#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y77 n ALA 73 N 0.00 0.00 -3.55 7.82 0.00 -1.26 -5.01 120.51 118.51 1y77 n ALA 73 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1y77 n ALA 73 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1y77 n ALA 73 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1y77 s ILE 74 N -1.83 -0.01 0.57 0.00 1.01 -1.21 -4.61 121.20 115.12 1y77 s ILE 74 Ca 0.00 0.03 -0.20 0.00 0.00 0.00 0.00 60.65 60.48 1y77 s ILE 74 Cb 0.00 -0.73 -0.05 0.00 0.01 0.00 0.00 42.46 41.68 1y77 s ILE 74 CO 0.00 0.01 1.07 -0.81 0.00 0.00 0.00 174.94 175.21 1y77 n PRO 75 N 3.56 1.14 0.06 2.79 -0.04 -1.26 -4.76 135.00 136.48 1y77 n PRO 75 Ca -0.18 0.43 0.05 0.00 -0.04 0.00 0.00 63.50 63.76 1y77 n PRO 75 Cb 0.56 -2.25 0.25 0.00 -0.04 0.00 0.00 33.50 32.02 1y77 n PRO 75 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1y77 n LYS 76 N -0.89 0.06 -3.47 0.54 4.81 -1.26 -3.98 118.16 113.96 1y77 n LYS 76 Ca 0.12 0.52 -0.23 0.00 -0.87 0.00 0.00 58.31 57.85 1y77 n LYS 76 Cb 0.46 -1.67 0.03 0.00 0.02 0.00 0.00 35.03 33.87 1y77 n LYS 76 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1y77 s ASP 77 N -3.40 4.83 0.00 3.14 -1.08 -1.26 -4.26 116.67 114.63 1y77 s ASP 77 Ca 0.00 -1.09 0.00 0.00 -0.52 0.00 0.00 52.55 50.94 1y77 s ASP 77 Cb 0.03 0.46 0.00 0.00 -1.46 0.00 0.00 42.92 41.95 1y77 s ASP 77 CO 0.11 -1.28 0.00 0.00 0.52 0.00 0.00 175.17 174.52 1y77 n GLN 78 N -2.04 -0.30 -1.62 4.34 6.02 -1.26 -4.88 117.38 117.64 1y77 n GLN 78 Ca 0.07 0.07 -0.40 0.00 -0.01 0.00 0.00 57.00 56.73 1y77 n GLN 78 Cb 0.63 -4.50 0.02 0.00 1.02 0.00 0.00 30.24 27.41 1y77 n GLN 78 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1y77 n ARG 79 N -1.56 1.30 0.00 -1.09 3.00 -1.26 -4.93 116.66 112.13 1y77 n ARG 79 Ca 0.00 0.47 0.00 0.00 -0.00 0.00 0.00 57.85 58.32 1y77 n ARG 79 Cb 0.07 -2.10 0.00 0.00 0.00 0.00 0.00 32.46 30.44 1y77 n ARG 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1y77 n ALA 80 N -0.74 0.46 -1.00 5.13 0.00 -1.26 -5.11 120.51 117.98 1y77 n ALA 80 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1y77 n ALA 80 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 1y77 n ALA 80 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1y77 n THR 81 N -0.27 0.00 -3.28 0.00 -1.04 -1.26 -4.95 114.28 103.48 1y77 n THR 81 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 1y77 n THR 81 Cb 0.00 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.44 1y77 n THR 81 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1y77 s THR 82 N -0.50 5.12 0.47 12.58 2.01 -1.26 -4.94 115.64 129.12 1y77 s THR 82 Ca 0.00 0.88 0.29 0.00 0.31 0.00 0.00 61.69 63.17 1y77 s THR 82 Cb 0.00 -3.81 0.29 0.00 0.01 0.00 0.00 72.50 68.99 1y77 s THR 82 CO 0.00 0.17 1.86 -0.65 -0.69 0.00 0.00 174.62 175.31 1y77 h PRO 83 N 7.59 0.00 -6.18 4.92 0.11 -1.98 -3.42 132.00 133.04 1y77 h PRO 83 Ca -0.33 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.25 1y77 h PRO 83 Cb 1.