#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vr0 h LEU 15 N 0.00 0.97 -0.41 -5.58 5.85 -2.06 -2.91 115.31 111.17 2vr0 h LEU 15 Ca 0.00 -0.48 -0.06 0.00 0.84 0.00 0.00 57.88 58.19 2vr0 h LEU 15 Cb 0.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 2vr0 h LEU 15 CO 0.00 1.27 -0.27 0.58 -0.34 0.00 0.00 178.44 179.68 2vr0 h VAL 16 N 0.72 0.52 -0.43 1.05 2.07 -2.05 -2.87 116.25 115.25 2vr0 h VAL 16 Ca 0.04 -1.51 -0.09 0.00 0.82 0.00 0.00 66.70 65.96 2vr0 h VAL 16 Cb 1.05 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 32.88 2vr0 h VAL 16 CO 0.11 0.27 -0.10 -0.07 0.02 0.00 0.00 177.57 177.80 2vr0 h LEU 17 N 0.00 0.76 -0.10 2.57 -0.00 -1.95 0.23 115.31 116.82 2vr0 h LEU 17 Ca -0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 57.88 57.66 2vr0 h LEU 17 Cb 1.05 -0.20 -0.00 0.00 -0.00 0.00 0.00 40.66 41.51 2vr0 h LEU 17 CO 0.04 0.88 0.06 1.23 -0.00 0.00 0.00 178.44 180.65 2vr0 h GLY 18 N 0.97 0.14 0.33 0.83 0.00 -1.40 -1.42 103.07 102.53 2vr0 h GLY 18 Ca 0.12 -0.06 0.07 0.00 0.00 0.00 0.00 47.33 47.47 2vr0 h GLY 18 CO 0.04 0.05 -0.02 -1.33 0.00 0.00 0.00 176.54 175.28 2vr0 h GLY 19 N 0.12 0.38 0.82 4.60 0.00 -1.22 -0.35 103.07 107.41 2vr0 h GLY 19 Ca 0.04 0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.46 2vr0 h GLY 19 CO -0.01 -0.11 0.14 0.00 0.00 0.00 0.00 176.54 176.57 2vr0 h ALA 20 N 1.36 0.38 -0.17 3.60 0.00 -0.51 -0.56 119.26 123.35 2vr0 h ALA 20 Ca 0.19 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2vr0 h ALA 20 Cb 0.28 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2vr0 h ALA 20 CO -0.34 -0.24 0.11 1.15 0.00 0.00 0.00 179.25 179.92 2vr0 h THR 21 N 0.30 1.05 -0.17 0.00 2.02 -0.76 -1.34 112.91 114.02 2vr0 h THR 21 Ca 0.13 -0.11 -0.17 0.00 0.77 0.00 0.00 66.41 67.04 2vr0 h THR 21 Cb 0.07 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 2vr0 h THR 21 CO -0.11 0.05 -0.54 0.25 0.37 0.00 0.00 175.52 175.54 2vr0 h LEU 22 N 0.24 0.77 -0.16 2.58 5.85 -0.58 -3.18 115.31 120.82 2vr0 h LEU 22 Ca 0.06 -0.59 0.05 0.00 0.84 0.00 0.00 57.88 58.24 2vr0 h LEU 22 Cb -0.01 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.73 2vr0 h LEU 22 CO -0.01 1.23 -0.22 1.23 -0.34 0.00 0.00 178.44 180.33 2vr0 h GLY 23 N 0.35 -0.18 1.01 3.75 0.00 -0.07 -0.18 103.07 107.75 2vr0 h GLY 23 Ca -0.02 0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.57 2vr0 h GLY 23 CO 0.11 -0.19 0.43 -0.39 0.00 0.00 0.00 176.54 176.51 2vr0 h VAL 24 N -0.26 1.23 0.26 4.60 -1.51 -1.41 -2.28 116.25 116.88 2vr0 h VAL 24 Ca 0.11 -0.56 -0.01 0.00 -1.23 0.00 0.00 66.70 65.01 2vr0 h VAL 24 Cb 0.43 0.20 0.00 0.00 -2.13 0.00 0.00 31.29 29.79 2vr0 h VAL 24 CO -0.31 0.25 -0.14 0.58 -1.23 0.00 0.00 177.57 176.72 2vr0 h VAL 25 N 1.06 0.72 -0.36 7.19 2.07 -1.47 -0.49 116.25 124.97 2vr0 h VAL 25 Ca 0.27 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.87 2vr0 h VAL 25 Cb 0.02 0.72 -0.09 0.00 -1.52 0.00 0.00 31.29 30.42 2vr0 h VAL 25 CO -0.05 0.00 -0.30 0.00 0.02 0.00 0.00 177.57 177.24 2vr0 h ALA 26 N 0.37 -0.16 -0.35 1.67 0.00 -0.74 0.11 119.26 120.16 2vr0 h ALA 26 Ca -0.03 0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 2vr0 h ALA 26 Cb 0.29 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2vr0 h ALA 26 CO 0.05 -0.71 -0.37 1.25 0.00 0.00 0.00 179.25 179.47 2vr0 h LEU 27 N -0.25 0.86 -0.41 0.00 6.46 -1.37 -1.60 115.31 119.00 2vr0 h LEU 27 Ca 0.17 -0.38 0.03 0.00 -0.12 0.00 0.00 57.88 57.57 2vr0 h LEU 27 Cb 0.52 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.18 2vr0 h LEU 27 CO -0.50 1.14 0.22 0.00 -0.62 0.00 0.00 178.44 178.67 2vr0 h ALA 28 N 0.91 0.51 -0.13 1.25 0.00 -0.60 0.17 119.26 121.37 2vr0 h ALA 28 Ca 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2vr0 h ALA 28 Cb 0.93 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2vr0 h ALA 28 CO 0.09 -0.14 0.07 1.15 0.00 0.00 0.00 179.25 180.42 2vr0 h THR 29 N 0.44 1.08 -0.32 0.00 2.02 -0.67 -0.77 112.91 114.69 2vr0 h THR 29 Ca 0.17 -0.21 0.03 0.00 0.77 0.00 0.00 66.41 67.17 2vr0 h THR 29 Cb 0.06 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 2vr0 h THR 29 CO -0.11 0.07 0.14 0.58 0.37 0.00 0.00 175.52 176.57 2vr0 h VAL 30 N 0.12 0.96 -0.08 3.16 2.07 -1.08 -0.10 116.25 121.31 2vr0 h VAL 30 Ca 0.04 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 2vr0 h VAL 30 Cb 0.05 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2vr0 h VAL 30 CO -0.01 0.06 0.04 0.00 0.02 0.00 0.00 177.57 177.68 2vr0 h ALA 31 N 1.18 0.10 -0.36 1.67 0.00 -0.85 0.27 119.26 121.27 2vr0 h ALA 31 Ca 0.14 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2vr0 h ALA 31 Cb 0.07 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2vr0 h ALA 31 CO -0.11 -0.35 0.09 0.35 0.00 0.00 0.00 179.25 179.24 2vr0 h PHE 32 N 0.01 0.16 -0.81 0.00 3.04 -0.96 -1.53 