#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hkr h ILE 60 N 0.00 1.09 0.00 0.61 1.08 -1.97 -0.94 117.51 117.37 2hkr h ILE 60 Ca 0.00 -0.21 -0.01 0.00 -0.39 0.00 0.00 64.86 64.24 2hkr h ILE 60 Cb 0.00 0.73 -0.00 0.00 -3.07 0.00 0.00 36.82 34.47 2hkr h ILE 60 CO 0.00 0.09 -0.06 0.77 -0.69 0.00 0.00 178.15 178.27 2hkr h SER 61 N 0.37 0.00 -0.01 1.72 4.64 -1.99 -1.54 113.55 116.73 2hkr h SER 61 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2hkr h SER 61 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2hkr h SER 61 CO -0.02 0.06 -0.11 0.18 -0.87 0.00 0.00 176.83 176.07 2hkr n LEU 62 N -3.40 2.51 -3.63 5.97 4.77 -0.37 -4.77 117.00 118.07 2hkr n LEU 62 Ca -0.02 -0.85 -0.27 0.00 -0.03 0.00 0.00 56.01 54.84 2hkr n LEU 62 Cb 0.20 -0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.17 2hkr n LEU 62 CO 0.27 0.43 -0.18 0.20 -1.33 0.00 0.00 177.39 176.77 2hkr s ASN 63 N -2.12 3.02 0.41 -1.43 0.01 -0.58 -4.99 114.94 109.27 2hkr s ASN 63 Ca 0.27 -3.45 0.17 0.00 -0.71 0.00 0.00 52.86 49.14 2hkr s ASN 63 Cb 0.20 -1.00 1.07 0.00 0.41 0.00 0.00 41.25 41.93 2hkr s ASN 63 CO 0.37 -0.13 1.84 -0.65 -1.51 0.00 0.00 177.10 177.02 2hkr h PRO 64 N 5.51 0.41 0.00 -0.60 0.11 -1.86 0.11 132.00 135.67 2hkr h PRO 64 Ca 0.21 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.29 2hkr h PRO 64 Cb 0.83 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.85 2hkr h PRO 64 CO 0.54 0.27 -0.03 -0.44 -0.21 0.00 0.00 178.00 178.12 2hkr h ASP 65 N 0.42 0.00 0.43 -2.05 3.32 -1.94 -1.31 116.42 115.29 2hkr h ASP 65 Ca 0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.54 2hkr h ASP 65 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2hkr h ASP 65 CO -0.20 0.03 -0.71 0.18 -1.72 0.00 0.00 179.24 176.82 2hkr n LEU 66 N -3.20 0.63 -4.94 1.55 4.77 0.36 -4.97 117.00 111.20 2hkr n LEU 66 Ca -0.01 -0.07 -0.25 0.00 -0.03 0.00 0.00 56.01 55.64 2hkr n LEU 66 Cb 0.22 -0.17 0.06 0.00 -2.33 0.00 0.00 43.42 41.21 2hkr n LEU 66 CO 0.26 0.12 0.57 0.00 -1.33 0.00 0.00 177.39 177.01 2hkr s ALA 67 N -3.06 3.28 0.15 -1.18 0.00 -0.50 -5.03 121.76 115.43 2hkr s ALA 67 Ca 0.08 -0.98 -0.31 0.00 0.00 0.00 0.00 51.96 50.75 2hkr s ALA 67 Cb 0.16 -2.52 -0.10 0.00 0.00 0.00 0.00 23.12 20.66 2hkr s ALA 67 CO 0.75 -1.19 1.63 1.21 0.00 0.00 0.00 175.76 178.17 2hkr s ASN 68 N -4.49 6.54 0.24 0.00 3.04 -1.26 -4.92 114.94 114.09 2hkr s ASN 68 Ca 0.59 2.64 -0.05 0.00 0.04 0.00 0.00 52.86 56.08 2hkr s ASN 68 Cb -0.11 -2.59 0.33 0.00 -1.54 0.00 0.00 41.25 37.35 2hkr s ASN 68 CO 0.44 -0.88 1.86 1.05 -3.04 0.00 0.00 177.10 176.53 2hkr h GLU 69 N 7.27 0.97 -0.08 0.43 -0.00 -1.96 -0.46 114.58 120.75 2hkr h GLU 69 Ca -0.43 -0.06 0.02 0.00 -0.00 0.00 0.00 59.36 58.90 2hkr h GLU 69 Cb 1.20 -0.22 -0.00 0.00 -0.00 0.00 0.00 28.75 29.73 2hkr h GLU 69 CO 0.93 0.64 0.06 -0.44 -0.00 0.00 0.00 179.01 180.20 2hkr h ASP 70 N 1.00 0.00 -0.00 3.06 3.32 -1.96 0.39 116.42 122.23 2hkr h ASP 70 Ca 0.38 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.36 2hkr h ASP 70 Cb 0.16 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.71 2hkr h ASP 70 CO -0.17 0.00 -0.28 -0.08 -1.72 0.00 0.00 179.24 176.99 2hkr h GLU 71 N 0.00 0.19 0.00 3.56 4.81 -1.48 -3.26 114.58 118.40 2hkr h GLU 71 Ca 0.04 -0.21 -0.05 0.00 -0.13 0.00 0.00 59.36 59.02 2hkr h GLU 71 Cb 0.16 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 2hkr h GLU 71 CO -0.00 0.93 -0.24 -0.39 -0.73 0.00 0.00 179.01 178.59 2hkr h VAL 72 N -0.46 0.57 -0.21 0.32 -1.51 -1.04 -2.86 116.25 111.05 2hkr h VAL 72 Ca -0.03 -1.16 0.00 0.00 -1.23 0.00 0.00 66.70 64.28 2hkr h VAL 72 Cb 1.03 1.