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1y77 h PRO 83 CO 0.73 0.00 -0.38 0.71 -0.21 0.00 0.00 178.00 178.85 1y77 s TYR 84 N -3.92 3.48 0.06 0.65 1.51 -1.26 -2.12 117.35 115.75 1y77 s TYR 84 Ca -0.03 0.23 -0.28 0.00 -1.01 0.00 0.00 57.07 55.97 1y77 s TYR 84 Cb 0.08 -1.76 -0.05 0.00 -0.11 0.00 0.00 41.96 40.12 1y77 s TYR 84 CO 0.26 0.42 0.91 1.41 -1.11 0.00 0.00 175.55 177.44 1y77 s MET 85 N -3.41 4.61 0.46 -0.62 -2.45 -0.47 -4.81 119.30 112.60 1y77 s MET 85 Ca 0.37 1.33 -0.19 0.00 -1.25 0.00 0.00 55.69 55.95 1y77 s MET 85 Cb -0.11 -3.40 -0.10 0.00 1.25 0.00 0.00 34.83 32.48 1y77 s MET 85 CO 0.29 0.16 0.95 0.95 1.05 0.00 0.00 175.02 178.42 1y77 s THR 86 N 0.26 4.48 0.23 10.11 -4.23 -1.26 -4.86 115.64 120.36 1y77 s THR 86 Ca 0.46 1.32 -0.07 0.00 -1.18 0.00 0.00 61.69 62.22 1y77 s THR 86 Cb -0.22 -3.65 0.18 0.00 1.34 0.00 0.00 72.50 70.15 1y77 s THR 86 CO 0.27 -0.46 1.82 0.07 -0.54 0.00 0.00 174.62 175.78 1y77 h LYS 87 N 1.52 0.77 -0.86 3.99 2.10 -1.99 -0.24 116.57 121.87 1y77 h LYS 87 Ca -0.48 -0.05 0.04 0.00 -2.00 0.00 0.00 60.65 58.17 1y77 h LYS 87 Cb 1.18 -0.17 -0.05 0.00 -0.90 0.00 0.00 32.23 32.29 1y77 h LYS 87 CO 0.62 0.51 0.56 1.88 -2.00 0.00 0.00 179.45 181.02 1y77 h TYR 88 N 0.80 1.02 0.00 0.07 -1.99 -1.98 0.42 116.97 115.30 1y77 h TYR 88 Ca 0.34 0.03 0.00 0.00 2.00 0.00 0.00 58.73 61.10 1y77 h TYR 88 Cb 0.22 -0.34 0.00 0.00 2.00 0.00 0.00 36.73 38.61 1y77 h TYR 88 CO -0.06 0.58 0.00 0.39 -0.00 0.00 0.00 178.16 179.07 1y77 n GLU 89 N -4.46 0.00 -0.33 4.88 1.02 -0.22 -1.37 120.64 120.16 1y77 n GLU 89 Ca 0.12 0.38 0.16 0.00 -0.02 0.00 0.00 57.16 57.80 1y77 n GLU 89 Cb 0.13 -1.25 0.32 0.00 -0.02 0.00 0.00 31.44 30.63 1y77 n GLU 89 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 1y77 h ARG 90 N 0.00 0.04 0.03 3.49 0.11 -1.10 0.79 114.38 117.74 1y77 h ARG 90 Ca 0.00 -0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.11 1y77 h ARG 90 Cb 0.00 -0.01 -0.05 0.00 1.11 0.00 0.00 29.97 31.03 1y77 h ARG 90 CO 0.00 0.03 -0.31 0.00 0.10 0.00 0.00 179.97 179.79 1y77 h ALA 91 N 1.95 -0.46 -0.12 0.08 0.00 -0.17 -1.46 119.26 119.09 1y77 h ALA 91 Ca 0.62 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.40 1y77 h ALA 91 Cb 1.33 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 19.64 1y77 h ALA 91 CO -0.86 -0.82 -0.39 -0.09 0.00 0.00 0.00 179.25 177.09 1y77 h ARG 92 N -0.47 0.25 0.85 0.00 2.43 0.16 -2.45 114.38 115.15 1y77 h ARG 92 Ca 0.05 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 1y77 