#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hkp s THR 26 N 0.00 1.56 0.44 0.00 -4.23 -1.26 -5.16 115.64 106.99 3hkp s THR 26 Ca 0.00 -1.40 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 3hkp s THR 26 Cb 0.00 -1.41 0.00 0.00 1.34 0.00 0.00 72.50 72.43 3hkp s THR 26 CO 0.00 -0.03 0.02 0.00 -0.54 0.00 0.00 174.62 174.07 3hkp n ALA 27 N 1.32 0.39 0.11 3.99 0.00 -1.26 -5.05 120.51 120.01 3hkp n ALA 27 Ca -0.19 -1.95 0.11 0.00 0.00 0.00 0.00 53.44 51.41 3hkp n ALA 27 Cb 0.54 1.05 0.01 0.00 0.00 0.00 0.00 19.45 21.05 3hkp n ALA 27 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 3hkp h ASP 28 N 1.01 0.00 -1.45 0.00 3.58 -2.09 -3.49 116.42 113.98 3hkp h ASP 28 Ca -0.36 0.00 -0.72 0.00 0.42 0.00 0.00 57.03 56.37 3hkp h ASP 28 Cb 1.09 0.00 0.05 0.00 1.72 0.00 0.00 39.33 42.19 3hkp h ASP 28 CO 0.59 0.01 0.39 0.41 -2.88 0.00 0.00 179.24 177.77 3hkp n THR 29 N -2.71 0.03 -2.82 2.25 -1.04 -1.26 -4.98 114.28 103.75 3hkp n THR 29 Ca 0.00 -0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.66 3hkp n THR 29 Cb 0.56 -0.61 -0.07 0.00 -1.82 0.00 0.00 70.33 68.39 3hkp n THR 29 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3hkp s SER 30 N 0.71 7.12 0.28 8.00 1.04 -1.26 -4.89 113.70 124.70 3hkp s SER 30 Ca 0.88 1.73 0.01 0.00 0.48 0.00 0.00 55.95 59.06 3hkp s SER 30 Cb -1.07 -2.55 0.66 0.00 0.10 0.00 0.00 66.02 63.15 3hkp s SER 30 CO 0.53 -0.21 1.69 -0.65 0.98 0.00 0.00 173.24 175.58 3hkp h PRO 31 N 2.54 0.34 -0.91 4.02 0.11 -1.99 0.19 132.00 136.30 3hkp h PRO 31 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 3hkp h PRO 31 Cb 1.19 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 3hkp h PRO 31 CO 0.63 0.23 0.51 1.49 -0.21 0.00 0.00 178.00 180.65 3hkp h GLU 32 N 0.35 1.25 0.22 1.05 4.81 -1.99 0.52 114.58 120.79 3hkp h GLU 32 Ca 0.52 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.61 3hkp h GLU 32 Cb 0.97 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.10 3hkp h GLU 32 CO -0.54 0.90 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.45 3hkp h ARG 33 N 1.26 -0.28 -0.72 1.92 2.43 -1.11 -2.76 114.38 115.12 3hkp h ARG 33 Ca 0.32 0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.66 3hkp h ARG 33 Cb -0.00 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 29.51 3hkp h ARG 33 CO -0.05 -0.03 0.21 1.25 -1.51 0.00 0.00 179.97 179.84 3hkp h LEU 34 N -0.51 0.11 -0.50 3.80 5.85 -0.85 -1.68 115.31 121.53 3hkp h LEU 34 Ca -0.03 0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3hkp h LEU 34 Cb 0.38 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 3hkp h LEU 34 CO 0.05 0.02 0.25 0.00 -0.34 0.00 0.00 178.44 178.42 3hkp h ALA 35 N 1.57 0.64 -0.31 1.25 0.00 -0.86 0.25 119.26 121.80 3hkp h ALA 35 Ca 0.40 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 3hkp h ALA 35 Cb 0.64 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3hkp h ALA 35 CO -0.45 -0.10 0.04 0.00 0.00 0.00 0.00 179.25 178.73 3hkp h ALA 36 N 1.27 0.41 0.31 0.00 0.00 -1.15 -0.66 119.26 119.45 3hkp h ALA 36 Ca 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3hkp h ALA 36 Cb 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3hkp h ALA 36 CO -0.16 0.12 -0.28 0.82 0.00 0.00 0.00 179.25 179.75 3hkp h ILE 37 N 0.34 0.42 -0.99 0.00 2.04 -1.06 -2.70 117.51 115.56 3hkp h ILE 37 Ca 0.09 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.04 3hkp h ILE 37 Cb 0.36 0.42 -0.07 0.00 -0.74 0.00 0.00 36.82 36.79 3hkp h ILE 37 CO 0.01 0.00 0.63 0.00 0.00 0.00 0.00 178.15 178.79 3hkp h ALA 38 N -0.02 1.48 -0.05 1.87 0.00 -0.45 -0.07 119.26 122.03 3hkp h ALA 38 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hkp h ALA 38 Cb 0.55 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3hkp h ALA 38 CO -0.04 0.33 -0.01 -0.22 0.00 0.00 0.00 179.25 179.31 3hkp h LYS 39 N 1.07 0.09 0.00 0.00 3.64 -0.98 0.24 116.57 120.63 3hkp h LYS 39 Ca 0.45 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.67 3hkp h LYS 39 Cb 0.31 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 3hkp h LYS 39 CO -0.20 0.45 -0.60 0.38 -2.27 0.00 0.00 179.45 177.21 3hkp h ASP 40 N -0.27 0.00 0.20 4.20 -0.00 -1.34 0.21 116.42 119.42 3hkp h ASP 40 Ca 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.03 3hkp h ASP 40 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.75 3hkp h ASP 40 CO 0.01 0.60 -0.10 0.00 -0.00 0.00 0.00 179.24 179.74 3hkp h ALA 41 N 1.40 -0.27 -0.81 4.15 0.00 -0.84 0.12 119.26 123.02 3hkp h ALA 41 Ca -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 3hkp h ALA 41 Cb 1.15 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 3hkp h ALA 41 CO 0.08 -0.49 0.43 -0.07 0.00 0.00 0.00 179.25 179.19 3hkp h LEU 42 N -0.59 1.01 -0.67 0.00 3.38 -0.53 -1.41 115.31 116.52 3hkp h LEU 42 Ca -0.03 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 3hkp h LEU 42 Cb 0.43 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3hkp h LEU 42 CO 0.05 0.82 0.07 1.23 0.09 0.00 0.00 178.44 180.70 3hkp h GLY 43 N 1.16 1.20 1.04 0.83 0.00 -0.50 -0.60 103.07 106.19 3hkp h GLY 43 Ca 0.28 -0.82 -0.09 0.00 0.00 0.00 0.00 47.33 46.70 3hkp h GLY 43 CO -0.04 0.76 -0.03 0.00 0.00 0.00 0.00 176.54 177.23 3hkp h ALA 44 N 1.04 0.71 -0.52 3.60 0.00 -0.47 -0.48 119.26 123.14 3hkp h ALA 44 Ca 0.20 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3hkp h ALA 44 Cb 0.48 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3hkp h ALA 44 CO 0.02 0.55 -0.09 -0.07 0.00 0.00 0.00 179.25 179.65 3hkp h LEU 45 N 0.81 0.96 -0.62 0.00 4.07 -1.01 -1.50 115.31 118.02 3hkp h LEU 45 Ca 0.14 -0.30 -0.11 0.00 0.08 0.00 0.00 57.88 57.69 3hkp h LEU 45 Cb 0.57 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.03 3hkp h LEU 45 CO 0.03 1.06 -0.10 0.78 -1.08 0.00 0.00 178.44 179.14 3hkp h ASN 46 N 0.86 0.99 -0.68 -0.43 -0.26 -0.96 -2.09 115.58 113.01 3hkp h ASN 46 Ca 0.14 -0.32 0.07 0.00 -0.56 0.00 0.00 56.30 55.64 3hkp h ASN 46 Cb 0.64 -0.27 -0.06 0.00 -1.06 0.00 0.00 38.32 37.57 3hkp h ASN 46 CO 0.04 1.09 0.35 0.44 -1.06 0.00 0.00 177.43 178.30 3hkp h ASP 47 N 0.89 0.49 -0.73 5.81 3.45 -0.92 -1.68 116.42 123.72 3hkp h ASP 47 Ca 0.14 0.04 -0.01 0.00 0.43 0.00 0.00 57.03 57.64 3hkp h ASP 47 Cb 0.65 -0.05 -0.04 0.00 -0.56 0.00 0.00 39.33 39.34 3hkp h ASP 47 CO 0.04 0.30 0.44 0.58 -1.57 0.00 0.00 179.24 179.04 3hkp h VAL 48 N 0.63 1.21 -0.30 -1.35 2.07 -0.88 0.12 116.25 117.75 3hkp h VAL 48 Ca 0.32 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 67.40 3hkp h VAL 48 Cb 0.27 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 3hkp h VAL 48 CO -0.22 0.22 0.11 0.40 0.02 0.00 0.00 177.57 178.10 3hkp h ILE 49 N 1.00 0.93 -0.30 4.57 2.04 -0.99 -1.45 117.51 123.32 3hkp h ILE 49 Ca 0.26 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 66.00 3hkp h ILE 49 Cb -0.03 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 3hkp h ILE 49 CO -0.05 0.05 0.04 -0.07 0.00 0.00 0.00 178.15 178.12 3hkp h LEU 50 N 0.25 0.49 -0.32 1.44 3.38 -1.13 0.10 115.31 119.52 3hkp h LEU 50 Ca 0.13 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 57.88 3hkp h LEU 50 Cb 0.09 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 3hkp h LEU 50 CO -0.13 0.63 0.08 0.50 0.09 0.00 0.00 178.44 179.62 3hkp h LYS 51 N 0.32 0.19 -0.01 1.13 3.64 -0.64 -2.81 116.57 118.40 3hkp h LYS 51 Ca 0.09 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3hkp h LYS 51 Cb 0.36 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3hkp h LYS 51 CO 0.01 0.13 -0.28 0.72 -2.27 0.00 0.00 179.45 177.76 3hkp n HIS 52 N -5.07 0.00 -3.44 1.91 8.25 -0.56 -4.97 115.22 111.34 3hkp n HIS 52 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.28 3hkp n HIS 52 Cb 0.13 -0.14 0.09 0.00 1.12 0.00 0.00 29.99 31.18 3hkp n HIS 52 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hkp n GLY 53 N 1.36 -0.38 3.68 -1.41 0.00 0.22 -4.92 105.19 103.74 3hkp n GLY 53 Ca 0.11 0.12 -0.45 0.00 0.00 0.00 0.00 46.02 45.81 3hkp n GLY 53 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hkp n VAL 54 N -4.25 0.04 -2.86 1.61 0.31 -0.39 -4.96 118.33 107.82 3hkp n VAL 54 Ca -0.23 -0.01 -0.23 0.00 -0.01 0.00 0.00 64.34 63.86 3hkp n VAL 54 Cb 0.65 -1.71 0.02 0.00 -0.91 0.00 0.00 33.84 31.89 3hkp n VAL 54 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3hkp s THR 55 N 1.18 3.72 0.16 2.52 -4.23 -1.26 -4.92 115.64 112.81 3hkp s THR 55 Ca 0.78 -0.47 -0.16 0.00 -1.18 0.00 0.00 61.69 60.66 3hkp s THR 55 Cb -0.62 -3.39 0.03 0.00 1.34 0.00 0.00 72.50 69.85 3hkp s THR 55 CO 0.37 -0.29 1.75 1.88 -0.54 0.00 0.00 174.62 177.79 3hkp h TYR 56 N 0.27 0.22 -0.81 3.99 -1.99 -1.99 0.42 116.97 117.09 3hkp h TYR 56 Ca -0.45 0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.36 3hkp h TYR 56 Cb 1.26 -0.05 -0.05 0.00 2.00 0.00 0.00 36.73 39.89 3hkp h TYR 56 CO 0.44 0.09 0.53 -1.35 -0.00 0.00 0.00 178.16 177.87 