#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvc s SER 2 N 0.00 6.45 -0.04 1.61 0.01 -1.26 -4.99 113.70 115.49 2kvc s SER 2 Ca 0.00 -1.46 -0.30 0.00 1.31 0.00 0.00 55.95 55.50 2kvc s SER 2 Cb 0.00 -2.49 -0.04 0.00 0.21 0.00 0.00 66.02 63.70 2kvc s SER 2 CO 0.00 -1.39 1.29 -2.28 0.41 0.00 0.00 173.24 171.27 2kvc s HIS 3 N 4.17 3.02 0.17 2.43 5.04 -1.26 -4.93 115.29 123.94 2kvc s HIS 3 Ca 0.37 1.03 -0.15 0.00 -1.54 0.00 0.00 55.06 54.76 2kvc s HIS 3 Cb -0.05 -3.53 0.13 0.00 0.04 0.00 0.00 32.58 29.16 2kvc s HIS 3 CO -0.04 -1.83 1.69 0.52 -2.34 0.00 0.00 174.74 172.74 2kvc h MET 4 N 7.67 0.09 -0.38 2.88 2.86 -1.99 -2.62 114.93 123.43 2kvc h MET 4 Ca -0.35 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.35 2kvc h MET 4 Cb 1.17 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.74 2kvc h MET 4 CO 0.89 0.06 0.01 -0.91 1.06 0.00 0.00 176.91 178.02 2kvc h ASN 5 N 0.09 -0.15 -0.18 1.22 4.21 -1.99 0.66 115.58 119.45 2kvc h ASN 5 Ca 0.21 0.09 -0.18 0.00 1.21 0.00 0.00 56.30 57.62 2kvc h ASN 5 Cb 0.30 0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 37.66 2kvc h ASN 5 CO -0.36 -0.04 -0.57 0.03 -1.29 0.00 0.00 177.43 175.21 2kvc h ARG 6 N 0.11 0.78 0.03 0.81 3.08 -1.90 -1.11 114.38 116.18 2kvc h ARG 6 Ca 0.19 -0.51 -0.00 0.00 0.07 0.00 0.00 59.98 59.73 2kvc h ARG 6 Cb 0.26 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2kvc h ARG 6 CO -0.31 1.13 -0.02 0.35 -1.07 0.00 0.00 179.97 180.06 2kvc h PHE 7 N 0.59 -0.04 -0.47 3.04 3.57 -1.11 -0.92 116.94 121.61 2kvc h PHE 7 Ca 0.01 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2kvc h PHE 7 Cb 1.16 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.89 2kvc h PHE 7 CO 0.07 0.28 0.20 -0.07 -2.23 0.00 0.00 178.31 176.56 2kvc h LEU 8 N -0.37 0.63 -1.14 0.59 3.38 -0.87 -0.88 115.31 116.67 2kvc h LEU 8 Ca -0.00 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 2kvc h LEU 8 Cb 0.34 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2kvc h LEU 8 CO 0.01 0.61 -0.11 0.74 0.09 0.00 0.00 178.44 179.78 2kvc h THR 9 N 0.61 1.22 -0.46 0.22 2.02 -1.21 0.62 112.91 115.92 2kvc h THR 9 Ca 0.16 -0.96 -0.03 0.00 0.77 0.00 0.00 66.41 66.35 2kvc h THR 9 Cb 0.17 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2kvc h THR 9 CO -0.02 0.32 0.19 -1.28 0.37 0.00 0.00 175.52 175.10 2kvc h SER 10 N 0.44 0.64 -0.33 4.18 0.87 -0.66 -0.25 113.55 118.45 2kvc h SER 10 Ca 0.09 -0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2kvc h SER 10 Cb 0.46 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 2kvc h SER 10 CO 0.03 0.63 0.20 0.40 -0.53 0.00 0.00 176.83 177.56 2kvc h ILE 11 N 0.61 1.10 -0.48 2.23 1.08 -0.57 -0.60 117.51 120.88 2kvc h ILE 11 Ca 0.15 -0.23 0.07 0.00 -0.39 0.00 0.00 64.86 64.47 2kvc h ILE 11 Cb 0.19 0.67 -0.06 0.00 -3.07 0.00 0.00 36.82 34.55 2kvc h ILE 11 CO -0.01 0.10 0.12 0.58 -0.69 0.00 0.00 178.15 178.25 2kvc h VAL 12 N 0.43 0.77 -0.67 1.67 2.07 -0.62 0.32 116.25 120.22 2kvc h VAL 12 Ca 0.12 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 2kvc h VAL 12 Cb -0.01 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 2kvc h VAL 12 CO -0.02 0.05 0.36 0.00 0.02 0.00 0.00 177.57 177.98 2kvc h ALA 13 N 1.35 0.86 -0.10 1.67 0.00 -0.73 -0.42 119.26 121.89 2kvc h ALA 13 Ca 0.23 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2kvc h ALA 13 Cb 0.29 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2kvc h ALA 13 CO -0.28 0.38 0.05 2.35 0.00 0.00 0.00 179.25 181.75 2kvc h TRP 14 N 0.92 0.15 -0.36 0.00 7.01 -0.36 -0.46 115.95 122.85 2kvc h TRP 14 Ca 0.23 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.23 2kvc h TRP 14 Cb 0.05 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.05 2kvc h TRP 14 CO -0.00 0.21 0.22 -0.07 -2.79 0.00 0.00 178.44 176.01 2kvc h LEU 15 N 0.05 0.42 -0.70 0.65 3.38 -0.11 0.21 115.31 119.20 2kvc h LEU 15 Ca 0.04 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 2kvc h LEU 15 Cb 0.12 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2kvc h LEU 15 CO -0.00 0.33 -0.29 0.08 0.09 0.00 0.00 178.44 178.65 2kvc h ARG 16 N 0.47 0.68 -0.03 1.13 0.11 -1.05 -2.12 114.38 113.57 2kvc h ARG 16 Ca 0.13 -0.30 -0.05 0.00 0.10 0.00 0.00 59.98 59.86 2kvc h ARG 16 Cb -0.02 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.04 2kvc h ARG 16 CO -0.03 0.89 -0.22 0.00 0.10 0.00 0.00 179.97 180.72 2kvc h ALA 17 N 1.10 1.59 -0.16 0.08 0.00 -0.66 -1.03 119.26 120.18 2kvc h ALA 17 Ca 0.07 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2kvc h ALA 17 Cb 0.79 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2kvc h ALA 17 CO 0.07 0.31 -0.19 0.78 0.00 0.00 0.00 179.25 180.21 2kvc h GLY 18 N 0.71 0.29 -5.92 0.00 0.00 -0.30 -3.38 103.07 94.48 2kvc h GLY 18 Ca 0.01 -0.20 -0.45 0.00 0.00 0.00 0.00 47.33 46.68 2kvc h GLY 18 CO 0.03 0.19 -0.84 -1.72 0.00 0.00 0.00 176.54 174.20 2kvc n TYR 19 N -4.21 -1.80 0.30 5.60 4.01 -0.49 -4.79 117.16 115.78 2kvc n TYR 19 Ca -0.01 -2.72 0.16 0.00 -0.16 0.00 0.00 57.90 55.17 2kvc n TYR 19 Cb 0.32 0.61 0.66 0.00 -0.31 0.00 0.00 39.34 40.63 2kvc n TYR 19 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2kvc h PRO 20 N 5.31 0.00 -0.30 -0.72 0.13 -1.48 -2.24 132.00 132.70 2kvc h PRO 20 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2kvc h PRO 20 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 2kvc h PRO 20 CO 0.27 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.19 2kvc n GLU 21 N -2.91 2.16 0.00 0.86 0.00 -1.26 -4.92 120.64 114.57 2kvc n GLU 21 Ca 0.01 -1.76 0.00 0.00 0.00 0.00 0.00 57.16 55.41 2kvc n GLU 21 Cb 0.28 -1.45 0.00 0.00 0.00 0.00 0.00 31.44 30.27 2kvc n GLU 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2kvc n GLY 22 N 1.34 2.13 3.64 -1.84 0.00 -0.84 -4.98 105.19 104.63 2kvc n GLY 22 Ca 0.18 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 2kvc n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2kvc s ILE 23 N -0.30 4.06 0.73 -0.61 1.01 -1.26 -4.87 121.20 119.97 2kvc s ILE 23 Ca 0.00 1.22 -0.13 0.00 0.00 0.00 0.00 60.65 61.74 2kvc s ILE 23 Cb 0.00 -4.02 0.04 0.00 0.01 0.00 0.00 42.46 38.49 2kvc s ILE 23 CO 0.00 -0.36 1.12 -2.16 0.00 0.00 0.00 174.94 173.53 2kvc s PRO 24 N 4.14 2.35 0.37 2.79 0.04 -1.26 -3.93 135.00 139.50 2kvc s PRO 24 Ca 0.60 1.37 0.14 0.00 0.04 0.00 0.00 61.00 63.15 2kvc s PRO 24 Cb -0.20 -1.90 0.99 0.00 0.04 0.00 0.00 34.50 33.44 2kvc s PRO 24 CO 0.23 -1.60 1.77 -1.35 0.04 0.00 0.00 177.00 176.09 2kvc h PRO 25 N -0.62 0.49 0.03 0.56 0.11 -1.94 -2.23 132.00 128.39 2kvc h PRO 25 Ca -0.45 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 2kvc h PRO 25 Cb 1.25 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2kvc h PRO 25 CO 0.51 0.32 -0.01 1.79 -0.21 0.00 0.00 178.00 180.40 2kvc h THR 26 N 0.50 1.23 0.00 -1.15 1.35 -2.02 -3.23 112.91 109.58 2kvc h THR 26 Ca 0.59 -0.80 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2kvc h THR 26 Cb 1.30 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 69.48 2kvc h THR 26 CO -0.33 0.20 0.00 0.44 -0.25 0.00 0.00 175.52 175.58 