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.98 2hkr h VAL 72 CO 0.06 0.23 0.00 0.59 -1.23 0.00 0.00 177.57 177.22 2hkr n ASN 73 N -3.39 1.19 -4.82 4.19 3.02 0.09 -4.85 115.26 110.70 2hkr n ASN 73 Ca 0.00 -1.95 -0.36 0.00 -0.03 0.00 0.00 54.58 52.25 2hkr n ASN 73 Cb 0.44 -0.14 -0.07 0.00 -0.61 0.00 0.00 39.78 39.40 2hkr n ASN 73 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2hkr s SER 74 N -1.08 5.98 0.56 6.41 0.15 -1.08 -4.94 113.70 119.71 2hkr s SER 74 Ca 0.17 0.33 0.37 0.00 0.70 0.00 0.00 55.95 57.52 2hkr s SER 74 Cb 0.09 -1.84 1.88 0.00 -1.71 0.00 0.00 66.02 64.44 2hkr s SER 74 CO 0.12 0.37 2.13 0.00 1.20 0.00 0.00 173.24 177.06 2hkr n ASP 76 N -2.91 0.69 -4.64 0.00 8.00 -1.26 -4.75 116.55 111.68 2hkr n ASP 76 Ca -0.01 -0.58 -0.47 0.00 0.71 0.00 0.00 54.79 54.44 2hkr n ASP 76 Cb 0.14 0.06 -0.04 0.00 -0.02 0.00 0.00 41.12 41.26 2hkr n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hkr n TYR 77 N -0.97 1.89 -0.20 1.24 -0.00 -0.81 -4.84 117.16 113.48 2hkr n TYR 77 Ca 0.11 0.48 0.11 0.00 -0.00 0.00 0.00 57.90 58.60 2hkr n TYR 77 Cb 0.32 -2.42 0.41 0.00 -0.00 0.00 0.00 39.34 37.66 2hkr n TYR 77 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.86 176.97 2hkr h TRP 78 N 4.41 0.69 -0.00 2.98 5.08 -1.89 -1.14 115.95 126.07 2hkr h TRP 78 Ca -0.45 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.54 2hkr h TRP 78 Cb 1.29 -0.22 0.00 0.00 -3.00 0.00 0.00 29.16 27.23 2hkr h TRP 78 CO 0.58 0.30 -0.08 2.89 -1.28 0.00 0.00 178.44 180.84 2hkr n ARG 79 N -4.51 0.47 -0.84 0.12 1.85 -1.26 -3.66 116.66 108.83 2hkr n ARG 79 Ca 0.14 -0.10 -0.17 0.00 -1.00 0.00 0.00 57.85 56.71 2hkr n ARG 79 Cb 0.40 -1.50 0.09 0.00 -1.05 0.00 0.00 32.46 30.40 2hkr n ARG 79 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2hkr n HIS 80 N -1.18 1.93 0.75 2.89 8.25 -0.43 -4.66 115.22 122.78 2hkr n HIS 80 Ca 0.13 -1.64 0.13 0.00 -0.26 0.00 0.00 57.72 56.08 2hkr n HIS 80 Cb 0.27 -0.82 0.49 0.00 1.12 0.00 0.00 29.99 31.06 2hkr n HIS 80 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2hkr n ALA 82 N -1.64 3.41 -2.67 0.00 0.00 -1.26 -1.21 120.51 117.14 2hkr n ALA 82 Ca 0.06 -3.10 -0.41 0.00 0.00 0.00 0.00 53.44 49.99 2hkr n ALA 82 Cb 0.35 -0.68 -0.05 0.00 0.00 0.00 0.00 19.45 19.07 2hkr n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2hkr s VAL 83 N -3.99 4.94 -0.36 0.00 1.01 -1.13 -4.86 120.40 116.01 2hkr s VAL 83 Ca 0.35 1.44 0.01 0.00 0.00 0.00 0.00 61.98 63.79 2hkr s VAL 83 Cb 0.35 -4.05 0.10 0.00 0.00 0.00 0.00 36.38 32.78 2hkr s VAL 83 CO -0.02 0.07 0.10 -0.62 0.00 0.00 0.00 175.10 174.63 2hkr s ASP 84 N 1.16 4.94 0.00 3.32 2.15 -1.26 -0.78 116.67 126.21 2hkr s ASP 84 Ca 0.34 -2.02 0.00 0.00 0.43 0.00 0.00 52.55 51.30 2hkr s ASP 84 Cb -0.16 -1.70 0.00 0.00 -0.30 0.00 0.00 42.92 40.75 2hkr s ASP 84 CO 0.12 -0.42 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 2hkr n GLY 85 N 4.41 -0.15 3.70 2.66 0.00 -0.40 -4.93 105.19 110.47 2hkr n GLY 85 Ca -0.00 -1.55 -0.38 0.00 0.00 0.00 0.00 46.02 44.09 2hkr n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hkr s PHE 86 N -2.60 3.43 0.06 1.61 0.40 -1.26 -0.73 117.98 118.90 2hkr s PHE 86 Ca 0.00 0.68 -0.31 0.00 -0.60 0.00 0.00 56.93 56.70 2hkr s PHE 86 Cb 0.00 -2.49 -0.08 0.00 0.51 0.00 0.00 43.02 40.97 2hkr s PHE 86 CO 0.00 0.10 1.61 -0.51 0.70 0.00 0.00 175.22 177.12 2hkr s LEU 87 N 0.92 4.36 0.57 -0.37 1.43 -0.38 -0.08 118.68 125.13 2hkr s LEU 87 Ca 0.20 2.43 0.26 0.00 -1.03 0.00 0.00 54.13 55.99 2hkr s LEU 87 Cb -0.14 -3.56 1.65 0.00 0.03 0.00 0.00 46.19 44.16 2hkr s LEU 87 CO 0.07 -0.86 2.22 0.00 0.23 