3hkp h PRO 57 N 0.28 0.85 -0.37 4.88 0.11 -2.00 -1.06 132.00 134.68 3hkp h PRO 57 Ca 0.16 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.12 3hkp h PRO 57 Cb 0.14 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 3hkp h PRO 57 CO -0.17 0.56 -0.17 0.93 -0.21 0.00 0.00 178.00 178.94 3hkp h GLU 58 N 0.87 0.76 -0.46 1.05 5.08 -1.83 -2.17 114.58 117.88 3hkp h GLU 58 Ca 0.35 -0.33 0.06 0.00 -1.00 0.00 0.00 59.36 58.44 3hkp h GLU 58 Cb 0.24 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 3hkp h GLU 58 CO -0.12 0.94 0.16 -0.92 -1.00 0.00 0.00 179.01 178.07 3hkp h TYR 59 N 0.55 0.29 -0.71 4.33 3.20 -0.44 0.78 116.97 124.97 3hkp h TYR 59 Ca 0.08 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.99 3hkp h TYR 59 Cb 0.71 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 3hkp h TYR 59 CO 0.06 0.10 0.47 0.00 -1.64 0.00 0.00 178.16 177.15 3hkp h ARG 60 N 0.33 0.92 -0.61 1.82 3.08 -1.09 0.65 114.38 119.49 3hkp h ARG 60 Ca 0.22 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 3hkp h ARG 60 Cb 0.22 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3hkp h ARG 60 CO -0.22 0.61 0.24 0.28 -1.07 0.00 0.00 179.97 179.81 3hkp h VAL 61 N 0.95 1.23 -0.30 2.04 2.07 -1.03 -1.60 116.25 119.61 3hkp h VAL 61 Ca 0.26 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3hkp h VAL 61 Cb -0.10 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 3hkp h VAL 61 CO -0.06 0.29 0.20 0.15 0.02 0.00 0.00 177.57 178.17 3hkp h PHE 62 N 0.86 0.38 -0.52 1.57 -0.00 -0.50 -0.19 116.94 118.54 3hkp h PHE 62 Ca 0.20 0.01 0.01 0.00 -0.00 0.00 0.00 57.97 58.19 3hkp h PHE 62 Cb 0.22 -0.13 -0.03 0.00 -0.00 0.00 0.00 35.95 36.01 3hkp h PHE 62 CO 0.01 0.25 0.34 -0.22 -0.00 0.00 0.00 178.31 178.69 3hkp h LYS 63 N 0.41 0.68 -0.49 1.11 3.64 -0.74 -1.63 116.57 119.55 3hkp h LYS 63 Ca 0.11 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 3hkp h LYS 63 Cb -0.04 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 3hkp h LYS 63 CO -0.02 0.45 0.01 0.37 -2.27 0.00 0.00 179.45 177.98 3hkp h GLN 64 N 0.70 0.81 -0.59 1.90 5.75 -1.02 -2.69 115.11 119.97 3hkp h GLN 64 Ca 0.19 -0.22 -0.04 0.00 -0.15 0.00 0.00 58.65 58.43 3hkp h GLN 64 Cb -0.08 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.35 3hkp h GLN 64 CO -0.04 0.81 0.19 2.35 -2.65 0.00 0.00 178.83 179.49 3hkp h TRP 65 N 0.76 0.94 -0.42 3.99 7.01 -0.74 0.17 115.95 127.66 3hkp h TRP 65 Ca 0.15 -0.09 0.06 0.00 2.11 0.00 0.00 58.89 61.12 3hkp h TRP 65 Cb 0.45 -0.27 -0.06 0.00 -2.10 0.00 0.00 29.16 27.18 3hkp h TRP 65 CO 0.02 0.78 0.09 -0.07 -2.79 0.00 0.00 178.44 176.47 3hkp h LEU 66 N 0.83 0.02 -0.51 0.65 3.38 -1.19 -0.24 115.31 118.25 3hkp h LEU 66 Ca 0.19 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 3hkp h LEU 66 Cb 0.27 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3hkp h LEU 66 CO -0.01 0.05 0.26 0.40 0.09 0.00 0.00 178.44 179.22 3hkp h ILE 67 N 0.22 1.19 -0.79 1.22 2.04 -1.14 -2.51 117.51 117.74 3hkp h ILE 67 Ca 0.20 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 3hkp h ILE 67 Cb 0.24 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 3hkp h ILE 67 CO -0.26 0.21 0.44 0.44 0.00 0.00 0.00 178.15 178.98 3hkp h ASP 68 N 0.68 0.98 -0.47 1.72 3.32 -0.27 -1.61 116.42 120.77 3hkp h ASP 68 Ca 0.18 -0.09 0.06 0.00 0.02 0.00 0.00 57.03 57.20 3hkp h ASP 68 Cb 0.10 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.35 3hkp h ASP 68 CO -0.02 0.78 0.16 0.58 -1.72 0.00 0.00 179.24 179.02 3hkp h VAL 69 N 1.09 0.85 0.19 -1.35 2.07 -0.63 0.75 116.25 119.22 3hkp h VAL 69 Ca 0.28 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.67 3hkp h VAL 69 Cb 0.01 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 3hkp h VAL 69 CO -0.05 0.06 -0.09 1.23 0.02 0.00 0.00 177.57 178.74 3hkp h GLY 70 N 0.34 -0.27 1.06 2.17 0.00 -1.10 -1.89 103.07 103.38 3hkp h GLY 70 Ca 0.22 0.10 0.11 0.00 0.00 0.00 0.00 47.33 47.76 3hkp h GLY 70 CO -0.23 -0.10 0.37 0.83 0.00 0.00 0.00 176.54 177.41 3hkp h GLU 71 N -0.47 0.22 -0.05 4.80 5.08 -1.07 -1.73 114.58 121.36 3hkp h GLU 71 Ca -0.03 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3hkp h GLU 71 Cb 0.36 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3hkp h GLU 71 CO 0.04 0.15 0.00 0.41 -1.00 0.00 0.00 179.01 178.61 3hkp n GLY 72 N -1.56 -0.32 2.49 -3.84 0.00 0.24 -4.94 105.19 97.26 3hkp n GLY 72 Ca 0.09 -0.32 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 3hkp n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hkp n GLY 73 N 1.05 0.64 1.55 -0.02 0.00 -0.65 -4.93 105.19 102.83 3hkp n GLY 73 Ca 0.18 -0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.30 3hkp n GLY 73 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hkp n GLU 74 N -2.73 3.47 0.09 1.61 1.02 -0.73 -4.56 120.64 118.81 3hkp n GLU 74 Ca -0.23 -2.83 -0.12 0.00 -0.02 0.00 0.00 57.16 53.96 3hkp n GLU 74 Cb 0.69 -1.81 -0.05 0.00 -0.02 0.00 0.00 31.44 30.24 3hkp n GLU 74 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 3hkp h TRP 75 N 4.22 -0.51 -0.48 -0.32 4.06 -1.91 0.13 115.95 121.14 3hkp h TRP 75 Ca 0.00 0.01 0.05 0.00 2.06 0.00 0.00 58.89 61.01 3hkp h TRP 75 Cb 1.33 0.22 -0.04 0.00 -1.00 0.00 0.00 29.16 29.66 3hkp h TRP 75 CO 0.70 -0.28 0.22 -1.35 -3.56 0.00 0.00 178.44 174.17 3hkp h PRO 76 N -0.35 0.43 0.56 0.49 0.11 -1.97 -0.46 132.00 130.81 3hkp h PRO 76 Ca 0.04 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 3hkp h PRO 76 Cb 0.39 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 3hkp h PRO 76 CO -0.13 0.28 -0.33 1.25 -0.21 0.00 0.00 178.00 178.86 3hkp h LEU 77 N 0.44 -0.82 -0.40 2.35 5.85 -1.79 -1.78 115.31 119.16 3hkp h LEU 77 Ca 0.21 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.99 3hkp h LEU 77 Cb 0.15 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3hkp h LEU 77 CO -0.17 -0.53 0.26 0.15 -0.34 0.00 0.00 178.44 177.81 3hkp h PHE 78 N -0.84 0.48 -0.23 1.25 3.04 -0.55 -2.42 116.94 117.66 3hkp h PHE 78 Ca -0.07 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.84 3hkp h PHE 78 Cb 0.68 -0.16 -0.01 0.00 2.56 0.00 0.00 35.95 39.02 3hkp h PHE 78 CO -0.09 0.30 -0.07 -0.07 -2.02 0.00 0.00 178.31 176.36 3hkp h LEU 79 N 0.52 0.46 -1.45 0.59 3.38 -1.01 -0.59 115.31 117.22 3hkp h LEU 79 Ca 0.15 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 57.76 3hkp h LEU 79 Cb -0.04 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3hkp h LEU 79 CO -0.05 0.74 0.39 0.44 0.09 0.00 0.00 178.44 180.05 3hkp h ASP 80 N 0.19 0.63 0.21 -0.43 3.32 -1.30 0.69 116.42 119.73 3hkp h ASP 80 Ca 0.06 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 3hkp h ASP 80 Cb 0.54 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3hkp h ASP 80 CO 0.03 0.44 -0.10 0.58 -1.72 0.00 0.00 179.24 178.47 3hkp h VAL 81 N 0.74 0.81 0.00 -1.35 2.07 -1.21 -3.34 116.25 113.97 3hkp h VAL 81 Ca 0.23 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.85 3hkp h VAL 81 Cb 0.00 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3hkp h VAL 81 CO -0.06 0.18 -1.14 0.49 0.02 0.00 0.00 177.57 177.06 3hkp n PHE 82 N -5.01 0.04 0.00 1.57 3.72 -0.25 -4.25 117.46 113.29 3hkp n PHE 82 Ca -0.08 0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 3hkp n PHE 82 Cb 0.26 -0.17 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 3hkp n PHE 82 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hkp n ILE 83 N -1.70 0.00 -0.25 4.37 2.08 0.23 -4.85 119.36 119.24 3hkp n ILE 83 Ca 0.02 0.00 0.18 0.00 0.56 0.00 0.00 62.75 63.52 3hkp n ILE 83 Cb 0.39 -0.70 0.49 0.00 -0.75 0.00 0.00 39.64 39.07 3hkp n ILE 83 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 3hkp h GLU 84 N 0.00 0.44 -0.49 0.38 4.81 -1.29 -1.65 114.58 116.79 3hkp h GLU 84 Ca 0.00 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3hkp h GLU 84 Cb 0.89 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.14 3hkp h GLU 84 CO 0.00 0.29 0.33 1.12 -0.73 0.00 0.00 179.01 180.01 3hkp h HIS 85 N 0.45 0.47 -0.31 0.92 2.07 -1.83 0.14 115.15 117.06 3hkp h HIS 85 Ca 0.48 0.01 -0.12 0.00 -2.85 0.00 0.00 60.37 57.89 3hkp h HIS 85 Cb 1.13 -0.16 -0.01 0.00 2.57 0.00 0.00 27.41 30.94 3hkp h HIS 85 CO -0.00 0.26 -0.32 0.77 -3.07 0.00 0.00 177.93 175.58 3hkp h SER 86 N 0.48 0.70 -0.30 3.10 0.02 -1.65 -1.22 113.55 114.67 3hkp h SER 86 Ca 0.21 -0.28 -0.16 0.00 -0.84 0.00 0.00 61.79 60.71 3hkp h SER 86 Cb 0.21 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 3hkp h SER 86 CO -0.05 0.97 -0.42 0.58 -1.14 0.00 0.00 176.83 176.76 3hkp h VAL 87 N 0.57 1.28 -0.53 2.27 2.07 -0.85 -2.12 116.25 118.94 3hkp h VAL 87 Ca 0.07 -1.60 -0.11 0.00 0.82 0.00 0.00 66.70 65.87 3hkp h VAL 87 Cb 0.82 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 3hkp h VAL 87 CO 0.07 0.53 -0.10 -0.08 0.02 0.00 0.00 177.57 178.01 3hkp h GLU 88 N 0.70 1.01 -0.96 1.57 4.22 -1.10 -2.51 114.58 117.51 3hkp h GLU 