2kvc h ASP 27 N -0.38 0.00 -0.88 5.36 5.19 -1.77 -2.58 116.42 121.36 2kvc h ASP 27 Ca -0.00 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.43 2kvc h ASP 27 Cb 0.36 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.82 2kvc h ASP 27 CO 0.01 0.00 0.58 0.77 -3.12 0.00 0.00 179.24 177.47 2kvc h SER 28 N 0.00 0.98 -0.48 6.45 4.64 -1.56 0.34 113.55 123.91 2kvc h SER 28 Ca 0.00 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 2kvc h SER 28 Cb 0.30 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 2kvc h SER 28 CO 0.00 0.69 0.24 -0.26 -0.87 0.00 0.00 176.83 176.63 2kvc h PHE 29 N 1.15 0.69 -0.44 4.77 -1.00 -1.66 -1.04 116.94 119.41 2kvc h PHE 29 Ca 0.34 -0.03 -0.09 0.00 2.81 0.00 0.00 57.97 61.00 2kvc h PHE 29 Cb -0.06 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.27 2kvc h PHE 29 CO -0.01 0.54 -0.06 0.00 -1.61 0.00 0.00 178.31 177.16 2kvc h ALA 30 N 1.08 0.60 -0.29 2.45 0.00 -1.50 -0.83 119.26 120.77 2kvc h ALA 30 Ca 0.17 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2kvc h ALA 30 Cb 0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2kvc h ALA 30 CO -0.02 0.45 0.12 0.28 0.00 0.00 0.00 179.25 180.09 2kvc h VAL 31 N 0.66 0.96 -0.53 0.00 2.07 -0.14 -0.18 116.25 119.09 2kvc h VAL 31 Ca 0.12 -0.09 -0.09 0.00 0.82 0.00 0.00 66.70 67.46 2kvc h VAL 31 Cb 0.59 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2kvc h VAL 31 CO 0.04 0.05 -0.02 0.17 0.02 0.00 0.00 177.57 177.83 2kvc h LEU 32 N 0.27 0.89 -1.20 2.57 8.10 -1.08 0.21 115.31 125.07 2kvc h LEU 32 Ca 0.12 -0.24 -0.01 0.00 0.11 0.00 0.00 57.88 57.86 2kvc h LEU 32 Cb 0.06 -0.24 -0.03 0.00 -0.44 0.00 0.00 40.66 40.01 2kvc h LEU 32 CO -0.10 0.96 0.40 0.00 -4.11 0.00 0.00 178.44 175.58 2kvc h ALA 33 N 1.13 1.40 0.08 0.17 0.00 -0.71 0.25 119.26 121.58 2kvc h ALA 33 Ca 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2kvc h ALA 33 Cb 0.52 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2kvc h ALA 33 CO 0.03 0.51 -0.04 1.25 0.00 0.00 0.00 179.25 181.00 2kvc h LEU 34 N 0.96 -0.09 -1.45 0.00 5.85 -0.42 -3.32 115.31 116.83 2kvc h LEU 34 Ca 0.25 -0.47 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 2kvc h LEU 34 Cb -0.01 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2kvc h LEU 34 CO -0.04 0.46 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.17 2kvc h LEU 35 N -0.67 0.00 -1.28 2.25 3.38 -0.37 -2.33 115.31 116.29 2kvc h LEU 35 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2kvc h LEU 35 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2kvc h LEU 35 CO 0.02 0.27 0.00 0.00 0.09 0.00 0.00 178.44 178.82 2kvc n ARG 37 N -2.25 1.48 0.00 0.00 1.74 -0.88 -4.16 116.66 112.59 2kvc n ARG 37 Ca -0.01 -0.80 0.00 0.00 -0.77 0.00 0.00 57.85 56.28 2kvc n ARG 37 Cb 0.07 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 2kvc n ARG 37 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2kvc n ARG 38 N -0.07 0.00 -4.26 5.56 3.00 0.38 -5.09 116.66 116.18 2kvc n ARG 38 Ca 0.19 0.00 -0.14 0.00 -0.00 0.00 0.00 57.85 57.90 2kvc n ARG 38 Cb 0.33 -0.81 -0.10 0.00 0.00 0.00 0.00 32.46 31.88 2kvc n ARG 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2kvc s LEU 39 N -4.32 2.24 0.70 6.15 1.43 0.12 -5.15 118.68 119.84 2kvc s LEU 39 Ca 0.00 -1.14 0.01 0.00 -1.03 0.00 0.00 54.13 51.97 2kvc s LEU 39 Cb 0.00 -0.15 0.12 0.00 0.03 0.00 0.00 46.19 46.19 2kvc s LEU 39 CO 0.00 -0.51 0.96 -0.94 0.23 0.00 0.00 176.35 176.09 2kvc s SER 40 N -3.19 4.47 0.57 2.29 1.04 -1.26 -3.60 113.70 114.01 2kvc s SER 40 