#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c5r s LEU 67 N 0.00 2.94 0.79 1.20 1.43 -1.26 -5.12 118.68 118.66 2c5r s LEU 67 Ca 0.00 -1.24 -0.15 0.00 -1.03 0.00 0.00 54.13 51.71 2c5r s LEU 67 Cb 0.00 -1.10 0.01 0.00 0.03 0.00 0.00 46.19 45.13 2c5r s LEU 67 CO 0.00 -0.44 0.70 -1.54 0.23 0.00 0.00 176.35 175.30 2c5r n SER 68 N -1.03 -0.71 0.11 2.29 3.41 -1.26 -4.81 113.62 111.62 2c5r n SER 68 Ca -0.04 0.54 -0.13 0.00 -0.26 0.00 0.00 58.87 58.98 2c5r n SER 68 Cb 0.66 -1.30 -0.07 0.00 -0.26 0.00 0.00 64.21 63.23 2c5r n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c5r h ALA 69 N -0.75 -0.21 -0.58 7.33 0.00 -1.99 -2.10 119.26 120.96 2c5r h ALA 69 Ca -0.45 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 2c5r h ALA 69 Cb 1.32 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2c5r h ALA 69 CO 0.42 -0.62 -0.04 0.00 0.00 0.00 0.00 179.25 179.02 2c5r h GLU 71 N 0.95 -0.33 -0.94 0.00 5.08 -1.90 0.14 114.58 117.58 2c5r h GLU 71 Ca 0.16 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.67 2c5r h GLU 71 Cb 0.60 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.85 2c5r h GLU 71 CO 0.04 -0.22 0.60 0.28 -1.00 0.00 0.00 179.01 178.70 2c5r h VAL 72 N -0.34 0.90 -0.42 3.13 2.07 -0.62 -1.85 116.25 119.11 2c5r h VAL 72 Ca 0.10 -0.30 0.07 0.00 0.82 0.00 0.00 66.70 67.40 2c5r h VAL 72 Cb 0.58 -0.04 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 2c5r h VAL 72 CO -0.63 0.16 0.08 0.00 0.02 0.00 0.00 177.57 177.20 2c5r h ALA 73 N 1.57 0.46 0.12 1.67 0.00 0.20 -2.56 119.26 120.72 2c5r h ALA 73 Ca 0.46 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.46 2c5r h ALA 73 Cb 0.56 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2c5r h ALA 73 CO -0.23 -0.32 -0.06 0.28 0.00 0.00 0.00 179.25 178.92 2c5r h VAL 74 N 0.21 0.89 -0.64 0.00 2.07 -0.49 -2.88 116.25 115.41 2c5r h VAL 74 Ca 0.21 -1.27 0.19 0.00 0.82 0.00 0.00 66.70 66.64 2c5r h VAL 74 Cb 0.26 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 2c5r h VAL 74 CO -0.28 0.25 0.73 -0.07 0.02 0.00 0.00 177.57 178.22 2c5r h LEU 75 N -0.89 0.00 0.00 2.57 3.38 -1.44 0.23 115.31 119.16 2c5r h LEU 75 Ca -0.02 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.76 2c5r h LEU 75 Cb 0.53 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2c5r h LEU 75 CO 0.03 0.00 -1.15 0.44 0.09 0.00 0.00 178.44 177.85 2c5r h ASP 76 N 0.00 0.00 -0.63 -0.43 3.45 -1.39 -2.07 116.42 115.36 2c5r h ASP 76 Ca 0.30 0.00 0.10 0.00 0.43 0.00 0.00 57.03 57.87 2c5r h ASP 76 Cb 1.76 0.00 -0.12 0.00 -0.56 0.00 0.00 39.33 40.41 2c5r h ASP 76 CO -0.00 0.79 -0.36 -0.07 -1.57 0.00 0.00 179.24 178.02 2c5r h LEU 77 N 0.00 -1.27 -0.86 1.55 3.38 -0.35 0.54 115.31 118.31 2c5r h LEU 77 Ca -0.11 0.24 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2c5r h LEU 77 Cb 1.69 0.62 -0.01 0.00 0.09 0.00 0.00 40.66 43.05 2c5r h LEU 77 CO 0.08 -0.31 -0.23 1.88 0.09 0.00 0.00 178.44 