#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnp h SER 71 N 0.00 -0.84 -4.47 1.61 4.64 -2.06 -3.47 113.55 108.96 2dnp h SER 71 Ca 0.00 0.06 -0.27 0.00 -0.47 0.00 0.00 61.79 61.11 2dnp h SER 71 Cb 0.00 0.26 0.10 0.00 -0.31 0.00 0.00 62.40 62.46 2dnp h SER 71 CO 0.00 -0.49 -0.50 -0.24 -0.87 0.00 0.00 176.83 174.73 2dnp n SER 72 N -5.45 -4.37 -3.13 4.97 2.88 -1.26 -5.00 113.62 102.26 2dnp n SER 72 Ca -0.11 -0.40 0.05 0.00 -1.33 0.00 0.00 58.87 57.08 2dnp n SER 72 Cb 0.35 -3.73 0.00 0.00 -0.75 0.00 0.00 64.21 60.08 2dnp n SER 72 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dnp s GLY 73 N -3.41 -1.04 -0.01 0.46 0.00 -1.26 -5.16 107.32 96.90 2dnp s GLY 73 Ca 0.32 1.81 0.05 0.00 0.00 0.00 0.00 44.72 46.90 2dnp s GLY 73 CO 0.52 4.02 -0.14 -0.45 0.00 0.00 0.00 173.10 177.05 2dnp s SER 74 N 2.86 4.08 0.00 1.64 0.15 -1.26 -5.01 113.70 116.16 2dnp s SER 74 Ca 0.23 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.62 2dnp s SER 74 Cb -0.03 -0.82 0.00 0.00 -1.71 0.00 0.00 66.02 63.46 2dnp s SER 74 CO -0.23 0.30 0.00 -1.54 1.20 0.00 0.00 173.24 172.97 2dnp n SER 75 N 1.89 1.01 0.00 5.45 3.41 -1.26 -5.08 113.62 119.05 2dnp n SER 75 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 2dnp n SER 75 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2dnp n SER 75 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dnp n GLY 76 N 2.79 -1.41 3.14 5.00 0.00 -1.26 -5.19 105.19 108.26 2dnp n GLY 76 Ca 0.00 0.62 -0.09 0.00 0.00 0.00 0.00 46.02 46.55 2dnp n GLY 76 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dnp s ASN 77 N 0.00 0.19 0.07 1.61 0.01 -1.26 -5.18 114.94 110.38 2dnp s ASN 77 Ca 0.00 -0.60 -0.09 0.00 -0.71 0.00 0.00 52.86 51.46 2dnp s ASN 77 Cb 0.00 0.25 -0.00 0.00 0.41 0.00 0.00 41.25 41.91 2dnp s ASN 77 CO 0.00 -0.57 0.19 -0.89 -1.51 0.00 0.00 177.10 174.32 2dnp s THR 78 N -3.00 0.13 1.10 1.60 2.01 -1.26 -4.96 115.64 111.26 2dnp s THR 78 Ca -0.02 -1.08 -0.18 0.00 0.31 0.00 0.00 61.69 60.72 2dnp s THR 78 Cb 0.01 -1.17 0.26 0.00 0.01 0.00 0.00 72.50 71.61 2dnp s THR 78 CO -0.06 -0.59 1.23 0.26 -0.69 0.00 0.00 174.62 174.77 2dnp s TRP 79 N -3.33 0.83 -0.13 4.92 0.52 0.57 -4.86 118.94 117.46 2dnp s TRP 79 Ca 0.01 0.33 -0.06 0.00 0.02 0.00 0.00 56.10 56.40 2dnp s TRP 79 Cb 0.03 -3.87 0.05 0.00 -1.15 0.00 0.00 33.47 28.53 2dnp s TRP 79 CO -0.08 -3.38 0.28 0.15 0.02 0.00 0.00 176.95 173.94 2dnp s LYS 80 N -5.72 0.22 -0.15 4.98 1.02 -1.26 -3.44 119.74 115.40 2dnp s LYS 80 Ca 0.74 0.65 0.01 0.00 0.02 0.00 0.00 55.97 57.39 2dnp s LYS 80 Cb -0.05 -0.06 0.02 0.00 -0.52 0.00 0.00 37.83 37.21 2dnp s LYS 80 CO 0.55 -0.20 -0.16 0.42 -0.92 0.00 0.00 175.35 175.03 2dnp s ILE 81 N 1.64 1.73 -0.06 2.17 1.01 0.26 -1.80 121.20 126.15 2dnp s ILE 81 Ca -0.06 -0.74 -0.23 0.00 0.00 0.00 0.00 60.65 59.62 2dnp s ILE 81 Cb -0.11 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 2dnp s ILE 81 CO -0.09 0.48 0.67 0.12 0.00 0.00 0.00 174.94 176.12 2dnp s PHE 82 N 