#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vhp s VAL 2 N 0.00 3.18 0.13 2.62 0.11 -1.26 -4.23 120.40 120.94 1vhp s VAL 2 Ca 0.00 -0.92 0.09 0.00 -2.93 0.00 0.00 61.98 58.23 1vhp s VAL 2 Cb 0.00 -2.33 -0.04 0.00 -1.53 0.00 0.00 36.38 32.48 1vhp s VAL 2 CO 0.00 0.42 -0.22 -1.10 -3.33 0.00 0.00 175.10 170.88 1vhp s GLN 3 N -1.25 1.25 0.00 1.54 -0.21 -1.26 -4.99 119.66 114.73 1vhp s GLN 3 Ca 0.15 -1.29 0.00 0.00 0.02 0.00 0.00 55.36 54.24 1vhp s GLN 3 Cb -0.11 -1.51 0.00 0.00 1.00 0.00 0.00 33.01 32.39 1vhp s GLN 3 CO 0.05 0.34 0.00 1.47 -2.12 0.00 0.00 175.29 175.03 1vhp n LEU 4 N 0.79 0.00 0.00 2.90 -0.00 -1.25 -3.37 117.00 116.07 1vhp n LEU 4 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.84 1vhp n LEU 4 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 1vhp n LEU 4 CO 0.25 0.00 0.00 0.55 -0.00 0.00 0.00 177.39 178.19 1vhp n VAL 5 N -0.58 0.00 -1.00 1.47 3.14 -1.03 -4.80 118.33 115.54 1vhp n VAL 5 Ca 0.00 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.00 1vhp n VAL 5 Cb 0.00 0.00 0.04 0.00 -1.06 0.00 0.00 33.84 32.82 1vhp n VAL 5 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 1vhp n GLU 6 N 0.00 -0.02 0.00 1.45 0.00 -1.26 -1.40 120.64 119.41 1vhp n GLU 6 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1vhp n GLU 6 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 31.44 30.43 1vhp n GLU 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1vhp n SER 7 N 3.42 0.00 0.00 -1.84 2.88 0.41 -4.61 113.62 113.88 1vhp n SER 7 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1vhp n SER 7 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 1vhp n SER 7 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vhp n GLY 8 N -0.70 1.56 0.25 0.46 0.00 -1.26 0.20 105.19 105.69 1vhp n GLY 8 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1vhp n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vhp n GLY 9 N 0.00 -0.28 3.61 -0.02 0.00 -1.25 -4.96 105.19 102.28 1vhp n GLY 9 Ca 0.00 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.97 1vhp n GLY 9 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vhp s GLY 10 N 0.00 0.60 0.17 -0.02 0.00 -1.26 -4.73 107.32 102.08 1vhp s GLY 10 Ca 0.00 -0.91 0.07 0.00 0.00 0.00 0.00 44.72 43.87 1vhp s GLY 10 CO 0.00 -0.62 0.04 1.08 0.00 0.00 0.00 173.10 173.60 1vhp s LEU 11 N -3.04 3.46 -0.43 0.66 1.43 -1.26 -2.09 118.68 117.40 1vhp s LEU 11 Ca 0.22 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.08 1vhp s LEU 11 Cb -0.01 -2.09 0.28 0.00 0.03 0.00 0.00 46.19 44.39 1vhp s LEU 11 CO 0.10 0.08 0.79 1.33 0.23 0.00 0.00 176.35 178.89 1vhp n VAL 12 N -0.18 -0.24 -0.11 -1.59 0.24 -0.56 -3.64 118.33 112.25 1vhp n VAL 12 Ca -0.09 -2.83 -0.08 0.00 -2.04 0.00 0.00 64.34 59.30 1vhp n VAL 12 Cb 0.55 0.13 0.07 0.00 -1.47 0.00 0.00 33.84 33.13 1vhp n VAL 12 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vhp n GLN 13 N 1.07 -1.75 -1.99 7.34 3.00 -1.23 -4.23 117.38 119.58 1vhp n GLN 13 Ca 0.15 -0.36 -0.42 0.00 -0.01 0.00 0.00 57.00 56.35 1vhp n GLN 13 Cb 0.62 -0.56 -0.03 0.00 0.00 0.00 0.00 30.24 30.28 1vhp n GLN 13 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1vhp s PRO 14 N -2.94 3.21 0.00 -1.09 0.04 -1.26 -0.71 135.00 132.25 1vhp s PRO 14 Ca 0.17 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.53 1vhp s PRO 14 Cb -0.03 -4.23 0.00 0.00 0.04 0.00 0.00 34.50 30.28 1vhp s PRO 14 CO 0.14 -2.01 0.00 0.41 0.04 0.00 0.00 177.00 175.58 1vhp n GLY 15 N 5.47 1.01 0.00 0.56 0.00 -1.23 -4.97 105.19 106.04 1vhp n GLY 15 Ca 0.23 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1vhp n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vhp n GLY 16 N -1.57 0.74 0.00 -0.02 0.00 0.12 -4.91 105.19 99.55 1vhp n GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1vhp n GLY 16 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1vhp