0.00 0.00 176.35 178.01 2hkr n SER 89 N -4.03 0.66 -0.86 0.00 3.41 -1.25 -1.05 113.62 110.50 2hkr n SER 89 Ca -0.03 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.39 2hkr n SER 89 Cb 0.09 -0.82 0.25 0.00 -0.26 0.00 0.00 64.21 63.48 2hkr n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hkr n GLY 92 N -1.10 0.72 0.00 0.00 0.00 -1.23 -4.68 105.19 98.89 2hkr n GLY 92 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2hkr n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hkr n GLY 93 N -2.10 5.33 2.48 -0.02 0.00 -0.93 -4.41 105.19 105.52 2hkr n GLY 93 Ca 0.00 -1.99 -0.18 0.00 0.00 0.00 0.00 46.02 43.85 2hkr n GLY 93 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2hkr n THR 94 N 0.00 0.00 0.02 2.61 -2.24 -0.80 -4.28 114.28 109.60 2hkr n THR 94 Ca 0.00 -1.79 0.19 0.00 -2.27 0.00 0.00 64.05 60.18 2hkr n THR 94 Cb 0.00 0.71 0.69 0.00 -2.10 0.00 0.00 70.33 69.63 2hkr n THR 94 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2hkr h THR 95 N 1.59 0.75 0.00 4.28 2.02 -1.92 -2.97 112.91 116.65 2hkr h THR 95 Ca -0.22 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.96 2hkr h THR 95 Cb 0.90 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 2hkr h THR 95 CO 0.34 0.00 -0.08 0.35 0.37 0.00 0.00 175.52 176.50 2hkr n THR 96 N -4.38 1.20 -3.94 3.16 -2.24 -1.26 -2.78 114.28 104.05 2hkr n THR 96 Ca 0.09 -1.40 -0.15 0.00 -2.27 0.00 0.00 64.05 60.32 2hkr n THR 96 Cb 0.56 0.16 -0.15 0.00 -2.10 0.00 0.00 70.33 68.81 2hkr n THR 96 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2hkr s THR 97 N -1.71 0.13 0.39 4.28 -4.23 -1.12 -5.11 115.64 108.28 2hkr s THR 97 Ca 0.16 0.00 -0.25 0.00 -1.18 0.00 0.00 61.69 60.42 2hkr s THR 97 Cb 0.14 -0.17 -0.09 0.00 1.34 0.00 0.00 72.50 73.73 2hkr s THR 97 CO 0.02 0.08 1.15 0.00 -0.54 0.00 0.00 174.62 175.32 2hkr n PRO 99 N 0.10 0.72 -1.58 0.00 -0.02 -1.26 -4.69 135.00 128.27 2hkr n PRO 99 Ca 0.04 0.29 -0.50 0.00 -2.02 0.00 0.00 63.50 61.31 2hkr n PRO 99 Cb 0.47 -2.04 -0.05 0.00 -0.02 0.00 0.00 33.50 31.86 2hkr n PRO 99 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2hkr n PRO 100 N -0.88 1.17 -1.01 0.52 -0.02 -1.26 -1.88 135.00 131.65 2hkr n PRO 100 Ca 0.13 0.42 -0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2hkr n PRO 100 Cb 0.48 -1.98 -0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2hkr n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hkr n GLY 101 N 2.22 0.46 3.50 -1.23 0.00 -1.26 -5.03 105.19 103.84 2hkr n GLY 101 Ca 0.16 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2hkr n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hkr s SER 102 N -2.12 3.93 -0.12 1.61 1.04 -0.79 -4.69 113.70 112.56 2hkr s SER 102 Ca 0.00 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.86 2hkr s SER 102 Cb 0.00 -0.56 -0.02 0.00 0.10 0.00 0.00 66.02 65.54 2hkr s SER 102 CO 0.00 0.17 -0.13 -0.89 0.98 0.00 0.00 173.24 173.37 2hkr s THR 103 N -1.24 3.07 0.53 2.02 2.01 -0.09 -4.73 115.64 117.20 2hkr s THR 103 Ca 0.19 -0.66 -0.22 0.00 0.31 0.00 0.00 61.69 61.31 2hkr s THR 103 Cb -0.10 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.07 2hkr s THR 103 CO 0.11 0.53 1.37 -2.84 -0.69 0.00 0.00 174.62 173.09 2hkr s PRO 104 N 0.26 3.23 0.18 4.92 0.02 -1.26 -0.56 135.00 141.78 2hkr s PRO 104 Ca -0.09 2.25 -0.30 0.00 0.02 0.00 0.00 61.00 62.88 2hkr s PRO 104 Cb -0.15 -2.32 -0.07 0.00 0.02 0.00 0.00 34.50 31.98 2hkr s PRO 104 CO 0.05 -1.13 0.96 -1.54 -0.33 0.00 0.00 177.00 175.01 2hkr s SER 105 N -0.90 7.56 0.20 2.53 1.04 0.41 -4.86 113.70 119.68 2hkr s SER 105 Ca 0.70 1.88 0.25 0.00 0.48 0.00 0.00 55.95 