179.96 2c5r h TYR 78 N -0.16 0.66 -0.43 1.13 0.05 -1.30 -0.55 116.97 116.37 2c5r h TYR 78 Ca 0.23 -0.14 -0.08 0.00 0.05 0.00 0.00 58.73 58.79 2c5r h TYR 78 Cb 0.56 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 2c5r h TYR 78 CO -0.68 0.77 -0.05 1.49 -1.05 0.00 0.00 178.16 178.65 2c5r h GLU 79 N 0.52 0.79 0.00 4.88 4.81 -0.90 -1.76 114.58 122.92 2c5r h GLU 79 Ca 0.08 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 2c5r h GLU 79 Cb 0.68 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.00 2c5r h GLU 79 CO 0.05 0.88 0.00 1.96 -0.73 0.00 0.00 179.01 181.17 2c5r h GLN 80 N 0.61 0.00 -0.55 1.92 4.20 0.82 0.92 115.11 123.04 2c5r h GLN 80 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2c5r h GLN 80 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2c5r h GLN 80 CO 0.03 0.00 0.00 0.43 -0.67 0.00 0.00 178.83 178.62 2c5r n SER 81 N -2.72 3.04 -3.87 1.46 7.64 -0.28 -4.98 113.62 113.90 2c5r n SER 81 Ca -0.01 -2.08 -0.24 0.00 1.01 0.00 0.00 58.87 57.55 2c5r n SER 81 Cb 0.16 -0.39 -0.00 0.00 -1.01 0.00 0.00 64.21 62.97 2c5r n SER 81 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2c5r n ASN 82 N 1.00 -0.74 -4.21 6.43 3.02 0.32 -5.01 115.26 116.07 2c5r n ASN 82 Ca 0.18 -0.96 -0.33 0.00 -0.03 0.00 0.00 54.58 53.44 2c5r n ASN 82 Cb 0.51 -3.34 -0.16 0.00 -0.61 0.00 0.00 39.78 36.18 2c5r n ASN 82 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2c5r s ILE 83 N -3.86 2.44 0.17 2.41 1.01 -0.70 -5.04 121.20 117.64 2c5r s ILE 83 Ca 0.02 -0.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.54 2c5r s ILE 83 Cb -0.01 -2.03 -0.07 0.00 0.01 0.00 0.00 42.46 40.36 2c5r s ILE 83 CO 0.87 0.52 0.99 -0.13 0.00 0.00 0.00 174.94 177.19 2c5r s ARG 84 N 1.04 4.72 -0.29 2.79 0.52 -1.26 -4.39 118.95 122.07 2c5r s ARG 84 Ca -0.01 1.54 -0.12 0.00 -0.52 0.00 0.00 55.73 56.62 2c5r s ARG 84 Cb -0.15 -3.31 -0.04 0.00 0.52 0.00 0.00 34.95 31.97 2c5r s ARG 84 CO -0.05 0.27 0.25 0.42 0.02 0.00 0.00 175.30 176.22 2c5r s ILE 85 N -0.48 5.26 0.61 1.52 -1.09 -1.26 -5.07 121.20 120.69 2c5r s ILE 85 Ca 0.46 0.21 -0.18 0.00 -2.23 0.00 0.00 60.65 58.91 2c5r s ILE 85 Cb -0.26 -3.62 -0.06 0.00 -1.58 0.00 0.00 42.46 36.94 2c5r s ILE 85 CO 0.32 0.17 0.67 -2.65 -1.23 0.00 0.00 174.94 172.22 2c5r n PRO 86 N 5.16 0.58 0.16 2.79 -0.02 -1.26 -4.86 135.00 137.55 2c5r n PRO 86 Ca -0.12 0.23 0.13 0.00 -2.02 0.00 0.00 63.50 61.72 2c5r n PRO 86 Cb 0.51 -1.88 0.30 0.00 -0.02 0.00 0.00 33.50 32.42 2c5r n PRO 86 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2c5r h SER 87 N 0.18 0.00 -0.78 2.55 4.64 -2.00 -2.53 113.55 115.61 2c5r h SER 87 Ca -0.47 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 60.91 2c5r h SER 87 Cb 1.38 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.42 2c5r h SER 87 CO 0.47 0.00 0.51 0.44 -0.87 0.00 0.00 176.83 177.38 2c5r h ASP 88 N 0.00 0.77 -0.70 4.97 5.19 -2.00 -2.02 116.42 122.63 2c5r h ASP 88 