h ARG 92 Cb 0.55 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.10 1y77 h ARG 92 CO -0.24 0.60 -0.41 0.82 -1.51 0.00 0.00 179.97 179.24 1y77 h ILE 93 N 0.21 0.14 -0.60 1.20 2.04 0.34 0.14 117.51 120.99 1y77 h ILE 93 Ca 0.02 -0.04 0.12 0.00 1.00 0.00 0.00 64.86 65.96 1y77 h ILE 93 Cb 0.78 0.15 -0.11 0.00 -0.74 0.00 0.00 36.82 36.89 1y77 h ILE 93 CO 0.06 0.00 -0.14 -0.07 0.00 0.00 0.00 178.15 178.01 1y77 h LEU 94 N -1.18 -0.53 0.06 1.44 3.38 -1.29 0.81 115.31 118.00 1y77 h LEU 94 Ca -0.12 0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1y77 h LEU 94 Cb 0.88 0.36 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 1y77 h LEU 94 CO 0.19 -0.19 -0.06 1.23 0.09 0.00 0.00 178.44 179.70 1y77 h GLY 95 N 0.01 -0.76 -0.98 0.83 0.00 -1.29 0.44 103.07 101.32 1y77 h GLY 95 Ca 0.29 0.33 0.17 0.00 0.00 0.00 0.00 47.33 48.12 1y77 h GLY 95 CO -0.61 -0.28 -0.35 -0.84 0.00 0.00 0.00 176.54 174.47 1y77 h THR 96 N -0.12 0.01 -0.93 4.70 2.02 -0.07 0.35 112.91 118.86 1y77 h THR 96 Ca -0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.18 1y77 h THR 96 Cb 0.10 0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 66.47 1y77 h THR 96 CO -0.01 0.00 0.62 -0.09 0.37 0.00 0.00 175.52 176.41 1y77 h ARG 97 N -0.00 1.23 0.40 6.66 9.65 0.92 -2.16 114.38 131.08 1y77 h ARG 97 Ca 0.38 -0.07 -0.02 0.00 -1.10 0.00 0.00 59.98 59.18 1y77 h ARG 97 Cb 0.64 -0.28 -0.01 0.00 -1.39 0.00 0.00 29.97 28.93 1y77 h ARG 97 CO -0.99 0.81 -0.30 0.00 2.80 0.00 0.00 179.97 182.28 1y77 h ALA 98 N 1.34 -1.07 -0.67 2.80 0.00 0.37 0.12 119.26 122.16 1y77 h ALA 98 Ca 0.34 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 55.25 1y77 h ALA 98 Cb -0.14 0.48 -0.12 0.00 0.00 0.00 0.00 17.79 18.00 1y77 h ALA 98 CO -0.08 -1.06 -0.18 -0.11 0.00 0.00 0.00 179.25 177.82 1y77 n LEU 99 N -4.23 -0.28 0.11 0.00 7.94 -0.02 0.13 117.00 120.65 1y77 n LEU 99 Ca -0.08 1.15 -0.13 0.00 -1.11 0.00 0.00 56.01 55.84 1y77 n LEU 99 Cb 0.29 -0.33 -0.08 0.00 0.53 0.00 0.00 43.42 43.83 1y77 n LEU 99 CO 0.19 -1.09 0.59 1.56 -1.11 0.00 0.00 177.39 177.52 1y77 h GLN 100 N 0.00 -0.28 -0.96 1.96 4.20 -0.97 -2.04 115.11 117.02 1y77 h GLN 100 Ca 0.30 0.02 0.15 0.00 0.06 0.00 0.00 58.65 59.19 1y77 h GLN 100 Cb 0.47 0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.23 1y77 h GLN 100 CO -0.68 0.05 0.61 0.82 -0.67 0.00 0.00 178.83 178.96 1y77 h ILE 101 N -0.64 0.81 0.00 2.54 2.04 0.25 1.29 117.51 123.80 1y77 h ILE 101 Ca -0.03 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1y77 h ILE 101 Cb 0.46 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1y77 h ILE 101 CO 0.05 0.14 0.00 -1.54 0.00 0.00 0.00 178.15 176.80 1y77 n SER 102 N -4.63 0.43 -1.30 1.72 3.41 0.35 -2.01 113.62 111.60 1y77 n SER 102 Ca 