59.26 2hkr s SER 105 Cb -0.41 -2.60 0.89 0.00 0.10 0.00 0.00 66.02 64.01 2hkr s SER 105 CO 0.49 0.04 1.76 -0.81 0.98 0.00 0.00 173.24 175.70 2hkr n PRO 106 N 2.15 0.21 -4.45 4.02 -0.04 -1.26 -4.71 135.00 130.91 2hkr n PRO 106 Ca 0.00 0.25 -0.23 0.00 -0.04 0.00 0.00 63.50 63.49 2hkr n PRO 106 Cb 0.48 -1.78 -0.10 0.00 -0.04 0.00 0.00 33.50 32.05 2hkr n PRO 106 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2hkr s ILE 107 N -3.15 1.97 0.00 0.52 -4.36 -1.26 -5.16 121.20 109.77 2hkr s ILE 107 Ca 0.09 -2.21 0.00 0.00 -0.26 0.00 0.00 60.65 58.27 2hkr s ILE 107 Cb 0.12 -2.41 0.00 0.00 1.25 0.00 0.00 42.46 41.42 2hkr s ILE 107 CO 0.52 -0.34 0.00 -1.54 0.24 0.00 0.00 174.94 173.82 2hkr n SER 108 N -0.61 1.41 -3.63 4.36 3.41 -1.26 -4.56 113.62 112.74 2hkr n SER 108 Ca -0.06 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.41 2hkr n SER 108 Cb 0.62 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.50 2hkr n SER 108 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2hkr s ILE 110 N 0.85 0.00 0.21 -1.33 -1.09 -0.28 -4.88 121.20 114.68 2hkr s ILE 110 Ca 0.00 -0.00 0.10 0.00 -2.23 0.00 0.00 60.65 58.52 2hkr s ILE 110 Cb 0.00 -0.98 -0.05 0.00 -1.58 0.00 0.00 42.46 39.85 2hkr s ILE 110 CO 0.00 -0.00 -0.19 -0.83 -1.23 0.00 0.00 174.94 172.69 2hkr s GLY 111 N 0.31 1.60 -0.21 6.18 0.00 0.93 -4.64 107.32 111.50 2hkr s GLY 111 Ca -0.00 -1.66 -0.02 0.00 0.00 0.00 0.00 44.72 43.04 2hkr s GLY 111 CO 0.01 -1.73 -0.11 -1.59 0.00 0.00 0.00 173.10 169.68 2hkr s THR 112 N -2.31 2.78 0.03 0.90 2.01 -1.26 -0.63 115.64 117.16 2hkr s THR 112 Ca 0.22 -0.73 0.06 0.00 0.31 0.00 0.00 61.69 61.55 2hkr s THR 112 Cb -0.05 -2.25 -0.02 0.00 0.01 0.00 0.00 72.50 70.19 2hkr s THR 112 CO 0.10 0.45 -0.18 0.00 -0.69 0.00 0.00 174.62 174.29 2hkr s HIS 114 N -0.72 3.58 -0.48 0.00 2.46 -1.26 -1.21 115.29 117.67 2hkr s HIS 114 Ca 0.06 1.16 -0.18 0.00 0.47 0.00 0.00 55.06 56.57 2hkr s HIS 114 Cb -0.08 -2.72 0.05 0.00 -0.13 0.00 0.00 32.58 29.70 2hkr s HIS 114 CO 0.01 0.14 0.54 1.21 -2.47 0.00 0.00 174.74 174.17 2hkr s ASN 115 N 0.63 6.21 0.09 9.88 3.84 0.33 -4.81 114.94 131.11 2hkr s ASN 115 Ca 0.34 -0.91 0.22 0.00 0.21 0.00 0.00 52.86 52.73 2hkr s ASN 115 Cb -0.17 -2.25 0.89 0.00 -0.55 0.00 0.00 41.25 39.17 2hkr s ASN 115 CO 0.16 -0.76 1.69 -0.81 -2.79 0.00 0.00 177.10 174.59 2hkr n PRO 116 N 5.85 0.08 0.00 0.43 -0.04 -1.26 -0.11 135.00 139.95 2hkr n PRO 116 Ca -0.08 0.22 -0.17 0.00 -0.04 0.00 0.00 63.50 63.43 2hkr n PRO 116 Cb 0.46 -1.63 -0.12 0.00 -0.04 0.00 0.00 33.50 32.16 2hkr n PRO 116 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2hkr h HIS 117 N 0.00 0.44 -0.01 0.54 3.86 -1.95 -3.36 115.15 114.67 2hkr h HIS 117 Ca 0.00 -0.27 0.00 0.00 -1.16 0.00 0.00 60.37 58.94 2hkr h HIS 117 Cb 0.42 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2hkr h HIS 117 CO 0.00 1.13 -0.21 -0.40 0.86 0.00 0.00 177.93 179.31 2hkr n ASP 118 N -4.30 1.78 -0.15 2.45 3.85 -1.20 -5.00 116.55 113.98 2hkr n ASP 118 Ca -0.11 -1.39 -0.02 0.00 -0.71 0.00 0.00 54.79 52.56 2hkr n ASP 118 Cb 0.66 0.32 -0.01 0.00 -1.35 0.00 0.00 41.12 40.74 2hkr n ASP 118 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2hkr n GLY 119 N 1.03 0.53 3.72 6.12 0.00 0.84 -5.02 105.19 112.40 2hkr n GLY 119 Ca 0.07 -0.35 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 2hkr n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hkr s LYS 120 N -1.24 2.48 -0.12 1.61 1.02 -1.17 -4.89 119.74 117.44 2hkr s LYS 120 Ca 0.00 -1.36 -0.04 0.00 0.02 0.00 0.00 55.97 54.60 2hkr s LYS 120 Cb 0.00 -2.27 -0.03 0.00 -0.52 0.00 0.00 37.83 35.00 2hkr s