Ca 0.00 -0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.37 2c5r h ASP 88 Cb 0.85 -0.17 -0.03 0.00 0.18 0.00 0.00 39.33 40.16 2c5r h ASP 88 CO 0.00 0.51 0.28 0.40 -3.12 0.00 0.00 179.24 177.31 2c5r h ILE 89 N 0.88 1.25 0.85 0.35 2.04 -1.80 -1.73 117.51 119.34 2c5r h ILE 89 Ca 0.33 -0.78 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 2c5r h ILE 89 Cb 0.17 0.44 0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2c5r h ILE 89 CO -0.11 0.31 -0.41 0.40 0.00 0.00 0.00 178.15 178.35 2c5r h ILE 90 N 1.01 0.00 -0.28 -0.67 1.08 -1.43 -0.91 117.51 116.30 2c5r h ILE 90 Ca 0.23 -0.08 0.03 0.00 -0.39 0.00 0.00 64.86 64.65 2c5r h ILE 90 Cb 0.21 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 33.93 2c5r h ILE 90 CO -0.02 0.00 -0.17 1.21 -0.69 0.00 0.00 178.15 178.48 2c5r n GLU 91 N -5.28 -0.12 0.25 2.37 4.07 -0.81 -0.70 120.64 120.42 2c5r n GLU 91 Ca -0.14 0.47 0.12 0.00 -0.06 0.00 0.00 57.16 57.55 2c5r n GLU 91 Cb 0.45 -0.69 0.61 0.00 -0.06 0.00 0.00 31.44 31.75 2c5r n GLU 91 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2c5r h ASP 92 N 0.00 0.00 0.21 4.31 3.45 -0.82 -2.81 116.42 120.75 2c5r h ASP 92 Ca 0.05 0.00 -0.30 0.00 0.43 0.00 0.00 57.03 57.21 2c5r h ASP 92 Cb 0.12 0.00 0.03 0.00 -0.56 0.00 0.00 39.33 38.92 2c5r h ASP 92 CO -0.27 0.15 -1.28 0.25 -1.57 0.00 0.00 179.24 176.52 2c5r h LEU 93 N 0.00 0.77 -0.87 1.55 5.85 0.49 -3.23 115.31 119.88 2c5r h LEU 93 Ca -0.00 -0.91 0.12 0.00 0.84 0.00 0.00 57.88 57.93 2c5r h LEU 93 Cb 0.54 -0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.24 2c5r h LEU 93 CO 0.02 1.62 0.49 -0.37 -0.34 0.00 0.00 178.44 179.86 2c5r h VAL 94 N 0.05 0.85 0.00 1.05 -1.51 -1.00 -2.78 116.25 112.91 2c5r h VAL 94 Ca -0.22 -0.27 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 2c5r h VAL 94 Cb 2.00 0.01 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 2c5r h VAL 94 CO 0.24 0.14 0.00 0.59 -1.23 0.00 0.00 177.57 177.31 2c5r n ASN 95 N -4.76 0.68 0.00 4.19 3.02 -1.12 -2.92 115.26 114.34 2c5r n ASN 95 Ca 0.16 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 54.17 2c5r n ASN 95 Cb 0.35 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 2c5r n ASN 95 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2c5r n GLN 96 N 0.74 0.00 -3.90 3.52 1.13 -1.05 -5.04 117.38 112.78 2c5r n GLN 96 Ca 0.00 0.00 -0.27 0.00 -1.94 0.00 0.00 57.00 54.79 2c5r n GLN 96 Cb 0.12 -0.17 -0.07 0.00 0.11 0.00 0.00 30.24 30.23 2c5r n GLN 96 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2c5r n ARG 97 N 0.00 -0.89 -1.24 -1.09 5.12 -1.15 -4.84 116.66 112.58 2c5r n ARG 97 Ca 0.00 0.08 -0.33 0.00 -1.93 0.00 0.00 57.85 55.68 2c5r n ARG 97 Cb 0.17 -3.10 0.11 0.00 -1.16 0.00 0.00 32.46 28.47 2c5r n ARG 97 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2c5r s LEU 98 N -6.20 3.14 -0.02 0.55 1.43 -1.26 -4.96 118.68 111.35 2c5r s LEU 98 Ca 0.24 2.16 0.15 0.00 -1.03 0.00 0.00 