116.94 116.85 2vr0 h PHE 32 Ca 0.03 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.98 2vr0 h PHE 32 Cb 0.11 -0.02 -0.04 0.00 2.56 0.00 0.00 35.95 38.56 2vr0 h PHE 32 CO -0.04 0.04 0.44 0.78 -2.02 0.00 0.00 178.31 177.52 2vr0 h GLY 33 N 0.23 1.20 0.50 2.40 0.00 -0.74 0.12 103.07 106.77 2vr0 h GLY 33 Ca 0.17 -0.55 0.06 0.00 0.00 0.00 0.00 47.33 47.02 2vr0 h GLY 33 CO -0.21 0.52 0.09 1.98 0.00 0.00 0.00 176.54 178.93 2vr0 h MET 34 N 1.12 0.22 -0.09 4.80 1.85 -0.02 -1.25 114.93 121.56 2vr0 h MET 34 Ca 0.28 -0.01 -0.04 0.00 -0.61 0.00 0.00 59.70 59.32 2vr0 h MET 34 Cb 0.03 -0.05 -0.00 0.00 0.43 0.00 0.00 31.60 32.01 2vr0 h MET 34 CO -0.05 0.15 -0.10 -0.22 -0.40 0.00 0.00 176.91 176.29 2vr0 h LYS 35 N 0.23 0.22 -0.89 0.39 1.63 -0.83 -3.20 116.57 114.11 2vr0 h LYS 35 Ca 0.20 -0.12 0.08 0.00 -0.85 0.00 0.00 60.65 59.96 2vr0 h LYS 35 Cb 0.24 0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 31.81 2vr0 h LYS 35 CO -0.26 0.66 0.55 -0.92 -3.45 0.00 0.00 179.45 176.02 2vr0 h TYR 36 N -0.21 1.00 0.00 1.91 5.03 -0.66 -0.42 116.97 123.63 2vr0 h TYR 36 Ca 0.01 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.35 2vr0 h TYR 36 Cb 0.62 -0.32 0.00 0.00 1.55 0.00 0.00 36.73 38.58 2vr0 h TYR 36 CO 0.09 0.47 0.00 0.25 -1.32 0.00 0.00 178.16 177.65 2vr0 n THR 37 N -4.64 0.00 -0.01 1.81 -2.24 -0.48 -2.21 114.28 106.51 2vr0 n THR 37 Ca 0.14 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.97 2vr0 n THR 37 Cb 0.23 -0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.14 2vr0 n THR 37 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2vr0 n ASP 38 N -0.21 2.63 -4.94 3.42 9.92 -0.17 -4.92 116.55 122.29 2vr0 n ASP 38 Ca 0.00 0.00 -0.24 0.00 -0.53 0.00 0.00 54.79 54.02 2vr0 n ASP 38 Cb 0.08 1.43 -0.00 0.00 -0.64 0.00 0.00 41.12 41.99 2vr0 n ASP 38 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2vr0 s GLN 39 N -2.69 3.38 0.36 -1.24 -0.21 -0.94 -2.51 119.66 115.80 2vr0 s GLN 39 Ca -0.04 -0.26 0.13 0.00 0.02 0.00 0.00 55.36 55.21 2vr0 s GLN 39 Cb 0.06 -2.57 0.95 0.00 1.00 0.00 0.00 33.01 32.45 2vr0 s GLN 39 CO 0.43 -0.05 1.78 -0.09 -2.12 0.00 0.00 175.29 175.24 2vr0 h ARG 40 N 0.54 0.53 -0.27 2.91 2.43 -1.90 -2.42 114.38 116.19 2vr0 h ARG 40 Ca -0.48 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.51 2vr0 h ARG 40 Cb 1.23 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.65 2vr0 h ARG 40 CO 0.60 0.35 -0.44 -1.35 -1.51 0.00 0.00 179.97 177.63 2vr0 h PRO 41 N 0.54 0.67 -0.16 0.20 0.11 -1.95 -1.79 132.00 129.63 2vr0 h PRO 41 Ca 0.58 -0.37 -0.02 0.00 0.11 0.00 0.00 66.00 66.30 2vr0 h PRO 41 Cb 1.22 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2vr0 h PRO 41 CO -0.33 0.98 0.03 0.35 -0.21 0.00 0.00 178.00 178.81 2vr0 h PHE 42 N 0.54 0.28 -0.88 0.65 3.57 -1.69 -3.12 116.94 116.29 2vr0 h PHE 42 Ca 0.04 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.52 2vr0 h PHE 42 Cb 0.97 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.59 2vr0 h PHE 42 CO 0.05 0.43 0.58 0.00 -2.23 0.00 0.00 178.31 177.14 2vr0 n THR 44 N -4.41 0.84 1.63 0.00 -2.24 -0.68 -3.57 114.28 105.85 2vr0 n THR 44 Ca 0.11 -0.56 0.13 0.00 -2.27 0.00 0.00 64.05 61.46 2vr0 n THR 44 Cb 0.04 -0.03 0.78 0.00 -2.10 0.00 0.00 70.33 69.02 2vr0 n THR 44 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2vr0 n SER 45 N 0.44 0.00 -4.34 3.42 3.41 -1.02 -4.42 113.62 111.11 2vr0 n SER 45 Ca 0.13 -0.79 -0.36 0.00 -0.26 0.00 0.00 58.87 57.58 2vr0 n SER 45 Cb 0.47 -0.01 -0.13 0.00 -0.26 0.00 0.00 64.21 64.28 2vr0 n SER 45 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2vr0 h HIS 47 N 8.17 0.00 0.00 0.00 2.07 -1.92 0.21 115.15 123.68 2vr0 h HIS 47 Ca -0.36 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.16 2vr0 h HIS 47 Cb 1.14 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.12 2vr0 h HIS 47 CO 0.61 0.00 0.00 0.97 -3.07 0.00 0.00 177.93 176.44 2vr0 h ILE 48 N 0.00 0.00 -0.59 6.12 2.10 -1.94 -2.93 117.51 120.27 2vr0 h ILE 48 Ca 0.03 -0.51 0.00 0.00 1.08 0.00 0.00 64.86 65.46 2vr0 h ILE 48 Cb 0.63 1.47 0.00 0.00 -1.09 0.00 0.00 36.82 37.82 2vr0 h ILE 48 CO -0.00 0.00 0.00 0.23 -1.08 0.00 0.00 178.15 177.30 2vr0 n MET 49 N -2.93 2.44 0.10 2.19 2.81 0.74 -4.54 117.12 117.93 2vr0 n MET 49 Ca 0.01 -2.23 -0.13 0.00 -1.81 0.00 0.00 57.70 53.54 2vr0 n MET 49 Cb 0.32 -1.49 -0.08 0.00 -0.71 0.00 0.00 33.22 31.26 2vr0 n MET 49 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2vr0 h ASN 50 N 3.73 -0.21 -0.64 7.83 -0.26 -1.63 -1.08 115.58 123.32 2vr0 h ASN 50 Ca 0.00 -0.17 0.13 0.00 -0.56 0.00 0.00 56.30 55.70 2vr0 h ASN 50 Cb 0.85 0.05 -0.12 0.00 -1.06 0.00 0.00 38.32 38.04 2vr0 h ASN 50 CO 0.00 0.06 -0.12 -0.65 -1.06 0.00 0.00 177.43 175.66 2vr0 h PRO 51 N -0.48 0.03 -0.21 0.81 0.11 -1.80 0.28 132.00 130.73 2vr0 h PRO 51 Ca -0.02 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 2vr0 h PRO 51 Cb 0.37 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 2vr0 h PRO 51 CO 0.04 0.02 -0.14 -0.39 -0.21 0.00 0.00 178.00 177.32 2vr0 h VAL 52 N 0.03 1.21 0.02 3.15 -1.51 -1.87 -1.58 116.25 115.69 2vr0 h VAL 52 Ca 0.31 -0.93 -0.00 0.00 -1.23 0.00 0.00 66.70 64.86 2vr0 h VAL 52 Cb 0.49 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 30.86 2vr0 h VAL 52 CO -0.63 0.29 -0.01 1.23 -1.23 0.00 0.00 177.57 177.23 2vr0 h GLY 53 N 0.86 -0.02 0.95 5.19 0.00 0.74 -2.25 103.07 108.53 2vr0 h GLY 53 Ca 0.06 0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 2vr0 h GLY 53 CO 0.03 -0.01 -0.27 -2.08 0.00 0.00 0.00 176.54 174.20 2vr0 h VAL 54 N -0.20 0.42 -0.33 4.60 2.07 -0.45 -1.29 116.25 121.07 2vr0 h VAL 54 Ca -0.00 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.51 2vr0 h VAL 54 Cb 0.19 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2vr0 h VAL 54 CO 0.00 0.02 0.27 0.71 0.02 0.00 0.00 177.57 178.59 2vr0 h THR 55 N -0.83 0.69 -0.00 2.57 1.35 -1.35 -0.13 112.91 115.21 2vr0 h THR 55 Ca -0.08 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.78 2vr0 h THR 55 Cb 0.61 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 2vr0 h THR 55 CO 0.13 0.00 -0.01 -0.74 -0.25 0.00 0.00 175.52 174.65 2vr0 h HIS 56 N 0.00 0.01 -0.04 4.73 6.17 -0.97 -2.57 115.15 122.48 2vr0 h HIS 56 Ca 0.16 -0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.21 2vr0 h HIS 56 Cb 0.69 -0.00 -0.00 0.00 2.52 0.00 0.00 27.41 30.61 2vr0 h HIS 56 CO 0.00 0.72 -0.06 -0.22 0.71 0.00 0.00 177.93 179.09 2vr0 h LYS 57 N -0.70 0.06 0.00 5.26 3.64 -0.16 -1.86 116.57 122.81 2vr0 h LYS 57 Ca -0.00 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 2vr0 h LYS 57 Cb 0.73 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 2vr0 h LYS 57 CO 0.00 0.13 -0.38 -0.07 -2.27 0.00 0.00 179.45 176.86 2vr0 h LEU 58 N 0.06 0.00-10.54 5.20 4.07 -1.07 -3.44 115.31 109.60 2vr0 h LEU 58 Ca 0.01 0.00 -0.45 0.00 0.08 0.00 0.00 57.88 57.52 2vr0 h LEU 58 Cb 0.15 0.00 0.07 0.00 1.08 0.00 0.00 40.66 41.95 2vr0 h LEU 58 CO 0.01 0.38 0.16 -0.94 -1.08 0.00 0.00 178.44 176.97 2vr0 s SER 59 N -6.39 5.00 0.60 -0.43 1.04 -0.70 -4.96 113.70 107.86 2vr0 s SER 59 Ca 0.04 0.37 0.29 0.00 0.48 0.00 0.00 55.95 57.13 2vr0 s SER 59 Cb 0.07 -1.11 1.47 0.00 0.10 0.00 0.00 66.02 66.54 2vr0 s SER 59 CO 0.72 -1.43 1.88 1.23 0.98 0.00 0.00 173.24 176.61 2vr0 h GLY 60 N -0.39 0.00 -2.66 7.32 0.00 -1.91 -1.85 103.07 103.58 2vr0 h GLY 60 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2vr0 h GLY 60 CO 0.58 0.00 0.00 1.42 0.00 0.00 0.00 176.54 178.54 2vr0 n HIS 61 N -3.62 1.27 -0.05 5.60 8.25 -1.26 -4.52 115.22 120.89 2vr0 n HIS 61 Ca 0.08 -0.50 0.07 0.00 -0.26 0.00 0.00 57.72 57.11 2vr0 n HIS 61 Cb 0.67 -0.23 0.45 0.00 1.12 0.00 0.00 29.99 32.00 2vr0 n HIS 61 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2vr0 h ALA 62 N 3.86 1.83 -0.40 -1.41 0.00 -1.31 -2.52 119.26 119.31 2vr0 h ALA 62 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2vr0 h ALA 62 Cb 1.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2vr0 h ALA 62 CO 0.21 0.10 0.00 0.09 0.00 0.00 0.00 179.25 179.64 2vr0 n ASN 63 N -4.47 3.66 -4.57 0.00 3.02 -1.26 -4.81 115.26 106.83 2vr0 n ASN 63 Ca 0.06 -2.44 -0.24 0.00 -0.03 0.00 0.00 54.58 51.94 2vr0 n ASN 63 Cb 0.20 -0.54 -0.09 0.00 -0.61 0.00 0.00 39.78 38.74 2vr0 n ASN 63 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2vr0 s ILE 64 N -1.93 2.89 0.70 2.41 -4.36 -0.95 -5.15 121.20 114.82 2vr0 s ILE 64 Ca 0.35 -2.12 -0.11 0.00 -0.26 0.00 0.00 60.65 58.50 2vr0 s ILE 64 Cb 0.24 -2.62 0.02 0.00 1.25 0.00 0.00 42.46 41.35 2vr0 s ILE 64 CO 0.14 -0.35 1.09 -0.94 0.24 0.00 0.00 174.94 175.11 2vr0 s SER 65 N -3.62 5.42 0.15 4.36 1.04 -1.26 -4.90 113.70 114.89 2vr0 s SER 65 Ca 0.32 1.08 -0.14 0.00 0.48 0.00 0.00 55.95 57.69 2vr0 s SER 65 Cb -0.04 -1.88 0.04 0.00 0.10 0.00 0.00 66.02 64.23 2vr0 s SER 65 CO 0.18 -1.34 1.71 0.00 0.98 0.00 0.00 173.24 174.77 2vr0 n ASN 67 N -4.56 0.35 0.28 0.00 3.02 -1.07 0.72 115.26 114.00 2vr0 n ASN 67 Ca 0.02 0.56 0.14 0.00 -0.03 0.00 0.00 54.58 55.26 2vr0 n ASN 67 Cb 0.15 -0.64 0.81 0.00 -0.61 0.00 0.00 39.78 39.49 2vr0 n ASN 67 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2vr0 h ASP 68 N 0.00 0.00 0.00 6.41 3.45 -1.77 -1.27 116.42 123.25 2vr0 h ASP 68 Ca 0.00 0.00 -0.29 0.00 0.43 0.00 0.00 57.03 57.17 2vr0 h ASP 68 Cb 0.46 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 39.18 2vr0 h ASP 68 CO 0.00 0.07 -2.09 0.00 -1.57 0.00 0.00 179.24 175.64 2vr0 n HIS 70 N -3.01 0.00 -4.30 0.00 8.25 0.22 -3.78 115.22 112.61 2vr0 n HIS 70 Ca -0.33 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 56.91 2vr0 n HIS 70 Cb 0.88 -0.06 -0.12 0.00 1.12 