0.20 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.51 1y77 n SER 102 Cb 0.48 -0.69 0.31 0.00 -0.26 0.00 0.00 64.21 64.04 1y77 n SER 102 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1y77 n MET 103 N -1.97 3.07 -2.04 4.33 2.81 0.44 -4.93 117.12 118.82 1y77 n MET 103 Ca 0.03 -2.64 -0.03 0.00 -1.81 0.00 0.00 57.70 53.25 1y77 n MET 103 Cb 0.22 -1.63 -0.00 0.00 -0.71 0.00 0.00 33.22 31.10 1y77 n MET 103 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1y77 n ASN 104 N 1.24 -1.61 -4.84 7.83 3.02 -0.85 -5.04 115.26 115.01 1y77 n ASN 104 Ca 0.23 -0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.47 1y77 n ASN 104 Cb 0.68 -1.04 0.06 0.00 -0.61 0.00 0.00 39.78 38.87 1y77 n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y77 s ALA 105 N -2.13 2.61 0.35 5.41 0.00 -0.93 -4.99 121.76 122.08 1y77 s ALA 105 Ca 0.00 -0.22 -0.27 0.00 0.00 0.00 0.00 51.96 51.47 1y77 s ALA 105 Cb 0.00 -3.08 -0.09 0.00 0.00 0.00 0.00 23.12 19.95 1y77 s ALA 105 CO 0.00 -1.37 1.13 -2.14 0.00 0.00 0.00 175.76 173.38 1y77 s PRO 106 N -5.23 4.33 -0.27 0.00 0.02 -1.26 -4.72 135.00 127.88 1y77 s PRO 106 Ca 0.59 1.80 -0.08 0.00 0.02 0.00 0.00 61.00 63.33 1y77 s PRO 106 Cb -0.13 -2.89 -0.02 0.00 0.02 0.00 0.00 34.50 31.48 1y77 s PRO 106 CO 0.53 -0.06 0.10 0.08 -0.33 0.00 0.00 177.00 177.32 1y77 s VAL 107 N -1.34 4.43 -1.56 3.83 1.01 -1.26 -4.93 120.40 120.57 1y77 s VAL 107 Ca 0.51 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.28 1y77 s VAL 107 Cb -0.30 -3.13 0.10 0.00 0.00 0.00 0.00 36.38 33.05 1y77 s VAL 107 CO 0.39 0.25 0.92 0.49 0.00 0.00 0.00 175.10 177.15 1y77 n PHE 108 N 4.94 0.21 -4.27 5.22 3.01 -1.26 -4.85 117.46 120.46 1y77 n PHE 108 Ca -0.15 -0.09 -0.15 0.00 1.01 0.00 0.00 57.45 58.07 1y77 n PHE 108 Cb 0.51 -0.06 -0.10 0.00 -0.01 0.00 0.00 39.48 39.81 1y77 n PHE 108 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1y77 s VAL 109 N -1.62 1.11 -0.03 -4.37 1.01 -1.26 -5.00 120.40 110.24 1y77 s VAL 109 Ca 0.07 -2.05 -0.29 0.00 0.00 0.00 0.00 61.98 59.71 1y77 s VAL 109 Cb 0.05 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1y77 s VAL 109 CO 0.04 -0.63 0.97 -1.81 0.00 0.00 0.00 175.10 173.66 1y77 s ASP 110 N -3.20 7.31 -0.45 3.32 1.01 -1.26 -4.96 116.67 118.44 1y77 s ASP 110 Ca 0.20 1.60 -0.29 0.00 0.71 0.00 0.00 52.55 54.76 1y77 s ASP 110 Cb 0.03 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 41.43 1y77 s ASP 110 CO 0.03 -0.29 1.20 -0.76 0.21 0.00 0.00 175.17 175.55 1y77 s LEU 111 N 1.22 3.65 0.00 1.23 1.02 -1.26 -4.79 118.68 119.76 1y77 s LEU 111 Ca 0.50 0.60 0.00 0.00 0.02 0.00 0.00 54.13 55.25 1y77 s LEU 111 Cb -0.20 -3.55 0.00 0.00 0.02 0.00 0.00 46.19 42.46 1y77 s LEU 111 CO 0.25 -1.26 0.24 1.21 0.02 0.00 0.00 176.35 