n SER 17 N 0.00 0.00 -4.94 1.61 2.88 -1.24 -4.62 113.62 107.30 1vhp n SER 17 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 1vhp n SER 17 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1vhp n SER 17 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1vhp s LEU 18 N 0.00 3.76 -0.37 2.46 0.20 -0.56 -4.52 118.68 119.66 1vhp s LEU 18 Ca 0.00 -0.36 0.00 0.00 0.69 0.00 0.00 54.13 54.46 1vhp s LEU 18 Cb 0.00 -2.52 0.13 0.00 -0.43 0.00 0.00 46.19 43.37 1vhp s LEU 18 CO 0.00 -0.48 0.20 -0.60 -0.29 0.00 0.00 176.35 175.18 1vhp s ARG 19 N -4.14 0.73 0.00 1.98 3.52 -1.22 -2.33 118.95 117.48 1vhp s ARG 19 Ca 0.46 -1.43 0.00 0.00 -0.13 0.00 0.00 55.73 54.63 1vhp s ARG 19 Cb -0.08 -1.61 0.00 0.00 -1.56 0.00 0.00 34.95 31.70 1vhp s ARG 19 CO 0.30 -1.17 0.00 1.28 -0.81 0.00 0.00 175.30 174.90 1vhp n LEU 20 N 4.06 0.00 0.00 -0.88 4.32 -1.08 -3.93 117.00 119.49 1vhp n LEU 20 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.08 1vhp n LEU 20 Cb 0.37 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.17 1vhp n LEU 20 CO 0.16 0.00 0.00 -1.54 -1.22 0.00 0.00 177.39 174.79 1vhp n SER 21 N 0.00 0.00 -4.24 -1.43 3.41 0.13 -2.07 113.62 109.42 1vhp n SER 21 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.27 1vhp n SER 21 Cb 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.80 1vhp n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vhp s ALA 23 N 1.34 2.27 -0.27 0.00 0.00 -0.49 -2.38 121.76 122.24 1vhp s ALA 23 Ca 0.04 0.50 -0.29 0.00 0.00 0.00 0.00 51.96 52.22 1vhp s ALA 23 Cb -0.14 -3.33 0.18 0.00 0.00 0.00 0.00 23.12 19.83 1vhp s ALA 23 CO -0.06 -1.64 1.30 0.00 0.00 0.00 0.00 175.76 175.35 1vhp s ALA 24 N -2.51 -2.10 0.00 0.00 0.00 0.50 -2.47 121.76 115.19 1vhp s ALA 24 Ca 0.66 1.82 0.00 0.00 0.00 0.00 0.00 51.96 54.44 1vhp s ALA 24 Cb -0.21 -1.41 0.00 0.00 0.00 0.00 0.00 23.12 21.50 1vhp s ALA 24 CO 0.48 -0.24 0.00 0.45 0.00 0.00 0.00 175.76 176.46 1vhp n SER 25 N 0.70 0.00 -0.15 0.00 2.88 -1.22 -3.85 113.62 111.99 1vhp n SER 25 Ca -0.03 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.48 1vhp n SER 25 Cb 0.58 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.10 1vhp n SER 25 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1vhp h GLY 26 N 0.00 0.51 2.00 0.46 0.00 -1.88 -0.25 103.07 103.90 1vhp h GLY 26 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1vhp h GLY 26 CO 0.00 -0.11 0.00 1.97 0.00 0.00 0.00 176.54 178.40 1vhp n PHE 27 N -5.19 0.41 0.00 5.60 1.16 -1.26 -4.98 117.46 113.20 1vhp n PHE 27 Ca 0.05 0.14 0.00 0.00 -1.87 0.00 0.00 57.45 55.77 1vhp n PHE 27 Cb 0.25 -0.72 0.00 0.00 -1.61 0.00 0.00 39.48 37.40 1vhp n PHE 27 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 1vhp n THR 28 N -1.85 0.00 0.00 1.97 -2.24 -0.11 -4.20 114.28 107.85 1vhp n THR 28 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1vhp n THR 28 Cb 0.29 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 1vhp n THR 28 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1vhp n PHE 29 N 13.47 -0.59 -0.04 4.78 3.01 -1.26 -4.40 117.46 132.43 1vhp n PHE 29 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.40 1vhp n PHE 29 Cb 0.00 0.18 -0.14 0.00 -0.01 0.00 0.00 39.48 39.51 1vhp n PHE 29 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1vhp n SER 30 N -1.85 0.49 -0.34 4.37 3.41 -1.26 -2.71 113.62 115.73 1vhp n SER 30 Ca 0.00 0.23 0.14 0.00 -0.26 0.00 0.00 58.87 58.98 1vhp n SER 30 Cb 0.00 0.51 0.36 0.00 -0.26 0.00 0.00 64.21 64.82 1vhp n SER 30 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1vhp h SER 31 N 0.00 0.72 -0.41 4.04 0.87 -1.91 -1.96 113.55 114.89 1vhp h SER 31 Ca -0.34 0.09 -0.31 0.00 -1.23 0.00 0.00 61.79 60.00 1vhp h SER 31 Cb 1.95 -0.04 -0.31 0.00 -0.44 0.00 0.00 62.40 63.56 1vhp h SER 31 CO 0.05 0.25 -0.83 -1.22 -0.53 0.00 0.00 176.83 