0.00 0.00 29.99 31.81 2vr0 n HIS 70 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2vr0 s ALA 71 N -2.29 1.86 0.59 -1.41 0.00 -0.48 -4.90 121.76 115.12 2vr0 s ALA 71 Ca 0.29 -1.38 -0.20 0.00 0.00 0.00 0.00 51.96 50.67 2vr0 s ALA 71 Cb 0.20 -0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 2vr0 s ALA 71 CO 0.44 0.25 1.28 -2.14 0.00 0.00 0.00 175.76 175.60 2vr0 s PRO 72 N -2.51 2.90 0.23 0.00 0.02 -1.26 -4.74 135.00 129.64 2vr0 s PRO 72 Ca 0.12 2.04 0.11 0.00 0.02 0.00 0.00 61.00 63.29 2vr0 s PRO 72 Cb -0.07 -2.02 0.16 0.00 0.02 0.00 0.00 34.50 32.59 2vr0 s PRO 72 CO 0.05 -1.32 1.49 0.45 -0.33 0.00 0.00 177.00 177.34 2vr0 h HIS 73 N 0.99 0.00 -2.73 6.54 3.86 -1.94 -3.41 115.15 118.46 2vr0 h HIS 73 Ca -0.51 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.17 2vr0 h HIS 73 Cb 1.31 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.81 2vr0 h HIS 73 CO 0.45 0.72 0.96 1.21 0.86 0.00 0.00 177.93 182.12 2vr0 s ASN 74 N -6.70 6.59 0.22 2.45 3.84 -1.26 -4.94 114.94 115.13 2vr0 s ASN 74 Ca 0.00 2.55 -0.08 0.00 0.21 0.00 0.00 52.86 55.54 2vr0 s ASN 74 Cb 0.11 -2.58 0.29 0.00 -0.55 0.00 0.00 41.25 38.52 2vr0 s ASN 74 CO 0.77 -0.87 1.78 0.25 -2.79 0.00 0.00 177.10 176.25 2vr0 h LEU 75 N 7.84 0.46 -0.67 3.21 5.85 -1.99 0.39 115.31 130.40 2vr0 h LEU 75 Ca -0.43 0.05 -0.13 0.00 0.84 0.00 0.00 57.88 58.21 2vr0 h LEU 75 Cb 1.20 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.19 2vr0 h LEU 75 CO 0.92 0.28 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.81 2vr0 h LEU 76 N 0.60 0.57 -0.03 2.25 3.38 -1.98 -2.91 115.31 117.19 2vr0 h LEU 76 Ca 0.32 -0.26 -0.19 0.00 0.09 0.00 0.00 57.88 57.85 2vr0 h LEU 76 Cb 0.29 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2vr0 h LEU 76 CO -0.24 0.92 -0.89 0.00 0.09 0.00 0.00 178.44 178.33 2vr0 h ALA 77 N 1.10 0.44 0.02 1.53 0.00 -1.86 -3.39 119.26 117.10 2vr0 h ALA 77 Ca 0.03 -0.81 -0.00 0.00 0.00 0.00 0.00 54.91 54.14 2vr0 h ALA 77 Cb 0.93 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2vr0 h ALA 77 CO 0.08 1.11 -0.01 -0.22 0.00 0.00 0.00 179.25 180.21 2vr0 h LYS 78 N 0.00 -0.02 -0.38 0.00 3.64 -0.85 -3.06 116.57 115.90 2vr0 h LYS 78 Ca -0.01 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.43 2vr0 h LYS 78 Cb 1.67 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 33.41 2vr0 h LYS 78 CO 0.12 0.58 -0.48 -0.07 -2.27 0.00 0.00 179.45 177.33 2vr0 h LEU 79 N -0.65 -1.58 -0.74 5.20 3.38 -1.70 0.51 115.31 119.74 2vr0 h LEU 79 Ca -0.00 0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 2vr0 h LEU 79 Cb 0.61 0.67 -0.04 0.00 0.09 0.00 0.00 40.66 41.99 2vr0 h LEU 79 CO 0.00 -0.39 0.44 1.55 0.09 0.00 0.00 178.44 180.13 2vr0 h PRO 80 N -0.37 1.01 -0.60 1.13 0.13 -1.77 -2.70 132.00 128.83 2vr0 h PRO 80 Ca 0.11 -0.09 0.04 0.00 -0.87 0.00 0.00 66.00 65.18 2vr0 h PRO 80 Cb 0.60 -0.21 -0.04 0.00 0.13 0.00 0.00 31.00 31.48 2vr0 h PRO 80 CO -0.57 0.72 0.35 0.35 -0.23 0.00 0.00 178.00 178.62 2vr0 h PHE 81 N 1.01 0.65 -0.98 1.56 3.04 -1.31 -0.84 116.94 120.06 2vr0 h PHE 81 Ca 0.26 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.24 2vr0 h PHE 81 Cb -0.02 -0.20 -0.05 0.00 2.56 0.00 0.00 35.95 38.23 2vr0 h PHE 81 CO -0.01 0.35 0.63 0.87 -2.02 0.00 0.00 178.31 178.13 2vr0 h LYS 82 N 0.67 1.30 0.00 1.11 1.57 -0.83 -1.21 116.57 119.20 2vr0 h LYS 82 Ca 0.25 -0.09 -0.18 0.00 -1.87 0.00 0.00 60.65 58.75 2vr0 h LYS 82 Cb 0.07 -0.29 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 2vr0 h LYS 82 CO -0.13 0.88 -0.88 0.00 -0.57 0.00 0.00 179.45 178.76 2vr0 h ALA 83 N 1.35 0.55 0.06 3.86 0.00 -1.13 -0.61 119.26 123.34 2vr0 h ALA 83 Ca 0.36 -0.80 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 2vr0 h ALA 83 Cb -0.12 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2vr0 h ALA 83 CO -0.07 1.09 -0.03 0.82 0.00 0.00 0.00 179.25 181.06 2vr0 h ILE 84 N 0.00 1.15 -0.90 0.00 2.04 -1.01 -1.55 117.51 117.23 2vr0 h ILE 84 Ca -0.01 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.29 2vr0 h ILE 84 Cb 1.55 2.04 -0.04 0.00 -0.74 0.00 0.00 36.82 39.63 2vr0 h ILE 84 CO 0.11 0.34 0.52 0.00 0.00 0.00 0.00 178.15 179.13 2vr0 h ALA 85 N -0.18 1.22 0.78 1.87 0.00 -1.33 -0.68 119.26 120.94 2vr0 h ALA 85 Ca -0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2vr0 h ALA 85 Cb 0.62 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2vr0 h ALA 85 CO 0.01 0.65 -0.49 0.78 0.00 0.00 0.00 179.25 180.21 2vr0 h GLY 86 N 1.26 -1.33 0.04 0.00 0.00 -1.18 0.10 103.07 101.96 2vr0 h GLY 86 Ca 0.32 0.55 0.12 0.00 0.00 0.00 0.00 47.33 48.32 2vr0 h GLY 86 CO -0.06 -0.45 0.07 0.00 0.00 0.00 0.00 176.54 176.10 2vr0 h ALA 87 N -1.19 0.68 -0.25 3.60 0.00 -1.18 -1.57 119.26 119.35 2vr0 h ALA 87 Ca -0.10 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2vr0 h ALA 87 Cb 0.95 