1.31 3.59 -0.25 3.97 2.19 -0.73 -0.34 117.98 127.72 2dnp s PHE 82 Ca 0.02 1.22 0.02 0.00 0.33 0.00 0.00 56.93 58.52 2dnp s PHE 82 Cb -0.13 -2.76 0.06 0.00 -1.31 0.00 0.00 43.02 38.88 2dnp s PHE 82 CO -0.09 0.14 -0.09 0.08 1.83 0.00 0.00 175.22 177.08 2dnp s VAL 83 N 0.62 1.91 0.51 3.12 1.01 -0.80 -1.50 120.40 125.27 2dnp s VAL 83 Ca 0.36 -1.45 0.08 0.00 0.00 0.00 0.00 61.98 60.96 2dnp s VAL 83 Cb -0.18 -2.07 0.04 0.00 0.00 0.00 0.00 36.38 34.17 2dnp s VAL 83 CO 0.17 -0.05 0.57 -0.83 0.00 0.00 0.00 175.10 174.97 2dnp s GLY 84 N 1.22 2.03 -1.48 4.51 0.00 0.57 0.10 107.32 114.27 2dnp s GLY 84 Ca -0.07 -1.78 -0.07 0.00 0.00 0.00 0.00 44.72 42.79 2dnp s GLY 84 CO -0.06 -1.74 0.78 -2.01 0.00 0.00 0.00 173.10 170.08 2dnp n ASN 85 N -1.92 -5.80 -4.63 1.64 5.15 -1.25 -0.82 115.26 107.63 2dnp n ASN 85 Ca 0.07 -0.41 -0.43 0.00 -0.60 0.00 0.00 54.58 53.21 2dnp n ASN 85 Cb 0.62 -4.65 -0.02 0.00 -0.53 0.00 0.00 39.78 35.20 2dnp n ASN 85 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2dnp s VAL 86 N -3.20 4.41 0.44 3.44 1.01 -1.05 -4.10 120.40 121.35 2dnp s VAL 86 Ca 0.42 1.61 -0.21 0.00 0.00 0.00 0.00 61.98 63.80 2dnp s VAL 86 Cb -0.20 -4.37 -0.13 0.00 0.00 0.00 0.00 36.38 31.68 2dnp s VAL 86 CO 0.52 -0.51 0.41 -0.24 0.00 0.00 0.00 175.10 175.28 2dnp n SER 87 N 7.08 -1.48 -0.16 3.32 2.88 -1.26 -4.86 113.62 119.15 2dnp n SER 87 Ca 0.13 0.85 -0.04 0.00 -1.33 0.00 0.00 58.87 58.47 2dnp n SER 87 Cb 0.47 -1.06 0.15 0.00 -0.75 0.00 0.00 64.21 63.02 2dnp n SER 87 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dnp h ALA 88 N 0.57 1.12 -0.51 -1.46 0.00 -1.94 -2.50 119.26 114.55 2dnp h ALA 88 Ca -0.40 -0.23 -0.29 0.00 0.00 0.00 0.00 54.91 53.99 2dnp h ALA 88 Cb 1.41 -0.23 -0.15 0.00 0.00 0.00 0.00 17.79 18.82 2dnp h ALA 88 CO 0.49 0.58 0.37 0.00 0.00 0.00 0.00 179.25 180.70 2dnp n ALA 89 N -2.46 4.48 -2.77 0.00 0.00 -1.26 -4.89 120.51 113.61 2dnp n ALA 89 Ca 0.04 -1.57 -0.35 0.00 0.00 0.00 0.00 53.44 51.56 2dnp n ALA 89 Cb 0.25 -1.29 -0.09 0.00 0.00 0.00 0.00 19.45 18.32 2dnp n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dnp s THR 91 N 0.32 5.41 0.36 0.00 -4.23 -1.26 -4.97 115.64 111.26 2dnp s THR 91 Ca 0.06 0.19 0.18 0.00 -1.18 0.00 0.00 61.69 60.94 2dnp s THR 91 Cb -0.12 -3.44 0.35 0.00 1.34 0.00 0.00 72.50 70.63 2dnp s THR 91 CO -0.01 0.48 1.63 0.77 -0.54 0.00 0.00 174.62 176.95 2dnp h SER 92 N 6.33 0.42 -0.98 3.99 4.64 -1.98 0.69 113.55 126.66 2dnp h SER 92 Ca -0.44 0.21 0.22 0.00 -0.47 0.00 0.00 61.79 61.32 2dnp h SER 92 Cb 1.17 0.19 -0.12 0.00 -0.31 0.00 0.00 62.40 63.33 2dnp h SER 92 CO 0.72 -0.26 0.56 -0.61 -0.87 0.00 0.00 176.83 176.37 2dnp h GLN 93 N 0.18 0.58 0.51 4.77 4.15 -1.97 0.10 115.11 123.43 2dnp h GLN 93 Ca 0.79 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 60.15 2dnp h GLN 93 Cb 1.96 -0.13 0.01 0.00 0.21 0.00 0.00 27.48 29.52 2dnp h GLN 93 CO -0.66 0.38 -0.25 1.49 -1.93 0.00 0.00 178.83 177.87 2dnp h GLU 94 N 0.60 -0.66 -0.22 1.69 