174.55 1vhp n TYR 32 N -4.72 1.44 -1.17 2.24 4.02 -1.26 -4.95 117.16 112.76 1vhp n TYR 32 Ca 0.23 -1.82 0.13 0.00 -0.01 0.00 0.00 57.90 56.42 1vhp n TYR 32 Cb 0.61 -0.27 -0.05 0.00 -0.02 0.00 0.00 39.34 39.61 1vhp n TYR 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1vhp n ALA 33 N -0.65 -3.23 0.00 -0.72 0.00 -0.74 -4.78 120.51 110.40 1vhp n ALA 33 Ca 0.26 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.21 1vhp n ALA 33 Cb 0.89 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1vhp n ALA 33 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1vhp n MET 34 N -3.65 0.00 -3.98 0.00 1.56 -0.40 -4.60 117.12 106.05 1vhp n MET 34 Ca -0.03 0.00 -0.22 0.00 -0.27 0.00 0.00 57.70 57.18 1vhp n MET 34 Cb 0.61 0.00 -0.05 0.00 2.15 0.00 0.00 33.22 35.93 1vhp n MET 34 CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 1vhp s SER 35 N 0.00 5.13 -0.15 6.12 0.01 0.51 -1.16 113.70 124.17 1vhp s SER 35 Ca 0.00 -0.52 -0.32 0.00 1.31 0.00 0.00 55.95 56.41 1vhp s SER 35 Cb 0.00 -0.99 0.13 0.00 0.21 0.00 0.00 66.02 65.37 1vhp s SER 35 CO 0.00 -0.25 1.12 -1.66 0.41 0.00 0.00 173.24 172.86 1vhp s TRP 36 N -2.30 -0.21 0.00 2.43 1.48 -0.77 -0.70 118.94 118.87 1vhp s TRP 36 Ca 0.38 0.19 0.00 0.00 -1.06 0.00 0.00 56.10 55.61 1vhp s TRP 36 Cb -0.05 0.51 0.00 0.00 -1.16 0.00 0.00 33.47 32.76 1vhp s TRP 36 CO 0.25 -0.29 0.00 0.28 -4.06 0.00 0.00 176.95 173.13 1vhp n VAL 37 N 0.06 0.00 0.00 -0.66 0.31 -0.22 -3.10 118.33 114.73 1vhp n VAL 37 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1vhp n VAL 37 Cb 0.59 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 1vhp n VAL 37 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1vhp n ARG 38 N 0.00 0.00 0.00 5.55 3.00 -0.94 -2.80 116.66 121.47 1vhp n ARG 38 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1vhp n ARG 38 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1vhp n ARG 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1vhp n GLN 39 N 0.00 -0.96 0.00 5.56 1.13 0.19 -3.95 117.38 119.35 1vhp n GLN 39 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1vhp n GLN 39 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 1vhp n GLN 39 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1vhp n ALA 40 N -0.74 0.00 -2.36 -1.58 0.00 -1.17 -1.28 120.51 113.39 1vhp n ALA 40 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1vhp n ALA 40 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1vhp n ALA 40 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1vhp s PRO 41 N -2.00 3.29 -1.18 0.00 0.04 -1.26 -3.95 135.00 129.94 1vhp s PRO 41 Ca 0.00 -1.39 0.00 0.00 0.04 0.00 0.00 61.00 59.65 1vhp s PRO 41 Cb 0.00 -5.36 0.00 0.00 0.04 0.00 0.00 34.50 29.18 1vhp s PRO 41 CO 0.00 -2.92 0.00 0.41 0.04 0.00 0.00 177.00 174.53 1vhp n GLY 42 N 5.95 0.76 1.36 0.56 0.00 -1.26 -4.69 105.19 107.88 1vhp n GLY 42 Ca 0.44 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.53 1vhp n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1vhp n LYS 43 N -1.99 3.77 -1.27 1.61 3.00 -1.25 -5.06 118.16 116.97 1vhp n LYS 43 Ca -0.12 -3.00 0.16 0.00 -0.00 0.00 0.00 58.31 55.35 1vhp n LYS 43 Cb 0.43 -2.04 -0.07 0.00 0.00 0.00 0.00 35.03 33.34 1vhp n LYS 43 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1vhp n GLU 44 N -0.04 -2.85 -0.07 1.64 0.28 -1.26 -4.83 120.64 113.50 1vhp n GLU 44 Ca 0.25 2.25 -0.03 0.00 -0.16 0.00 0.00 57.16 59.47 1vhp n GLU 44 Cb 1.05 -3.37 0.03 0.00 1.43 0.00 0.00 31.44 30.59 1vhp n GLU 44 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1vhp n ARG 45 N -4.08 -0.81 0.00 3.44 1.74 -1.26 -3.59 116.66 112.10 1vhp n ARG 45 Ca -0.06 -0.16 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 1vhp n ARG 45 Cb 0.60 -0.28 0.00 0.00 -1.02 0.00 0.00 32.46 31.76 1vhp n ARG 45 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1vhp n GLU 46 