LYS 120 CO 0.00 0.30 0.03 -0.51 -0.92 0.00 0.00 175.35 174.25 2hkr s ASP 121 N -3.77 5.40 0.02 2.83 1.01 -1.26 -0.51 116.67 120.40 2hkr s ASP 121 Ca 0.34 0.14 0.05 0.00 0.71 0.00 0.00 52.55 53.79 2hkr s ASP 121 Cb -0.06 -1.68 -0.02 0.00 1.01 0.00 0.00 42.92 42.17 2hkr s ASP 121 CO 0.22 0.32 -0.16 -0.31 0.21 0.00 0.00 175.17 175.45 2hkr s TYR 122 N -0.51 1.42 -0.10 4.23 1.51 -0.35 -1.11 117.35 122.45 2hkr s TYR 122 Ca 0.09 -0.32 -0.30 0.00 -1.01 0.00 0.00 57.07 55.54 2hkr s TYR 122 Cb -0.12 -0.87 -0.02 0.00 -0.11 0.00 0.00 41.96 40.84 2hkr s TYR 122 CO 0.02 0.03 1.12 -1.17 -1.11 0.00 0.00 175.55 174.44 2hkr s LEU 123 N -0.85 4.24 -0.20 -1.29 2.96 0.87 -1.41 118.68 123.02 2hkr s LEU 123 Ca 0.05 1.66 0.01 0.00 -0.22 0.00 0.00 54.13 55.63 2hkr s LEU 123 Cb -0.07 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.09 2hkr s LEU 123 CO 0.01 -0.55 -0.17 -0.63 -1.32 0.00 0.00 176.35 173.69 2hkr s ILE 124 N 2.32 2.00 -0.26 6.68 -1.09 0.20 -0.88 121.20 130.17 2hkr s ILE 124 Ca 0.52 -1.08 -0.19 0.00 -2.23 0.00 0.00 60.65 57.67 2hkr s ILE 124 Cb -0.21 -1.91 -0.02 0.00 -1.58 0.00 0.00 42.46 38.74 2hkr s ILE 124 CO 0.19 0.37 0.57 -0.94 -1.23 0.00 0.00 174.94 173.90 2hkr s SER 125 N 1.28 6.50 -1.07 3.58 1.04 0.20 -0.05 113.70 125.17 2hkr s SER 125 Ca 0.01 0.59 -0.14 0.00 0.48 0.00 0.00 55.95 56.90 2hkr s SER 125 Cb -0.15 -2.31 0.19 0.00 0.10 0.00 0.00 66.02 63.85 2hkr s SER 125 CO -0.11 -0.34 1.21 -0.31 0.98 0.00 0.00 173.24 174.67 2hkr s TYR 126 N 2.42 3.62 0.38 5.02 1.51 -1.26 -1.02 117.35 128.03 2hkr s TYR 126 Ca 0.24 -2.07 -0.23 0.00 -1.01 0.00 0.00 57.07 53.99 2hkr s TYR 126 Cb -0.16 -4.14 -0.10 0.00 -0.11 0.00 0.00 41.96 37.45 2hkr s TYR 126 CO 0.09 -1.27 0.96 -1.01 -1.11 0.00 0.00 175.55 173.21 2hkr s HIS 127 N 1.01 3.47 0.32 2.71 3.76 -1.23 -4.60 115.29 120.73 2hkr s HIS 127 Ca 0.35 1.69 0.04 0.00 -0.15 0.00 0.00 55.06 56.99 2hkr s HIS 127 Cb -0.06 -2.91 -0.02 0.00 1.11 0.00 0.00 32.58 30.70 2hkr s HIS 127 CO -0.05 -0.03 0.47 -0.51 -0.85 0.00 0.00 174.74 173.77 2hkr s ASP 128 N -1.88 6.13 -0.06 1.40 1.01 -1.26 0.15 116.67 122.16 2hkr s ASP 128 Ca 0.57 0.07 0.00 0.00 0.71 0.00 0.00 52.55 53.90 2hkr s ASP 128 Cb -0.14 -1.63 -0.03 0.00 1.01 0.00 0.00 42.92 42.13 2hkr s ASP 128 CO 0.19 -0.31 -0.05 0.00 0.21 0.00 0.00 175.17 175.21 2hkr n GLY 131 N -0.14 0.68 3.11 0.00 0.00 0.02 -0.91 105.19 107.93 2hkr n GLY 131 Ca -0.09 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 2hkr n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hkr s LYS 132 N -0.54 0.65 0.95 1.61 1.02 -1.26 -4.92 119.74 117.25 2hkr s LYS 132 Ca 0.00 -0.98 -0.12 0.00 0.02 0.00 0.00 55.97 54.89 2hkr s LYS 132 Cb 0.00 -0.28 0.16 0.00 -0.52 0.00 0.00 37.83 37.19 2hkr s LYS 132 CO 0.00 0.03 1.10 0.95 -0.92 0.00 0.00 175.35 176.51 2hkr s THR 133 N -2.20 2.31 0.13 2.17 -4.23 -1.26 -3.27 115.64 109.29 2hkr s THR 133 Ca -0.02 0.10 -0.35 0.00 -1.18 0.00 0.00 61.69 60.24 2hkr s THR 133 Cb -0.04 -2.62 -0.15 0.00 1.34 0.00 0.00 72.50 71.02 2hkr s THR 133 CO -0.01 -0.13 1.42 0.00 -0.54 0.00 0.00 174.62 175.35 2hkr n ALA 134 N -4.02 0.01 -0.21 3.99 0.00 -1.20 -4.57 120.51 114.51 2hkr n ALA 134 Ca 0.06 0.48 -0.09 0.00 0.00 0.00 0.00 53.44 53.89 2hkr n ALA 134 Cb 0.57 -2.18 0.02 0.00 0.00 0.00 0.00 19.45 17.85 2hkr n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hkr n GLY 136 N -0.47 1.85 3.68 0.00 0.00 -1.26 -5.02 105.19 103.97 2hkr n GLY 136 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2hkr n GLY 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hkr s ARG 137 N -0.39 2.76 -1.19 1.61 0.52 -1.26 -4.65 