88 Ca 0.05 -0.37 0.19 0.00 0.08 0.00 0.00 59.36 59.30 3hkp h GLU 88 Cb 1.01 -0.06 -0.11 0.00 0.50 0.00 0.00 28.75 30.09 3hkp h GLU 88 CO 0.10 1.06 0.56 1.49 -2.18 0.00 0.00 179.01 180.03 3hkp h GLU 89 N 0.88 0.67 0.58 1.92 4.81 -0.93 0.26 114.58 122.78 3hkp h GLU 89 Ca 0.14 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 3hkp h GLU 89 Cb 0.67 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 29.90 3hkp h GLU 89 CO 0.05 0.45 -0.28 0.28 -0.73 0.00 0.00 179.01 178.77 3hkp h VAL 90 N 0.69 0.43 -0.55 0.32 2.07 -1.30 -3.12 116.25 114.79 3hkp h VAL 90 Ca 0.56 -0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.15 3hkp h VAL 90 Cb 0.89 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 3hkp h VAL 90 CO -0.40 0.00 0.37 0.25 0.02 0.00 0.00 177.57 177.81 3hkp h LEU 91 N -0.79 0.40 -2.10 2.57 5.85 -0.80 -1.66 115.31 118.79 3hkp h LEU 91 Ca -0.08 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 3hkp h LEU 91 Cb 0.60 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 3hkp h LEU 91 CO 0.13 0.25 -0.05 0.00 -0.34 0.00 0.00 178.44 178.43 3hkp h ALA 92 N 1.71 1.65 -0.11 1.25 0.00 -0.48 -2.95 119.26 120.33 3hkp h ALA 92 Ca 0.24 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 3hkp h ALA 92 Cb 0.38 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3hkp h ALA 92 CO -0.07 0.07 -0.13 0.00 0.00 0.00 0.00 179.25 179.12 3hkp h ARG 93 N 0.00 0.17 -0.08 0.00 3.08 -1.29 -2.61 114.38 113.65 3hkp h ARG 93 Ca -0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3hkp h ARG 93 Cb 0.12 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3hkp h ARG 93 CO 0.01 0.31 0.00 -1.13 -1.07 0.00 0.00 179.97 178.09 3hkp n SER 94 N -4.30 2.48 -4.59 7.04 3.41 -1.11 -4.94 113.62 111.61 3hkp n SER 94 Ca -0.01 -1.82 -0.34 0.00 -0.26 0.00 0.00 58.87 56.44 3hkp n SER 94 Cb 0.25 -0.04 -0.11 0.00 -0.26 0.00 0.00 64.21 64.05 3hkp n SER 94 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3hkp s ARG 95 N -1.92 2.75 -0.01 4.33 0.52 -0.99 -5.01 118.95 118.62 3hkp s ARG 95 Ca 0.33 -0.56 0.08 0.00 -0.52 0.00 0.00 55.73 55.07 3hkp s ARG 95 Cb 0.20 -2.60 -0.13 0.00 0.52 0.00 0.00 34.95 32.95 3hkp s ARG 95 CO 0.31 0.66 0.18 1.63 0.02 0.00 0.00 175.30 178.10 3hkp n LYS 96 N 2.14 0.33 0.00 3.54 5.02 -1.26 -4.99 118.16 122.94 3hkp n LYS 96 Ca -0.18 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.04 3hkp n LYS 96 Cb 0.53 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 34.34 3hkp n LYS 96 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hkp n GLY 97 N 2.05 -0.58 3.77 0.72 0.00 -1.26 -4.96 105.19 104.93 3hkp n GLY 97 Ca -0.02 -1.46 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 3hkp n GLY 97 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3hkp s THR 98 N 0.00 2.25 0.28 2.61 -1.32 0.62 -4.88 115.64 115.20 3hkp s THR 98 Ca 0.00 0.24 -0.30 0.00 -1.21 0.00 0.00 61.69 60.42 3hkp s THR 98 Cb 0.00 -3.14 -0.13 0.00 -1.51 0.00 0.00 72.50 67.72 3hkp s THR 98 CO 0.00 0.04 1.34 0.23 -2.21 0.00 0.00 174.62 174.03 3hkp n MET 99 N 0.17 2.03 -2.36 7.08 0.00 -1.26 -4.97 117.12 117.81 3hkp n MET 99 Ca 0.03 0.72 -0.24 0.00 0.00 0.00 0.00 57.70 58.20 3hkp n MET 99 Cb 0.41 -2.33 0.08 0.00 0.00 0.00 0.00 33.22 31.38 3hkp n MET 99 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3hkp s GLY 100 N 0.03 1.74 0.35 3.03 0.00 -1.26 -4.78 107.32 106.44 3hkp s GLY 100 Ca 0.63 -1.19 -0.02 0.00 0.00 0.00 0.00 44.72 44.14 3hkp s GLY 100 CO 0.55 -0.76 0.50 -1.26 0.00 0.00 0.00 173.10 172.13 3hkp n SER 101 N -2.83 -1.40 -4.75 1.64 2.88 -0.64 -4.85 113.62 103.67 3hkp n SER 101 Ca 0.10 -2.87 -0.34 0.00 -1.33 0.00 0.00 58.87 54.42 3hkp n SER 101 Cb 0.60 2.60 0.05 0.00 -0.75 0.00 0.00 64.21 66.71 3hkp n SER 101 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 3hkp s ILE 102 N -2.78 2.89 0.06 2.46 -4.36 -1.26 -4.27 121.20 113.94 3hkp s ILE 102 Ca 0.28 0.45 -0.15 0.00 -0.26 0.00 0.00 60.65 60.97 3hkp s ILE 102 Cb -0.01 -3.01 -0.22 0.00 1.25 0.00 0.00 42.46 40.46 3hkp s ILE 102 CO 0.20 -0.22 1.19 -0.08 0.24 0.00 0.00 174.94 176.27 3hkp h GLU 103 N 0.16 0.65 -0.87 0.37 4.81 -1.92 -3.44 114.58 114.34 3hkp h GLU 103 Ca -0.48 -0.66 0.10 0.00 -0.13 0.00 0.00 59.36 58.19 3hkp h GLU 103 Cb 1.27 0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.80 3hkp h GLU 103 CO 0.53 1.26 -0.17 0.41 -0.73 0.00 0.00 179.01 180.31 3hkp n GLY 104 N 1.01 -1.65 0.74 1.92 0.00 -1.26 -4.59 105.19 101.36 3hkp n GLY 104 Ca -0.10 -1.42 0.09 0.00 0.00 0.00 0.00 46.02 44.58 3hkp n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hkp n PRO 105 N -2.21 1.95 -0.07 1.61 -0.04 -1.26 -4.42 135.00 130.56 3hkp n PRO 105 Ca -0.00 -1.45 0.06 0.00 -0.04 0.00 0.00 63.50 62.06 3hkp n PRO 105 Cb 0.18 -1.38 0.10 0.00 -0.04 0.00 0.00 33.50 32.35 3hkp n PRO 105 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3hkp n TYR 106 N 0.67 0.08 -2.36 0.54 0.53 -1.26 -4.99 117.16 110.37 3hkp n TYR 106 Ca 0.16 -0.79 -0.41 0.00 -1.02 0.00 0.00 57.90 55.84 3hkp n TYR 106 Cb 0.38 -0.12 -0.04 0.00 -1.03 0.00 0.00 39.34 38.54 3hkp n TYR 106 CO 0.00 0.00 0.00 -0.47 -1.02 0.00 0.00 176.86 175.37 3hkp s TYR 107 N -2.11 3.41 -0.08 -0.72 5.04 -1.26 -5.04 117.35 116.59 3hkp s TYR 107 Ca 0.20 1.55 0.02 0.00 -2.44 0.00 0.00 57.07 56.41 3hkp s TYR 107 Cb 0.17 -3.42 0.01 0.00 0.35 0.00 0.00 41.96 39.07 3hkp s TYR 107 CO 0.03 -1.06 -0.14 0.42 -1.34 0.00 0.00 175.55 173.46 3hkp s ILE 108 N -0.88 1.30 0.79 3.14 -1.09 -1.26 -5.14 121.20 118.06 3hkp s ILE 108 Ca 0.48 -0.56 -0.12 0.00 -2.23 0.00 0.00 60.65 58.23 3hkp s ILE 108 Cb -0.34 -1.19 0.06 0.00 -1.58 0.00 0.00 42.46 39.41 3hkp s ILE 108 CO 0.43 0.40 1.11 -1.61 -1.23 0.00 0.00 174.94 174.03 3hkp s GLU 109 N 0.78 2.19 -1.63 2.79 2.02 -1.26 -4.07 118.70 119.52 3hkp s GLU 109 Ca -0.12 0.52 0.00 0.00 0.02 0.00 0.00 54.97 55.39 3hkp s GLU 109 Cb -0.16 -1.94 0.00 0.00 0.10 0.00 0.00 34.13 32.13 3hkp s GLU 109 CO 0.02 -1.52 0.00 -1.71 0.02 0.00 0.00 175.26 172.07 3hkp n ASN 110 N -3.35 -5.36 -4.75 -0.19 4.05 -1.26 -4.98 115.26 99.42 3hkp n ASN 110 Ca 0.07 0.03 -0.40 0.00 0.45 0.00 0.00 54.58 54.74 3hkp n ASN 110 Cb 0.57 -4.43 0.03 0.00 1.23 0.00 0.00 39.78 37.18 3hkp n ASN 110 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 3hkp n SER 111 N -1.49 3.11 -4.69 1.20 3.41 -1.26 -4.85 113.62 109.05 3hkp n SER 111 Ca -0.22 1.08 -0.44 0.00 -0.26 0.00 0.00 58.87 59.03 3hkp n SER 111 Cb 0.66 -1.59 -0.02 0.00 -0.26 0.00 0.00 64.21 63.00 3hkp n SER 111 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3hkp n PRO 112 N -0.41 2.24 -2.26 4.33 -0.02 -1.26 -3.66 135.00 133.97 3hkp n PRO 112 Ca 0.07 0.80 -0.40 0.00 -2.02 0.00 0.00 63.50 61.95 3hkp n PRO 112 Cb 0.42 -2.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.38 3hkp n PRO 112 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3hkp s GLU 113 N -0.37 4.33 0.10 -0.52 2.02 -1.26 -1.69 118.70 121.32 3hkp s GLU 113 Ca 0.67 2.00 0.06 0.00 0.02 0.00 0.00 54.97 57.73 3hkp s GLU 113 Cb -0.60 -2.98 -0.03 0.00 0.10 0.00 0.00 34.13 30.61 3hkp s GLU 113 CO 0.49 -0.13 -0.16 -0.51 0.02 0.00 0.00 175.26 174.97 3hkp s LEU 114 N -1.92 2.34 0.95 1.80 1.43 0.67 -4.88 118.68 119.06 3hkp s LEU 114 Ca 0.50 -0.72 -0.10 0.00 -1.03 0.00 0.00 54.13 52.78 3hkp s LEU 114 Cb -0.35 -0.64 0.16 0.00 0.03 0.00 0.00 46.19 45.39 3hkp s LEU 114 CO 0.46 -0.07 1.12 -0.81 0.23 0.00 0.00 176.35 177.27 3hkp n PRO 115 N 0.88 -0.66 0.10 1.29 -0.04 -1.26 -0.74 135.00 134.56 3hkp n PRO 115 Ca -0.18 -0.13 0.05 0.00 -0.04 0.00 0.00 63.50 63.20 3hkp n PRO 115 Cb 0.55 -2.35 0.49 0.00 -0.04 0.00 0.00 33.50 32.16 3hkp n PRO 115 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3hkp h SER 116 N -1.98 0.29 -3.57 3.54 4.64 -1.70 -3.34 113.55 111.44 3hkp h SER 116 Ca -0.45 -0.01 -0.65 0.00 -0.47 0.00 0.00 61.79 60.21 3hkp h SER 116 Cb 1.28 -0.07 -0.22 0.00 -0.31 0.00 0.00 62.40 63.07 3hkp h SER 116 CO 0.42 0.24 -0.63 -0.75 -0.87 0.00 0.00 176.83 175.23 3hkp s LYS 117 N -5.28 3.66 0.20 4.77 2.20 -1.26 0.10 119.74 124.13 3hkp s LYS 117 Ca -0.07 -0.48 -0.23 0.00 -0.36 0.00 0.00 55.97 54.83 3hkp s LYS 117 Cb 0.17 -3.26 0.05 0.00 -1.51 0.00 0.00 37.83 33.28 3hkp s LYS 117 CO 0.71 -0.12 0.80 0.00 -0.36 0.00 0.00 175.35 176.39 3hkp s THR 119 N -3.62 2.15 0.59 0.00 -1.32 -1.26 -0.69 115.64 111.50 3hkp s THR 119 Ca 0.10 -1.23 -0.20 0.00 -1.21 0.00 0.00 61.69 59.15 3hkp s THR 119 Cb -0.03 -1.79 -0.03 0.00 -1.51 0.00 0.00 72.50 69.13 3hkp s THR 119 CO 0.02 0.48 1.32 0.47 -2.21 0.00 0.00 174.62 174.69 3hkp n ASP 120 N 2.11 2.36 -4.75 8.08 8.00 -0.38 -4.94 116.55 127.02 3hkp n ASP 120 Ca -0.16 0.91 -0.42 0.00 0.71 0.00 0.00 54.79 55.83 3hkp n ASP 120 Cb 0.51 -1.56 -0.01 0.00 -0.02 0.00 0.00 41.12 40.04 3hkp n ASP 120 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3hkp n PRO 121 N -1.41 2.70 -3.69 -0.24 -0.02 -1.26 -4.82 135.00 126.26 3hkp n PRO 121 Ca 0.13 0.96 -0.10 0.00 -2.02 0.00 0.00 63.50 62.47 3hkp n PRO 121 Cb 0.46 -2.73 -0.04 0.00 -0.02 0.00 0.00 33.50 31.17 3hkp n PRO 121 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hkp s MET 122 N -0.88 1.29 0.47 -0.52 0.23 -1.26 0.07 119.30 118.70 3hkp s MET 122 Ca 0.61 -0.79 -0.01 0.00 -1.03 0.00 0.00 55.69 54.48 3hkp s MET 122 Cb -0.49 0.51 -0.00 0.00 -1.53 0.00 0.00 34.83 33.32 3hkp s MET 122 CO 0.52 -0.54 0.71 1.03 -2.03 0.00 0.00 175.02 174.71 3hkp s ARG 123 N -3.85 3.03 0.29 3.16 0.52 -1.26 -4.97 118.95 115.88 3hkp s ARG 123 Ca 0.07 -0.43 0.02 0.00 -0.52 0.00 0.00 55.73 54.87 3hkp s ARG 123 Cb -0.00 -2.52 0.57 0.00 0.52 0.00 0.00 34.95 33.53 3hkp s ARG 123 CO -0.06 -0.34 1.85 0.93 0.02 0.00 0.00 175.30 177.70 3hkp h GLU 124 N 0.31 0.95 -0.37 3.54 5.08 -2.02 -0.01 114.58 122.06 3hkp h GLU 124 Ca -0.46 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 57.80 3hkp h GLU 124 Cb 1.25 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 3hkp h GLU 124 CO 0.58 0.63 0.05 0.93 -1.00 0.00 0.00 179.01 180.20 3hkp h GLU 125 N 0.98 0.56 0.00 2.33 3.07 -2.02 -2.33 114.58 117.16 3hkp h GLU 125 Ca 0.47 -0.10 -0.05 0.00 -0.50 0.00 0.00 59.36 59.17 3hkp h GLU 125 Cb 0.46 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.27 3hkp h GLU 125 CO -0.24 0.54 -0.26 -0.44 -1.40 0.00 0.00 179.01 177.22 3hkp h ASP 126 N 0.54 0.00 0.74 1.42 3.45 -1.38 -2.61 116.42 118.57 3hkp h ASP 126 Ca 0.12 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.58 3hkp h ASP 126 Cb 0.27 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.04 3hkp h ASP 126 CO 0.00 0.26 0.00 -0.33 -1.57 0.00 0.00 179.24 177.60 3hkp h GLU 127 N 0.00 0.00 0.00 3.56 5.08 -0.99 -2.00 114.58 120.23 3hkp h GLU 127 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hkp h GLU 127 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 3hkp h GLU 127 CO 0.03 0.00 0.00 0.87 -1.00 0.00 0.00 179.01 178.91 3hkp h LYS 128 N 0.00 0.00 -6.51 2.33 6.56 -1.51 -3.46 116.57 113.98 3hkp h LYS 128 Ca 0.00 0.00 -0.53 0.00 -1.06 0.00 0.00 60.65 59.06 3hkp h LYS 128 Cb 0.37 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.00 3hkp h LYS 128 CO 0.00 0.00 -0.06 0.42 -2.06 0.00 0.00 179.45 177.75 3hkp s ILE 129 N -3.71 4.86 0.14 1.86 -1.09 -0.75 -5.00 121.20 117.50 3hkp s ILE 129 Ca -0.01 0.62 -0.31 0.00 -2.23 0.00 0.00 60.65 58.72 3hkp s ILE 129 Cb 0.10 -3.62 -0.11 0.00 -1.58 0.00 0.00 42.46 37.25 3hkp s ILE 129 CO 0.39 -0.09 1.81 0.28 -1.23 0.00 0.00 174.94 176.11 3hkp s THR 130 N -1.85 2.44 0.54 2.92 -1.32 -1.26 -4.83 115.64 112.29 3hkp s THR 130 Ca 0.49 0.04 -0.20 0.00 -1.21 0.00 0.00 61.69 60.81 3hkp s THR 130 Cb -0.11 -3.03 -0.06 0.00 -1.51 0.00 0.00 72.50 67.80 3hkp s THR 130 CO 0.20 0.00 1.14 -2.84 -2.21 0.00 0.00 174.62 170.91 3hkp s PRO 131 N 2.47 3.34 -0.13 7.08 0.02 -1.26 -1.41 135.00 145.10 3hkp s PRO 131 Ca 0.80 1.66 0.03 0.00 0.02 0.00 0.00 61.00 63.50 3hkp s PRO 131 Cb -0.47 -2.03 0.01 0.00 0.02 0.00 0.00 34.50 32.03 3hkp s PRO 131 CO 0.36 -0.87 -0.22 -1.17 -0.33 0.00 0.00 177.00 174.76 3hkp s LEU 132 N -3.77 2.08 -0.34 -5.54 2.96 -0.06 -1.15 118.68 112.86 3hkp s LEU 132 Ca 0.73 -0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 54.00 3hkp s LEU 132 Cb -0.25 -1.42 0.06 0.00 0.50 0.00 0.00 46.19 45.08 3hkp s LEU 132 CO 0.28 0.09 0.10 -0.69 -1.32 0.00 0.00 176.35 174.81 3hkp s VAL 133 N 0.75 3.53 -0.30 1.68 1.01 0.12 -0.81 120.40 126.38 3hkp s VAL 133 Ca -0.09 -1.35 -0.07 0.00 0.00 0.00 0.00 61.98 60.47 3hkp s VAL 133 Cb -0.16 -3.08 0.01 0.00 0.00 0.00 0.00 36.38 33.15 3hkp s VAL 133 CO -0.00 -0.25 0.09 0.12 0.00 0.00 0.00 175.10 175.05 3hkp s PHE 134 N 1.33 3.15 0.25 5.22 5.36 0.67 -1.64 117.98 132.32 3hkp s PHE 134 Ca -0.01 -0.90 0.11 0.00 -0.96 0.00 0.00 56.93 55.17 3hkp s PHE 134 Cb -0.20 -2.27 -0.05 0.00 -0.34 0.00 0.00 43.02 40.16 3hkp s PHE 134 CO 0.01 -0.55 -0.19 -1.12 -1.46 0.00 0.00 175.22 171.90 3hkp s SER 135 N 1.52 3.36 0.00 6.13 0.01 -0.38 0.13 113.70 124.47 3hkp s SER 135 Ca 0.03 -1.00 0.00 0.00 1.31 0.00 0.00 55.95 56.29 3hkp s SER 135 Cb -0.17 -0.26 0.00 0.00 0.21 0.00 0.00 66.02 65.80 3hkp s SER 135 CO 0.03 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.30 3hkp n GLY 136 N -0.44 -1.34 2.98 3.44 0.00 -0.95 -0.24 105.19 108.63 3hkp n GLY 136 Ca -0.07 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 3hkp n GLY 136 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hkp s GLN 137 N -1.82 0.19 -0.25 1.61 0.74 -1.25 -1.43 119.66 117.43 3hkp s GLN 137 Ca 0.00 -0.09 -0.14 0.00 0.05 0.00 0.00 55.36 55.18 3hkp s GLN 137 Cb 0.00 0.08 -0.04 0.00 1.10 0.00 0.00 33.01 34.15 3hkp s GLN 137 CO 0.00 -0.03 0.34 0.08 -0.55 0.00 0.00 175.29 175.13 3hkp s VAL 138 N -0.42 5.21 0.24 1.34 1.01 0.15 -0.83 120.40 127.10 3hkp s VAL 138 Ca -0.05 0.52 0.04 0.00 0.00 0.00 0.00 61.98 62.50 3hkp s VAL 138 Cb -0.03 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 3hkp s VAL 138 CO 0.00 0.20 -0.03 0.42 0.00 0.00 0.00 175.10 175.70 3hkp s THR 139 N 1.80 1.22 0.38 3.92 -4.23 0.20 -0.67 115.64 118.25 3hkp s THR 139 Ca 0.14 -2.06 -0.06 0.00 -1.18 0.00 0.00 61.69 58.53 3hkp s THR 139 Cb -0.15 -2.33 0.09 0.00 1.34 0.00 0.00 72.50 71.44 3hkp s THR 139 CO 0.09 -0.35 0.46 -0.90 -0.54 0.00 0.00 174.62 173.38 3hkp n ASP 140 N -0.45 -0.31 0.24 3.99 5.68 -0.03 -0.71 116.55 124.96 3hkp n ASP 140 Ca -0.06 -1.07 0.16 0.00 -0.50 0.00 0.00 54.79 53.32 3hkp n ASP 140 Cb 0.63 -0.37 0.74 0.00 -1.14 0.00 0.00 41.12 40.99 3hkp n ASP 140 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3hkp h LEU 141 N 0.00 0.00 -1.74 -2.12 4.07 -1.90 -1.65 115.31 111.97 3hkp h LEU 141 Ca -0.16 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.80 3hkp h LEU 141 Cb 0.44 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.18 3hkp h LEU 141 CO 0.11 0.00 -0.07 0.47 -1.08 0.00 0.00 178.44 177.87 3hkp n ASP 142 N -2.74 2.75 0.00 -0.43 8.00 -1.26 -4.97 116.55 117.90 3hkp n ASP 142 Ca -0.00 -1.87 0.00 0.00 0.71 0.00 0.00 54.79 53.62 3hkp n ASP 142 Cb 0.19 0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 3hkp n ASP 142 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hkp n GLY 143 N 1.29 0.75 3.73 0.44 0.00 -0.62 -5.05 105.19 105.74 3hkp n GLY 143 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3hkp n GLY 143 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hkp s ASN 144 N -2.50 7.05 0.33 1.61 -0.87 -1.26 -4.78 114.94 114.53 3hkp s ASN 144 Ca 0.00 2.22 -0.29 0.00 -1.57 0.00 0.00 52.86 53.22 3hkp s ASN 144 Cb 0.00 -2.60 -0.10 0.00 -0.02 0.00 0.00 41.25 38.53 3hkp s ASN 144 CO 0.00 -0.42 1.29 -0.83 -2.57 0.00 0.00 177.10 174.57 3hkp s GLY 145 N 0.37 3.00 -0.19 0.66 0.00 -1.26 -0.85 107.32 109.04 3hkp s GLY 145 Ca 0.55 1.23 -0.05 0.00 0.00 0.00 0.00 44.72 46.45 3hkp s GLY 145 CO 0.35 1.87 0.00 1.08 0.00 0.00 0.00 173.10 176.41 3hkp s LEU 146 N -1.81 3.33 0.53 0.66 1.43 0.15 -4.84 118.68 118.14 3hkp s LEU 146 Ca 0.49 -0.16 -0.16 0.00 -1.03 0.00 0.00 54.13 53.27 3hkp s LEU 146 Cb -0.39 -1.84 -0.07 0.00 0.03 0.00 0.00 46.19 43.92 3hkp s LEU 146 CO 0.52 0.09 0.99 0.00 0.23 0.00 0.00 176.35 178.18 3hkp s ALA 147 N 0.85 3.05 0.00 4.21 0.00 -1.25 -2.94 121.76 125.68 3hkp s ALA 147 Ca 0.01 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.14 3hkp s ALA 147 Cb -0.14 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.86 3hkp s ALA 147 CO 0.02 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.88 3hkp n GLY 148 N -1.65 0.57 3.83 0.00 0.00 -1.26 -4.46 105.19 102.22 3hkp n GLY 148 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 3hkp n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hkp s ALA 149 N -2.18 3.24 -0.01 4.61 0.00 -1.26 -4.35 121.76 121.81 3hkp s ALA 149 Ca 0.00 0.21 0.04 0.00 0.00 0.00 0.00 51.96 52.21 3hkp s ALA 149 Cb 0.00 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.18 3hkp s ALA 149 CO 0.00 0.26 -0.12 0.15 0.00 0.00 0.00 175.76 176.05 3hkp s LYS 150 N -2.80 0.92 -0.27 0.00 1.02 -0.12 -1.26 119.74 117.23 3hkp s LYS 150 Ca 0.54 -0.43 0.03 0.00 0.02 0.00 0.00 55.97 56.13 3hkp s LYS 150 Cb -0.12 -0.89 0.06 0.00 -0.52 0.00 0.00 37.83 36.37 3hkp s LYS 150 CO 0.17 0.24 -0.09 0.08 -0.92 0.00 0.00 175.35 174.83 3hkp s VAL 151 N -0.32 2.20 -0.26 3.17 1.01 0.51 -1.62 120.40 125.09 3hkp s VAL 151 Ca 0.04 -1.71 -0.15 0.00 0.00 0.00 0.00 61.98 60.16 3hkp s VAL 151 Cb -0.05 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 3hkp s VAL 151 CO -0.00 -0.09 0.38 -1.61 0.00 0.00 0.00 175.10 173.78 3hkp s GLU 152 N 1.08 4.04 -0.06 2.72 2.02 0.55 0.26 118.70 129.32 3hkp s GLU 152 Ca -0.07 0.07 0.06 0.00 0.02 0.00 0.00 54.97 55.05 3hkp s GLU 152 Cb -0.20 -3.64 -0.01 0.00 0.10 0.00 0.00 34.13 30.39 3hkp s GLU 152 CO -0.05 -0.24 -0.23 -1.17 0.02 0.00 0.00 175.26 173.59 3hkp s LEU 