N -1.47 0.00 -1.30 5.56 0.00 -1.22 -4.48 120.64 117.73 1vhp n GLU 46 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 57.16 56.88 1vhp n GLU 46 Cb 0.07 0.00 0.21 0.00 0.00 0.00 0.00 31.44 31.72 1vhp n GLU 46 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.13 175.63 1vhp s ILE 47 N 0.00 1.76 0.00 6.31 -1.16 -1.26 -2.22 121.20 124.63 1vhp s ILE 47 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.14 1vhp s ILE 47 Cb 0.00 -2.62 0.00 0.00 0.61 0.00 0.00 42.46 40.45 1vhp s ILE 47 CO 0.00 0.00 0.00 0.52 -2.81 0.00 0.00 174.94 172.65 1vhp n VAL 48 N -4.41 0.00 -3.65 4.00 0.31 -1.24 -3.54 118.33 109.81 1vhp n VAL 48 Ca 0.12 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.43 1vhp n VAL 48 Cb 0.59 -0.03 -0.03 0.00 -0.91 0.00 0.00 33.84 33.47 1vhp n VAL 48 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1vhp s SER 49 N -2.06 -0.01 0.29 4.52 0.01 -1.18 -1.32 113.70 113.95 1vhp s SER 49 Ca 0.00 0.00 -0.19 0.00 1.31 0.00 0.00 55.95 57.08 1vhp s SER 49 Cb 0.00 0.01 0.02 0.00 0.21 0.00 0.00 66.02 66.26 1vhp s SER 49 CO 0.00 -0.01 0.68 0.00 0.41 0.00 0.00 173.24 174.31 1vhp s ALA 50 N -1.61 -0.94 -0.40 1.44 0.00 -1.08 -1.84 121.76 117.33 1vhp s ALA 50 Ca 0.11 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 51.62 1vhp s ALA 50 Cb -0.01 0.88 0.16 0.00 0.00 0.00 0.00 23.12 24.15 1vhp s ALA 50 CO -0.05 -0.99 0.40 0.54 0.00 0.00 0.00 175.76 175.66 1vhp s VAL 51 N -3.75 -0.25 0.32 0.00 0.11 -0.30 -1.23 120.40 115.30 1vhp s VAL 51 Ca 0.14 -1.35 -0.20 0.00 -2.93 0.00 0.00 61.98 57.63 1vhp s VAL 51 Cb -0.05 -0.72 -0.10 0.00 -1.53 0.00 0.00 36.38 33.99 1vhp s VAL 51 CO 0.08 -0.67 0.84 -0.55 -3.33 0.00 0.00 175.10 171.47 1vhp s SER 52 N 1.07 7.02 0.55 3.54 0.15 -0.55 -1.28 113.70 124.20 1vhp s SER 52 Ca 0.22 1.55 0.00 0.00 0.70 0.00 0.00 55.95 58.41 1vhp s SER 52 Cb -0.10 -2.47 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 1vhp s SER 52 CO -0.06 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.84 1vhp n GLY 53 N 0.05 -0.90 0.47 9.45 0.00 -1.26 -2.49 105.19 110.50 1vhp n GLY 53 Ca 0.03 -1.13 0.25 0.00 0.00 0.00 0.00 46.02 45.17 1vhp n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1vhp h SER 54 N 0.00 0.00 0.00 1.61 0.02 -1.90 -3.34 113.55 109.94 1vhp h SER 54 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1vhp h SER 54 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1vhp h SER 54 CO 0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1vhp n GLY 55 N -1.61 0.42 0.42 -3.77 0.00 -1.04 -4.86 105.19 94.75 1vhp n GLY 55 Ca 0.16 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.49 1vhp n GLY 55 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1vhp h GLY 56 N 0.00 1.48 -4.83 -0.02 0.00 -1.80 -3.37 103.07 94.53 1vhp h GLY 56 Ca 0.00 -0.16 -0.58 0.00 0.00 0.00 0.00 47.33 46.59 1vhp h GLY 56 CO 0.00 -0.38 -0.09 -0.56 0.00 0.00 0.00 176.54 175.51 1vhp s SER 57 N -4.74 6.96 -0.01 0.19 0.01 -1.04 -4.97 113.70 110.10 1vhp s SER 57 Ca -0.08 1.13 -0.11 0.00 1.31 0.00 0.00 55.95 58.20 1vhp s SER 57 Cb 0.29 -2.32 0.01 0.00 0.21 0.00 0.00 66.02 64.21 1vhp s SER 57 CO 0.81 0.25 0.23 0.42 0.41 0.00 0.00 173.24 175.36 1vhp s THR 58 N -0.88 0.07 0.18 1.44 -4.23 -1.26 -1.48 115.64 109.48 1vhp s THR 58 Ca 0.27 -0.55 0.08 0.00 -1.18 0.00 0.00 61.69 60.32 1vhp s THR 58 Cb -0.18 -0.51 -0.04 0.00 1.34 0.00 0.00 72.50 73.10 1vhp s THR 58 CO 0.17 -0.30 -0.17 -0.47 -0.54 0.00 0.00 174.62 173.30 1vhp s TYR 59 N -1.27 1.81 -0.44 3.99 5.04 -0.36 -4.81 117.35 121.32 1vhp s TYR 59 Ca -0.13 -0.49 0.07 0.00 -2.44 0.00 0.00 57.07 54.08 1vhp s TYR 59 Cb -0.06 -0.88 0.24 0.00 0.35 0.00 0.00 41.96 41.61 1vhp s TYR 59 CO 0.03 0.36 0.67 0.66 -1.34 0.00 0.00 175.55 175.92 1vhp n TYR 60 N 0.06 -1.72 -4.06 4.97 4.02 -1.24 -2.64 117.16 116.55 1vhp n TYR 60 Ca -0.11 -2.74 0.00 0.00 -0.01 0.00 