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2vr0 h ALA 87 CO 0.10 -0.36 -0.18 -0.09 0.00 0.00 0.00 179.25 178.72 2vr0 h ARG 88 N 0.18 0.44 -0.23 0.00 2.43 -0.92 -2.27 114.38 114.02 2vr0 h ARG 88 Ca 0.33 -0.14 -0.19 0.00 -0.81 0.00 0.00 59.98 59.16 2vr0 h ARG 88 Cb 0.52 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2vr0 h ARG 88 CO -0.47 0.61 -0.61 -0.44 -1.51 0.00 0.00 179.97 177.55 2vr0 h ASP 89 N 0.40 0.90 -0.57 -3.80 3.32 -0.10 -2.13 116.42 114.45 2vr0 h ASP 89 Ca 0.07 -0.51 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 2vr0 h ASP 89 Cb 0.55 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 2vr0 h ASP 89 CO 0.04 1.30 0.32 0.58 -1.72 0.00 0.00 179.24 179.75 2vr0 h VAL 90 N 0.59 1.19 -0.27 -1.35 2.07 -1.19 -1.87 116.25 115.42 2vr0 h VAL 90 Ca -0.00 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 2vr0 h VAL 90 Cb 1.22 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2vr0 h VAL 90 CO 0.13 0.20 0.13 0.22 0.02 0.00 0.00 177.57 178.26 2vr0 h TYR 91 N 0.77 0.40 -0.20 1.57 5.03 -1.40 -1.98 116.97 121.16 2vr0 h TYR 91 Ca 0.20 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.46 2vr0 h TYR 91 Cb 0.04 -0.12 -0.01 0.00 1.55 0.00 0.00 36.73 38.18 2vr0 h TYR 91 CO -0.01 0.38 -0.00 0.52 -1.32 0.00 0.00 178.16 177.72 2vr0 h MET 92 N 0.30 0.29 0.00 1.82 2.86 -1.24 -1.33 114.93 117.64 2vr0 h MET 92 Ca 0.09 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2vr0 h MET 92 Cb 0.13 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.74 2vr0 h MET 92 CO -0.01 0.32 -0.22 -1.71 1.06 0.00 0.00 176.91 176.35 2vr0 n ASN 93 N -4.37 0.64 0.00 1.22 5.15 -0.71 -4.08 115.26 113.10 2vr0 n ASN 93 Ca -0.00 0.37 0.00 0.00 -0.60 0.00 0.00 54.58 54.35 2vr0 n ASN 93 Cb 0.18 -0.40 0.00 0.00 -0.53 0.00 0.00 39.78 39.04 2vr0 n ASN 93 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2vr0 n THR 94 N -2.05 0.00 0.11 -0.44 -2.24 -0.77 -4.92 114.28 103.97 2vr0 n THR 94 Ca 0.05 0.05 0.06 0.00 -2.27 0.00 0.00 64.05 61.94 2vr0 n THR 94 Cb 0.41 -0.84 0.01 0.00 -2.10 0.00 0.00 70.33 67.81 2vr0 n THR 94 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2vr0 h LEU 95 N 0.00 0.00-10.39 3.22 3.38 -1.51 -3.46 115.31 106.55 2vr0 h LEU 95 Ca 0.00 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.51 2vr0 h LEU 95 Cb 0.00 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.78 2vr0 h LEU 95 CO 0.00 0.29 -0.06 -0.83 0.09 0.00 0.00 178.44 177.93 2vr0 s GLY 96 N -4.48 1.62 -0.54 0.83 0.00 -0.90 -5.04 107.32 98.80 2vr0 s GLY 96 Ca 0.01 -1.07 0.00 0.00 0.00 0.00 0.00 44.72 43.66 2vr0 s GLY 96 CO 0.76 -0.87 0.32 0.30 0.00 0.00 0.00 173.10 173.61 2vr0 s HIS 97 N -2.63 3.37 0.58 1.90 3.76 -1.26 -4.66 115.29 116.35 2vr0 s HIS 97 Ca 0.50 -2.89 -0.19 0.00 -0.15 0.00 0.00 55.06 52.33 2vr0 s HIS 97 Cb -0.10 -3.03 -0.04 0.00 1.11 0.00 0.00 32.58 30.51 2vr0 s HIS 97 CO 0.39 -0.82 1.17 -2.14 -0.85 0.00 0.00 174.74 172.48 2vr0 s PRO 98 N 0.04 3.12 0.44 8.40 0.02 -1.26 -5.03 135.00 140.72 2vr0 s PRO 98 Ca 0.16 1.72 -0.06 0.00 0.02 0.00 0.00 61.00 62.84 2vr0 s PRO 98 Cb -0.23 -1.96 0.10 0.00 0.02 0.00 0.00 34.50 32.43 2vr0 s PRO 98 CO -0.03 -1.07 0.60 0.41 -0.33 0.00 0.00 177.00 176.58 2vr0 n GLY 99 N 0.32 -0.85 0.19 0.52 0.00 -1.26 -4.98 105.19 99.14 2vr0 n GLY 99 Ca 0.13 -1.76 0.06 0.00 0.00 0.00 0.00 46.02 44.45 2vr0 n GLY 99 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2vr0 h ASP 100 N -0.71 0.00 -3.49 1.61 3.32 -2.08 -3.42 116.42 111.65 2vr0 h ASP 100 Ca -0.19 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.21 2vr0 h ASP 100 Cb 0.57 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.88 2vr0 h ASP 100 CO 0.15 0.36 -0.66 -0.76 -1.72 0.00 0.00 179.24 176.60 2vr0 s LEU 101 N -6.89 3.23 -0.36 1.55 1.43 -1.26 -5.07 118.68 111.30 2vr0 s LEU 101 Ca 0.01 -0.25 -0.12 0.00 -1.03 0.00 0.00 54.13 52.74 2vr0 s LEU 101 Cb 0.10 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.50 2vr0 s LEU 101 CO 0.68 0.01 0.23 -0.63 0.23 0.00 0.00 176.35 176.87 2vr0 s ILE 102 N 1.30 4.92 0.00 -0.59 1.01 -1.26 -5.07 121.20 121.51 2vr0 s ILE 102 Ca 0.04 -0.57 0.07 0.00 0.00 0.00 0.00 60.65 60.19 2vr0 s ILE 102 Cb -0.15 -3.64 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 2vr0 s ILE 102 CO 0.01 -0.14 -0.23 -0.76 0.00 0.00 0.00 174.94 173.83 2vr0 s LEU 103 N 1.64 2.08 0.19 2.97 1.43 -1.26 -5.11 118.68 120.62 2vr0 s LEU 103 Ca 0.04 -0.45 -0.32 0.00 -1.03 0.00 0.00 54.13 52.37 2vr0 s LEU 103 Cb -0.18 -1.13 -0.11 0.00 0.03 0.00 0.00 46.19 44.79 2vr0 s LEU 103 CO 0.08 0.25 1.67 0.00 0.23 0.00 0.00 176.35 178.58 2vr0 s ALA 104 N -0.62 3.87 0.77 4.21 0.00 -1.26 -5.00 121.76 123.73 2vr0 s ALA 104 Ca 0.09 1.50 -0.11 0.00 0.00 0.00 0.00 51.96 53.43 2vr0 s ALA 104 Cb -0.09 -3.67 0.05 0.00 0.00 0.00 0.00 23.12 19.41 2vr0 s ALA 