153 N 1.96 2.03 0.01 1.80 2.96 -0.72 -0.94 118.68 125.78 3hkp s LEU 153 Ca 0.16 -0.47 -0.13 0.00 -0.22 0.00 0.00 54.13 53.47 3hkp s LEU 153 Cb -0.16 -1.27 0.02 0.00 0.50 0.00 0.00 46.19 45.29 3hkp s LEU 153 CO 0.09 0.22 0.27 -1.66 -1.32 0.00 0.00 176.35 173.95 3hkp s TRP 154 N -0.09 -0.11 0.07 5.38 -2.14 -0.58 -1.77 118.94 119.71 3hkp s TRP 154 Ca -0.04 0.08 -0.27 0.00 2.66 0.00 0.00 56.10 58.52 3hkp s TRP 154 Cb -0.13 0.06 0.08 0.00 -3.10 0.00 0.00 33.47 30.38 3hkp s TRP 154 CO 0.04 -0.41 0.97 -3.38 -2.66 0.00 0.00 176.95 171.51 3hkp s HIS 155 N -1.80 -0.19 0.45 1.66 -3.43 -1.18 -0.65 115.29 110.14 3hkp s HIS 155 Ca -0.11 -0.03 -0.20 0.00 -0.80 0.00 0.00 55.06 53.92 3hkp s HIS 155 Cb -0.04 0.59 -0.10 0.00 -1.43 0.00 0.00 32.58 31.60 3hkp s HIS 155 CO 0.01 -0.66 0.96 0.00 -2.00 0.00 0.00 174.74 173.05 3hkp s ALA 156 N -3.12 3.03 1.05 -1.38 0.00 -1.26 -4.78 121.76 115.29 3hkp s ALA 156 Ca 0.10 0.37 -0.15 0.00 0.00 0.00 0.00 51.96 52.28 3hkp s ALA 156 Cb -0.01 -3.15 0.21 0.00 0.00 0.00 0.00 23.12 20.17 3hkp s ALA 156 CO -0.02 0.03 1.13 0.16 0.00 0.00 0.00 175.76 177.05 3hkp s ASP 157 N -2.34 2.27 0.34 0.00 3.84 -0.12 -4.70 116.67 115.96 3hkp s ASP 157 Ca 0.62 0.87 0.24 0.00 -0.00 0.00 0.00 52.55 54.28 3hkp s ASP 157 Cb -0.10 -1.33 1.24 0.00 -1.38 0.00 0.00 42.92 41.35 3hkp s ASP 157 CO 0.17 -3.31 1.73 -1.13 -0.00 0.00 0.00 175.17 172.63 3hkp h ASN 158 N -2.02 0.00 0.36 2.11 -1.24 -1.89 -0.46 115.58 112.42 3hkp h ASN 158 Ca -0.50 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.51 3hkp h ASN 158 Cb 1.31 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.36 3hkp h ASN 158 CO 0.50 0.00 -0.26 0.47 -1.29 0.00 0.00 177.43 176.85 3hkp n ASP 159 N -2.34 0.73 0.00 1.15 10.43 -1.26 -4.94 116.55 120.32 3hkp n ASP 159 Ca -0.01 -0.62 0.00 0.00 2.57 0.00 0.00 54.79 56.73 3hkp n ASP 159 Cb 0.08 0.08 0.00 0.00 1.84 0.00 0.00 41.12 43.11 3hkp n ASP 159 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hkp n GLY 160 N 1.36 0.65 3.66 0.44 0.00 -0.18 -5.04 105.19 106.09 3hkp n GLY 160 Ca 0.11 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 3hkp n GLY 160 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hkp s TYR 161 N -2.00 3.04 -0.19 1.61 1.51 -1.26 -4.86 117.35 115.21 3hkp s TYR 161 Ca 0.00 0.07 -0.08 0.00 -1.01 0.00 0.00 57.07 56.05 3hkp s TYR 161 Cb 0.00 -1.67 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 3hkp s TYR 161 CO 0.00 0.44 0.07 0.71 -1.11 0.00 0.00 175.55 175.66 3hkp s TYR 162 N -1.05 3.24 0.37 2.71 1.51 -1.26 -0.95 117.35 121.93 3hkp s TYR 162 Ca 0.18 0.05 -0.27 0.00 -1.01 0.00 0.00 57.07 56.02 3hkp s TYR 162 Cb -0.11 -2.10 -0.12 0.00 -0.11 0.00 0.00 41.96 39.52 3hkp s TYR 162 CO 0.09 0.11 1.26 -1.13 -1.11 0.00 0.00 175.55 174.77 3hkp n SER 163 N 3.68 2.55 0.00 2.29 3.41 -1.26 -1.34 113.62 122.96 3hkp n SER 163 Ca -0.16 1.17 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 3hkp n SER 163 Cb 0.52 -1.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.00 3hkp n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hkp n GLN 164 N 0.39 -0.09 -0.78 4.33 6.02 -1.26 -4.73 117.38 121.26 3hkp n GLN 164 Ca 0.06 0.02 0.01 0.00 -0.01 0.00 0.00 57.00 57.08 3hkp n GLN 164 Cb 0.37 -2.94 0.01 0.00 1.02 0.00 0.00 30.24 28.70 3hkp n GLN 164 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3hkp n PHE 165 N -2.32 0.00 -3.26 1.08 3.01 -0.45 -4.98 117.46 110.55 3hkp n PHE 165 Ca 0.00 -0.17 -0.04 0.00 1.01 0.00 0.00 57.45 58.25 3hkp n PHE 165 Cb 0.02 -0.08 -0.04 0.00 -0.01 0.00 0.00 39.48 39.37 3hkp n PHE 165 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hkp s ALA 166 N -0.08 -1.63 0.60 4.37 0.00 -1.08 -4.72 121.76 119.22 3hkp s ALA 166 Ca 0.11 1.06 0.29 0.00 0.00 0.00 0.00 51.96 53.41 3hkp s ALA 166 Cb 0.12 -2.02 1.50 0.00 0.00 0.00 0.00 23.12 22.72 3hkp s ALA 166 CO -0.05 -1.46 1.91 -1.35 0.00 0.00 0.00 175.76 174.81 3hkp h PRO 167 N 8.10 0.00 -0.00 0.00 0.11 -1.93 -1.92 132.00 136.35 3hkp h PRO 167 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3hkp h PRO 167 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3hkp h PRO 167 CO 0.25 0.00 -0.10 -2.39 -0.21 0.00 0.00 178.00 175.55 3hkp n HIS 168 N -3.64 0.00 -3.76 0.65 1.44 -1.26 -4.90 115.22 103.75 3hkp n HIS 168 Ca 0.07 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.41 3hkp n HIS 168 Cb 0.62 -0.37 -0.06 0.00 0.12 0.00 0.00 29.99 30.30 3hkp n HIS 168 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3hkp s LEU 169 N -2.83 4.41 0.76 2.39 1.43 -0.73 -5.07 118.68 119.04 3hkp s LEU 169 Ca 0.19 0.62 -0.15 0.00 -1.03 0.00 0.00 54.13 53.76 3hkp s LEU 169 Cb 0.19 -2.23 0.05 0.00 0.03 0.00 0.00 46.19 44.23 3hkp s LEU 169 CO 0.54 0.38 1.24 -2.84 0.23 0.00 0.00 176.35 175.89 3hkp s PRO 170 N -1.00 1.90 0.42 1.29 0.02 -1.26 -4.63 135.00 131.74 3hkp s PRO 170 Ca 0.18 1.87 0.23 0.00 0.02 0.00 0.00 61.00 63.29 3hkp s PRO 170 Cb -0.13 -1.79 0.68 0.00 0.02 0.00 0.00 34.50 33.27 3hkp s PRO 170 CO 0.07 -2.04 1.72 1.05 -0.33 0.00 0.00 177.00 177.47 3hkp h GLU 171 N -0.46 0.00 -0.35 5.54 4.11 -1.96 -2.47 114.58 118.98 3hkp h GLU 171 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3hkp h GLU 171 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 3hkp h GLU 171 CO 0.48 0.21 0.00 0.91 0.07 0.00 0.00 179.01 180.69 3hkp n TRP 172 N -3.26 0.98 -1.68 2.06 7.02 -1.26 -4.27 117.44 117.04 3hkp n TRP 172 Ca 0.01 -0.74 -0.47 0.00 -1.02 0.00 0.00 57.50 55.28 3hkp n TRP 172 Cb 0.50 -0.25 -0.04 0.00 -2.42 0.00 0.00 31.31 29.09 3hkp n TRP 172 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 3hkp n ASN 173 N 0.02 3.34 -3.11 -0.99 4.05 -0.93 -0.53 115.26 117.11 3hkp n ASN 173 Ca 0.20 1.01 -0.22 0.00 0.45 0.00 0.00 54.58 56.02 3hkp n ASN 173 Cb 0.81 -1.40 0.05 0.00 1.23 0.00 0.00 39.78 40.46 3hkp n ASN 173 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 3hkp n LEU 174 N 5.37 -2.89 -3.86 1.20 4.77 0.11 -4.43 117.00 117.27 3hkp n LEU 174 Ca 0.20 -0.36 -0.16 0.00 -0.03 0.00 0.00 56.01 55.67 3hkp n LEU 174 Cb 0.30 -2.93 -0.15 0.00 -2.33 0.00 0.00 43.42 38.30 3hkp n LEU 174 CO 0.69 0.36 -0.38 -0.13 -1.33 0.00 0.00 177.39 176.60 3hkp s ARG 175 N -5.86 0.28 0.20 3.23 0.52 0.31 -3.12 118.95 114.51 3hkp s ARG 175 Ca 0.38 0.00 -0.23 0.00 -0.52 0.00 0.00 55.73 55.36 3hkp s ARG 175 Cb -0.17 -0.39 0.05 0.00 0.52 0.00 0.00 34.95 34.96 3hkp s ARG 175 CO 0.47 -0.06 0.80 0.20 0.02 0.00 0.00 175.30 176.74 3hkp s GLY 176 N 0.59 -0.23 -0.29 -3.53 0.00 -0.73 -4.48 107.32 98.65 3hkp s GLY 176 Ca -0.06 0.04 -0.02 0.00 0.00 0.00 0.00 44.72 44.68 3hkp s GLY 176 CO -0.01 0.01 -0.01 -1.08 0.00 0.00 0.00 173.10 172.01 3hkp s THR 177 N -3.61 3.03 -0.21 0.90 -1.32 -0.68 -1.75 115.64 112.00 3hkp s THR 177 Ca 0.10 -1.26 -0.25 0.00 -1.21 0.00 0.00 61.69 59.07 3hkp s THR 177 Cb -0.03 -2.69 -0.01 0.00 -1.51 0.00 0.00 72.50 68.26 3hkp s THR 177 CO 0.02 -0.03 0.83 -0.63 -2.21 0.00 0.00 174.62 172.59 3hkp s ILE 178 N 1.29 4.86 -0.57 5.08 1.09 0.14 -0.24 121.20 132.84 3hkp s ILE 178 Ca -0.04 1.58 -0.24 0.00 -1.10 0.00 0.00 60.65 60.86 3hkp s ILE 178 Cb -0.19 -4.12 0.04 0.00 -1.06 0.00 0.00 42.46 37.14 3hkp s ILE 178 CO -0.02 -0.03 0.96 -0.63 -0.10 0.00 0.00 174.94 175.12 3hkp s ILE 179 N 2.57 4.36 0.60 2.92 -1.09 0.08 -0.36 121.20 130.27 3hkp s ILE 179 Ca 0.36 0.20 -0.16 0.00 -2.23 0.00 0.00 60.65 58.82 3hkp s ILE 179 Cb -0.16 -4.57 -0.03 0.00 -1.58 0.00 0.00 42.46 36.12 3hkp s ILE 179 CO 0.09 -1.19 1.08 0.00 -1.23 0.00 0.00 174.94 173.70 3hkp s ALA 180 N 4.03 2.66 1.01 9.38 0.00 -0.39 -1.89 121.76 136.56 3hkp s ALA 180 Ca 0.30 0.49 -0.01 0.00 0.00 0.00 0.00 51.96 52.74 3hkp s ALA 180 Cb -0.13 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.74 3hkp s ALA 180 CO 0.18 -0.93 0.08 -0.40 0.00 0.00 0.00 175.76 174.69 3hkp n ASP 181 N -2.03 -0.77 0.28 0.00 5.68 0.12 -4.62 116.55 115.21 3hkp n ASP 181 Ca 0.10 -0.68 0.13 0.00 -0.50 0.00 0.00 54.79 53.84 3hkp n ASP 181 Cb 0.52 -0.07 0.80 0.00 -1.14 0.00 0.00 41.12 41.24 3hkp n ASP 181 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3hkp h GLU 182 N 0.00 0.00 -0.04 0.11 3.07 -1.91 -0.83 114.58 114.98 3hkp h GLU 182 Ca -0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3hkp h GLU 182 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 3hkp h GLU 182 CO 0.02 0.07 0.00 0.39 -1.40 0.00 0.00 179.01 178.09 3hkp n GLU 183 N -3.77 2.09 -0.36 2.33 -0.58 -1.26 -3.81 120.64 115.28 3hkp n GLU 183 Ca -0.02 -1.59 0.00 0.00 -0.42 0.00 0.00 57.16 55.13 3hkp n GLU 183 Cb 0.17 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 3hkp n GLU 183 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hkp n GLY 184 N 1.29 0.80 3.91 0.62 0.00 -0.32 -3.54 105.19 107.95 3hkp n GLY 184 Ca 0.16 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 3hkp n GLY 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hkp