4.57 0.00 -1.92 114.58 118.64 2dnp h GLU 94 Ca 0.61 0.05 0.05 0.00 -1.18 0.00 0.00 59.36 58.89 2dnp h GLU 94 Cb 1.09 0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 29.77 2dnp h GLU 94 CO -0.46 -0.38 -0.16 1.25 -1.18 0.00 0.00 179.01 178.09 2dnp h LEU 95 N -0.85 -0.51 -0.36 1.64 5.85 -1.29 -2.21 115.31 117.58 2dnp h LEU 95 Ca -0.07 0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.83 2dnp h LEU 95 Cb 0.59 0.26 -0.08 0.00 0.37 0.00 0.00 40.66 41.81 2dnp h LEU 95 CO 0.12 -0.20 -0.16 -0.09 -0.34 0.00 0.00 178.44 177.77 2dnp h ARG 96 N -0.16 -0.09 -0.00 1.25 2.43 -1.01 -2.27 114.38 114.53 2dnp h ARG 96 Ca 0.13 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 2dnp h ARG 96 Cb 0.34 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 2dnp h ARG 96 CO -0.31 -0.06 -0.50 0.77 -1.51 0.00 0.00 179.97 178.36 2dnp h SER 97 N -0.09 -1.54 -0.58 -3.80 0.02 -0.76 0.42 113.55 107.22 2dnp h SER 97 Ca 0.18 0.17 0.06 0.00 -0.84 0.00 0.00 61.79 61.36 2dnp h SER 97 Cb 0.36 0.58 -0.09 0.00 0.14 0.00 0.00 62.40 63.39 2dnp h SER 97 CO -0.42 -0.48 -0.56 -0.07 -1.14 0.00 0.00 176.83 174.15 2dnp h LEU 98 N -0.62 -1.95 -1.37 5.07 3.38 -1.06 0.36 115.31 119.12 2dnp h LEU 98 Ca 0.01 0.27 0.07 0.00 0.09 0.00 0.00 57.88 58.32 2dnp h LEU 98 Cb 0.67 0.82 -0.05 0.00 0.09 0.00 0.00 40.66 42.19 2dnp h LEU 98 CO -0.33 -0.35 0.49 -0.26 0.09 0.00 0.00 178.44 178.08 2dnp h PHE 99 N -0.28 0.77 0.85 1.13 0.04 -1.07 -2.21 116.94 116.17 2dnp h PHE 99 Ca 0.10 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.85 2dnp h PHE 99 Cb 0.54 -0.25 0.01 0.00 2.20 0.00 0.00 35.95 38.44 2dnp h PHE 99 CO -0.82 0.39 -0.41 0.93 -0.60 0.00 0.00 178.31 177.81 2dnp h GLU 100 N 0.75 -1.10 -1.02 1.51 4.39 0.34 -1.38 114.58 118.08 2dnp h GLU 100 Ca 0.33 0.08 0.24 0.00 0.34 0.00 0.00 59.36 60.35 2dnp h GLU 100 Cb 0.31 0.25 -0.10 0.00 -0.10 0.00 0.00 28.75 29.11 2dnp h GLU 100 CO -0.11 -0.73 0.63 0.00 -1.16 0.00 0.00 179.01 177.64 2dnp h ARG 101 N -1.29 0.49 0.00 2.33 3.08 -0.26 0.72 114.38 119.46 2dnp h ARG 101 Ca -0.12 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.83 2dnp h ARG 101 Cb 0.88 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 2dnp h ARG 101 CO 0.19 0.33 -0.35 0.00 -1.07 0.00 0.00 179.97 179.07 2dnp h ARG 102 N 0.51 0.00 0.00 0.04 -0.00 -1.24 -3.48 114.38 110.21 2dnp h ARG 102 Ca 0.60 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 60.08 2dnp h ARG 102 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.28 2dnp h ARG 102 CO -0.36 0.35 0.00 0.41 0.00 0.00 0.00 179.97 180.38 2dnp n GLY 103 N 0.13 -0.34 3.74 0.04 0.00 0.25 -4.81 105.19 104.20 2dnp n GLY 103 Ca -0.00 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.56 2dnp n GLY 103 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2dnp n ARG 104 N -0.30 2.51 -3.80 1.61 3.00 -1.26 -3.73 116.66 114.69 2dnp n ARG 104 Ca 0.00 0.89 -0.29 0.00 -0.00 0.00 0.00 57.85 58.45 2dnp n ARG 104 Cb 0.00 -2.60 -0.16 0.00 0.00 0.00 0.00 