118.95 116.35 2hkr s ARG 137 Ca 0.00 -0.63 -0.12 0.00 -0.52 0.00 0.00 55.73 54.47 2hkr s ARG 137 Cb 0.00 -2.65 -0.02 0.00 0.52 0.00 0.00 34.95 32.80 2hkr s ARG 137 CO 0.00 0.62 0.76 0.00 0.02 0.00 0.00 175.30 176.70 2hkr s GLN 139 N -5.78 4.35 0.19 0.00 0.74 -1.26 -1.24 119.66 116.66 2hkr s GLN 139 Ca 0.32 1.84 0.09 0.00 0.05 0.00 0.00 55.36 57.65 2hkr s GLN 139 Cb -0.10 -3.46 -0.04 0.00 1.10 0.00 0.00 33.01 30.51 2hkr s GLN 139 CO 0.83 -0.42 -0.18 0.00 -0.55 0.00 0.00 175.29 174.97 2hkr n ASN 141 N 0.05 -0.01 -4.87 0.00 5.15 -1.12 -1.28 115.26 113.19 2hkr n ASN 141 Ca -0.11 -2.96 -0.32 0.00 -0.60 0.00 0.00 54.58 50.59 2hkr n ASN 141 Cb 0.58 0.14 -0.06 0.00 -0.53 0.00 0.00 39.78 39.92 2hkr n ASN 141 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2hkr s THR 142 N -1.72 4.89 -0.02 -0.44 2.01 0.04 -4.94 115.64 115.46 2hkr s THR 142 Ca 0.30 0.57 0.06 0.00 0.31 0.00 0.00 61.69 62.93 2hkr s THR 142 Cb 0.38 -3.63 0.11 0.00 0.01 0.00 0.00 72.50 69.37 2hkr s THR 142 CO -0.04 -0.06 1.05 0.00 -0.69 0.00 0.00 174.62 174.88 2hkr n GLN 143 N -0.09 0.14 -1.80 4.92 1.13 -1.12 -3.27 117.38 117.30 2hkr n GLN 143 Ca 0.00 -1.35 -0.42 0.00 -1.94 0.00 0.00 57.00 53.29 2hkr n GLN 143 Cb 0.52 -0.52 -0.03 0.00 0.11 0.00 0.00 30.24 30.32 2hkr n GLN 143 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2hkr s THR 144 N -0.31 3.16 -0.33 5.09 2.01 -0.35 -1.91 115.64 123.01 2hkr s THR 144 Ca 0.09 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.37 2hkr s THR 144 Cb 0.10 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.43 2hkr s THR 144 CO -0.03 -0.02 0.00 0.54 -0.69 0.00 0.00 174.62 174.42 2hkr n ARG 145 N 7.10 -1.49 -2.45 4.92 1.74 -1.26 -4.58 116.66 120.64 2hkr n ARG 145 Ca 0.19 0.52 -0.39 0.00 -0.77 0.00 0.00 57.85 57.39 2hkr n ARG 145 Cb 0.41 -4.70 -0.04 0.00 -1.02 0.00 0.00 32.46 27.11 2hkr n ARG 145 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2hkr s GLU 146 N -1.91 4.48 0.15 5.56 -6.30 -0.80 -4.98 118.70 114.90 2hkr s GLU 146 Ca 0.00 1.77 0.03 0.00 -2.50 0.00 0.00 54.97 54.27 2hkr s GLU 146 Cb 0.00 -3.01 -0.05 0.00 0.00 0.00 0.00 34.13 31.07 2hkr s GLU 146 CO 0.00 0.08 -0.06 1.03 0.02 0.00 0.00 175.26 176.33 2hkr s ARG 147 N -1.74 1.06 1.21 4.30 1.81 -0.90 -5.03 118.95 119.65 2hkr s ARG 147 Ca 0.48 -1.47 -0.20 0.00 -1.72 0.00 0.00 55.73 52.82 2hkr s ARG 147 Cb -0.30 -0.45 0.30 0.00 -0.45 0.00 0.00 34.95 34.04 2hkr s ARG 147 CO 0.39 -0.01 1.14 -2.14 -0.68 0.00 0.00 175.30 174.00 2hkr s PRO 148 N -3.82 -1.31 0.25 3.54 0.02 -1.26 -3.65 135.00 128.77 2hkr s PRO 148 Ca 0.19 -0.22 0.21 0.00 0.02 0.00 0.00 61.00 61.20 2hkr s PRO 148 Cb 0.04 -1.60 0.96 0.00 0.02 0.00 0.00 34.50 33.93 2hkr s PRO 148 CO 0.01 -3.74 1.63 0.41 -0.33 0.00 0.00 177.00 174.98 2hkr n GLY 149 N -1.28 -1.07 0.00 0.52 0.00 -1.26 -0.59 105.19 101.52 2hkr n GLY 149 Ca 0.15 0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.40 2hkr n GLY 149 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2hkr n TYR 150 N -2.15 0.00 -3.48 1.61 0.18 -1.26 -3.07 117.16 108.99 2hkr n TYR 150 Ca 0.01 0.00 -0.27 0.00 1.88 0.00 0.00 57.90 59.52 2hkr n TYR 150 Cb 0.14 -0.23 -0.09 0.00 -0.38 0.00 0.00 39.34 38.79 2hkr n TYR 150 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2hkr n GLU 151 N -1.23 2.17 -0.28 -3.48 1.02 0.25 -5.02 120.64 114.07 2hkr n GLU 151 Ca 0.13 -4.46 -0.05 0.00 -0.02 0.00 0.00 57.16 52.76 2hkr n GLU 151 Cb 0.17 -2.14 0.09 0.00 -0.02 0.00 0.00 31.44 29.54 2hkr n GLU 151 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2hkr h PHE 152 N 4.40 1.17 -0.03 -0.32 3.57 -1.69 -0.98 116.94 