s ARG 185 N -0.68 3.59 0.04 1.61 0.52 -1.26 0.33 118.95 123.10 3hkp s ARG 185 Ca 0.00 -0.15 -0.11 0.00 -0.52 0.00 0.00 55.73 54.95 3hkp s ARG 185 Cb 0.00 -2.80 0.01 0.00 0.52 0.00 0.00 34.95 32.68 3hkp s ARG 185 CO 0.00 0.39 0.23 1.52 0.02 0.00 0.00 175.30 177.46 3hkp s TYR 186 N -1.82 -0.01 -0.22 -0.53 1.13 -0.51 -0.70 117.35 114.68 3hkp s TYR 186 Ca 0.41 -0.17 -0.03 0.00 -1.41 0.00 0.00 57.07 55.86 3hkp s TYR 186 Cb -0.11 0.02 0.10 0.00 -1.10 0.00 0.00 41.96 40.87 3hkp s TYR 186 CO 0.27 -0.45 0.24 -2.00 -2.51 0.00 0.00 175.55 171.10 3hkp s GLU 187 N -2.50 0.23 -0.15 -3.49 2.12 0.12 -2.24 118.70 112.78 3hkp s GLU 187 Ca -0.05 0.14 0.01 0.00 0.36 0.00 0.00 54.97 55.43 3hkp s GLU 187 Cb -0.01 -1.06 0.02 0.00 0.26 0.00 0.00 34.13 33.34 3hkp s GLU 187 CO -0.03 -0.73 -0.19 0.42 -0.54 0.00 0.00 175.26 174.19 3hkp s ILE 188 N 2.34 1.88 -0.16 -3.70 1.01 0.12 -1.02 121.20 121.68 3hkp s ILE 188 Ca 0.08 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.81 3hkp s ILE 188 Cb -0.15 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.57 3hkp s ILE 188 CO -0.17 0.51 0.09 0.28 0.00 0.00 0.00 174.94 175.66 3hkp s THR 189 N 1.19 5.10 0.00 2.92 -1.32 0.14 -0.24 115.64 123.42 3hkp s THR 189 Ca 0.01 0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.55 3hkp s THR 189 Cb -0.14 -3.26 0.00 0.00 -1.51 0.00 0.00 72.50 67.59 3hkp s THR 189 CO -0.08 0.52 0.00 1.07 -2.21 0.00 0.00 174.62 173.92 3hkp n THR 190 N 2.90 0.00 -4.01 5.08 5.66 0.01 -1.25 114.28 122.67 3hkp n THR 190 Ca -0.18 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.58 3hkp n THR 190 Cb 0.53 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.27 3hkp n THR 190 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3hkp s ILE 191 N -1.90 4.96 -0.19 1.09 -4.36 -1.26 -0.88 121.20 118.67 3hkp s ILE 191 Ca 0.00 -0.95 -0.29 0.00 -0.26 0.00 0.00 60.65 59.15 3hkp s ILE 191 Cb 0.00 -3.60 -0.02 0.00 1.25 0.00 0.00 42.46 40.10 3hkp s ILE 191 CO 0.00 -0.18 1.35 -1.58 0.24 0.00 0.00 174.94 174.78 3hkp s GLN 192 N -3.42 4.11 0.60 0.37 2.00 -0.50 -4.63 119.66 118.19 3hkp s GLN 192 Ca 0.33 1.63 -0.19 0.00 -2.00 0.00 0.00 55.36 55.13 3hkp s GLN 192 Cb -0.10 -3.85 -0.03 0.00 0.80 0.00 0.00 33.01 29.83 3hkp s GLN 192 CO 0.27 -0.88 1.25 -2.14 -0.50 0.00 0.00 175.29 173.29 3hkp s PRO 193 N 3.84 2.90 0.27 1.67 0.02 -1.26 -4.85 135.00 137.58 3hkp s PRO 193 Ca 0.59 1.94 0.11 0.00 0.02 0.00 0.00 61.00 63.66 3hkp s PRO 193 Cb -0.22 -1.96 -0.05 0.00 0.02 0.00 0.00 34.50 32.29 3hkp s PRO 193 CO 0.20 -1.29 -0.15 0.00 -0.33 0.00 0.00 177.00 175.43 3hkp s ALA 194 N -1.50 2.86 0.49 -1.55 0.00 -1.26 -4.76 121.76 116.05 3hkp s ALA 194 Ca 0.78 -1.79 -0.21 0.00 0.00 0.00 0.00 51.96 50.74 3hkp s ALA 194 Cb -0.34 -0.42 -0.10 0.00 0.00 0.00 0.00 23.12 22.27 3hkp s ALA 194 CO 0.37 0.29 0.65 -2.30 0.00 0.00 0.00 175.76 174.77 3hkp n PRO 195 N -0.63 0.71 -4.00 0.00 -0.02 -1.26 -4.13 135.00 125.66 3hkp n PRO 195 Ca -0.06 0.27 -0.34 0.00 -2.02 0.00 0.00 63.50 61.35 3hkp n PRO 195 Cb 0.59 -1.73 -0.15 0.00 -0.02 0.00 0.00 33.50 32.19 3hkp n PRO 195 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3hkp s TYR 196 N -1.54 2.94 -0.15 6.00 6.14 -0.38 -4.82 117.35 125.53 3hkp s TYR 196 Ca 0.66 -1.42 -0.22 0.00 0.64 0.00 0.00 57.07 56.74 3hkp s TYR 196 Cb -0.52 -2.02 -0.03 0.00 0.42 0.00 0.00 41.96 39.82 3hkp s TYR 196 CO 0.55 -0.71 0.66 -1.14 0.64 0.00 0.00 175.55 175.56 3hkp s GLN 197 N 1.35 4.29 0.38 4.97 0.74 -1.26 0.00 119.66 130.15 3hkp s GLN 197 Ca 0.03 0.72 -0.26 0.00 0.05 0.00 0.00 55.36 55.90 3hkp s GLN 197 Cb -0.15 -3.53 -0.09 0.00 1.10 0.00 0.00 33.01 30.35 3hkp s GLN 197 CO -0.07 -0.13 1.22 0.96 -0.55 0.00 0.00 175.29 176.71 3hkp s ILE 198 N 1.53 2.98 -0.15 -2.34 -4.36 -0.28 -4.90 121.20 113.68 3hkp s ILE 198 Ca 0.32 0.87 -0.35 0.00 -0.26 0.00 0.00 60.65 61.23 3hkp s ILE 198 Cb -0.16 -3.51 -0.12 0.00 1.25 0.00 0.00 42.46 39.92 3hkp s ILE 198 CO 0.13 0.12 1.89 -2.65 0.24 0.00 0.00 174.94 174.66 3hkp n PRO 199 N 0.25 1.88 -0.06 0.37 -0.02 -1.26 -4.89 135.00 131.27 3hkp n PRO 199 Ca 0.03 0.68 0.08 0.00 -2.02 0.00 0.00 63.50 62.27 3hkp n PRO 199 Cb 0.45 -2.53 0.10 0.00 -0.02 0.00 0.00 33.50 31.50 3hkp n PRO 199 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3hkp n THR 200 N 5.26 0.23 0.91 3.45 -2.24 -1.26 -4.07 114.28 116.55 3hkp n THR 200 Ca 0.25 -0.61 0.07 0.00 -2.27 0.00 0.00 64.05 61.49 3hkp n THR 200 Cb 0.26 1.14 0.22 0.00 -2.10 0.00 0.00 70.33 69.85 3hkp n THR 200 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3hkp n ASP 201 N 0.91 1.93 -2.00 3.42 5.68 -1.26 -4.16 116.55 121.08 3hkp n ASP 201 Ca 0.11 -1.93 0.00 0.00 -0.50 0.00 0.00 54.79 52.47 3hkp n ASP 201 Cb 0.42 -0.21 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 3hkp n ASP 201 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hkp n GLY 202 N 1.11 2.96 0.36 6.12 0.00 -1.26 -4.96 105.19 109.52 3hkp n GLY 202 Ca 0.13 -2.17 0.05 0.00 0.00 0.00 0.00 46.02 44.04 3hkp n GLY 202 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hkp h PRO 203 N 0.00 0.88 -0.24 1.61 0.11 -1.90 -1.54 132.00 130.91 3hkp h PRO 203 Ca 0.00 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 3hkp h PRO 203 Cb 0.00 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.90 3hkp h PRO 203 CO 0.00 0.58 0.09 1.15 -0.21 0.00 0.00 178.00 179.60 3hkp h THR 204 N 0.90 1.18 -0.43 -1.15 2.02 -1.93 -0.36 112.91 113.15 3hkp h THR 204 Ca 0.34 -0.56 0.07 0.00 0.77 0.00 0.00 66.41 67.03 3hkp h THR 204 Cb 0.19 1.11 -0.06 0.00 -1.74 0.00 0.00 68.15 67.65 3hkp h THR 204 CO -0.12 0.18 0.10 1.23 0.37 0.00 0.00 175.52 177.28 3hkp h GLY 205 N 0.22 0.52 0.45 2.16 0.00 -1.62 -0.26 103.07 104.54 3hkp h GLY 205 Ca 0.08 -0.03 0.06 0.00 0.00 0.00 0.00 47.33 47.43 3hkp h GLY 205 CO -0.00 -0.04 -0.03 -1.61 0.00 0.00 0.00 176.54 174.85 3hkp h GLN 206 N 0.23 0.05 0.12 4.80 4.15 -1.10 0.79 115.11 124.15 3hkp h GLN 206 Ca 0.21 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.63 3hkp h GLN 206 Cb 0.25 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.92 3hkp h GLN 206 CO -0.27 0.03 -0.11 0.35 -1.93 0.00 0.00 178.83 176.91 3hkp h PHE 207 N 0.05 -0.28 0.13 3.99 3.57 -0.71 0.20 116.94 123.88 3hkp h PHE 207 Ca 0.15 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 3hkp h PHE 207 Cb 0.22 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.07 3hkp h PHE 207 CO -0.26 -0.17 -0.06 0.82 -2.23 0.00 0.00 178.31 176.41 3hkp h ILE 208 N -0.25 0.91 -0.98 1.41 2.04 -0.78 -3.02 117.51 116.85 3hkp h ILE 208 Ca 0.00 -0.13 0.08 0.00 1.00 0.00 0.00 64.86 65.81 3hkp h ILE 208 Cb 0.23 1.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 3hkp h ILE 208 CO -0.02 0.03 0.63 -0.08 0.00 0.00 0.00 178.15 178.71 3hkp h GLU 209 N -0.23 1.05 0.00 2.37 4.57 0.75 -1.99 114.58 121.10 3hkp h GLU 209 Ca -0.02 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 3hkp h GLU 209 Cb 0.18 -0.24 0.00 0.00 -0.16 0.00 0.00 28.75 28.54 3hkp h GLU 209 CO 0.03 0.69 0.00 0.00 -1.18 0.00 0.00 179.01 178.55 3hkp n ALA 210 N -2.37 1.38 -0.69 2.92 0.00 0.70 -1.70 120.51 120.75 3hkp n ALA 210 Ca 0.16 0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.80 3hkp n ALA 210 Cb 0.24 -1.35 0.15 0.00 0.00 0.00 0.00 19.45 18.50 3hkp n ALA 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hkp n GLN 211 N -2.22 2.39 -2.65 0.00 10.64 -0.93 -4.98 117.38 119.64 3hkp n GLN 211 Ca 0.01 -2.36 -0.21 0.00 -1.83 0.00 0.00 57.00 52.60 3hkp n GLN 211 Cb 0.14 -1.47 0.01 0.00 -0.86 0.00 0.00 30.24 28.06 3hkp n GLN 211 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3hkp n ASN 212 N -0.64 -5.88 -3.29 2.61 3.02 -0.69 -4.99 115.26 105.40 3hkp n ASN 212 Ca 0.14 -0.13 -0.21 0.00 -0.03 0.00 0.00 54.58 54.35 3hkp n ASN 212 Cb 0.61 -4.81 0.16 0.00 -0.61 0.00 0.00 39.78 35.13 3hkp n ASN 212 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hkp n GLY 213 N -1.23 -1.94 2.90 7.41 0.00 -0.79 -5.05 105.19 106.48 3hkp n GLY 213 Ca -0.18 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 43.93 3hkp n GLY 213 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hkp s HIS 214 N -2.77 2.15 -0.04 1.61 0.09 -1.26 -4.79 115.29 110.28 3hkp s HIS 214 Ca 0.52 -1.62 -0.06 0.00 -0.00 0.00 0.00 55.06 53.90 3hkp s HIS 214 Cb -0.03 -1.51 -0.23 0.00 -0.00 0.00 0.00 32.58 30.81 3hkp s HIS 214 CO 0.38 -0.75 3.51 -0.35 -0.00 0.00 0.00 174.74 177.52 3hkp n PRO 215 N 4.74 2.01 -4.20 8.40 -0.04 -1.26 -4.54 135.00 140.11 3hkp n PRO 215 Ca -0.11 -1.10 -0.16 0.00 -0.04 0.00 0.00 63.50 62.08 3hkp n PRO 215 Cb 0.44 -1.99 -0.13 0.00 -0.04 0.00 0.00 33.50 31.78 3hkp n PRO 215 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3hkp s TRP 216 N 0.72 0.72 0.11 0.54 0.52 -1.26 -1.13 118.94 119.15 3hkp s TRP 216 Ca 0.65 -0.27 0.07 0.00 0.02 0.00 0.00 56.10 56.57 3hkp s TRP 216 Cb 0.32 -0.45 -0.04 0.00 -1.15 0.00 0.00 33.47 32.15 3hkp s TRP 216 CO -0.02 -0.02 -0.11 1.03 0.02 0.00 0.00 176.95 177.85 3hkp s ARG 217 N -0.74 2.10 0.63 4.98 0.52 0.10 -2.16 118.95 124.37 3hkp s ARG 217 Ca -0.01 -1.04 -0.17 0.00 -0.52 0.00 0.00 55.73 53.99 3hkp s ARG 217 Cb -0.06 -2.29 -0.02 0.00 0.52 0.00 0.00 34.95 33.11 3hkp s ARG 217 CO 0.00 0.50 1.16 -1.25 0.02 0.00 0.00 175.30 175.74 3hkp s PRO 218 N -2.21 2.86 0.21 3.54 0.04 -1.26 -1.25 135.00 136.92 3hkp s PRO 218 Ca 0.21 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.59 3hkp s PRO 218 Cb -0.11 -1.94 -0.16 0.00 0.04 0.00 0.00 34.50 32.33 3hkp s PRO 218 CO 0.14 -1.25 0.82 0.00 0.04 0.00 0.00 177.00 176.74 3hkp n ALA 219 N -1.96 -1.81 -3.35 8.56 0.00 -1.26 -4.43 120.51 116.26 3hkp n ALA 219 Ca 0.12 0.44 -0.15 0.00 0.00 0.00 0.00 53.44 53.86 3hkp n ALA 219 Cb 0.51 -1.81 -0.05 0.00 0.00 0.00 0.00 19.45 18.09 3hkp n ALA 219 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3hkp s HIS 220 N -0.80 -0.46 -0.10 0.00 -3.43 -1.26 -4.28 115.29 104.96 3hkp s HIS 220 Ca 0.66 0.58 -0.05 0.00 -0.80 0.00 0.00 55.06 55.45 3hkp s HIS 220 Cb -0.88 0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 30.59 3hkp s HIS 220 CO 0.57 -0.64 0.11 -0.51 -2.00 0.00 0.00 174.74 172.27 3hkp s LEU 221 N -1.83 4.19 -0.13 5.38 1.43 -0.04 -4.52 118.68 123.15 3hkp s LEU 221 Ca -0.06 0.38 -0.06 0.00 -1.03 0.00 0.00 54.13 53.35 3hkp s LEU 221 Cb -0.01 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 3hkp s LEU 221 CO 0.00 0.39 0.11 -1.00 0.23 0.00 0.00 176.35 176.08 3hkp s HIS 222 N -1.02 3.48 -0.04 0.29 3.76 0.17 -1.64 115.29 120.28 3hkp s HIS 222 Ca 0.16 0.42 -0.04 0.00 -0.15 0.00 0.00 55.06 55.45 3hkp s HIS 222 Cb -0.12 -1.94 0.01 0.00 1.11 0.00 0.00 32.58 31.64 3hkp s HIS 222 CO 0.05 0.61 0.11 -0.51 -0.85 0.00 0.00 174.74 174.15 3hkp s LEU 223 N -0.78 1.56 -0.15 0.89 1.02 -0.38 -1.52 118.68 119.32 3hkp s LEU 223 Ca 0.13 0.22 0.02 0.00 0.02 0.00 0.00 54.13 54.53 3hkp s LEU 223 Cb -0.12 0.39 0.01 0.00 0.02 0.00 0.00 46.19 46.50 3hkp s LEU 223 CO 0.03 -0.04 -0.21 -0.63 0.02 0.00 0.00 176.35 175.52 3hkp s ILE 224 N 0.04 2.00 -0.07 -0.59 1.01 -0.12 -0.34 121.20 123.13 3hkp s ILE 224 Ca -0.00 -0.93 0.04 0.00 0.00 0.00 0.00 60.65 59.76 3hkp s ILE 224 Cb -0.01 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.68 3hkp s ILE 224 CO 0.00 0.54 -0.21 -0.69 0.00 0.00 0.00 174.94 174.58 3hkp s VAL 225 N 0.98 1.76 0.02 2.92 1.01 -0.21 -0.33 120.40 126.55 3hkp s VAL 225 Ca -0.03 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 3hkp s VAL 225 Cb -0.15 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.72 3hkp s VAL 225 CO -0.05 0.49 0.17 -0.94 0.00 0.00 0.00 175.10 174.77 3hkp s SER 226 N 0.19 0.03 -0.02 3.32 1.04 -0.64 -0.68 113.70 116.94 3hkp s SER 226 Ca -0.11 -0.29 -0.24 0.00 0.48 0.00 0.00 55.95 55.80 3hkp s SER 226 Cb -0.15 0.25 0.05 0.00 0.10 0.00 0.00 66.02 66.27 3hkp s SER 226 CO 0.05 -0.47 0.52 0.00 0.98 0.00 0.00 173.24 174.32 3hkp s ALA 227 N -2.01 -1.34 0.31 5.32 0.00 -1.26 -0.95 121.76 121.83 3hkp s ALA 227 Ca -0.10 0.82 -0.29 0.00 0.00 0.00 0.00 51.96 52.39 3hkp s ALA 227 Cb -0.04 0.11 -0.10 0.00 0.00 0.00 0.00 23.12 23.09 3hkp s ALA 227 CO -0.01 -0.36 1.43 -2.14 0.00 0.00 0.00 175.76 174.68 3hkp s PRO 228 N -1.53 4.24 0.00 0.00 0.02 -1.26 -1.00 135.00 135.47 3hkp s PRO 228 Ca -0.11 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.29 3hkp s PRO 228 Cb -0.02 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.45 3hkp s PRO 228 CO 0.05 -0.40 0.00 0.41 -0.33 0.00 0.00 177.00 176.73 3hkp n GLY 229 N 1.38 1.34 3.51 0.52 0.00 -1.26 -5.01 105.19 105.68 3hkp n GLY 229 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 3hkp n GLY 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hkp s LYS 230 N -0.11 1.84 -0.02 1.61 -0.14 -0.17 -0.73 119.74 122.02 3hkp s LYS 230 Ca 0.00 -1.39 -0.30 0.00 -1.36 0.00 0.00 55.97 52.92 3hkp s LYS 230 Cb 0.00 -2.02 -0.03 0.00 -1.68 0.00 0.00 37.83 34.10 3hkp s LYS 230 CO 0.00 0.42 1.03 -2.00 -0.76 0.00 0.00 175.35 174.04 3hkp s GLU 231 N -2.81 4.49 0.74 1.68 2.12 -0.10 -4.51 118.70 120.31 3hkp s GLU 231 Ca 0.24 1.48 -0.14 0.00 0.36 0.00 0.00 54.97 56.90 3hkp s GLU 231 Cb -0.08 -3.47 0.05 0.00 0.26 0.00 0.00 34.13 30.88 3hkp s GLU 231 CO 0.13 -0.17 1.18 -1.12 -0.54 0.00 0.00 175.26 174.74 3hkp s SER 232 N 1.07 4.19 -0.08 -1.70 0.01 -1.26 -4.32 113.70 111.61 3hkp s SER 232 Ca 0.52 2.25 0.03 0.00 1.31 0.00 0.00 55.95 60.06 3hkp s SER 232 Cb -0.22 -2.58 0.01 0.00 0.21 0.00 0.00 66.02 63.45 3hkp s SER 232 CO 0.25 -2.26 -0.16 0.54 0.41 0.00 0.00 173.24 172.03 3hkp s VAL 233 N -2.17 1.45 -0.25 3.43 0.11 0.14 -4.96 120.40 118.15 3hkp s VAL 233 Ca 0.71 -0.65 -0.12 0.00 -2.93 0.00 0.00 61.98 58.99 3hkp s VAL 233 Cb -0.26 -1.29 -0.05 0.00 -1.53 0.00 0.00 36.38 33.24 3hkp s VAL 233 CO 0.47 0.43 0.21 -0.89 -3.33 0.00 0.00 175.10 171.98 3hkp s THR 234 N 0.62 5.32 0.02 5.04 2.01 -1.26 -1.04 115.64 126.34 3hkp s THR 234 Ca -0.15 0.26 -0.00 0.00 0.31 0.00 0.00 61.69 62.11 3hkp s THR 234 Cb -0.16 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 68.80 3hkp s THR 234 CO 0.04 0.30 0.03 1.07 -0.69 0.00 0.00 174.62 175.38 3hkp n THR 235 N 4.55 0.00 -3.72 -0.82 5.66 0.53 -1.62 114.28 118.86 3hkp n THR 235 Ca -0.14 -0.10 -0.13 0.00 -3.05 0.00 0.00 64.05 60.63 3hkp n THR 235 Cb 0.52 0.06 -0.08 0.00 -1.55 0.00 0.00 70.33 69.28 3hkp n THR 235 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3hkp s GLN 236 N -2.04 0.76 -0.00 1.09 -0.21 -1.26 -1.25 119.66 116.75 3hkp s GLN 236 Ca 0.02 -0.21 0.06 0.00 0.02 0.00 0.00 55.36 55.25 3hkp s GLN 236 Cb -0.00 0.34 -0.02 0.00 1.00 0.00 0.00 33.01 34.33 3hkp s GLN 236 CO 0.01 -0.23 -0.20 -0.51 -2.12 0.00 0.00 175.29 172.25 3hkp s LEU 237 N -1.50 2.06 0.00 2.90 1.43 -0.65 -4.82 118.68 118.10 3hkp s LEU 237 Ca -0.11 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 3hkp s LEU 237 Cb -0.03 -0.99 -0.00 0.00 0.03 0.00 0.00 46.19 45.19 3hkp s LEU 237 CO 0.03 0.22 0.01 -1.22 0.23 0.00 0.00 176.35 175.62 3hkp n TYR 238 N 2.44 0.26 -4.15 0.29 4.01 -0.21 -0.87 117.16 118.93 3hkp n TYR 238 Ca -0.15 -0.70 -0.21 0.00 -0.16 0.00 0.00 57.90 56.67 3hkp n TYR 238 Cb 0.53 -0.07 -0.17 0.00 -0.31 0.00 0.00 39.34 39.33 3hkp n TYR 238 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3hkp s PHE 239 N -1.62 0.89 0.20 -0.72 0.40 -1.26 -0.50 117.98 115.37 3hkp s PHE 239 Ca 0.01 -0.29 -0.32 0.00 -0.60 0.00 0.00 56.93 55.73 3hkp s PHE 239 Cb 0.00 -0.78 -0.14 0.00 0.51 0.00 0.00 43.02 42.61 3hkp s PHE 239 CO 0.01 -0.24 1.39 1.17 0.70 0.00 0.00 175.22 178.25 3hkp n LYS 240 N 4.22 1.83 -0.44 0.44 4.81 1.00 -1.31 118.16 128.70 3hkp n LYS 240 Ca -0.21 0.65 0.00 0.00 -0.87 0.00 0.00 58.31 57.88 3hkp n LYS 240 Cb 0.51 -2.30 0.00 0.00 0.02 0.00 0.00 35.03 33.25 3hkp n LYS 240 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hkp n GLY 241 N 2.42 1.73 3.76 3.14 0.00 -1.26 -4.99 105.19 109.98 3hkp n GLY 241 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 3hkp n GLY 241 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hkp s GLY 242 N -1.93 2.54 0.34 -0.02 0.00 -0.42 -4.96 107.32 102.87 3hkp s GLY 242 Ca 0.00 0.83 -0.29 0.00 0.00 0.00 0.00 44.72 45.26 3hkp s GLY 242 CO 0.00 1.20 1.44 -0.54 0.00 0.00 0.00 173.10 175.20 3hkp s GLU 243 N -3.53 4.20 0.00 2.90 0.41 -1.26 -2.66 118.70 118.75 3hkp s GLU 243 Ca 0.73 2.44 0.00 0.00 -0.41 0.00 0.00 54.97 57.73 3hkp s GLU 243 Cb -0.26 -3.02 0.00 0.00 -1.78 0.00 0.00 34.13 29.08 3hkp s GLU 243 CO 0.34 -0.43 0.00 0.91 -0.49 0.00 0.00 175.26 175.58 3hkp n TRP 244 N 0.94 0.00 0.07 1.61 7.02 -1.26 -4.17 117.44 121.65 3hkp n TRP 244 Ca 0.02 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.57 3hkp n TRP 244 Cb 0.40 -0.44 0.51 0.00 -2.42 0.00 0.00 31.31 29.36 3hkp n TRP 244 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 3hkp h ILE 245 N 0.00 1.04 -0.63 -0.99 1.08 -1.89 -1.63 117.51 114.49 3hkp h ILE 245 Ca 0.00 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.35 3hkp h ILE 245 Cb 0.16 0.65 0.00 0.00 -3.07 0.00 0.00 36.82 34.56 3hkp h ILE 245 CO 0.00 0.06 0.00 -0.90 -0.69 0.00 0.00 178.15 176.62 3hkp n ASP 246 N -4.49 3.76 -2.70 1.72 5.75 -1.26 -4.48 116.55 114.85 3hkp n ASP 246 Ca 0.02 -1.99 -0.06 0.00 -0.01 0.00 0.00 54.79 52.75 3hkp n ASP 246 Cb 0.12 -0.42 0.09 0.00 -1.03 0.00 0.00 41.12 39.88 3hkp n ASP 246 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3hkp n SER 247 N 1.51 -0.68 -4.69 -1.12 3.41 -0.66 -5.11 113.62 106.29 3hkp n SER 247 Ca 0.22 -2.46 -0.42 0.00 -0.26 0.00 0.00 58.87 55.95 3hkp n SER 247 Cb 0.60 0.44 -0.03 0.00 -0.26 0.00 0.00 64.21 64.96 3hkp n SER 247 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hkp s ASP 248 N -1.90 6.85 0.48 4.04 2.15 -0.95 -4.85 116.67 122.48 3hkp s ASP 248 Ca 0.22 2.09 0.19 0.00 0.43 