104 CO 0.00 -0.88 1.09 0.20 0.00 0.00 0.00 175.76 176.17 2vr0 s GLY 105 N 1.23 1.63 0.17 0.00 0.00 -1.26 -4.82 107.32 104.27 2vr0 s GLY 105 Ca 0.73 -0.20 -0.28 0.00 0.00 0.00 0.00 44.72 44.97 2vr0 s GLY 105 CO 0.32 0.20 1.55 -0.33 0.00 0.00 0.00 173.10 174.84 2vr0 h MET 106 N -0.96 -0.14 -0.63 2.90 2.86 -2.00 -1.84 114.93 115.13 2vr0 h MET 106 Ca -0.46 0.01 0.13 0.00 -2.06 0.00 0.00 59.70 57.32 2vr0 h MET 106 Cb 1.26 0.03 -0.11 0.00 0.06 0.00 0.00 31.60 32.84 2vr0 h MET 106 CO 0.60 -0.09 -0.01 1.49 1.06 0.00 0.00 176.91 179.96 2vr0 h GLU 107 N -0.14 0.11 -0.02 1.72 4.81 -2.00 -1.46 114.58 117.60 2vr0 h GLU 107 Ca 0.18 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.26 2vr0 h GLU 107 Cb 0.52 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 2vr0 h GLU 107 CO -0.81 0.07 -0.63 1.79 -0.73 0.00 0.00 179.01 178.70 2vr0 h THR 108 N 0.11 1.44 -0.97 0.32 1.35 -1.73 -1.86 112.91 111.56 2vr0 h THR 108 Ca 0.33 -2.13 0.10 0.00 -0.55 0.00 0.00 66.41 64.16 2vr0 h THR 108 Cb 0.53 2.13 -0.08 0.00 -1.73 0.00 0.00 68.15 69.01 2vr0 h THR 108 CO -0.54 0.62 0.62 0.11 -0.25 0.00 0.00 175.52 176.07 2vr0 h LYS 109 N 0.06 0.97 -0.07 4.72 1.57 -0.58 -1.60 116.57 121.63 2vr0 h LYS 109 Ca -0.01 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2vr0 h LYS 109 Cb 1.13 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 2vr0 h LYS 109 CO 0.09 0.64 -0.08 1.49 -0.57 0.00 0.00 179.45 181.02 2vr0 h GLU 110 N 1.00 0.18 0.00 3.15 4.57 -0.98 -1.87 114.58 120.62 2vr0 h GLU 110 Ca 0.46 -0.10 -0.09 0.00 -1.18 0.00 0.00 59.36 58.45 2vr0 h GLU 110 Cb 0.41 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 2vr0 h GLU 110 CO -0.22 0.63 -0.44 -0.39 -1.18 0.00 0.00 179.01 177.41 2vr0 h VAL 111 N -0.27 1.21 0.32 0.32 -1.51 -1.10 -2.16 116.25 113.06 2vr0 h VAL 111 Ca 0.01 -1.55 -0.02 0.00 -1.23 0.00 0.00 66.70 63.91 2vr0 h VAL 111 Cb 0.60 1.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.62 2vr0 h VAL 111 CO 0.02 0.43 -0.15 0.58 -1.23 0.00 0.00 177.57 177.22 2vr0 h VAL 112 N 0.00 0.67 -0.98 7.19 2.07 -1.32 -2.41 116.25 121.47 2vr0 h VAL 112 Ca -0.00 -0.59 0.06 0.00 0.82 0.00 0.00 66.70 66.98 2vr0 h VAL 112 Cb 0.83 0.96 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 2vr0 h VAL 112 CO 0.06 0.11 0.63 -1.13 0.02 0.00 0.00 177.57 177.26 2vr0 h ASN 113 N -0.77 1.02 -0.92 0.57 -1.24 -1.24 0.22 115.58 113.22 2vr0 h ASN 113 Ca -0.04 0.01 0.14 0.00 0.71 0.00 0.00 56.30 57.11 2vr0 h ASN 113 Cb 0.51 -0.21 -0.09 0.00 0.73 0.00 0.00 38.32 39.26 2vr0 h ASN 113 CO 0.07 0.66 0.53 0.00 -1.29 0.00 0.00 177.43 177.40 2vr0 h ALA 114 N 1.43 1.39 0.00 1.57 0.00 -1.41 -1.77 119.26 120.47 2vr0 h ALA 114 Ca 0.41 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.30 2vr0 h ALA 114 Cb 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2vr0 h ALA 114 CO -0.16 0.05 -0.40 -0.91 0.00 0.00 0.00 179.25 177.82 2vr0 h ASN 115 N 0.79 0.00 -0.00 0.00 2.35 -0.14 -0.83 115.58 117.74 2vr0 h ASN 115 Ca 0.48 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 56.26 2vr0 h ASN 115 Cb 0.59 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.93 2vr0 h ASN 115 CO -0.32 0.40 -0.16 0.00 -1.65 0.00 0.00 177.43 175.71 2vr0 h LYS 117 N -0.26 0.84 -0.84 0.00 1.57 -1.03 -2.24 116.57 114.61 2vr0 h LYS 117 Ca 0.05 -0.05 0.16 0.00 -1.87 0.00 0.00 60.65 58.94 2vr0 h LYS 117 Cb 0.33 -0.19 -0.06 0.00 0.08 0.00 0.00 32.23 32.39 2vr0 h LYS 117 CO -0.16 0.55 0.55 0.00 -0.57 0.00 0.00 179.45 179.83 2vr0 h ALA 118 N 1.39 2.01 0.00 3.86 0.00 -0.82 -2.82 119.26 122.89 2vr0 h ALA 118 Ca 0.35 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2vr0 h ALA 118 Cb 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2vr0 h ALA 118 CO -0.18 -0.25 -1.20 0.00 0.00 0.00 0.00 179.25 177.62 2vr0 n HIS 120 N -1.69 2.29 0.13 0.00 8.25 -0.87 -4.83 115.22 118.50 2vr0 n HIS 120 Ca -0.00 -2.27 -0.13 0.00 -0.26 0.00 0.00 57.72 55.05 2vr0 n HIS 120 Cb 0.29 -0.29 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 2vr0 n HIS 120 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2vr0 h THR 121 N 3.27 0.77 -0.04 1.59 2.02 -1.74 -3.32 112.91 115.46 2vr0 h THR 121 Ca 0.20 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 2vr0 h THR 121 Cb 1.41 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 68.93 2vr0 h THR 121 CO 0.58 0.13 -0.04 0.24 0.37 0.00 0.00 175.52 176.80 2vr0 h MET 122 N -0.71 0.06 0.00 6.66 2.86 -1.90 0.17 114.93 122.07 2vr0 h MET 122 Ca -0.04 -0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 2vr0 h MET 122 Cb 0.49 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 2vr0 h MET 122 CO 0.06 0.11 -0.22 1.15 1.06 0.00 0.00 176.91 179.07 2vr0 h THR 123 N 0.06 1.05 -0.24 2.22 2.02 -1.95 -3.29 112.91 112.78 2vr0 h THR 123 Ca 0.01 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.41 