0.00 57.90 55.04 1vhp n TYR 60 Cb 0.58 0.52 0.00 0.00 -0.02 0.00 0.00 39.34 40.42 1vhp n TYR 60 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1vhp n ALA 61 N 1.63 0.00 -0.24 -0.72 0.00 -0.43 -2.82 120.51 117.92 1vhp n ALA 61 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.61 1vhp n ALA 61 Cb 0.57 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.03 1vhp n ALA 61 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1vhp n ASP 62 N -3.19 1.77 -0.32 0.00 9.92 -1.26 -4.71 116.55 118.76 1vhp n ASP 62 Ca 0.00 -1.98 0.00 0.00 -0.53 0.00 0.00 54.79 52.28 1vhp n ASP 62 Cb 0.00 -0.04 0.00 0.00 -0.64 0.00 0.00 41.12 40.44 1vhp n ASP 62 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1vhp n SER 63 N -0.52 0.00 -2.15 -2.24 7.64 -1.25 -4.92 113.62 110.18 1vhp n SER 63 Ca 0.01 -1.18 -0.06 0.00 1.01 0.00 0.00 58.87 58.66 1vhp n SER 63 Cb 0.32 -0.04 0.05 0.00 -1.01 0.00 0.00 64.21 63.54 1vhp n SER 63 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1vhp n VAL 64 N 0.00 1.55 0.31 0.44 0.24 -1.13 -4.84 118.33 114.89 1vhp n VAL 64 Ca 0.00 -3.04 0.13 0.00 -2.04 0.00 0.00 64.34 59.39 1vhp n VAL 64 Cb 0.54 0.37 0.64 0.00 -1.47 0.00 0.00 33.84 33.91 1vhp n VAL 64 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1vhp h LYS 65 N 2.06 0.00 0.00 7.34 2.10 -1.90 -0.57 116.57 125.60 1vhp h LYS 65 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1vhp h LYS 65 Cb 1.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.75 1vhp h LYS 65 CO 0.32 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.18 1vhp n GLY 66 N -1.31 -0.18 0.09 0.07 0.00 -1.26 -4.74 105.19 97.86 1vhp n GLY 66 Ca -0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1vhp n GLY 66 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vhp n ARG 67 N -0.07 1.25 -4.40 1.61 0.63 -0.28 -5.03 116.66 110.36 1vhp n ARG 67 Ca 0.00 -2.48 -0.20 0.00 -0.92 0.00 0.00 57.85 54.25 1vhp n ARG 67 Cb 0.22 -1.44 -0.10 0.00 0.45 0.00 0.00 32.46 31.58 1vhp n ARG 67 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1vhp s PHE 68 N -2.70 1.80 -0.19 -0.14 0.40 -0.82 -3.93 117.98 112.41 1vhp s PHE 68 Ca 0.30 -1.06 -0.12 0.00 -0.60 0.00 0.00 56.93 55.45 1vhp s PHE 68 Cb 0.26 -1.14 0.06 0.00 0.51 0.00 0.00 43.02 42.71 1vhp s PHE 68 CO 0.03 -0.13 0.48 -0.08 0.70 0.00 0.00 175.22 176.21 1vhp s THR 69 N -3.46 -0.01 -1.24 0.64 -1.32 -0.79 -5.00 115.64 104.45 1vhp s THR 69 Ca 0.37 0.05 -0.14 0.00 -1.21 0.00 0.00 61.69 60.76 1vhp s THR 69 Cb 0.08 -0.69 0.16 0.00 -1.51 0.00 0.00 72.50 70.53 1vhp s THR 69 CO 0.15 0.02 1.56 0.00 -2.21 0.00 0.00 174.62 174.14 1vhp n ILE 70 N 3.88 4.21 -2.28 5.08 0.13 -1.26 -2.24 119.36 126.89 1vhp n ILE 70 Ca -0.20 -4.56 -0.37 0.00 -1.10 0.00 0.00 62.75 56.52 1vhp n ILE 70 Cb 0.56 -2.44 -0.01 0.00 -0.84 0.00 0.00 39.64 36.91 1vhp n ILE 70 CO 0.00 0.00 0.00 -0.44 2.80 0.00 0.00 176.55 178.91 1vhp s SER 71 N 2.70 6.22 0.04 9.51 0.01 0.37 -4.86 113.70 127.69 1vhp s SER 71 Ca 0.44 2.29 -0.02 0.00 1.31 0.00 0.00 55.95 59.97 1vhp s SER 71 Cb 0.00 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 1vhp s SER 71 CO 0.01 -0.88 -0.00 -0.13 0.41 0.00 0.00 173.24 172.65 1vhp s ARG 72 N -2.67 0.54 -0.37 12.44 0.52 -1.26 0.19 118.95 128.33 1vhp s ARG 72 Ca 0.63 -0.98 0.00 0.00 -0.52 0.00 0.00 55.73 54.87 1vhp s ARG 72 Cb -0.28 0.19 0.12 0.00 0.52 0.00 0.00 34.95 35.51 1vhp s ARG 72 CO 0.34 -0.11 0.18 -0.51 0.02 0.00 0.00 175.30 175.23 1vhp s ASP 73 N -2.41 3.59 0.00 0.23 1.11 0.99 -4.71 116.67 115.48 1vhp s ASP 73 Ca -0.01 -2.15 0.00 0.00 0.18 0.00 0.00 52.55 50.57 1vhp s ASP 73 Cb 0.02 -0.79 0.00 0.00 1.07 0.00 0.00 42.92 43.21 1vhp s ASP 73 CO -0.07 -0.33 0.97 -3.20 1.18 0.00 0.00 175.17 173.72 1vhp n ASN 74 N 4.14 0.00 -1.47 0.27 2.85 -1.26 -2.37 115.26 117.42 1vhp n ASN 74 Ca 0.05 0.97 -0.02 0.00 -0.11 0.00 0.00 54.58 