Ca 0.23 -0.48 0.26 0.00 0.48 0.00 0.00 55.95 56.44 2kvc s SER 40 Cb 0.05 0.08 1.58 0.00 0.10 0.00 0.00 66.02 67.84 2kvc s SER 40 CO 0.04 -1.78 2.14 1.12 0.98 0.00 0.00 173.24 175.74 2kvc h HIS 41 N -0.40 0.00 -0.00 5.02 2.07 -1.95 -1.17 115.15 118.71 2kvc h HIS 41 Ca -0.35 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.17 2kvc h HIS 41 Cb 1.27 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.25 2kvc h HIS 41 CO -0.09 0.00 -0.00 0.22 -3.07 0.00 0.00 177.93 174.99 2kvc h ASP 42 N 0.00 0.01 -0.52 3.10 1.82 -1.96 -0.01 116.42 118.85 2kvc h ASP 42 Ca 0.06 -0.54 -0.03 0.00 -0.39 0.00 0.00 57.03 56.13 2kvc h ASP 42 Cb 0.31 -0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.29 2kvc h ASP 42 CO -0.00 0.55 0.20 -0.33 -1.61 0.00 0.00 179.24 178.05 2kvc h GLU 43 N -0.54 0.79 -0.18 0.28 3.07 -1.77 -0.59 114.58 115.64 2kvc h GLU 43 Ca 0.00 -0.15 -0.13 0.00 -0.50 0.00 0.00 59.36 58.59 2kvc h GLU 43 Cb 0.55 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 2kvc h GLU 43 CO 0.00 0.70 -0.44 -0.39 -1.40 0.00 0.00 179.01 177.48 2kvc h VAL 44 N 0.71 1.31 -0.57 3.13 -1.51 -1.28 0.82 116.25 118.86 2kvc h VAL 44 Ca 0.17 -1.62 0.02 0.00 -1.23 0.00 0.00 66.70 64.04 2kvc h VAL 44 Cb 0.21 1.66 -0.03 0.00 -2.13 0.00 0.00 31.29 31.00 2kvc h VAL 44 CO -0.01 0.50 0.36 0.50 -1.23 0.00 0.00 177.57 177.69 2kvc h LYS 45 N 0.35 0.71 0.04 5.19 3.64 -0.62 -0.96 116.57 124.93 2kvc h LYS 45 Ca 0.03 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2kvc h LYS 45 Cb 0.91 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 2kvc h LYS 45 CO 0.08 0.47 -0.02 0.00 -2.27 0.00 0.00 179.45 177.71 2kvc h ALA 46 N 1.23 -0.06 -0.61 5.00 0.00 -0.73 -2.05 119.26 122.04 2kvc h ALA 46 Ca 0.22 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2kvc h ALA 46 Cb -0.04 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2kvc h ALA 46 CO -0.07 -0.32 0.20 -0.24 0.00 0.00 0.00 179.25 178.82 2kvc h VAL 47 N -0.49 1.23 -0.46 0.00 3.04 -0.79 -0.39 116.25 118.40 2kvc h VAL 47 Ca -0.01 -0.77 -0.13 0.00 -1.01 0.00 0.00 66.70 64.78 2kvc h VAL 47 Cb 0.44 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.26 2kvc h VAL 47 CO 0.01 0.30 -0.22 0.00 -1.01 0.00 0.00 177.57 176.65 2kvc h ALA 48 N 1.33 0.75 -0.14 3.17 0.00 -1.22 0.29 119.26 123.43 2kvc h ALA 48 Ca 0.20 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2kvc h ALA 48 Cb 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2kvc h ALA 48 CO -0.01 0.66 0.07 -0.97 0.00 0.00 0.00 179.25 179.00 2kvc h ASN 49 N 0.80 0.19 0.64 0.00 -0.73 -0.59 -0.69 115.58 115.20 2kvc h ASN 49 Ca 0.11 -0.12 -0.13 0.00 1.87 0.00 0.00 56.30 58.02 2kvc h ASN 49 Cb 0.78 -0.05 -0.02 0.00 0.27 0.00 0.00 38.32 39.30 2kvc h ASN 49 CO 0.06 0.26 -0.61 1.05 -0.37 0.00 0.00 177.43 177.83 2kvc h GLU 50 N 0.11 0.00 -0.78 6.67 4.11 -1.07 -2.81 114.58 120.80 2kvc h GLU 50 Ca 0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.45 2kvc h GLU 50 Cb 0.12 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 2kvc h GLU 50 CO -0.01 0.61 0.37 1.25 0.07 0.00 0.00 179.01 181.31 2kvc h LEU 51 N 0.00 1.03 -1.09 3.06 5.85 -0.60 0.15 115.31 123.71 2kvc h LEU 51 Ca -0.01 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2kvc h LEU 51 Cb 1.09 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.82 2kvc h LEU 51 CO 0.08 0.88 0.44 0.24 -0.34 0.00 0.00 178.44 179.74 2kvc h MET 52 N 1.11 1.07 0.01 1.25 2.86 -0.90 -1.28 114.93 119.04 2kvc h MET 52 Ca 0.27 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2kvc