32.46 29.70 2dnp n ARG 104 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2dnp s VAL 105 N -0.57 0.95 -0.04 5.15 1.01 -1.26 -3.75 120.40 121.88 2dnp s VAL 105 Ca 0.59 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 61.50 2dnp s VAL 105 Cb -0.52 -1.44 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 2dnp s VAL 105 CO 0.56 -0.28 0.43 0.40 0.00 0.00 0.00 175.10 176.21 2dnp h ILE 106 N 6.56 0.00 -2.78 2.22 2.04 -1.87 -3.47 117.51 120.22 2dnp h ILE 106 Ca -0.16 -0.54 -0.61 0.00 1.00 0.00 0.00 64.86 64.55 2dnp h ILE 106 Cb 1.08 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 37.03 2dnp h ILE 106 CO 0.39 0.00 -0.71 -1.61 0.00 0.00 0.00 178.15 176.22 2dnp s GLU 107 N -2.60 2.05 -0.30 2.37 2.02 -1.20 -5.03 118.70 116.02 2dnp s GLU 107 Ca -0.05 -1.35 -0.01 0.00 0.02 0.00 0.00 54.97 53.58 2dnp s GLU 107 Cb 0.00 -2.11 0.19 0.00 0.10 0.00 0.00 34.13 32.31 2dnp s GLU 107 CO 0.14 0.41 0.64 0.00 0.02 0.00 0.00 175.26 176.47 2dnp s ASP 109 N 2.86 3.19 -0.06 0.00 1.11 -0.16 -5.00 116.67 118.62 2dnp s ASP 109 Ca 0.17 -1.11 0.02 0.00 0.18 0.00 0.00 52.55 51.81 2dnp s ASP 109 Cb -0.13 -0.24 0.02 0.00 1.07 0.00 0.00 42.92 43.63 2dnp s ASP 109 CO -0.21 -0.16 -0.08 -0.69 1.18 0.00 0.00 175.17 175.20 2dnp s VAL 110 N -2.76 0.82 0.47 -1.27 1.01 -1.26 -1.72 120.40 115.69 2dnp s VAL 110 Ca 0.29 -0.29 0.09 0.00 0.00 0.00 0.00 61.98 62.07 2dnp s VAL 110 Cb -0.00 -0.79 0.04 0.00 0.00 0.00 0.00 36.38 35.63 2dnp s VAL 110 CO 0.13 0.29 0.65 -0.69 0.00 0.00 0.00 175.10 175.47 2dnp s VAL 111 N 0.82 2.69 0.00 2.92 1.01 0.19 -4.96 120.40 123.07 2dnp s VAL 111 Ca -0.12 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.85 2dnp s VAL 111 Cb -0.15 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.54 2dnp s VAL 111 CO 0.02 0.00 0.42 0.29 0.00 0.00 0.00 175.10 175.83 2dnp n LYS 112 N -1.99 0.00 -0.11 2.72 5.02 -1.26 -3.80 118.16 118.74 2dnp n LYS 112 Ca 0.11 0.42 -0.15 0.00 -2.02 0.00 0.00 58.31 56.67 2dnp n LYS 112 Cb 0.60 -0.72 -0.10 0.00 -0.02 0.00 0.00 35.03 34.79 2dnp n LYS 112 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2dnp n ASP 113 N -1.54 2.29 -4.77 4.39 5.75 -1.26 -4.97 116.55 116.45 2dnp n ASP 113 Ca 0.00 -0.09 -0.23 0.00 -0.01 0.00 0.00 54.79 54.46 2dnp n ASP 113 Cb 0.00 -0.36 0.09 0.00 -1.03 0.00 0.00 41.12 39.82 2dnp n ASP 113 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 2dnp s TYR 114 N -2.43 1.97 0.30 2.11 1.13 -1.25 -2.53 117.35 116.65 2dnp s TYR 114 Ca -0.29 -0.18 0.00 0.00 -1.41 0.00 0.00 57.07 55.19 2dnp s TYR 114 Cb 0.08 -2.93 -0.02 0.00 -1.10 0.00 0.00 41.96 37.98 2dnp s TYR 114 CO 0.49 -1.48 0.34 0.00 -2.51 0.00 0.00 175.55 172.39 2dnp s ALA 115 N -3.05 1.13 -0.16 9.51 0.00 0.28 0.57 121.76 130.03 2dnp s ALA 115 Ca 0.64 -1.69 -0.05 0.00 0.00 0.00 0.00 51.96 50.86 2dnp s ALA 115 Cb -0.07 1.31 0.08 0.00 0.00 0.00 0.00 23.12 24.44 2dnp s ALA 115 CO 0.43 -0.71 0.30 -0.06 0.00 0.00 0.00 175.76 175.72 2dnp s PHE 116 N -3.50 -0.53 -0.15 0.00 0.08 -0.70 -1.90 117.98 111.28 2dnp s PHE 116 Ca 0.35 0.99 0.01 0.00 0.12 0.00 0.00 56.93 58.41 2dnp s PHE 116 Cb 0.02 0.00 0.02 0.00 -0.57 0.00 0.00 43.02 42.49 2dnp s PHE 116 CO 0.20 -0.45 -0.19 0.08 -0.10 0.00 0.00 175.22 174.76 2dnp s VAL 117 N 2.46 1.89 -0.14 -0.44 1.01 0.53 -0.99 120.40 124.73 2dnp s VAL 117 Ca 0.02 -0.85 -0.10 0.00 0.00 0.00 0.00 61.98 61.05 2dnp s VAL 117 Cb -0.13 -1.71 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 2dnp s VAL 117 CO -0.11 0.51 0.20 -1.00 0.00 0.00 0.00 175.10 174.71 2dnp s HIS 118 N 1.15 3.52 0.18 5.22 0.09 -0.69 0.91 115.29 125.67 2dnp s HIS 118 Ca -0.00 0.53 0.08 0.00 -0.00 0.00 0.00 55.06 55.67 2dnp s HIS 118 Cb -0.14 -2.13 -0.04 0.00 -0.00 0.00 0.00 32.58 30.26 2dnp s HIS 118 CO -0.08 0.48 -0.17 -1.64 -0.00 0.00 0.00 174.74 173.33 2dnp s MET 119 N -0.26 1.29 -0.08 1.40 -1.94 -1.22 -2.78 119.30 115.71 2dnp s MET 119 Ca 0.14 -1.47 -0.04 0.00 -1.71 0.00 0.00 55.69 52.61 2dnp s MET 119 Cb -0.12 -1.26 -0.01 0.00 2.01 0.00 0.00 34.83 35.44 2dnp s MET 119 CO 0.03 0.24 -0.08 1.49 -0.01 0.00 0.00 175.02 176.69 2dnp h GLU 120 N 3.01 0.00 -6.27 2.03 4.81 -1.94 0.16 114.58 116.39 2dnp h GLU 120 Ca -0.41 0.00 -0.55 0.00 -0.13 0.00 0.00 59.36 58.27 2dnp h GLU 120 Cb 1.21 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 2dnp h GLU 120 CO 0.55 0.00 0.99 0.15 -0.73 0.00 0.00 179.01 179.97 2dnp s LYS 121 N -1.66 4.21 0.07 1.92 -0.14 -1.26 -4.76 119.74 118.13 2dnp s LYS 121 Ca -0.07 2.03 -0.22 0.00 -1.36 0.00 0.00 55.97 56.35 2dnp s LYS 121 Cb 0.01 -3.84 -0.14 0.00 -1.68 0.00 0.00 37.83 32.19 2dnp s LYS 121 CO 0.10 -0.76 1.63 1.49 -0.76 0.00 0.00 175.35 177.05 2dnp h GLU 122 N 8.84 0.10 -0.80 1.68 4.81 -1.99 -2.06 114.58 125.16 2dnp h GLU 122 Ca -0.36 -0.02 0.19 0.00 -0.13 0.00 0.00 59.36 59.04 2dnp h GLU 122 Cb 1.16 -0.02 -0.14 0.00 0.63 0.00 0.00 28.75 30.39 2dnp h GLU 122 CO 0.95 0.20 0.06 0.00 -0.73 0.00 0.00 179.01 179.49 2dnp h ALA 123 N 0.90 0.92 -0.37 2.92 0.00 -2.01 0.28 119.26 121.90 2dnp h ALA 123 Ca 0.02 0.24 -0.12 0.00 0.00 0.00 0.00 54.91 55.05 2dnp h ALA 123 Cb 0.13 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2dnp h ALA 123 CO -0.00 -0.44 -0.27 -0.44 0.00 0.00 0.00 179.25 178.10 2dnp h ASP 124 N 0.13 0.80 0.05 0.00 3.32 -1.83 -2.32 116.42 116.57 2dnp h ASP 124 Ca 0.46 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 57.22 2dnp h ASP 124 Cb 0.84 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 40.12 2dnp h ASP 124 CO -0.68 1.02 -0.51 0.00 -1.72 0.00 0.00 179.24 177.36 2dnp h ALA 125 N 1.03 -0.90 0.17 3.45 0.00 0.28 0.11 119.26 123.40 2dnp h ALA 125 Ca 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2dnp h ALA 125 Cb 0.79 0.88 0.00 0.00 0.00 0.00 0.00 17.79 19.47 2dnp h ALA 125 CO 0.07 -1.08 -0.08 0.87 0.00 0.00 0.00 179.25 179.02 2dnp h LYS 126 N -0.68 -0.22 -0.96 0.00 6.56 -1.45 -2.40 116.57 117.40 2dnp h LYS 126 Ca 0.01 0.02 0.26 0.00 -1.06 0.00 0.00 60.65 59.88 2dnp