22 0.02 0.28 -0.85 0.00 0.00 174.74 174.23 1rv6 n VAL 108 N 4.61 0.89 -3.83 -0.90 0.31 -0.05 -4.59 118.33 114.77 1rv6 n VAL 108 Ca 0.06 -0.52 -0.12 0.00 -0.01 0.00 0.00 64.34 63.74 1rv6 n VAL 108 Cb 0.49 -0.71 -0.13 0.00 -0.91 0.00 0.00 33.84 32.58 1rv6 n VAL 108 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1rv6 s ARG 109 N -2.31 0.17 0.04 5.55 3.52 -1.15 -4.91 118.95 119.86 1rv6 s ARG 109 Ca -0.09 0.12 0.04 0.00 -0.13 0.00 0.00 55.73 55.67 1rv6 s ARG 109 Cb 0.04 0.08 -0.02 0.00 -1.56 0.00 0.00 34.95 33.49 1rv6 s ARG 109 CO 0.51 -0.02 -0.11 0.00 -0.81 0.00 0.00 175.30 174.87 1rv6 s GLU 111 N -1.37 1.19 -0.04 0.00 -1.05 -0.62 -4.86 118.70 111.94 1rv6 s GLU 111 Ca -0.04 -1.14 -0.26 0.00 -0.15 0.00 0.00 54.97 53.38 1rv6 s GLU 111 Cb -0.09 0.39 -0.03 0.00 -0.44 0.00 0.00 34.13 33.96 1rv6 s GLU 111 CO 0.01 -0.44 0.81 0.00 0.95 0.00 0.00 175.26 176.58 1rv6 s ARG 113 N 0.90 1.03 0.48 0.00 1.81 0.70 -4.93 118.95 118.94 1rv6 s ARG 113 Ca 0.43 -1.46 -0.23 0.00 -1.72 0.00 0.00 55.73 52.75 1rv6 s ARG 113 Cb -0.19 -0.38 -0.07 0.00 -0.45 0.00 0.00 34.95 33.86 1rv6 s ARG 113 CO 0.22 -0.04 1.21 -2.14 -0.68 0.00 0.00 175.30 173.87 1rv6 s PRO 114 N -3.84 3.62 0.00 3.54 0.02 -1.26 0.62 135.00 137.70 1rv6 s PRO 114 Ca 0.19 1.89 0.17 0.00 0.02 0.00 0.00 61.00 63.27 1rv6 s PRO 114 Cb 0.05 -2.38 1.01 0.00 0.02 0.00 0.00 34.50 33.19 1rv6 s PRO 114 CO 0.01 -0.70 1.42 1.28 -0.33 0.00 0.00 177.00 178.68