h MET 52 Cb 0.12 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.57 2kvc h MET 52 CO -0.03 0.78 -0.00 0.00 1.06 0.00 0.00 176.91 178.71 2kvc h ARG 53 N 1.08 -0.01 -0.07 1.72 2.47 -1.14 -3.34 114.38 115.09 2kvc h ARG 53 Ca 0.28 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.86 2kvc h ARG 53 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.31 2kvc h ARG 53 CO -0.05 0.60 -0.56 -0.07 0.56 0.00 0.00 179.97 180.46 2kvc h LEU 54 N -0.63 0.23 0.00 3.04 -0.00 -0.68 -3.46 115.31 113.80 2kvc h LEU 54 Ca -0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.76 2kvc h LEU 54 Cb 0.62 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.21 2kvc h LEU 54 CO 0.00 0.74 0.00 0.61 -0.00 0.00 0.00 178.44 179.79 2kvc n GLY 55 N 0.15 5.52 3.19 0.83 0.00 -0.49 -5.09 105.19 109.30 2kvc n GLY 55 Ca -0.02 -1.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 2kvc n GLY 55 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kvc s ASP 56 N 1.00 5.39 -0.10 1.61 2.15 -1.26 -4.75 116.67 120.71 2kvc s ASP 56 Ca 0.00 -1.72 0.03 0.00 0.43 0.00 0.00 52.55 51.29 2kvc s ASP 56 Cb 0.00 -1.89 0.01 0.00 -0.30 0.00 0.00 42.92 40.74 2kvc s ASP 56 CO 0.00 -0.52 -0.18 0.12 -0.17 0.00 0.00 175.17 174.42 2kvc s PHE 57 N 1.28 2.17 0.30 -5.34 2.19 -1.26 -3.88 117.98 113.44 2kvc s PHE 57 Ca 0.04 -0.97 -0.29 0.00 0.33 0.00 0.00 56.93 56.04 2kvc s PHE 57 Cb -0.23 -1.51 -0.13 0.00 -1.31 0.00 0.00 43.02 39.85 2kvc s PHE 57 CO -0.01 -0.45 1.38 -3.47 1.83 0.00 0.00 175.22 174.49 2kvc n ASP 58 N 3.92 2.92 -4.58 6.13 2.03 -1.25 -4.81 116.55 120.91 2kvc n ASP 58 Ca -0.20 1.18 -0.37 0.00 0.52 0.00 0.00 54.79 55.92 2kvc n ASP 58 Cb 0.52 -1.48 -0.03 0.00 -0.72 0.00 0.00 41.12 39.41 2kvc n ASP 58 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2kvc s GLN 59 N -1.18 3.39 0.39 -0.67 2.00 -1.26 -4.90 119.66 117.45 2kvc s GLN 59 Ca 0.61 -1.58 0.08 0.00 -2.00 0.00 0.00 55.36 52.46 2kvc s GLN 59 Cb -0.59 -5.41 -0.06 0.00 0.80 0.00 0.00 33.01 27.75 2kvc s GLN 59 CO 0.56 -2.89 0.08 0.96 -0.50 0.00 0.00 175.29 173.50 2kvc s ILE 60 N 6.83 2.26 -0.57 -2.34 -4.36 -1.26 -5.08 121.20 116.68 2kvc s ILE 60 Ca 0.59 -1.87 -0.28 0.00 -0.26 0.00 0.00 60.65 58.83 2kvc s ILE 60 Cb 0.02 -2.95 0.03 0.00 1.25 0.00 0.00 42.46 40.81 2kvc s ILE 60 CO 0.08 -0.05 1.16 -0.62 0.24 0.00 0.00 174.94 175.75 2kvc s ASP 61 N -3.79 6.44 -0.24 4.36 2.15 -1.26 -4.81 116.67 119.53 2kvc s ASP 61 Ca 0.37 0.06 -0.05 0.00 0.43 0.00 0.00 52.55 53.37 2kvc s ASP 61 Cb 0.05 -2.54 -0.18 0.00 -0.30 0.00 0.00 42.92 39.96 2kvc s ASP 61 CO 0.20 -1.44 -0.13 -0.38 -0.17 0.00 0.00 175.17 173.26 2kvc n ILE 62 N 6.61 1.55 0.02 4.11 2.08 -1.26 -4.35 119.36 128.13 2kvc n ILE 62 Ca 0.08 -0.51 -0.10 0.00 0.56 0.00 0.00 62.75 62.77 2kvc n ILE 62 Cb 0.49 -1.62 -0.04 0.00 -0.75 0.00 0.00 39.64 37.72 2kvc n ILE 62 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2kvc h GLY 63 N 0.99 -0.09 1.56 7.39 0.00 -1.94 -1.50 103.07 109.48 2kvc h GLY 63 Ca -0.57 0.14 -0.17 0.00 0.00 0.00 0.00 47.33 46.74 2kvc h GLY 63 CO -0.14 -0.13 -0.65 -2.08 0.00 0.00 0.00 176.54 173.55 2kvc h VAL 64 N -0.17 1.36 -0.21 4.60 2.07 -1.94 -2.89 116.25 119.06 2kvc h VAL 64 Ca 0.07 -1.99 -0.01 0.00 0.82 0.00 0.00 66.70 65.59 2kvc h VAL 64 Cb 0.26 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 2kvc h VAL 64 CO -0.17 0.60 0.08 0.58 0.02 0.00 0.00 177.57 178.69 2kvc h VAL 65 N 0.32 1.17 0.00 2.57 2.07 -1.68 0.39 116.25 121.10 2kvc h VAL 65 Ca -0.01 -0.53 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 