h LYS 126 Cb 0.72 0.05 -0.13 0.00 -0.57 0.00 0.00 32.23 32.30 2dnp h LYS 126 CO -0.32 -0.04 0.50 0.00 -2.06 0.00 0.00 179.45 177.53 2dnp h ALA 127 N 0.44 1.70 0.06 3.86 0.00 -1.19 -0.11 119.26 124.02 2dnp h ALA 127 Ca -0.02 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2dnp h ALA 127 Cb 0.29 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2dnp h ALA 127 CO 0.04 -0.40 -0.03 0.00 0.00 0.00 0.00 179.25 178.85 2dnp h ALA 128 N 1.77 -0.08 -0.73 0.00 0.00 -0.54 -1.85 119.26 117.83 2dnp h ALA 128 Ca 0.64 -0.16 0.21 0.00 0.00 0.00 0.00 54.91 55.60 2dnp h ALA 128 Cb 1.32 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 2dnp h ALA 128 CO -0.55 -0.39 0.52 0.82 0.00 0.00 0.00 179.25 179.65 2dnp h ILE 129 N -0.39 0.65 0.06 0.00 2.04 -0.55 0.89 117.51 120.20 2dnp h ILE 129 Ca -0.01 -0.02 -0.16 0.00 1.00 0.00 0.00 64.86 65.68 2dnp h ILE 129 Cb 0.35 0.60 0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2dnp h ILE 129 CO 0.01 0.01 -0.66 0.00 0.00 0.00 0.00 178.15 177.52 2dnp h ALA 130 N 1.64 0.00 -0.00 1.87 0.00 -1.07 0.51 119.26 122.21 2dnp h ALA 130 Ca 0.35 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2dnp h ALA 130 Cb 1.33 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2dnp h ALA 130 CO -0.02 0.34 -0.04 1.04 0.00 0.00 0.00 179.25 180.56 2dnp n GLN 131 N -4.20 0.71 -0.06 0.00 6.02 -0.35 -4.02 117.38 115.47 2dnp n GLN 131 Ca -0.12 -0.14 -0.12 0.00 -0.01 0.00 0.00 57.00 56.61 2dnp n GLN 131 Cb 0.72 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 30.44 2dnp n GLN 131 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2dnp n LEU 132 N -1.03 0.84 -4.50 1.08 4.77 0.30 -4.66 117.00 113.80 2dnp n LEU 132 Ca 0.17 0.14 -0.41 0.00 -0.03 0.00 0.00 56.01 55.88 2dnp n LEU 132 Cb 0.23 -0.34 -0.11 0.00 -2.33 0.00 0.00 43.42 40.87 2dnp n LEU 132 CO 0.22 0.25 2.12 -3.20 -1.33 0.00 0.00 177.39 175.45 2dnp n ASN 133 N -3.51 1.03 0.00 -1.43 2.85 0.18 0.10 115.26 114.48 2dnp n ASN 133 Ca -0.23 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.24 2dnp n ASN 133 Cb 0.66 -1.14 0.00 0.00 1.24 0.00 0.00 39.78 40.54 2dnp n ASN 133 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dnp n GLY 134 N 6.39 2.15 3.63 8.20 0.00 -0.47 -4.88 105.19 120.22 2dnp n GLY 134 Ca 0.55 -0.38 -0.64 0.00 0.00 0.00 0.00 46.02 45.56 2dnp n GLY 134 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dnp n LYS 135 N 0.00 0.02 -2.16 1.61 4.81 0.28 -4.36 118.16 118.36 2dnp n LYS 135 Ca 0.00 0.01 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 2dnp n LYS 135 Cb 0.00 -1.51 -0.03 0.00 0.02 0.00 0.00 35.03 33.51 2dnp n LYS 135 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2dnp s GLU 136 N 1.59 4.25 -0.14 1.64 2.12 -1.26 -2.91 118.70 123.99 2dnp s GLU 136 Ca 0.98 2.04 -0.02 0.00 0.36 0.00 0.00 54.97 58.34 2dnp s GLU 136 Cb -1.38 -3.64 0.04 0.00 0.26 0.00 0.00 34.13 29.41 2dnp s GLU 136 CO 0.70 -0.64 -0.01 0.08 -0.54 0.00 0.00 175.26 174.85 2dnp s VAL 137 N 2.70 