55.47 1vhp n ASN 74 Cb 0.38 -0.47 0.01 0.00 1.24 0.00 0.00 39.78 40.93 1vhp n ASN 74 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1vhp n SER 75 N -2.31 5.06 0.00 1.20 3.41 -1.26 -3.23 113.62 116.49 1vhp n SER 75 Ca 0.00 -2.43 0.00 0.00 -0.26 0.00 0.00 58.87 56.18 1vhp n SER 75 Cb 0.00 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 62.94 1vhp n SER 75 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1vhp n LYS 76 N 1.17 0.15 -2.23 4.33 4.01 -1.00 -5.00 118.16 119.59 1vhp n LYS 76 Ca 0.04 -0.43 -0.15 0.00 -0.51 0.00 0.00 58.31 57.26 1vhp n LYS 76 Cb 0.52 -0.69 -0.01 0.00 -0.51 0.00 0.00 35.03 34.34 1vhp n LYS 76 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1vhp n ASN 77 N -0.07 -4.51 0.00 4.39 5.03 -1.20 -4.95 115.26 113.96 1vhp n ASN 77 Ca 0.00 0.01 0.00 0.00 0.87 0.00 0.00 54.58 55.46 1vhp n ASN 77 Cb 0.24 -3.63 0.00 0.00 -1.02 0.00 0.00 39.78 35.37 1vhp n ASN 77 CO 0.00 0.00 0.00 1.07 -1.83 0.00 0.00 177.26 176.50 1vhp n THR 78 N -3.93 0.00 -4.55 3.41 5.66 -1.13 -0.37 114.28 113.37 1vhp n THR 78 Ca -0.17 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.56 1vhp n THR 78 Cb 0.63 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.27 1vhp n THR 78 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1vhp s LEU 79 N 0.00 2.23 0.40 1.09 2.34 -1.00 -0.00 118.68 123.73 1vhp s LEU 79 Ca 0.00 -0.62 0.08 0.00 0.06 0.00 0.00 54.13 53.65 1vhp s LEU 79 Cb 0.00 -1.04 -0.04 0.00 -0.56 0.00 0.00 46.19 44.55 1vhp s LEU 79 CO 0.00 0.15 0.27 -0.31 -1.06 0.00 0.00 176.35 175.40 1vhp s TYR 80 N -0.94 2.69 -0.11 3.48 1.51 0.50 -0.83 117.35 123.64 1vhp s TYR 80 Ca 0.09 -0.49 -0.00 0.00 -1.01 0.00 0.00 57.07 55.66 1vhp s TYR 80 Cb -0.10 -1.99 0.02 0.00 -0.11 0.00 0.00 41.96 39.79 1vhp s TYR 80 CO 0.03 0.08 -0.08 -0.51 -1.11 0.00 0.00 175.55 173.96 1vhp s LEU 81 N -4.00 1.23 -0.61 -1.29 1.43 -0.88 0.14 118.68 114.70 1vhp s LEU 81 Ca 0.44 -0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 53.05 1vhp s LEU 81 Cb -0.01 -0.86 0.13 0.00 0.03 0.00 0.00 46.19 45.48 1vhp s LEU 81 CO 0.25 -0.11 0.63 -1.10 0.23 0.00 0.00 176.35 176.25 1vhp s GLN 82 N 1.67 3.10 -0.33 1.70 -1.52 -0.95 -2.65 119.66 120.68 1vhp s GLN 82 Ca 0.05 -1.65 -0.00 0.00 -1.95 0.00 0.00 55.36 51.81 1vhp s GLN 82 Cb -0.13 -4.32 0.08 0.00 -0.22 0.00 0.00 33.01 28.42 1vhp s GLN 82 CO -0.08 -1.42 0.05 0.00 -0.25 0.00 0.00 175.29 173.59 1vhp s MET 83 N 1.90 2.05 -0.06 2.91 0.23 -0.98 -1.89 119.30 123.46 1vhp s MET 83 Ca 0.09 -1.58 0.05 0.00 -1.03 0.00 0.00 55.69 53.22 1vhp s MET 83 Cb -0.25 -3.26 -0.02 0.00 -1.53 0.00 0.00 34.83 29.78 1vhp s MET 83 CO 0.02 -0.82 -0.21 0.54 -2.03 0.00 0.00 175.02 172.53 1vhp s ASN 84 N 1.31 3.44 0.00 -1.18 4.22 -1.25 -1.49 114.94 119.98 1vhp s ASN 84 Ca 0.02 -0.40 0.00 0.00 -2.14 0.00 0.00 52.86 50.34 1vhp s ASN 84 Cb -0.20 -0.87 0.00 0.00 1.28 0.00 0.00 41.25 41.45 1vhp s ASN 84 CO -0.04 0.27 0.00 -0.24 -2.04 0.00 0.00 177.10 175.05 1vhp n SER 85 N 2.78 0.00 -3.08 3.54 2.88 -1.26 -4.75 113.62 113.74 1vhp n SER 85 Ca -0.17 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.32 1vhp n SER 85 Cb 0.52 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.03 1vhp n SER 85 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1vhp n LEU 86 N 0.00 0.00 -2.69 2.46 7.99 -1.26 -4.65 117.00 118.84 1vhp n LEU 86 Ca 0.00 -0.14 -0.07 0.00 -0.01 0.00 0.00 56.01 55.79 1vhp n LEU 86 Cb 0.00 -0.19 0.10 0.00 -0.11 0.00 0.00 43.42 43.22 1vhp n LEU 86 CO 0.00 -1.64 0.36 -2.11 -1.51 0.00 0.00 177.39 172.50 1vhp n ARG 87 N -1.87 1.21 -4.37 3.23 1.85 -1.26 -3.56 116.66 111.89 1vhp n ARG 87 Ca 0.02 -2.14 -0.35 0.00 -1.00 0.00 0.00 57.85 54.38 1vhp n ARG 87 Cb 0.10 -0.32 -0.09 0.00 -1.05 0.00 0.00 32.46 31.10 1vhp n ARG 87 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1vhp n ALA 88 N -0.54 -1.72 -1.60 