176.80 1y77 n GLU 112 N 7.82 0.30 0.00 1.70 2.13 -1.26 -4.39 120.64 126.95 1y77 n GLU 112 Ca 0.13 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.95 1y77 n GLU 112 Cb 0.49 -1.07 0.00 0.00 0.27 0.00 0.00 31.44 31.13 1y77 n GLU 112 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1y77 n GLY 113 N 0.04 0.94 3.55 8.31 0.00 -1.26 -5.11 105.19 111.66 1y77 n GLY 113 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1y77 n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1y77 n GLU 114 N -0.31 -0.58 0.00 1.61 -0.58 -1.26 -4.95 120.64 114.56 1y77 n GLU 114 Ca 0.00 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 1y77 n GLU 114 Cb 0.00 -2.16 0.00 0.00 -0.57 0.00 0.00 31.44 28.71 1y77 n GLU 114 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1y77 n THR 115 N -4.09 0.00 -3.80 2.62 -2.24 -1.26 -4.98 114.28 100.52 1y77 n THR 115 Ca 0.09 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.51 1y77 n THR 115 Cb 0.53 0.43 -0.13 0.00 -2.10 0.00 0.00 70.33 69.06 1y77 n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1y77 s ASP 116 N 0.00 4.94 0.14 3.42 -1.08 -1.26 -5.02 116.67 117.81 1y77 s ASP 116 Ca 0.00 -0.69 -0.29 0.00 -0.52 0.00 0.00 52.55 51.05 1y77 s ASP 116 Cb 0.00 -1.84 -0.07 0.00 -1.46 0.00 0.00 42.92 39.55 1y77 s ASP 116 CO 0.00 -0.16 1.50 1.55 0.52 0.00 0.00 175.17 178.58 1y77 h PRO 117 N 8.19 -0.07 0.00 4.34 0.13 -1.94 0.60 132.00 143.25 1y77 h PRO 117 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1y77 h PRO 117 Cb 1.13 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1y77 h PRO 117 CO 0.60 -0.05 0.09 -0.11 -0.23 0.00 0.00 178.00 178.30 1y77 n LEU 118 N -5.12 0.32 -0.04 1.56 7.94 -1.26 0.55 117.00 120.95 1y77 n LEU 118 Ca 0.01 0.60 -0.12 0.00 -1.11 0.00 0.00 56.01 55.39 1y77 n LEU 118 Cb 0.26 -0.62 -0.14 0.00 0.53 0.00 0.00 43.42 43.44 1y77 n LEU 118 CO -0.12 -0.71 -0.77 -1.14 -1.11 0.00 0.00 177.39 173.54 1y77 n ARG 119 N -1.92 0.67 -0.07 1.96 0.63 0.19 -2.48 116.66 115.64 1y77 n ARG 119 Ca -0.01 0.22 -0.15 0.00 -0.92 0.00 0.00 57.85 56.99 1y77 n ARG 119 Cb 0.11 -1.70 -0.05 0.00 0.45 0.00 0.00 32.46 31.27 1y77 n ARG 119 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1y77 h ILE 120 N 0.01 1.27 -0.68 5.15 2.04 0.16 -2.33 117.51 123.14 1y77 h ILE 120 Ca -0.39 -1.77 0.02 0.00 1.00 0.00 0.00 64.86 63.71 1y77 h ILE 120 Cb 2.06 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 39.81 1y77 h ILE 120 CO 0.06 0.58 0.44 0.00 0.00 0.00 0.00 178.15 179.22 1y77 h ALA 121 N 0.65 0.87 -0.32 1.87 0.00 -0.01 0.41 119.26 122.73 1y77 h ALA 121 Ca -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1y77 h ALA 121 Cb 1.