54.13 55.65 2c5r s LEU 98 Cb -0.14 -4.56 -0.23 0.00 0.03 0.00 0.00 46.19 41.29 2c5r s LEU 98 CO 0.78 -2.37 0.35 0.00 0.23 0.00 0.00 176.35 175.35 2c5r n GLN 99 N -3.26 0.60 -4.01 1.70 6.02 -1.26 -4.90 117.38 112.26 2c5r n GLN 99 Ca 0.12 -0.13 -0.22 0.00 -0.01 0.00 0.00 57.00 56.76 2c5r n GLN 99 Cb 0.51 -1.34 -0.04 0.00 1.02 0.00 0.00 30.24 30.39 2c5r n GLN 99 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2c5r s SER 100 N -3.63 5.26 0.23 1.08 1.04 -1.26 -5.00 113.70 111.43 2c5r s SER 100 Ca -0.05 -0.43 -0.07 0.00 0.48 0.00 0.00 55.95 55.88 2c5r s SER 100 Cb 0.10 -1.12 0.32 0.00 0.10 0.00 0.00 66.02 65.42 2c5r s SER 100 CO 0.63 -0.18 1.81 -0.33 0.98 0.00 0.00 173.24 176.14 2c5r h GLU 101 N 1.44 0.70 -0.96 4.02 5.08 -1.92 -2.69 114.58 120.25 2c5r h GLU 101 Ca -0.46 -0.04 0.19 0.00 -1.00 0.00 0.00 59.36 58.04 2c5r h GLU 101 Cb 1.25 -0.16 -0.11 0.00 0.50 0.00 0.00 28.75 30.23 2c5r h GLU 101 CO 0.60 0.47 0.55 0.37 -1.00 0.00 0.00 179.01 180.00 2c5r h GLN 102 N 0.73 0.67 -0.02 2.33 5.75 -1.98 0.61 115.11 123.20 2c5r h GLN 102 Ca 0.35 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.71 2c5r h GLN 102 Cb 0.28 -0.15 0.01 0.00 1.07 0.00 0.00 27.48 28.69 2c5r h GLN 102 CO -0.22 0.45 -0.36 0.93 -2.65 0.00 0.00 178.83 176.97 2c5r h GLU 103 N 0.69 0.28 -0.10 1.69 5.08 -1.94 -2.27 114.58 118.02 2c5r h GLU 103 Ca 0.56 -0.27 0.03 0.00 -1.00 0.00 0.00 59.36 58.68 2c5r h GLU 103 Cb 0.88 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 30.14 2c5r h GLU 103 CO -0.40 0.96 -0.48 0.28 -1.00 0.00 0.00 179.01 178.38 2c5r h VAL 104 N -0.31 0.07 -0.53 3.13 2.07 -1.02 0.18 116.25 119.85 2c5r h VAL 104 Ca -0.04 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.57 2c5r h VAL 104 Cb 1.08 0.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.85 2c5r h VAL 104 CO 0.07 0.00 0.14 0.25 0.02 0.00 0.00 177.57 178.05 2c5r h LEU 105 N -0.56 0.07 -1.27 2.57 6.46 0.21 0.87 115.31 123.66 2c5r h LEU 105 Ca 0.05 0.09 -0.03 0.00 -0.12 0.00 0.00 57.88 57.87 2c5r h LEU 105 Cb 0.67 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.68 2c5r h LEU 105 CO -0.40 0.06 0.19 0.78 -0.62 0.00 0.00 178.44 178.45 2c5r h ASN 106 N 0.29 0.63 0.20 1.25 -0.26 -0.91 0.59 115.58 117.36 2c5r h ASN 106 Ca 0.27 -0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.93 2c5r h ASN 106 Cb 0.35 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 2c5r h ASN 106 CO -0.32 0.58 -0.09 0.22 -1.06 0.00 0.00 177.43 176.75 2c5r h TYR 107 N 0.69 -0.24 -0.30 1.19 3.20 0.17 -2.14 116.97 119.54 2c5r h TYR 107 Ca 0.17 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.07 2c5r h TYR 107 Cb 0.15 0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 2c5r h TYR 107 CO 0.01 0.08 0.05 0.82 -1.64 0.00 0.00 178.16 177.48 2c5r h ILE 108 N -0.58 0.84 -0.85 1.81 2.04 -1.03 -1.77 117.51 117.97 2c5r h ILE 108 Ca -0.03 -0.05 0.15 0.00 1.00 0.00 0.00 64.86 65.93 2c5r h