2.89 0.00 -1.26 -4.60 120.51 113.68 1vhp n ALA 88 Ca -0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 53.44 53.09 1vhp n ALA 88 Cb 0.84 -1.51 -0.02 0.00 0.00 0.00 0.00 19.45 18.76 1vhp n ALA 88 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1vhp n GLU 89 N -4.40 0.00 -2.69 0.00 1.02 -1.26 -4.99 120.64 108.31 1vhp n GLU 89 Ca -0.17 -0.27 -0.06 0.00 -0.02 0.00 0.00 57.16 56.64 1vhp n GLU 89 Cb 0.61 0.35 0.08 0.00 -0.02 0.00 0.00 31.44 32.46 1vhp n GLU 89 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1vhp n ASP 90 N 0.00 -1.77 -4.30 1.62 8.00 -1.26 -5.14 116.55 113.70 1vhp n ASP 90 Ca -0.08 -2.52 -0.35 0.00 0.71 0.00 0.00 54.79 52.55 1vhp n ASP 90 Cb 0.36 1.26 0.08 0.00 -0.02 0.00 0.00 41.12 42.79 1vhp n ASP 90 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1vhp n THR 91 N -0.22 0.37 -4.17 -3.53 -1.04 -1.26 -4.94 114.28 99.48 1vhp n THR 91 Ca -0.06 -0.34 -0.14 0.00 -2.04 0.00 0.00 64.05 61.47 1vhp n THR 91 Cb 0.76 -0.43 -0.08 0.00 -1.82 0.00 0.00 70.33 68.76 1vhp n THR 91 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vhp s ALA 92 N -2.16 1.09 -0.00 2.41 0.00 -1.08 -4.05 121.76 117.97 1vhp s ALA 92 Ca 0.54 -1.66 0.01 0.00 0.00 0.00 0.00 51.96 50.85 1vhp s ALA 92 Cb -0.25 1.33 0.00 0.00 0.00 0.00 0.00 23.12 24.20 1vhp s ALA 92 CO 0.70 -0.68 -0.02 0.08 0.00 0.00 0.00 175.76 175.83 1vhp s VAL 93 N -3.74 0.17 0.31 0.00 1.01 -0.40 -1.87 120.40 115.88 1vhp s VAL 93 Ca 0.36 -0.08 0.07 0.00 0.00 0.00 0.00 61.98 62.32 1vhp s VAL 93 Cb 0.03 -0.15 -0.06 0.00 0.00 0.00 0.00 36.38 36.20 1vhp s VAL 93 CO 0.17 0.05 -0.03 -0.31 0.00 0.00 0.00 175.10 174.98 1vhp s TYR 94 N 0.01 2.09 -0.18 5.22 2.02 -1.00 0.55 117.35 126.06 1vhp s TYR 94 Ca 0.00 -0.71 -0.06 0.00 -0.37 0.00 0.00 57.07 55.93 1vhp s TYR 94 Cb -0.02 -1.27 0.09 0.00 -0.40 0.00 0.00 41.96 40.36 1vhp s TYR 94 CO -0.00 0.30 0.36 0.71 -1.57 0.00 0.00 175.55 175.35 1vhp s TYR 95 N -2.97 -0.68 1.25 2.71 1.51 -1.12 -1.14 117.35 116.92 1vhp s TYR 95 Ca 0.32 1.25 -0.18 0.00 -1.01 0.00 0.00 57.07 57.46 1vhp s TYR 95 Cb 0.05 0.16 0.28 0.00 -0.11 0.00 0.00 41.96 42.33 1vhp s TYR 95 CO 0.14 -0.47 0.68 0.00 -1.11 0.00 0.00 175.55 174.79 1vhp n ALA 97 N -5.11 0.00 -1.61 0.00 0.00 0.12 -4.54 120.51 109.37 1vhp n ALA 97 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.34 1vhp n ALA 97 Cb 0.55 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.16 1vhp n ALA 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1vhp n ARG 98 N 0.00 -1.13 -2.65 0.00 1.74 -1.25 -0.36 116.66 113.00 1vhp n ARG 98 Ca 0.00 -1.49 -0.03 0.00 -0.77 0.00 0.00 57.85 55.56 1vhp n ARG 98 Cb 0.00 -1.03 0.05 0.00 -1.02 0.00 0.00 32.46 30.46 1vhp n ARG 98 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 1vhp n LEU 99 N 0.00 -1.01 -0.41 0.55 -0.00 -1.25 -4.54 117.00 110.34 1vhp n LEU 99 Ca 0.12 -0.76 0.00 0.00 -0.00 0.00 0.00 56.01 55.38 1vhp n LEU 99 Cb 0.43 0.50 0.00 0.00 -0.00 0.00 0.00 43.42 44.35 1vhp n LEU 99 CO 0.31 1.13 0.22 2.29 -0.00 0.00 0.00 177.39 181.34 1vhp n LYS 100 N 2.26 0.00 -0.75 1.47 -0.00 -1.26 -4.57 118.16 115.30 1vhp n LYS 100 Ca 0.08 -0.36 0.00 0.00 -0.00 0.00 0.00 58.31 58.03 1vhp n LYS 100 Cb 0.68 -0.20 0.00 0.00 -0.00 0.00 0.00 35.03 35.51 1vhp n LYS 100 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1vhp n LYS 101 N 0.00 -2.00 0.00 -1.58 4.81 -1.26 -4.67 118.16 113.46 1vhp n LYS 101 Ca 0.00 1.47 0.00 0.00 -0.87 0.00 0.00 58.31 58.91 1vhp n LYS 101 Cb 0.56 -1.58 0.00 0.00 0.02 0.00 0.00 35.03 34.03 1vhp n LYS 101 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 1vhp n TYR 102 N -0.03 0.00 -2.48 5.64 4.19 -1.26 -4.68 117.16 118.54 1vhp n TYR 102 Ca 0.00 0.00 -0.01 0.00 3.31 0.00 0.00 57.90 61.20 1vhp n TYR 102 Cb 0.00 0.00 0.05 0.00 0.49 0.00 0.00 39.34 39.88 1vhp n TYR 102 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1vhp