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1y77 h ALA 121 CO 0.13 0.24 0.17 0.52 0.00 0.00 0.00 179.25 180.31 1y77 h MET 122 N 0.88 0.43 0.37 0.00 2.86 -1.21 -1.10 114.93 117.16 1y77 h MET 122 Ca 0.26 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.84 1y77 h MET 122 Cb -0.06 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.52 1y77 h MET 122 CO -0.07 0.33 -0.18 -0.22 1.06 0.00 0.00 176.91 177.83 1y77 h LYS 123 N 0.44 -0.48 -0.98 1.72 3.64 -0.30 -2.90 116.57 117.72 1y77 h LYS 123 Ca 0.11 0.03 0.30 0.00 -1.27 0.00 0.00 60.65 59.83 1y77 h LYS 123 Cb 0.03 0.11 -0.15 0.00 -0.41 0.00 0.00 32.23 31.81 1y77 h LYS 123 CO -0.02 -0.23 0.50 0.93 -2.27 0.00 0.00 179.45 178.36 1y77 h GLU 124 N -1.07 0.29 0.00 1.90 5.08 -0.11 0.29 114.58 120.96 1y77 h GLU 124 Ca -0.05 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1y77 h GLU 124 Cb 0.47 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1y77 h GLU 124 CO 0.08 0.19 0.00 -0.11 -1.00 0.00 0.00 179.01 178.18 1y77 n LEU 125 N -5.09 0.43 -0.01 1.33 7.94 -0.43 -0.81 117.00 120.36 1y77 n LEU 125 Ca 0.30 0.60 0.10 0.00 -1.11 0.00 0.00 56.01 55.90 1y77 n LEU 125 Cb 0.92 -0.54 -0.14 0.00 0.53 0.00 0.00 43.42 44.19 1y77 n LEU 125 CO 0.09 -0.42 -0.42 0.00 -1.11 0.00 0.00 177.39 175.53 1y77 n ALA 126 N -1.67 3.72 -0.75 1.96 0.00 0.99 -3.72 120.51 121.03 1y77 n ALA 126 Ca 0.03 -0.55 0.08 0.00 0.00 0.00 0.00 53.44 53.00 1y77 n ALA 126 Cb 0.22 -0.75 0.30 0.00 0.00 0.00 0.00 19.45 19.22 1y77 n ALA 126 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1y77 n GLU 127 N -1.89 3.51 -3.90 0.00 1.02 -1.08 -4.94 120.64 113.36 1y77 n GLU 127 Ca -0.00 -2.79 -0.26 0.00 -0.02 0.00 0.00 57.16 54.09 1y77 n GLU 127 Cb 0.45 -1.85 -0.06 0.00 -0.02 0.00 0.00 31.44 29.96 1y77 n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1y77 n LYS 128 N 0.29 -0.86 -2.39 3.49 5.02 -1.00 -4.83 118.16 117.87 1y77 n LYS 128 Ca 0.22 0.04 -0.29 0.00 -2.02 0.00 0.00 58.31 56.26 1y77 n LYS 128 Cb 0.88 -2.55 0.01 0.00 -0.02 0.00 0.00 35.03 33.35 1y77 n LYS 128 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1y77 n LYS 129 N -3.79 3.32 -4.04 1.97 5.02 0.01 -4.68 118.16 115.97 1y77 n LYS 129 Ca -0.22 -4.35 -0.33 0.00 -2.02 0.00 0.00 58.31 51.39 1y77 n LYS 129 Cb 0.52 -2.25 -0.15 0.00 -0.02 0.00 0.00 35.03 33.12 1y77 n LYS 129 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1y77 s ILE 130 N -5.44 2.47 -0.87 -0.18 1.01 -1.26 -4.77 121.20 112.16 1y77 s ILE 130 Ca 0.49 -1.08 0.00 0.00 0.00 0.00 0.00 60.65 60.05 1y77 s ILE 130 Cb 0.40 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.67 1y77 s ILE 130 CO -0.23 0.29 0.17 -0.81 0.00 0.00 0.00 174.94 174.37 1y77 n PRO 131 N 4.61 0.31 -3.54 2.79 -0.04 -1.26 -4.52 135.00 133.35 1y77 n PRO 131 Ca -0.18 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.09 1y77 