2kvc h VAL 65 Cb 1.20 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 2kvc h VAL 65 CO 0.11 0.17 -0.17 0.16 0.02 0.00 0.00 177.57 177.86 2kvc h ILE 66 N 0.18 0.36 0.00 4.57 3.07 -1.30 -3.02 117.51 121.37 2kvc h ILE 66 Ca 0.07 -1.18 0.00 0.00 1.55 0.00 0.00 64.86 65.30 2kvc h ILE 66 Cb 0.19 1.90 0.00 0.00 -0.27 0.00 0.00 36.82 38.64 2kvc h ILE 66 CO -0.00 0.17 -1.86 0.35 -1.05 0.00 0.00 178.15 175.76 2kvc n THR 67 N -3.22 0.00 -3.55 0.16 -2.24 -1.09 -4.71 114.28 99.62 2kvc n THR 67 Ca 0.02 -0.43 -0.29 0.00 -2.27 0.00 0.00 64.05 61.08 2kvc n THR 67 Cb 0.49 0.14 -0.12 0.00 -2.10 0.00 0.00 70.33 68.73 2kvc n THR 67 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2kvc s HIS 68 N -3.44 1.28 0.47 4.78 5.65 0.14 -5.08 115.29 119.08 2kvc s HIS 68 Ca -0.06 -2.04 -0.24 0.00 0.25 0.00 0.00 55.06 52.98 2kvc s HIS 68 Cb 0.14 -1.30 -0.07 0.00 -1.18 0.00 0.00 32.58 30.17 2kvc s HIS 68 CO 0.90 -0.80 1.28 -0.06 -0.65 0.00 0.00 174.74 175.41 2kvc s PHE 69 N 0.62 2.66 0.75 3.88 0.40 -1.17 -4.33 117.98 120.79 2kvc s PHE 69 Ca 0.20 1.43 -0.07 0.00 -0.60 0.00 0.00 56.93 57.89 2kvc s PHE 69 Cb -0.19 -3.63 0.16 0.00 0.51 0.00 0.00 43.02 39.86 2kvc s PHE 69 CO -0.03 -2.20 1.02 0.25 0.70 0.00 0.00 175.22 174.96 2kvc n THR 70 N -0.42 0.00 -0.04 0.64 -2.24 -1.23 -5.06 114.28 105.93 2kvc n THR 70 Ca 0.07 -1.15 -0.00 0.00 -2.27 0.00 0.00 64.05 60.70 2kvc n THR 70 Cb 0.45 -1.23 -0.00 0.00 -2.10 0.00 0.00 70.33 67.45 2kvc n THR 70 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2kvc h ASP 71 N -1.00 0.00 0.88 3.42 3.32 -2.00 -3.41 116.42 117.64 2kvc h ASP 71 Ca -0.33 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.51 2kvc h ASP 71 Cb 1.06 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 2kvc h ASP 71 CO 0.29 0.40 -1.19 -0.33 -1.72 0.00 0.00 179.24 176.69 2kvc h GLU 72 N -0.76 0.00 -5.73 3.56 4.39 -2.04 -3.45 114.58 110.55 2kvc h GLU 72 Ca 0.00 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 59.04 2kvc h GLU 72 Cb 0.04 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.62 2kvc h GLU 72 CO 0.00 0.66 -0.49 -0.51 -1.16 0.00 0.00 179.01 177.50 2kvc s LEU 73 N -6.34 4.33 -0.02 1.33 1.43 -1.26 -2.21 118.68 115.94 2kvc s LEU 73 Ca -0.01 0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 53.19 2kvc s LEU 73 Cb 0.09 -2.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 2kvc s LEU 73 CO 0.81 0.35 1.08 -2.16 0.23 0.00 0.00 176.35 176.66 2kvc s PRO 74 N -1.37 4.46 0.44 1.29 0.04 -1.26 -3.55 135.00 135.04 2kvc s PRO 74 Ca 0.20 1.54 -0.21 0.00 0.04 0.00 0.00 61.00 62.57 2kvc s PRO 74 Cb -0.12 -3.47 -0.10 0.00 0.04 0.00 0.00 34.50 30.84 2kvc s PRO 74 CO 0.09 -0.24 0.98 -1.12 0.04 0.00 0.00 177.00 176.76 2kvc s SER 75 N 1.14 6.78 0.31 6.66 0.01 -0.94 -4.88 113.70 122.78 2kvc s SER 75 Ca 0.53 1.79 0.07 0.00 1.31 0.00 0.00 55.95 59.66 2kvc s SER 75 Cb -0.23 -2.55 0.78 0.00 0.21 0.00 0.00 66.02 64.23 2kvc s SER 75 CO 0.25 -0.47 1.77 -0.65 0.41 0.00 0.00 173.24 174.54 2kvc h PRO 76 N 1.93 0.69 -0.68 12.44 0.11 -1.99 -0.25 132.00 144.25 2kvc h PRO 76 Ca -0.49 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.61 2kvc h PRO 76 Cb 1.19 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 2kvc h PRO 76 CO 0.61 0.46 0.42 1.49 -0.21 0.00 0.00 178.00 180.77 2kvc h GLU 77 N 0.71 0.81 -0.16 1.05 4.57 -1.98 0.16 114.58 119.75 2kvc h GLU 77 Ca 0.59 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.67 2kvc h GLU 77 Cb 0.99 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.39 