ILE 108 Cb 0.43 0.67 -0.09 0.00 -0.74 0.00 0.00 36.82 37.09 2c5r h ILE 108 CO 0.04 0.03 0.43 -0.33 0.00 0.00 0.00 178.15 178.32 2c5r h GLU 109 N 0.16 0.60 -0.20 2.37 4.39 -0.89 -0.72 114.58 120.28 2c5r h GLU 109 Ca 0.14 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2c5r h GLU 109 Cb 0.16 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2c5r h GLU 109 CO -0.19 0.39 0.01 1.15 -1.16 0.00 0.00 179.01 179.21 2c5r h THR 110 N 0.61 1.12 0.11 1.13 2.02 -0.65 -2.44 112.91 114.81 2c5r h THR 110 Ca 0.46 -0.47 -0.27 0.00 0.77 0.00 0.00 66.41 66.91 2c5r h THR 110 Cb 0.66 0.96 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 2c5r h THR 110 CO -0.37 0.16 -1.24 1.56 0.37 0.00 0.00 175.52 176.00 2c5r h GLN 111 N 0.29 0.22 -0.53 6.66 7.50 -0.36 -2.28 115.11 126.60 2c5r h GLN 111 Ca 0.07 -0.38 0.07 0.00 0.50 0.00 0.00 58.65 58.91 2c5r h GLN 111 Cb 0.18 0.14 -0.06 0.00 0.05 0.00 0.00 27.48 27.79 2c5r h GLN 111 CO 0.00 1.16 0.21 0.00 -1.50 0.00 0.00 178.83 178.70 2c5r h ARG 112 N 0.06 0.38 -0.15 1.46 3.08 -1.18 -0.63 114.38 117.41 2c5r h ARG 112 Ca -0.13 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 2c5r h ARG 112 Cb 1.95 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.90 2c5r h ARG 112 CO 0.19 0.25 -0.01 1.15 -1.07 0.00 0.00 179.97 180.48 2c5r h THR 113 N 0.39 1.10 0.08 2.04 2.02 -1.39 -0.10 112.91 117.06 2c5r h THR 113 Ca 0.26 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 2c5r h THR 113 Cb 0.27 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2c5r h THR 113 CO -0.25 0.13 -0.04 0.22 0.37 0.00 0.00 175.52 175.95 2c5r h TYR 114 N 0.21 -0.10 0.00 3.16 5.03 -0.56 -2.19 116.97 122.52 2c5r h TYR 114 Ca 0.05 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.36 2c5r h TYR 114 Cb 0.15 0.03 0.00 0.00 1.55 0.00 0.00 36.73 38.47 2c5r h TYR 114 CO 0.00 0.03 -0.17 -1.49 -1.32 0.00 0.00 178.16 175.21 2c5r h TRP 115 N -0.20 0.00 -0.29 -3.82 4.06 -0.99 0.17 115.95 114.88 2c5r h TRP 115 Ca -0.01 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.91 2c5r h TRP 115 Cb 0.17 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.32 2c5r h TRP 115 CO -0.04 0.00 0.06 -0.22 -3.56 0.00 0.00 178.44 174.68 2c5r h LYS 116 N 0.00 0.46 -0.27 0.49 3.64 -0.93 -2.08 116.57 117.89 2c5r h LYS 116 Ca 0.00 -0.12 -0.16 0.00 -1.27 0.00 0.00 60.65 59.10 2c5r h LYS 116 Cb 0.99 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 2c5r h LYS 116 CO 0.00 0.56 -0.45 -0.07 -2.27 0.00 0.00 179.45 177.22 2c5r h LEU 117 N 0.29 0.86 0.02 5.20 4.07 -0.99 -2.67 115.31 122.10 2c5r h LEU 117 Ca 0.09 -0.52 0.01 0.00 0.08 0.00 0.00 57.88 57.53 2c5r h LEU 117 Cb 0.31 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.79 2c5r h LEU 117 CO 0.00 1.22 -0.04 -0.08 -1.08 0.00 0.00 178.44 178.46 2c5r h GLU 118 N 0.54 -0.08 0.00 1.13 4.57 -0.65 -2.60 114.58 117.49 2c5r h GLU 118 Ca 0.02 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2c5r