123.06 2hkr h PHE 152 Ca 0.18 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2hkr h PHE 152 Cb 0.70 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.09 2hkr h PHE 152 CO 0.67 0.88 0.00 1.19 -2.23 0.00 0.00 178.31 178.81 2hkr n PHE 153 N -4.29 0.04 0.14 0.41 3.01 -1.26 -1.96 117.46 113.55 2hkr n PHE 153 Ca 0.07 -0.02 0.10 0.00 1.01 0.00 0.00 57.45 58.61 2hkr n PHE 153 Cb 0.17 0.00 0.19 0.00 -0.01 0.00 0.00 39.48 39.83 2hkr n PHE 153 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2hkr n LEU 154 N -0.59 3.19 -4.61 4.37 4.77 -0.38 -1.13 117.00 122.63 2hkr n LEU 154 Ca 0.15 -1.60 -0.34 0.00 -0.03 0.00 0.00 56.01 54.20 2hkr n LEU 154 Cb 0.12 -0.24 -0.10 0.00 -2.33 0.00 0.00 43.42 40.87 2hkr n LEU 154 CO 0.12 0.72 -0.29 -2.28 -1.33 0.00 0.00 177.39 174.32 2hkr s HIS 155 N -1.24 3.17 -0.19 -1.77 2.46 -0.83 -2.12 115.29 114.77 2hkr s HIS 155 Ca 0.33 -0.01 0.09 0.00 0.47 0.00 0.00 55.06 55.94 2hkr s HIS 155 Cb 0.19 -1.98 0.19 0.00 -0.13 0.00 0.00 32.58 30.85 2hkr s HIS 155 CO 0.26 0.18 1.13 0.27 -2.47 0.00 0.00 174.74 174.10 2hkr n ASN 156 N 3.20 2.44 -1.43 9.88 0.23 -1.26 -4.51 115.26 123.81 2hkr n ASN 156 Ca -0.17 -2.45 0.08 0.00 -0.53 0.00 0.00 54.58 51.50 2hkr n ASN 156 Cb 0.53 -0.23 0.31 0.00 -2.08 0.00 0.00 39.78 38.31 2hkr n ASN 156 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2hkr n ASP 157 N -0.66 4.22 -4.47 0.53 8.00 -1.26 -4.68 116.55 118.24 2hkr n ASP 157 Ca 0.09 -2.43 -0.25 0.00 0.71 0.00 0.00 54.79 52.91 2hkr n ASP 157 Cb 0.47 -0.55 -0.10 0.00 -0.02 0.00 0.00 41.12 40.91 2hkr n ASP 157 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2hkr s VAL 158 N -1.89 2.50 -0.53 2.53 -7.23 -1.26 -5.10 120.40 109.41 2hkr s VAL 158 Ca 0.44 -2.25 -0.27 0.00 -1.81 0.00 0.00 61.98 58.09 2hkr s VAL 158 Cb 0.29 -2.27 0.03 0.00 0.56 0.00 0.00 36.38 34.99 2hkr s VAL 158 CO 0.20 -0.30 1.06 0.21 -0.31 0.00 0.00 175.10 175.96 2hkr s ASN 159 N -3.24 6.46 0.00 4.85 2.47 -1.26 -4.90 114.94 119.33 2hkr s ASN 159 Ca 0.27 0.05 0.22 0.00 0.42 0.00 0.00 52.86 53.83 2hkr s ASN 159 Cb -0.06 -2.50 1.32 0.00 -1.45 0.00 0.00 41.25 38.56 2hkr s ASN 159 CO 0.14 -1.28 1.71 0.79 -3.72 0.00 0.00 177.10 174.73 2hkr n TRP 160 N 7.80 0.00 1.98 0.43 7.02 -1.26 -1.16 117.44 132.26 2hkr n TRP 160 Ca 0.07 0.00 0.08 0.00 -1.02 0.00 0.00 57.50 56.63 2hkr n TRP 160 Cb 0.48 0.00 0.46 0.00 -2.42 0.00 0.00 31.31 29.84 2hkr n TRP 160 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2hkr h MET 162 N 0.05 0.00 -0.29 0.00 -0.00 -1.42 -1.72 114.93 111.55 2hkr h MET 162 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2hkr h MET 162 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.61 2hkr h MET 162 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.91 176.91 2hkr n ALA 163 N -2.21 2.26 -1.55 -3.00 0.00 -1.26 -4.92 120.51 109.83 2hkr n ALA 163 Ca -0.02 -1.02 -0.31 0.00 0.00 0.00 0.00 53.44 52.09 2hkr n ALA 163 Cb 0.14 -0.45 0.06 0.00 0.00 0.00 0.00 19.45 19.21 2hkr n ALA 163 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2hkr s ASN 164 N -1.00 5.16 0.27 0.00 0.01 -0.65 -4.95 114.94 113.78 2hkr s ASN 164 Ca 0.22 1.57 -0.02 0.00 -0.71 0.00 0.00 52.86 53.92 2hkr s ASN 164 Cb 0.12 -2.41 0.43 0.00 0.41 0.00 0.00 41.25 39.80 2hkr s ASN 164 CO 0.16 -1.58 1.87 -0.08 -1.51 0.00 0.00 177.10 175.96 2hkr h GLU 165 N -0.81 1.07 -4.79 -0.60 4.81 -1.95 -3.34 114.58 108.95 2hkr h GLU 165 Ca -0.44 -0.06 -0.61 0.00 -0.13 0.00 0.00 59.36 58.11 2hkr h GLU 165 Cb 1.22 -0.24 -0.35 0.00 0.63 0.00 0.00 28.75 30.01 2hkr h GLU 165 CO 0.57 0.71 -0.84 1.21 -0.73 0.00 0.00 179.01 179.93 2hkr s ASN 166 