2vr0 h THR 123 Cb 0.12 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 2vr0 h THR 123 CO 0.01 0.22 0.00 0.59 0.37 0.00 0.00 175.52 176.70 2vr0 n ASN 124 N -4.12 2.64 0.33 4.18 3.02 0.56 -4.77 115.26 117.11 2vr0 n ASN 124 Ca -0.02 -1.81 0.22 0.00 -0.03 0.00 0.00 54.58 52.94 2vr0 n ASN 124 Cb 0.29 -0.16 1.17 0.00 -0.61 0.00 0.00 39.78 40.48 2vr0 n ASN 124 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2vr0 h VAL 125 N 2.35 0.00 -0.01 2.41 -1.51 -1.53 -3.06 116.25 114.90 2vr0 h VAL 125 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2vr0 h VAL 125 Cb 0.66 0.95 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 2vr0 h VAL 125 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 175.72 2vr0 n GLU 126 N -3.04 1.51 -3.69 5.19 1.02 -1.26 -4.99 120.64 115.37 2vr0 n GLU 126 Ca -0.03 -2.50 -0.11 0.00 -0.02 0.00 0.00 57.16 54.51 2vr0 n GLU 126 Cb 0.10 -1.47 -0.11 0.00 -0.02 0.00 0.00 31.44 29.93 2vr0 n GLU 126 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2vr0 s VAL 127 N -2.71 -0.15 -0.27 2.62 1.01 -1.16 -5.04 120.40 114.70 2vr0 s VAL 127 Ca 0.30 0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.35 2vr0 s VAL 127 Cb 0.26 -0.57 -0.19 0.00 0.00 0.00 0.00 36.38 35.88 2vr0 s VAL 127 CO 0.03 0.05 2.99 0.00 0.00 0.00 0.00 175.10 178.17 2vr0 n ALA 128 N 4.51 5.63 0.37 5.51 0.00 -1.26 -4.43 120.51 130.84 2vr0 n ALA 128 Ca -0.20 -1.78 0.12 0.00 0.00 0.00 0.00 53.44 51.58 2vr0 n ALA 128 Cb 0.54 -2.49 0.52 0.00 0.00 0.00 0.00 19.45 18.01 2vr0 n ALA 128 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2vr0 h SER 129 N 3.93 0.00 1.93 0.00 4.64 -1.97 -2.65 113.55 119.43 2vr0 h SER 129 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2vr0 h SER 129 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2vr0 h SER 129 CO 0.55 0.00 0.00 0.24 -0.87 0.00 0.00 176.83 176.75 2vr0 h MET 130 N 0.00 0.00 0.00 4.77 2.86 -1.88 -3.34 114.93 117.34 2vr0 h MET 130 Ca 0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 2vr0 h MET 130 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 2vr0 h MET 130 CO 0.00 0.00 -2.00 0.39 1.06 0.00 0.00 176.91 176.36 2vr0 n GLU 131 N -3.10 0.68 0.00 1.72 -0.58 -1.00 -4.65 120.64 113.72 2vr0 n GLU 131 Ca 0.04 -0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 2vr0 n GLU 131 Cb 0.51 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.90 2vr0 n GLU 131 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2vr0 n ALA 132 N -2.30 -0.19 -2.80 0.62 0.00 -1.20 -4.85 120.51 109.79 2vr0 n ALA 132 Ca -0.09 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.08 2vr0 n ALA 132 Cb 0.65 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 20.07 2vr0 n ALA 132 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2vr0 s LYS 133 N -1.81 2.92 0.20 0.00 -0.14 -1.26 -5.04 119.74 114.62 2vr0 s LYS 133 Ca 0.00 -0.84 -0.10 0.00 -1.36 0.00 0.00 55.97 53.67 2vr0 s LYS 133 Cb 0.00 -2.67 0.21 0.00 -1.68 0.00 0.00 37.83 33.69 2vr0 s LYS 133 CO 0.00 0.49 1.82 -0.22 -0.76 0.00 0.00 175.35 176.68 2vr0 h LYS 134 N 2.50 0.70 -5.81 1.68 3.64 -1.88 -3.43 116.57 113.96 2vr0 h LYS 134 Ca -0.48 -0.04 -0.52 0.00 -1.27 0.00 0.00 60.65 58.35 2vr0 h LYS 134 Cb 1.20 -0.16 -0.24 0.00 -0.41 0.00 0.00 32.23 32.62 2vr0 h LYS 134 CO 0.64 0.46 -0.82 0.71 -2.27 0.00 0.00 179.45 178.17 2vr0 s TYR 135 N -6.11 1.57 0.31 1.91 1.51 -1.26 -5.02 117.35 110.27 2vr0 s TYR 135 Ca -0.13 -0.39 0.08 0.00 -1.01 0.00 0.00 57.07 55.62 2vr0 s TYR 135 Cb 0.15 -0.91 0.86 0.00 -0.11 0.00 0.00 41.96 41.96 2vr0 s TYR 135 CO 0.76 0.11 1.70 0.00 -1.11 0.00 0.00 175.55 177.01 2vr0 n THR 137 N -4.98 0.63 0.59 0.00 -2.24 -1.26 -1.59 114.28 105.43 2vr0 n THR 137 Ca 0.26 0.16 0.10 0.00 -2.27 0.00 0.00 64.05 62.30 2vr0 n THR 137 Cb 0.75 -0.89 0.42 0.00 -2.10 0.00 0.00 70.33 68.52 2vr0 n THR 137 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2vr0 n ASP 138 N -1.34 0.22 -0.05 3.42 8.00 -0.40 -3.17 116.55 123.23 2vr0 n ASP 138 Ca 0.07 0.54 -0.11 0.00 0.71 0.00 0.00 54.79 56.00 2vr0 n ASP 138 Cb 0.14 -0.59 -0.04 0.00 -0.02 0.00 0.00 41.12 40.62 2vr0 n ASP 138 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vr0 n HIS 140 N -3.56 3.10 -0.33 0.00 8.25 -0.67 -4.74 115.22 117.26 2vr0 n HIS 140 Ca -0.19 -3.01 -0.03 0.00 -0.26 0.00 0.00 57.72 54.23 2vr0 n HIS 140 Cb 0.58 -2.50 0.11 0.00 1.12 0.00 0.00 29.99 29.30 2vr0 n HIS 140 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2vr0 h ARG 141 N 5.60 1.25 0.00 -0.41 3.08 -1.85 -2.62 114.38 119.44 2vr0 h ARG 141 Ca 0.68 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.61 2vr0 h ARG 141 Cb 0.50 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.29 2vr0 h ARG 141 CO 1.84 0.88 0.00 0.09 -1.07 0.00 0.00 179.97 181.71 2vr0 n ASN 142 N -4.35 0.27 0.26 7.04 