h GLU 118 Cb 1.05 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 2c5r h GLU 118 CO 0.10 -0.06 0.00 -0.91 -1.18 0.00 0.00 179.01 176.97 2c5r h ASN 119 N -0.09 0.00 1.68 1.04 2.35 -1.36 -0.33 115.58 118.87 2c5r h ASN 119 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2c5r h ASN 119 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2c5r h ASN 119 CO -0.03 0.00 -0.18 -0.61 -1.65 0.00 0.00 177.43 174.95 2c5r h GLN 120 N 0.00 0.00 -6.66 0.81 4.15 -1.10 -3.46 115.11 108.85 2c5r h GLN 120 Ca 0.00 0.00 -0.54 0.00 0.77 0.00 0.00 58.65 58.88 2c5r h GLN 120 Cb 0.21 0.00 0.07 0.00 0.21 0.00 0.00 27.48 27.97 2c5r h GLN 120 CO 0.00 0.00 0.91 1.63 -1.93 0.00 0.00 178.83 179.44 2c5r n LYS 121 N -2.81 2.58 -3.04 1.69 5.02 -0.14 -4.93 118.16 116.52 2c5r n LYS 121 Ca 0.04 0.93 -0.40 0.00 -2.02 0.00 0.00 58.31 56.86 2c5r n LYS 121 Cb 0.51 -2.73 -0.05 0.00 -0.02 0.00 0.00 35.03 32.74 2c5r n LYS 121 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2c5r s LYS 122 N 0.57 4.44 0.09 1.97 2.20 -1.26 -5.05 119.74 122.71 2c5r s LYS 122 Ca 0.72 0.94 -0.26 0.00 -0.36 0.00 0.00 55.97 57.01 2c5r s LYS 122 Cb -0.55 -3.39 -0.06 0.00 -1.51 0.00 0.00 37.83 32.32 2c5r s LYS 122 CO 0.39 0.23 0.82 -1.17 -0.36 0.00 0.00 175.35 175.26 2c5r s LEU 123 N 0.19 4.50 -0.13 5.43 2.96 -1.26 -5.02 118.68 125.35 2c5r s LEU 123 Ca 0.37 1.59 -0.28 0.00 -0.22 0.00 0.00 54.13 55.59 2c5r s LEU 123 Cb -0.19 -3.34 -0.01 0.00 0.50 0.00 0.00 46.19 43.15 2c5r s LEU 123 CO 0.20 0.04 0.94 -0.47 -1.32 0.00 0.00 176.35 175.75 2c5r s TYR 124 N -0.31 3.48 -0.36 5.38 6.14 -1.26 -5.03 117.35 125.39 2c5r s TYR 124 Ca 0.40 1.47 -0.12 0.00 0.64 0.00 0.00 57.07 59.46 2c5r s TYR 124 Cb -0.22 -3.12 0.01 0.00 0.42 0.00 0.00 41.96 39.05 2c5r s TYR 124 CO 0.26 -0.22 0.22 1.03 0.64 0.00 0.00 175.55 177.47 2c5r s ARG 125 N 2.04 3.14 0.00 4.97 0.52 -1.26 -4.95 118.95 123.41 2c5r s ARG 125 Ca 0.45 -0.87 0.25 0.00 -0.52 0.00 0.00 55.73 55.03 2c5r s ARG 125 Cb -0.18 -3.74 0.53 0.00 0.52 0.00 0.00 34.95 32.08 2c5r s ARG 125 CO 0.16 -0.57 1.43 0.41 0.02 0.00 0.00 175.30 176.75 2c5r n GLY 126 N 5.05 -1.19 0.73 -3.53 0.00 -1.26 -4.72 105.19 100.27 2c5r n GLY 126 Ca -0.12 -0.35 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 2c5r n GLY 126 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2c5r n SER 127 N -1.42 0.59 0.00 1.61 7.64 -1.26 -4.94 113.62 115.84 2c5r n SER 127 Ca 0.06 0.08 0.00 0.00 1.01 0.00 0.00 58.87 60.03 2c5r n SER 127 Cb 0.34 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 2c5r n SER 127 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2c5r n LEU 128 N -3.05 0.00 0.00 -3.43 7.94 -1.26 -5.34 117.00 111.86 2c5r n LEU 128 Ca -0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 2c5r n LEU 128 Cb 0.07 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.02 2c5r n LEU 128 CO 0.03 0.00 0.00 2.29 -1.11 0.00 0.00 177.39 178.60