0.67 -1.33 3.70 1.01 -0.45 -4.80 120.40 121.90 2dnp s VAL 137 Ca 0.66 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 62.23 2dnp s VAL 137 Cb -0.33 -0.95 0.01 0.00 0.00 0.00 0.00 36.38 35.11 2dnp s VAL 137 CO 0.27 0.06 0.69 0.29 0.00 0.00 0.00 175.10 176.42 2dnp n LYS 138 N 5.02 -5.16 0.00 2.72 4.76 -1.26 -1.86 118.16 122.38 2dnp n LYS 138 Ca -0.09 0.79 0.00 0.00 -2.87 0.00 0.00 58.31 56.13 2dnp n LYS 138 Cb 0.48 -5.46 0.00 0.00 -1.84 0.00 0.00 35.03 28.21 2dnp n LYS 138 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dnp n GLY 139 N -1.56 2.77 3.66 0.72 0.00 -1.26 -4.94 105.19 104.57 2dnp n GLY 139 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 2dnp n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dnp s LYS 140 N -0.05 4.06 -0.50 1.61 1.02 -0.78 -5.04 119.74 120.06 2dnp s LYS 140 Ca 0.00 -0.28 -0.28 0.00 0.02 0.00 0.00 55.97 55.43 2dnp s LYS 140 Cb 0.00 -3.50 0.01 0.00 -0.52 0.00 0.00 37.83 33.82 2dnp s LYS 140 CO 0.00 0.09 1.47 1.03 -0.92 0.00 0.00 175.35 177.02 2dnp s ARG 141 N 0.96 3.34 0.34 1.68 0.52 -1.26 -1.34 118.95 123.20 2dnp s ARG 141 Ca 0.07 0.70 -0.28 0.00 -0.52 0.00 0.00 55.73 55.70 2dnp s ARG 141 Cb -0.13 -4.12 -0.10 0.00 0.52 0.00 0.00 34.95 31.13 2dnp s ARG 141 CO 0.04 -1.87 1.22 0.96 0.02 0.00 0.00 175.30 175.67 2dnp s ILE 142 N 6.13 3.00 -0.41 1.52 -4.36 -1.14 -4.81 121.20 121.13 2dnp s ILE 142 Ca 0.58 0.96 -0.08 0.00 -0.26 0.00 0.00 60.65 61.85 2dnp s ILE 142 Cb -0.13 -3.59 0.08 0.00 1.25 0.00 0.00 42.46 40.07 2dnp s ILE 142 CO 0.28 0.19 0.24 0.21 0.24 0.00 0.00 174.94 176.10 2dnp s ASN 143 N -0.75 5.58 -0.11 4.36 3.84 0.00 -1.36 114.94 126.50 2dnp s ASN 143 Ca 0.50 -1.50 -0.06 0.00 0.21 0.00 0.00 52.86 52.02 2dnp s ASN 143 Cb -0.36 -1.96 -0.04 0.00 -0.55 0.00 0.00 41.25 38.34 2dnp s ASN 143 CO 0.46 -0.51 0.11 -0.69 -2.79 0.00 0.00 177.10 173.68 2dnp s VAL 144 N 1.41 5.22 -0.09 -5.21 1.01 -1.26 -0.32 120.40 121.16 2dnp s VAL 144 Ca 0.03 0.10 -0.23 0.00 0.00 0.00 0.00 61.98 61.88 2dnp s VAL 144 Cb -0.23 -3.26 0.05 0.00 0.00 0.00 0.00 36.38 32.94 2dnp s VAL 144 CO 0.02 0.61 0.54 -1.83 0.00 0.00 0.00 175.10 174.44 2dnp s GLU 145 N -0.95 0.83 0.27 2.72 -1.05 -0.56 -4.49 118.70 115.46 2dnp s GLU 145 Ca 0.14 0.29 -0.30 0.00 -0.15 0.00 0.00 54.97 54.95 2dnp s GLU 145 Cb -0.12 0.39 -0.12 0.00 -0.44 0.00 0.00 34.13 33.84 2dnp s GLU 145 CO 0.03 -0.21 1.55 -0.11 0.95 0.00 0.00 175.26 177.47 2dnp n LEU 146 N 1.58 3.98 -4.43 1.83 7.94 -1.26 -1.77 117.00 124.86 2dnp n LEU 146 Ca -0.18 1.14 -0.44 0.00 -1.11 0.00 0.00 56.01 55.42 2dnp n LEU 146 Cb 0.56 -1.54 -0.01 0.00 0.53 0.00 0.00 43.42 42.96 2dnp n LEU 146 CO 0.19 -0.03 1.15 -0.55 -1.11 0.00 0.00 177.39 177.03 2dnp s SER 147 N 0.47 7.00 0.09 1.96 0.15 -0.75 -4.80 113.70 117.82 2dnp s SER 147 Ca 0.66 -2.87 0.06 0.00 0.70 0.00 0.00 55.95 54.49 2dnp s SER 147 Cb -0.54 -2.36 -0.03 0.00 -1.71 0.00 0.00 66.02 61.38 2dnp s SER 147 CO 0.48 -0.73 -0.15 0.42 1.20 0.00 0.00 173.24 174.46 