3.02 -1.26 -2.31 115.26 117.94 2vr0 n ASN 142 Ca 0.10 0.53 0.12 0.00 -0.03 0.00 0.00 54.58 55.31 2vr0 n ASN 142 Cb 0.07 -0.60 0.73 0.00 -0.61 0.00 0.00 39.78 39.36 2vr0 n ASN 142 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2vr0 h VAL 143 N 0.00 0.62 0.00 2.41 2.07 -1.84 -0.96 116.25 118.55 2vr0 h VAL 143 Ca 0.00 -0.46 -0.64 0.00 0.82 0.00 0.00 66.70 66.42 2vr0 h VAL 143 Cb 0.52 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2vr0 h VAL 143 CO 0.00 0.11 3.05 1.67 0.02 0.00 0.00 177.57 182.42 2vr0 n GLN 144 N -3.75 2.65 -4.07 1.57 7.27 -0.98 -4.67 117.38 115.39 2vr0 n GLN 144 Ca -0.02 -2.19 -0.33 0.00 0.07 0.00 0.00 57.00 54.53 2vr0 n GLN 144 Cb 0.21 -2.98 -0.00 0.00 2.41 0.00 0.00 30.24 29.88 2vr0 n GLN 144 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2vr0 n HIS 145 N 5.57 -2.01 -3.87 3.69 8.25 -1.15 -2.67 115.22 123.04 2vr0 n HIS 145 Ca 0.57 0.85 -0.29 0.00 -0.26 0.00 0.00 57.72 58.59 2vr0 n HIS 145 Cb 0.32 -3.45 0.03 0.00 1.12 0.00 0.00 29.99 28.01 2vr0 n HIS 145 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2vr0 n MET 146 N -4.53 -5.84 0.27 -0.41 2.81 -0.38 -4.84 117.12 104.20 2vr0 n MET 146 Ca 0.06 0.63 0.17 0.00 -1.81 0.00 0.00 57.70 56.74 2vr0 n MET 146 Cb 0.51 -5.53 0.92 0.00 -0.71 0.00 0.00 33.22 28.40 2vr0 n MET 146 CO 0.00 0.00 0.00 0.07 1.51 0.00 0.00 175.97 177.55 2vr0 h ARG 147 N -2.17 0.00 0.00 0.03 0.11 -1.76 -2.11 114.38 108.49 2vr0 h ARG 147 Ca -0.58 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.47 2vr0 h ARG 147 Cb 1.37 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.45 2vr0 h ARG 147 CO 0.65 0.00 -0.24 0.52 0.10 0.00 0.00 179.97 181.01 2vr0 h MET 148 N 0.00 0.00 -7.09 0.08 2.86 -1.89 -3.47 114.93 105.43 2vr0 h MET 148 Ca 0.03 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.20 2vr0 h MET 148 Cb 0.23 0.00 0.04 0.00 0.06 0.00 0.00 31.60 31.92 2vr0 h MET 148 CO -0.00 0.13 0.39 0.15 1.06 0.00 0.00 176.91 178.64 2vr0 s LYS 149 N -3.16 3.70 0.50 1.72 1.02 -0.79 -4.97 119.74 117.76 2vr0 s LYS 149 Ca 0.05 1.38 -0.21 0.00 0.02 0.00 0.00 55.97 57.21 2vr0 s LYS 149 Cb 0.06 -2.08 -0.08 0.00 -0.52 0.00 0.00 37.83 35.21 2vr0 s LYS 149 CO 0.70 -0.52 0.93 -2.30 -0.92 0.00 0.00 175.35 173.24 2vr0 n PRO 150 N -1.12 1.09 -0.32 -1.68 -0.02 -1.26 -4.86 135.00 126.83 2vr0 n PRO 150 Ca 0.10 0.40 0.16 0.00 -2.02 0.00 0.00 63.50 62.14 2vr0 n PRO 150 Cb 0.52 -2.04 0.35 0.00 -0.02 0.00 0.00 33.50 32.32 2vr0 n PRO 150 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2vr0 h ILE 151 N 1.01 0.45 0.00 4.25 1.08 -1.95 -0.62 117.51 121.73 2vr0 h ILE 151 Ca -0.46 -0.14 0.00 0.00 -0.39 0.00 0.00 64.86 63.87 2vr0 h ILE 151 Cb 1.35 -0.01 0.00 0.00 -3.07 0.00 0.00 36.82 35.10 2vr0 h ILE 151 CO 0.53 0.08 0.00 -1.54 -0.69 0.00 0.00 178.15 176.53 2vr0 n SER 152 N -5.02 0.26 -0.58 1.72 3.41 -1.26 -1.69 113.62 110.46 2vr0 n SER 152 Ca 0.25 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.56 2vr0 n SER 152 Cb 0.73 -0.63 0.41 0.00 -0.26 0.00 0.00 64.21 64.46 2vr0 n SER 152 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2vr0 n THR 153 N -1.80 0.14 0.00 6.66 -2.24 -0.24 -4.46 114.28 112.33 2vr0 n THR 153 Ca 0.02 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 2vr0 n THR 153 Cb 0.12 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2vr0 n THR 153 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2vr0 n ARG 154 N 0.38 1.88 -3.81 -0.78 1.74 -0.68 -4.89 116.66 110.51 2vr0 n ARG 154 Ca 0.17 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.13 2vr0 n ARG 154 Cb 0.37 -0.66 -0.11 0.00 -1.02 0.00 0.00 32.46 31.03 2vr0 n ARG 154 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2vr0 s GLU 155 N -1.18 0.31 0.39 5.56 2.12 -0.81 -4.24 118.70 120.85 2vr0 s GLU 155 Ca 0.00 0.16 0.04 0.00 0.36 0.00 0.00 54.97 55.53 2vr0 s GLU 155 Cb 0.00 0.14 -0.02 0.00 0.26 0.00 0.00 34.13 34.52 2vr0 s GLU 155 CO 0.00 -0.05 0.15 1.33 -0.54 0.00 0.00 175.26 176.15 2vr0 n VAL 156 N 2.63 0.00 -1.76 3.70 0.24 -1.26 -4.61 118.33 117.28 2vr0 n VAL 156 Ca -0.15 -2.29 -0.29 0.00 -2.04 0.00 0.00 64.34 59.57 2vr0 n VAL 156 Cb 0.58 0.84 0.14 0.00 -1.47 0.00 0.00 33.84 33.92 2vr0 n VAL 156 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2vr0 s ALA 157 N -3.08 2.18 0.40 2.33 0.00 -1.26 -5.07 121.76 117.26 2vr0 s ALA 157 Ca 0.21 -0.77 -0.03 0.00 0.00 0.00 0.00 51.96 51.37 2vr0 s ALA 157 Cb 0.01 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.16 2vr0 s ALA 157 CO 0.15 -2.15 0.65 -0.51 0.00 0.00 0.00 175.76 173.90 2vr0 s ASP 158 N -4.46 6.31 0.00 0.00 1.01 -1.26 -5.23 116.67 113.04 2vr0 s ASP 158 Ca 0.66 0.70 0.26 0.00 0.71 0.00 0.00 52.55 54.88 2vr0 s ASP 158 Cb -0.10 -2.14 0.60 0.00 1.01 0.00 0.00 42.92 42.29 2vr0 s ASP 158 CO 0.52 -0.40 1.49 -0.62 0.21 0.00 0.00 175.17 176.37