2kvc h GLU 77 CO -0.40 0.54 -0.13 0.22 -1.18 0.00 0.00 179.01 178.06 2kvc h ASP 78 N 0.83 0.39 -0.69 1.04 1.82 -1.47 -1.63 116.42 116.71 2kvc h ASP 78 Ca 0.27 -0.46 0.02 0.00 -0.39 0.00 0.00 57.03 56.47 2kvc h ASP 78 Cb 0.02 -0.11 -0.04 0.00 0.68 0.00 0.00 39.33 39.88 2kvc h ASP 78 CO -0.11 0.77 0.44 0.58 -1.61 0.00 0.00 179.24 179.32 2kvc h VAL 79 N 0.02 1.12 -0.73 2.25 2.07 -0.99 -1.27 116.25 118.72 2kvc h VAL 79 Ca 0.03 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 2kvc h VAL 79 Cb 0.65 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 2kvc h VAL 79 CO 0.03 0.16 0.44 -0.33 0.02 0.00 0.00 177.57 177.90 2kvc h GLU 80 N 0.88 1.00 0.35 1.57 4.39 -0.58 0.14 114.58 122.33 2kvc h GLU 80 Ca 0.27 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 2kvc h GLU 80 Cb -0.03 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.40 2kvc h GLU 80 CO -0.09 0.71 -0.26 -0.09 -1.16 0.00 0.00 179.01 178.12 2kvc h ARG 81 N 1.00 -0.58 -0.23 2.33 2.43 -0.54 -0.78 114.38 118.02 2kvc h ARG 81 Ca 0.26 0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.39 2kvc h ARG 81 Cb -0.03 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 2kvc h ARG 81 CO -0.05 -0.39 -0.21 -0.24 -1.51 0.00 0.00 179.97 177.58 2kvc h VAL 82 N -0.61 1.24 -0.55 0.20 3.04 -1.11 -0.13 116.25 118.34 2kvc h VAL 82 Ca -0.03 -1.12 -0.07 0.00 -1.01 0.00 0.00 66.70 64.46 2kvc h VAL 82 Cb 0.52 1.30 -0.02 0.00 -2.01 0.00 0.00 31.29 31.08 2kvc h VAL 82 CO -0.00 0.36 0.06 -0.09 -1.01 0.00 0.00 177.57 176.88 2kvc h ARG 83 N 0.37 0.93 -0.02 4.17 2.43 -0.43 0.37 114.38 122.20 2kvc h ARG 83 Ca 0.06 -0.26 -0.22 0.00 -0.81 0.00 0.00 59.98 58.75 2kvc h ARG 83 Cb 0.57 -0.10 0.02 0.00 -0.42 0.00 0.00 29.97 30.04 2kvc h ARG 83 CO 0.04 0.91 -0.83 0.00 -1.51 0.00 0.00 179.97 178.58 2kvc h ALA 84 N 0.98 0.13 -0.26 2.80 0.00 -0.95 -2.65 119.26 119.31 2kvc h ALA 84 Ca 0.16 -0.63 0.01 0.00 0.00 0.00 0.00 54.91 54.45 2kvc h ALA 84 Cb 0.45 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2kvc h ALA 84 CO 0.02 0.54 0.16 -0.09 0.00 0.00 0.00 179.25 179.88 2kvc h ARG 85 N 0.21 0.32 0.00 0.00 9.65 -0.86 -2.88 114.38 120.82 2kvc h ARG 85 Ca -0.10 -0.02 -0.13 0.00 -1.10 0.00 0.00 59.98 58.64 2kvc h ARG 85 Cb 1.50 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.99 2kvc h ARG 85 CO 0.16 0.21 -0.60 -0.07 2.80 0.00 0.00 179.97 182.47 2kvc h LEU 86 N 0.33 0.00 -2.08 3.80 -0.00 -1.02 -3.10 115.31 113.24 2kvc h LEU 86 Ca 0.10 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.96 2kvc h LEU 86 Cb -0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.64 2kvc h LEU 86 CO -0.04 0.60 -0.08 0.00 -0.00 0.00 0.00 178.44 178.92 2kvc h ALA 87 N 1.40 1.34 0.00 1.53 0.00 -1.24 -1.65 119.26 120.63 2kvc h ALA 87 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2kvc h ALA 87 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2kvc h ALA 87 CO 0.08 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.43 2kvc n ALA 88 N -2.29 1.56 -0.38 0.00 0.00 -1.17 -1.75 120.51 116.49 2kvc n ALA 88 Ca -0.02 0.08 0.05 0.00 0.00 0.00 0.00 53.44 53.56 2kvc n ALA 88 Cb 0.19 -1.35 0.15 0.00 0.00 0.00 0.00 19.45 18.43 2kvc n ALA 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2kvc n GLN 89 N -2.15 2.80 0.00 0.00 3.00 -0.62 -5.08 117.38 115.33 2kvc n GLN 89 Ca 0.02 -2.15 0.00 0.00 -0.01 0.00 0.00 57.00 54.86 2kvc n GLN 89 Cb 0.19 -1.36 0.00 0.00 0.00 0.00 0.00 30.24 29.07 2kvc n GLN 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2kvc n GLY 90 N -0.04 2.73 2.77 