N -5.83 2.66 0.00 1.04 3.84 -1.26 -5.03 114.94 110.36 2hkr s ASN 166 Ca -0.12 -0.49 0.23 0.00 0.21 0.00 0.00 52.86 52.69 2hkr s ASN 166 Cb 0.20 -1.19 0.96 0.00 -0.55 0.00 0.00 41.25 40.67 2hkr s ASN 166 CO 0.81 -0.00 1.67 -1.54 -2.79 0.00 0.00 177.10 175.24 2hkr n SER 167 N 4.42 1.19 -4.72 -4.21 3.41 -1.26 -3.28 113.62 109.19 2hkr n SER 167 Ca -0.18 -1.56 -0.42 0.00 -0.26 0.00 0.00 58.87 56.45 2hkr n SER 167 Cb 0.51 -0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 2hkr n SER 167 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2hkr s THR 168 N -1.89 2.34 -0.14 6.66 2.01 -1.26 -4.70 115.64 118.66 2hkr s THR 168 Ca 0.34 0.21 -0.25 0.00 0.31 0.00 0.00 61.69 62.30 2hkr s THR 168 Cb 0.18 -3.13 -0.02 0.00 0.01 0.00 0.00 72.50 69.53 2hkr s THR 168 CO 0.28 0.01 0.79 0.12 -0.69 0.00 0.00 174.62 175.13 2hkr s PHE 169 N 1.32 3.47 -0.16 4.92 5.36 -1.26 -0.80 117.98 130.83 2hkr s PHE 169 Ca 0.73 1.25 -0.13 0.00 -0.96 0.00 0.00 56.93 57.83 2hkr s PHE 169 Cb -0.47 -2.95 -0.07 0.00 -0.34 0.00 0.00 43.02 39.20 2hkr s PHE 169 CO 0.32 -0.14 -0.28 1.58 -1.46 0.00 0.00 175.22 175.24 2hkr n HIS 170 N 4.77 0.00 -3.83 10.12 -0.00 -0.56 -3.26 115.22 122.47 2hkr n HIS 170 Ca 0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.69 2hkr n HIS 170 Cb 0.50 -0.55 -0.01 0.00 -0.00 0.00 0.00 29.99 29.92 2hkr n HIS 170 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2hkr s THR 172 N -3.54 2.87 0.33 0.00 2.01 0.89 -0.45 115.64 117.74 2hkr s THR 172 Ca 0.12 -0.78 0.08 0.00 0.31 0.00 0.00 61.69 61.42 2hkr s THR 172 Cb -0.05 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.31 2hkr s THR 172 CO 0.06 0.58 0.23 0.42 -0.69 0.00 0.00 174.62 175.22 2hkr s THR 173 N -0.46 3.39 -0.34 -0.82 -4.23 0.12 -1.45 115.64 111.86 2hkr s THR 173 Ca 0.05 -1.50 -0.00 0.00 -1.18 0.00 0.00 61.69 59.07 2hkr s THR 173 Cb -0.12 -3.12 0.11 0.00 1.34 0.00 0.00 72.50 70.71 2hkr s THR 173 CO 0.02 -0.19 0.13 -0.44 -0.54 0.00 0.00 174.62 173.59 2hkr s SER 174 N -3.93 3.96 -0.21 3.99 0.01 -1.12 -3.47 113.70 112.93 2hkr s SER 174 Ca 0.39 -1.86 -0.06 0.00 1.31 0.00 0.00 55.95 55.73 2hkr s SER 174 Cb -0.05 -0.91 -0.03 0.00 0.21 0.00 0.00 66.02 65.24 2hkr s SER 174 CO 0.25 -0.38 0.03 -0.69 0.41 0.00 0.00 173.24 172.86 2hkr s VAL 175 N 1.33 4.24 -0.21 3.43 1.01 -0.19 -4.73 120.40 125.28 2hkr s VAL 175 Ca 0.12 -0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 2hkr s VAL 175 Cb -0.19 -2.93 -0.01 0.00 0.00 0.00 0.00 36.38 33.25 2hkr s VAL 175 CO -0.19 0.41 1.30 -0.22 0.00 0.00 0.00 175.10 176.40 2hkr s LEU 176 N 1.04 4.07 -0.19 3.92 0.20 -1.26 -0.63 118.68 125.83 2hkr s LEU 176 Ca 0.03 1.54 -0.21 0.00 0.69 0.00 0.00 54.13 56.19 2hkr s LEU 176 Cb -0.14 -3.54 -0.18 0.00 -0.43 0.00 0.00 46.19 41.90 2hkr s LEU 176 CO 0.02 -0.90 0.22 0.58 -0.29 0.00 0.00 176.35 175.99 2hkr h VAL 177 N 5.68 0.89 0.00 1.68 2.07 -1.39 -3.48 116.25 121.70 2hkr h VAL 177 Ca -0.27 -2.04 0.00 0.00 0.82 0.00 0.00 66.70 65.21 2hkr h VAL 177 Cb 1.11 2.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.93 2hkr h VAL 177 CO 0.99 0.30 0.00 0.61 0.02 0.00 0.00 177.57 179.49 2hkr n GLY 178 N 1.48 -1.37 3.77 2.17 0.00 -1.20 -5.01 105.19 105.04 2hkr n GLY 178 Ca -0.26 -1.05 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 2hkr n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hkr s LEU 179 N 0.00 4.38 0.00 0.99 1.43 -1.26 -0.09 118.68 124.13 2hkr s LEU 179 Ca 0.00 2.83 0.12 0.00 -1.03 0.00 0.00 54.13 56.05 2hkr s LEU 179 Cb 0.00 -3.66 0.70 0.00 0.03 0.00 0.00 46.19 43.26 2hkr s LEU 179 CO 0.00 -0.67 1.13 0.00 0.23 0.00 0.00 176.35 177.04