n PRO 131 Cb 0.47 -1.18 -0.01 0.00 -0.04 0.00 0.00 33.50 32.75 1y77 n PRO 131 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1y77 s LEU 132 N 0.00 4.02 -0.07 1.53 1.43 -1.26 -5.03 118.68 119.30 1y77 s LEU 132 Ca 0.00 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1y77 s LEU 132 Cb 0.00 -2.79 0.02 0.00 0.03 0.00 0.00 46.19 43.45 1y77 s LEU 132 CO 0.00 -0.38 -0.04 -0.69 0.23 0.00 0.00 176.35 175.47 1y77 s VAL 133 N -2.16 0.61 -0.53 -1.59 1.01 -1.26 -2.40 120.40 114.08 1y77 s VAL 133 Ca 0.43 -0.09 -0.21 0.00 0.00 0.00 0.00 61.98 62.11 1y77 s VAL 133 Cb -0.09 -0.67 0.05 0.00 0.00 0.00 0.00 36.38 35.66 1y77 s VAL 133 CO 0.31 0.27 0.75 -0.63 0.00 0.00 0.00 175.10 175.80 1y77 s ILE 134 N 1.40 4.69 -0.17 2.22 1.01 0.59 -4.93 121.20 126.01 1y77 s ILE 134 Ca -0.03 -0.24 -0.27 0.00 0.00 0.00 0.00 60.65 60.12 1y77 s ILE 134 Cb -0.13 -4.40 -0.01 0.00 0.01 0.00 0.00 42.46 37.93 1y77 s ILE 134 CO -0.03 -0.94 0.91 -0.60 0.00 0.00 0.00 174.94 174.28 1y77 s ARG 135 N 3.12 4.31 -0.69 2.79 3.52 -1.26 -2.48 118.95 128.26 1y77 s ARG 135 Ca 0.20 1.16 -0.12 0.00 -0.13 0.00 0.00 55.73 56.84 1y77 s ARG 135 Cb -0.17 -3.58 0.18 0.00 -1.56 0.00 0.00 34.95 29.82 1y77 s ARG 135 CO 0.14 -0.39 0.61 1.03 -0.81 0.00 0.00 175.30 175.88 1y77 s ARG 136 N 2.36 3.18 0.43 5.12 0.52 0.14 -4.91 118.95 125.79 1y77 s ARG 136 Ca 0.41 -2.22 -0.25 0.00 -0.52 0.00 0.00 55.73 53.15 1y77 s ARG 136 Cb -0.17 -4.24 -0.08 0.00 0.52 0.00 0.00 34.95 30.99 1y77 s ARG 136 CO 0.12 -1.27 1.27 0.71 0.02 0.00 0.00 175.30 176.15 1y77 s TYR 137 N 0.59 2.81 0.35 -0.53 1.51 -1.26 -1.90 117.35 118.92 1y77 s TYR 137 Ca 0.13 1.44 0.07 0.00 -1.01 0.00 0.00 57.07 57.71 1y77 s TYR 137 Cb -0.18 -3.60 -0.02 0.00 -0.11 0.00 0.00 41.96 38.05 1y77 s TYR 137 CO -0.05 -1.98 0.40 -0.51 -1.11 0.00 0.00 175.55 172.30 1y77 s LEU 138 N -2.64 3.73 0.49 -1.29 1.43 0.17 -4.95 118.68 115.62 1y77 s LEU 138 Ca 0.59 -0.39 0.26 0.00 -1.03 0.00 0.00 54.13 53.56 1y77 s LEU 138 Cb -0.36 -2.45 1.32 0.00 0.03 0.00 0.00 46.19 44.73 1y77 s LEU 138 CO 0.45 -0.45 1.88 1.55 0.23 0.00 0.00 176.35 180.01 1y77 h PRO 139 N 1.03 0.16 -0.06 1.29 0.13 -1.96 -0.39 132.00 132.21 1y77 h PRO 139 Ca -0.44 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1y77 h PRO 139 Cb 1.26 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1y77 h PRO 139 CO 0.55 0.11 0.00 -0.40 -0.23 0.00 0.00 178.00 178.03 1y77 n ASP 140 N -4.38 2.06 0.00 1.44 5.68 -1.26 -4.96 116.55 115.13 1y77 n ASP 140 Ca 0.19 -1.69 0.00 0.00 -0.50 0.00 0.00 54.79 52.78 1y77 n ASP 140 Cb 0.85 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.80 1y77 n ASP 140 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1y77 n GLY 141 N 1.24 2.13 3.71 6.12 0.00 -0.16 -5.04 