1.08 0.00 -0.72 -5.01 105.19 106.01 2kvc n GLY 90 Ca 0.12 -1.93 -0.30 0.00 0.00 0.00 0.00 46.02 43.91 2kvc n GLY 90 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kvc s TRP 91 N -2.95 2.13 -0.72 1.61 -0.11 -1.26 -4.26 118.94 113.38 2kvc s TRP 91 Ca 0.00 -2.24 0.09 0.00 1.22 0.00 0.00 56.10 55.16 2kvc s TRP 91 Cb 0.00 -1.98 0.47 0.00 -1.50 0.00 0.00 33.47 30.46 2kvc s TRP 91 CO 0.00 -0.84 1.24 -0.35 -4.62 0.00 0.00 176.95 172.37 2kvc n PRO 92 N 4.15 3.14 0.08 5.86 -0.04 -1.26 -4.27 135.00 142.66 2kvc n PRO 92 Ca 0.04 -1.80 -0.22 0.00 -0.04 0.00 0.00 63.50 61.47 2kvc n PRO 92 Cb 0.38 -1.88 -0.15 0.00 -0.04 0.00 0.00 33.50 31.81 2kvc n PRO 92 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2kvc h LEU 93 N 2.34 0.60 -8.26 1.53 -0.00 -2.00 -3.47 115.31 106.06 2kvc h LEU 93 Ca 0.00 -0.94 -0.22 0.00 -0.00 0.00 0.00 57.88 56.73 2kvc h LEU 93 Cb 1.28 -0.20 -0.18 0.00 -0.00 0.00 0.00 40.66 41.57 2kvc h LEU 93 CO 0.26 1.54 -0.71 1.51 -0.00 0.00 0.00 178.44 181.04 2kvc s ASP 94 N -7.21 0.84 -0.20 -0.43 -4.77 -1.26 -4.99 116.67 98.65 2kvc s ASP 94 Ca -0.13 -0.78 -0.17 0.00 -3.30 0.00 0.00 52.55 48.17 2kvc s ASP 94 Cb 0.02 0.09 -0.04 0.00 -1.09 0.00 0.00 42.92 41.91 2kvc s ASP 94 CO 0.87 -0.37 0.47 -1.81 0.70 0.00 0.00 175.17 175.02 2kvc s ASP 95 N -2.32 6.50 -0.46 2.11 1.01 -1.26 -5.00 116.67 117.25 2kvc s ASP 95 Ca 0.00 0.60 -0.12 0.00 0.71 0.00 0.00 52.55 53.74 2kvc s ASP 95 Cb -0.02 -2.27 0.09 0.00 1.01 0.00 0.00 42.92 41.74 2kvc s ASP 95 CO -0.03 -0.14 0.35 -0.69 0.21 0.00 0.00 175.17 174.87 2kvc s VAL 96 N 1.52 4.69 -0.28 -1.27 1.01 -1.26 -4.89 120.40 119.91 2kvc s VAL 96 Ca 0.22 -1.35 0.03 0.00 0.00 0.00 0.00 61.98 60.88 2kvc s VAL 96 Cb -0.15 -3.89 0.01 0.00 0.00 0.00 0.00 36.38 32.35 2kvc s VAL 96 CO 0.09 -0.61 0.43 0.54 0.00 0.00 0.00 175.10 175.55 2kvc n ARG 97 N 5.05 1.67 -3.96 2.72 1.74 -1.26 -5.03 116.66 117.59 2kvc n ARG 97 Ca -0.11 -0.45 -0.12 0.00 -0.77 0.00 0.00 57.85 56.41 2kvc n ARG 97 Cb 0.43 -0.91 -0.13 0.00 -1.02 0.00 0.00 32.46 30.83 2kvc n ARG 97 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2kvc s ASP 98 N -0.58 0.24 -0.22 0.55 2.15 -1.26 -5.13 116.67 112.43 2kvc s ASP 98 Ca 0.03 -0.23 -0.06 0.00 0.43 0.00 0.00 52.55 52.72 2kvc s ASP 98 Cb 0.02 0.03 0.11 0.00 -0.30 0.00 0.00 42.92 42.77 2kvc s ASP 98 CO 0.06 -0.11 0.42 -0.60 -0.17 0.00 0.00 175.17 174.77 2kvc s ARG 99 N -0.63 0.34 0.12 4.34 3.52 -1.26 -5.05 118.95 120.32 2kvc s ARG 99 Ca -0.06 0.91 -0.09 0.00 -0.13 0.00 0.00 55.73 56.37 2kvc s ARG 99 Cb -0.04 0.14 -0.12 0.00 -1.56 0.00 0.00 34.95 33.36 2kvc s ARG 99 CO -0.00 -0.37 1.30 0.93 -0.81 0.00 0.00 175.30 176.35 2kvc h GLU 100 N 8.17 0.60 -5.52 5.12 5.08 -2.06 -3.45 114.58 122.52 2kvc h GLU 100 Ca -0.17 -0.57 -0.65 0.00 -1.00 0.00 0.00 59.36 56.97 2kvc h GLU 100 Cb 1.12 0.14 -0.09 0.00 0.50 0.00 0.00 28.75 30.43 2kvc h GLU 100 CO 0.16 1.19 -0.48 -1.21 -1.00 0.00 0.00 179.01 177.67 2kvc s GLU 101 N -3.49 3.70 -0.19 2.33 0.41 -1.26 -5.00 118.70 115.20 2kvc s GLU 101 Ca -0.08 -0.15 -0.19 0.00 -0.41 0.00 0.00 54.97 54.13 2kvc s GLU 101 Cb 0.09 -3.27 -0.21 0.00 -1.78 0.00 0.00 34.13 28.96 2kvc s GLU 101 CO 0.89 0.61 0.26 0.45 -0.49 0.00 0.00 175.26 176.98 2kvc h HIS 102 N 5.56 0.08 0.00 1.61 3.86 -2.06 -3.55 115.15 120.65 2kvc h HIS 102 Ca -0.50 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 58.65 2kvc h HIS 102 Cb 1.20 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 2kvc h HIS 102 CO 0.70 1.53 0.00 0.00 0.86 0.00 0.00 177.93 181.02