n ALA 103 N -0.09 2.93 -3.90 2.98 0.00 -1.26 -5.02 120.51 116.15 1vhp n ALA 103 Ca 0.00 -2.80 -0.30 0.00 0.00 0.00 0.00 53.44 50.34 1vhp n ALA 103 Cb 0.00 -0.70 -0.16 0.00 0.00 0.00 0.00 19.45 18.59 1vhp n ALA 103 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1vhp s PHE 104 N -2.39 2.15 0.00 0.00 2.19 -1.26 -3.96 117.98 114.71 1vhp s PHE 104 Ca 0.34 -1.61 0.00 0.00 0.33 0.00 0.00 56.93 55.99 1vhp s PHE 104 Cb 0.36 -1.50 0.00 0.00 -1.31 0.00 0.00 43.02 40.57 1vhp s PHE 104 CO -0.08 -0.75 0.00 -0.25 1.83 0.00 0.00 175.22 175.97 1vhp n ASP 105 N 4.74 0.00 0.00 6.13 8.00 -1.26 -4.98 116.55 129.17 1vhp n ASP 105 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 1vhp n ASP 105 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 1vhp n ASP 105 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1vhp n TYR 106 N 0.00 0.00 -2.61 1.24 4.01 -1.26 -5.08 117.16 113.46 1vhp n TYR 106 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.71 1vhp n TYR 106 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.01 1vhp n TYR 106 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1vhp n TRP 107 N 0.00 -3.10 -3.02 -0.72 7.02 -1.26 -4.65 117.44 111.71 1vhp n TRP 107 Ca 0.00 1.82 -0.00 0.00 -1.02 0.00 0.00 57.50 58.30 1vhp n TRP 107 Cb 0.00 -2.95 -0.00 0.00 -2.42 0.00 0.00 31.31 25.94 1vhp n TRP 107 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1vhp s GLY 108 N -0.43 -1.35 0.03 6.99 0.00 -1.26 -4.62 107.32 106.67 1vhp s GLY 108 Ca -0.14 0.29 0.00 0.00 0.00 0.00 0.00 44.72 44.87 1vhp s GLY 108 CO 0.38 3.81 0.00 -0.18 0.00 0.00 0.00 173.10 177.11 1vhp n GLN 109 N 3.90 0.00 0.00 2.90 7.27 -1.26 -5.03 117.38 125.16 1vhp n GLN 109 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.19 1vhp n GLN 109 Cb 0.58 -0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.23 1vhp n GLN 109 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1vhp n GLY 110 N 1.56 3.64 0.00 1.69 0.00 -1.26 -5.08 105.19 105.74 1vhp n GLY 110 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1vhp n GLY 110 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1vhp n THR 111 N 0.00 0.00 -3.38 2.61 5.66 -0.29 -4.87 114.28 114.01 1vhp n THR 111 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1vhp n THR 111 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1vhp n THR 111 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1vhp n LEU 112 N 0.00 0.00 -3.62 1.09 -0.00 -1.26 -2.38 117.00 110.83 1vhp n LEU 112 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 56.01 55.97 1vhp n LEU 112 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 1vhp n LEU 112 CO 0.00 0.00 0.14 0.68 -0.00 0.00 0.00 177.39 178.21 1vhp s VAL 113 N -2.05 -0.83 -0.42 1.47 -7.23 -0.78 -4.49 120.40 106.06 1vhp s VAL 113 Ca 0.00 0.07 -0.12 0.00 -1.81 0.00 0.00 61.98 60.12 1vhp s VAL 113 Cb 0.00 -0.85 0.05 0.00 0.56 0.00 0.00 36.38 36.14 1vhp s VAL 113 CO 0.00 0.03 0.29 -0.89 -0.31 0.00 0.00 175.10 174.21 1vhp s THR 114 N 2.76 4.77 -0.75 5.32 2.01 -0.89 -2.62 115.64 126.24 1vhp s THR 114 Ca -0.02 -1.02 -0.24 0.00 0.31 0.00 0.00 61.69 60.71 1vhp s THR 114 Cb -0.12 -3.78 -0.15 0.00 0.01 0.00 0.00 72.50 68.46 1vhp s THR 114 CO -0.16 -0.41 2.40 1.33 -0.69 0.00 0.00 174.62 177.09 1vhp n VAL 115 N 5.06 -0.02 -1.12 3.82 0.24 -1.26 -1.49 118.33 123.56 1vhp n VAL 115 Ca -0.11 -0.55 -0.36 0.00 -2.04 0.00 0.00 64.34 61.27 1vhp n VAL 115 Cb 0.45 -1.92 0.06 0.00 -1.47 0.00 0.00 33.84 30.96 1vhp n VAL 115 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1vhp n SER 116 N 16.40 -2.86 0.00 -1.34 2.88 -1.26 -4.39 113.62 123.04 1vhp n SER 116 Ca 0.48 0.46 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1vhp n SER 116 Cb 0.41 -1.05 0.00 0.00 -0.75 0.00 0.00 64.21 62.82 1vhp n SER 116 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57