0.00 0.00 52.55 55.48 3hkp s ASP 248 Cb 0.42 -2.56 1.18 0.00 -0.30 0.00 0.00 42.92 41.66 3hkp s ASP 248 CO -0.06 -0.73 2.04 1.62 -0.17 0.00 0.00 175.17 177.87 3hkp h VAL 249 N 4.99 0.94 -0.01 1.11 3.04 -1.67 -0.98 116.25 123.67 3hkp h VAL 249 Ca -0.37 -0.54 0.00 0.00 -1.01 0.00 0.00 66.70 64.78 3hkp h VAL 249 Cb 1.17 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 31.76 3hkp h VAL 249 CO 0.91 0.15 -0.11 0.00 -1.01 0.00 0.00 177.57 177.50 3hkp n ALA 250 N -2.44 2.79 -3.63 3.17 0.00 -1.26 -4.76 120.51 114.37 3hkp n ALA 250 Ca -0.02 -0.33 -0.27 0.00 0.00 0.00 0.00 53.44 52.82 3hkp n ALA 250 Cb 0.23 -1.27 0.04 0.00 0.00 0.00 0.00 19.45 18.44 3hkp n ALA 250 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hkp n SER 251 N -0.64 -5.26 -0.01 0.00 7.64 -0.37 -4.67 113.62 110.31 3hkp n SER 251 Ca 0.16 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.44 3hkp n SER 251 Cb 0.29 -4.21 0.00 0.00 -1.01 0.00 0.00 64.21 59.29 3hkp n SER 251 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hkp n ALA 252 N -4.44 2.45 -2.40 -0.43 0.00 -1.26 -4.88 120.51 109.55 3hkp n ALA 252 Ca 0.01 -0.56 -0.37 0.00 0.00 0.00 0.00 53.44 52.52 3hkp n ALA 252 Cb 0.55 -0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.94 3hkp n ALA 252 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3hkp s THR 253 N -0.12 4.90 0.03 0.00 -4.23 -1.26 -4.67 115.64 110.29 3hkp s THR 253 Ca 0.00 0.88 0.06 0.00 -1.18 0.00 0.00 61.69 61.46 3hkp s THR 253 Cb 0.00 -3.76 -0.02 0.00 1.34 0.00 0.00 72.50 70.06 3hkp s THR 253 CO 0.00 0.42 -0.19 -0.54 -0.54 0.00 0.00 174.62 173.77 3hkp s LYS 254 N -1.50 1.32 0.34 3.99 1.02 -1.26 -5.04 119.74 118.61 3hkp s LYS 254 Ca 0.31 -0.82 0.10 0.00 0.02 0.00 0.00 55.97 55.58 3hkp s LYS 254 Cb -0.16 -1.37 0.86 0.00 -0.52 0.00 0.00 37.83 36.64 3hkp s LYS 254 CO 0.17 0.36 1.79 -1.35 -0.92 0.00 0.00 175.35 175.40 3hkp h PRO 255 N 5.12 0.62 0.00 -1.68 0.11 -1.98 -1.21 132.00 132.97 3hkp h PRO 255 Ca -0.40 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3hkp h PRO 255 Cb 1.16 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3hkp h PRO 255 CO 0.45 0.41 0.00 0.93 -0.21 0.00 0.00 178.00 179.58 3hkp h GLU 256 N 0.64 0.00 -0.63 1.05 3.07 -2.01 -3.00 114.58 113.70 3hkp h GLU 256 Ca 0.56 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.42 3hkp h GLU 256 Cb 1.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.95 3hkp h GLU 256 CO -0.33 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.56 3hkp n LEU 257 N -2.73 3.96 -4.60 1.33 4.77 -0.46 -4.93 117.00 114.35 3hkp n LEU 257 Ca -0.00 -2.14 -0.41 0.00 -0.03 0.00 0.00 56.01 53.43 3hkp n LEU 257 Cb 0.19 -0.47 -0.07 0.00 -2.33 0.00 0.00 43.42 40.74 3hkp n LEU 257 CO 0.21 0.89 0.27 -0.63 -1.33 0.00 0.00 177.39 176.79 3hkp s ILE 258 N -1.27 5.03 0.25 -0.08 1.01 -1.14 -1.05 121.20 123.96 3hkp s ILE 258 Ca 0.44 0.72 -0.08 0.00 0.00 0.00 0.00 60.65 61.73 3hkp s ILE 258 Cb 0.25 -3.90 -0.07 0.00 0.01 0.00 0.00 42.46 38.75 3hkp s ILE 258 CO 0.27 -0.05 0.56 -0.76 0.00 0.00 0.00 174.94 174.97 3hkp s LEU 259 N 2.40 4.12 -0.59 2.97 1.43 0.35 -4.83 118.68 124.52 3hkp s LEU 259 Ca 0.21 0.88 0.06 0.00 -1.03 0.00 0.00 54.13 54.25 3hkp s LEU 259 Cb -0.15 -3.66 0.21 0.00 0.03 0.00 0.00 46.19 42.62 3hkp s LEU 259 CO 0.11 -0.12 0.58 -0.67 0.23 0.00 0.00 176.35 176.47 3hkp n ASP 260 N -0.41 2.40 -4.76 2.29 2.03 -1.26 -0.00 116.55 116.83 3hkp n ASP 260 Ca 0.00 -3.11 -0.34 0.00 0.52 0.00 0.00 54.79 51.86 3hkp n ASP 260 Cb 0.53 -0.68 0.05 0.00 -0.72 0.00 0.00 41.12 40.30 3hkp n ASP 260 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3hkp s PRO 261 N -1.62 2.71 -0.08 -0.67 0.02 -1.26 -4.91 135.00 129.18 3hkp s PRO 261 Ca 0.34 1.53 0.01 0.00 0.02 0.00 0.00 61.00 62.89 3hkp s PRO 261 Cb 0.08 -1.93 -0.03 0.00 0.02 0.00 0.00 34.50 32.64 3hkp s PRO 261 CO -0.10 -1.34 -0.10 0.15 -0.33 0.00 0.00 177.00 175.28 3hkp s LYS 262 N -3.92 2.88 -0.12 5.54 -0.14 0.11 -4.84 119.74 119.24 3hkp s LYS 262 Ca 0.70 -0.61 -0.18 0.00 -1.36 0.00 0.00 55.97 54.52 3hkp s LYS 262 Cb -0.23 -2.57 -0.04 0.00 -1.68 0.00 0.00 37.83 33.31 3hkp s LYS 262 CO 0.40 0.54 0.48 -0.08 -0.76 0.00 0.00 175.35 175.93 3hkp s THR 263 N -0.48 5.18 0.68 2.17 -1.32 -1.26 0.03 115.64 120.64 3hkp s THR 263 Ca 0.07 0.95 -0.02 0.00 -1.21 0.00 0.00 61.69 61.48 3hkp s THR 263 Cb -0.12 -3.82 0.09 0.00 -1.51 0.00 0.00 72.50 67.14 3hkp s THR 263 CO 0.02 0.32 0.94 -0.83 -2.21 0.00 0.00 174.62 172.86 3hkp s GLY 264 N 0.66 1.77 0.25 6.08 0.00 -0.03 -4.95 107.32 111.10 3hkp s GLY 264 Ca 0.26 -1.45 0.21 0.00 0.00 0.00 0.00 44.72 43.74 3hkp s GLY 264 CO 0.10 -0.99 1.63 1.22 0.00 0.00 0.00 173.10 175.07 3hkp n ASP 265 N -2.74 0.55 -0.24 1.64 10.43 -1.26 -0.67 116.55 124.25 3hkp n ASP 265 Ca 0.12 0.68 0.09 0.00 2.57 0.00 0.00 54.79 58.25 3hkp n ASP 265 Cb 0.60 -0.78 0.42 0.00 1.84 0.00 0.00 41.12 43.20 3hkp n ASP 265 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3hkp n ASP 266 N -2.16 0.73 0.00 -2.24 3.85 -1.26 -4.92 116.55 110.56 3hkp n ASP 266 Ca 0.01 -1.60 0.00 0.00 -0.71 0.00 0.00 54.79 52.48 3hkp n ASP 266 Cb 0.14 -0.05 0.00 0.00 -1.35 0.00 0.00 41.12 39.85 3hkp n ASP 266 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hkp n GLY 267 N 0.91 1.24 3.86 6.12 0.00 0.16 -5.01 105.19 112.46 3hkp n GLY 267 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 3hkp n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hkp s LYS 268 N -0.13 3.90 -0.23 1.61 1.02 -1.26 -4.66 119.74 120.00 3hkp s LYS 268 Ca 0.00 0.58 -0.14 0.00 0.02 0.00 0.00 55.97 56.44 3hkp s LYS 268 Cb 0.00 -2.40 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 3hkp s LYS 268 CO 0.00 0.06 0.31 -0.80 -0.92 0.00 0.00 175.35 173.99 3hkp s ASN 269 N -2.70 6.29 -0.06 2.83 0.02 -0.30 -0.85 114.94 120.17 3hkp s ASN 269 Ca 0.53 0.33 0.02 0.00 -1.02 0.00 0.00 52.86 52.72 3hkp s ASN 269 Cb -0.10 -2.18 -0.03 0.00 0.02 0.00 0.00 41.25 38.96 3hkp s ASN 269 CO 0.24 -0.04 -0.12 -0.31 0.02 0.00 0.00 177.10 176.89 3hkp s TYR 270 N 1.34 2.79 -0.24 2.20 1.51 0.10 0.15 117.35 125.22 3hkp s TYR 270 Ca 0.14 -0.10 -0.20 0.00 -1.01 0.00 0.00 57.07 55.90 3hkp s TYR 270 Cb -0.14 -1.66 0.06 0.00 -0.11 0.00 0.00 41.96 40.10 3hkp s TYR 270 CO 0.07 0.23 0.62 0.54 -1.11 0.00 0.00 175.55 175.90 3hkp s VAL 271 N -0.73 -0.00 -0.06 0.71 0.11 -0.65 0.05 120.40 119.83 3hkp s VAL 271 Ca 0.11 0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.20 3hkp s VAL 271 Cb -0.11 -0.87 -0.03 0.00 -1.53 0.00 0.00 36.38 33.85 3hkp s VAL 271 CO 0.01 0.00 -0.14 0.28 -3.33 0.00 0.00 175.10 171.93 3hkp s THR 272 N 0.65 3.11 -0.09 5.04 -1.32 -1.26 -1.25 115.64 120.53 3hkp s THR 272 Ca -0.03 -0.70 -0.04 0.00 -1.21 0.00 0.00 61.69 59.71 3hkp s THR 272 Cb -0.05 -2.23 0.05 0.00 -1.51 0.00 0.00 72.50 68.76 3hkp s THR 272 CO -0.04 0.59 0.21 -0.47 -2.21 0.00 0.00 174.62 172.70 3hkp s TYR 273 N -0.66 -0.27 0.04 9.09 6.14 0.66 -4.95 117.35 127.39 3hkp s TYR 273 Ca 0.10 0.70 -0.09 0.00 0.64 0.00 0.00 57.07 58.42 3hkp s TYR 273 Cb -0.11 -0.03 -0.05 0.00 0.42 0.00 0.00 41.96 42.19 3hkp s TYR 273 CO 0.01 -0.23 0.34 -0.80 0.64 0.00 0.00 175.55 175.50 3hkp s ASN 274 N 1.46 6.58 -0.14 4.32 0.02 -1.26 -3.96 114.94 121.96 3hkp s ASN 274 Ca -0.07 0.69 -0.07 0.00 -1.02 0.00 0.00 52.86 52.39 3hkp s ASN 274 Cb -0.11 -2.14 -0.04 0.00 0.02 0.00 0.00 41.25 38.98 3hkp s ASN 274 CO -0.07 0.23 0.13 -0.36 0.02 0.00 0.00 177.10 177.04 3hkp s PHE 275 N -1.32 3.54 -0.23 2.20 0.40 -0.01 -4.94 117.98 117.61 3hkp s PHE 275 Ca 0.29 0.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.09 3hkp s PHE 275 Cb -0.14 -1.98 0.06 0.00 0.51 0.00 0.00 43.02 41.48 3hkp s PHE 275 CO 0.16 0.63 -0.03 0.08 0.70 0.00 0.00 175.22 176.77 3hkp s VAL 276 N -0.73 1.33 -0.02 -0.44 1.01 -1.26 0.58 120.40 120.87 3hkp s VAL 276 Ca 0.13 -1.12 -0.08 0.00 0.00 0.00 0.00 61.98 60.91 3hkp s VAL 276 Cb -0.12 -1.66 -0.05 0.00 0.00 0.00 0.00 36.38 34.55 3hkp s VAL 276 CO 0.03 -0.15 0.26 -0.76 0.00 0.00 0.00 175.10 174.47 3hkp s LEU 277 N 1.48 4.39 0.52 3.92 1.43 0.11 -0.27 118.68 130.26 3hkp s LEU 277 Ca -0.04 0.60 -0.13 0.00 -1.03 0.00 0.00 54.13 53.53 3hkp s LEU 277 Cb -0.18 -2.51 -0.06 0.00 0.03 0.00 0.00 46.19 43.46 3hkp s LEU 277 CO -0.07 0.30 0.94 -1.81 0.23 0.00 0.00 176.35 175.94 3hkp s ASP 278 N -1.44 6.49 0.64 2.29 1.01 -1.26 -3.54 116.67 120.86 3hkp s ASP 278 Ca 0.24 1.41 -0.17 0.00 0.71 0.00 0.00 52.55 54.74 3hkp s ASP 278 Cb -0.13 -2.45 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 3hkp s ASP 278 CO 0.13 -0.62 1.17 -2.84 0.21 0.00 0.00 175.17 173.22 3hkp s PRO 279 N -4.32 2.78 0.00 8.23 0.02 -1.26 -0.93 135.00 139.52 3hkp s PRO 279 Ca 0.56 1.65 0.32 0.00 0.02 0.00 0.00 61.00 63.54 3hkp s PRO 279 Cb -0.10 -1.92 1.83 0.00 0.02 0.00 0.00 34.50 34.33 3hkp s PRO 279 CO 0.37 -1.31 2.19 0.00 -0.33 0.00 0.00 177.00 177.92