2dnp s THR 148 N 1.27 1.23 0.11 6.45 -4.23 -1.26 -4.76 115.64 114.45 2dnp s THR 148 Ca 0.37 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 59.44 2dnp s THR 148 Cb -0.05 -1.25 0.00 0.00 1.34 0.00 0.00 72.50 72.55 2dnp s THR 148 CO -0.04 -0.26 0.00 0.29 -0.54 0.00 0.00 174.62 174.07 2dnp n LYS 149 N 1.06 0.00 -1.94 3.99 4.76 -1.26 -5.00 118.16 119.77 2dnp n LYS 149 Ca -0.20 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.82 2dnp n LYS 149 Cb 0.55 -0.30 -0.03 0.00 -1.84 0.00 0.00 35.03 33.41 2dnp n LYS 149 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2dnp s GLY 150 N -3.98 0.68 -0.85 0.72 0.00 -1.26 -4.92 107.32 97.71 2dnp s GLY 150 Ca 0.00 0.26 -0.25 0.00 0.00 0.00 0.00 44.72 44.72 2dnp s GLY 150 CO 0.00 3.37 1.33 1.62 0.00 0.00 0.00 173.10 179.42 2dnp s GLN 151 N 5.91 3.35 0.07 2.90 0.74 -1.26 -4.99 119.66 126.37 2dnp s GLN 151 Ca 0.82 -0.62 0.06 0.00 0.05 0.00 0.00 55.36 55.67 2dnp s GLN 151 Cb -0.23 -4.64 -0.04 0.00 1.10 0.00 0.00 33.01 29.20 2dnp s GLN 151 CO 0.33 -2.15 -0.09 -1.59 -0.55 0.00 0.00 175.29 171.23 2dnp s LYS 152 N 5.34 2.28 -0.72 1.67 0.00 -1.26 -5.08 119.74 121.98 2dnp s LYS 152 Ca 0.39 -0.91 -0.18 0.00 0.00 0.00 0.00 55.97 55.26 2dnp s LYS 152 Cb -0.05 -2.37 0.13 0.00 0.00 0.00 0.00 37.83 35.54 2dnp s LYS 152 CO 0.05 0.54 0.83 -1.59 0.00 0.00 0.00 175.35 175.18 2dnp s LYS 153 N -1.89 3.28 0.37 1.78 0.00 -1.26 -5.03 119.74 116.99 2dnp s LYS 153 Ca 0.20 -1.61 -0.27 0.00 0.00 0.00 0.00 55.97 54.29 2dnp s LYS 153 Cb -0.11 -4.45 -0.12 0.00 0.00 0.00 0.00 37.83 33.15 2dnp s LYS 153 CO 0.11 -1.57 1.16 -1.13 0.00 0.00 0.00 175.35 173.92 2dnp n SER 154 N 6.02 2.03 -4.86 0.03 3.41 -1.26 -4.98 113.62 114.01 2dnp n SER 154 Ca 0.03 1.14 -0.28 0.00 -0.26 0.00 0.00 58.87 59.50 2dnp n SER 154 Cb 0.45 -1.41 0.09 0.00 -0.26 0.00 0.00 64.21 63.07 2dnp n SER 154 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dnp s GLY 155 N -0.52 1.64 1.15 5.00 0.00 -1.26 -5.07 107.32 108.26 2dnp s GLY 155 Ca 0.59 -0.81 -0.17 0.00 0.00 0.00 0.00 44.72 44.33 2dnp s GLY 155 CO 0.60 -0.33 1.10 2.56 0.00 0.00 0.00 173.10 177.03 2dnp s PRO 156 N -5.46 -0.78 0.21 2.90 0.04 -1.26 -5.09 135.00 125.56 2dnp s PRO 156 Ca 0.62 0.09 -0.14 0.00 0.04 0.00 0.00 61.00 61.61 2dnp s PRO 156 Cb -0.10 -1.63 0.01 0.00 0.04 0.00 0.00 34.50 32.81 2dnp s PRO 156 CO 0.47 -3.45 0.47 -1.12 0.04 0.00 0.00 177.00 173.42 2dnp s SER 157 N -3.76 -0.14 -0.16 6.66 0.01 -1.26 -5.12 113.70 109.92 2dnp s SER 157 Ca 0.69 -0.72 -0.29 0.00 1.31 0.00 0.00 55.95 56.94 2dnp s SER 157 Cb -0.12 0.56 -0.03 0.00 0.21 0.00 0.00 66.02 66.64 2dnp s SER 157 CO 0.57 -1.07 1.45 -0.94 0.41 0.00 0.00 173.24 173.66 2dnp s SER 158 N -2.94 6.71 0.00 2.44 1.04 -1.26 -5.23 113.70 114.46 2dnp s SER 158 Ca 0.15 1.76 0.00 0.00 0.48 0.00 0.00 55.95 58.35 2dnp s SER 158 Cb -0.00 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2dnp s SER 158 CO 0.02 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 173.90