105.19 113.18 1y77 n GLY 141 Ca 0.17 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 1y77 n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y77 s SER 142 N -0.14 3.62 0.24 1.61 1.04 -1.26 -4.49 113.70 114.33 1y77 s SER 142 Ca 0.00 2.19 0.01 0.00 0.48 0.00 0.00 55.95 58.63 1y77 s SER 142 Cb 0.00 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.50 1y77 s SER 142 CO 0.00 -2.64 0.10 0.72 0.98 0.00 0.00 173.24 172.40 1y77 s PHE 143 N -2.45 1.45 -0.01 5.02 -0.12 -1.26 0.45 117.98 121.05 1y77 s PHE 143 Ca 0.69 -1.22 0.04 0.00 -0.05 0.00 0.00 56.93 56.39 1y77 s PHE 143 Cb -0.24 -0.82 -0.01 0.00 -0.63 0.00 0.00 43.02 41.32 1y77 s PHE 143 CO 0.53 -0.40 -0.13 -1.21 -0.05 0.00 0.00 175.22 173.97 1y77 s GLU 144 N -4.06 1.02 -0.22 1.99 2.02 -0.80 -3.31 118.70 115.35 1y77 s GLU 144 Ca 0.38 -0.48 -0.04 0.00 0.02 0.00 0.00 54.97 54.85 1y77 s GLU 144 Cb 0.08 -0.99 -0.01 0.00 0.10 0.00 0.00 34.13 33.31 1y77 s GLU 144 CO 0.13 0.27 -0.03 -0.51 0.02 0.00 0.00 175.26 175.14 1y77 s ASP 145 N -0.37 4.39 0.17 -0.19 1.11 -1.26 0.27 116.67 120.80 1y77 s ASP 145 Ca 0.05 -0.37 0.11 0.00 0.18 0.00 0.00 52.55 52.52 1y77 s ASP 145 Cb -0.05 -1.76 -0.04 0.00 1.07 0.00 0.00 42.92 42.14 1y77 s ASP 145 CO -0.00 -0.02 -0.23 0.26 1.18 0.00 0.00 175.17 176.36 1y77 s TRP 146 N 1.48 2.35 0.06 4.23 0.52 -1.03 -4.99 118.94 121.56 1y77 s TRP 146 Ca 0.06 -0.34 0.03 0.00 0.02 0.00 0.00 56.10 55.87 1y77 s TRP 146 Cb -0.14 -1.19 -0.04 0.00 -1.15 0.00 0.00 33.47 30.95 1y77 s TRP 146 CO -0.02 0.46 0.03 -1.54 0.02 0.00 0.00 176.95 175.90 1y77 s SER 147 N -2.53 5.24 0.46 2.95 1.04 -1.26 -0.30 113.70 119.29 1y77 s SER 147 Ca 0.20 -0.06 0.20 0.00 0.48 0.00 0.00 55.95 56.76 1y77 s SER 147 Cb -0.09 -1.35 1.17 0.00 0.10 0.00 0.00 66.02 65.86 1y77 s SER 147 CO 0.10 0.21 1.92 -0.37 0.98 0.00 0.00 173.24 176.07 1y77 h VAL 148 N 2.97 0.74 0.00 5.02 -1.51 -1.71 -1.45 116.25 120.31 1y77 h VAL 148 Ca -0.48 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 1y77 h VAL 148 Cb 1.17 0.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 1y77 h VAL 148 CO 0.61 0.05 0.00 1.21 -1.23 0.00 0.00 177.57 178.21 1y77 n GLU 149 N -4.44 0.00 0.00 5.19 2.13 -1.26 -3.86 120.64 118.39 1y77 n GLU 149 Ca 0.15 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.61 1y77 n GLU 149 Cb 0.62 -1.44 0.00 0.00 0.27 0.00 0.00 31.44 30.89 1y77 n GLU 149 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1y77 n GLU 150 N -2.21 0.00 -0.88 5.31 1.02 -0.60 -4.75 120.64 118.53 1y77 n GLU 150 Ca 0.00 0.67 -0.34 0.00 -0.02 0.00 0.00 57.16 57.47 1y77 n GLU 150 Cb 0.00 -1.36 -0.05 0.00 -0.02 0.00 0.00 31.44 30.01 1y77 n GLU 150 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1y77 n LEU 151 N -2.11 0.29 -4.76 -4.62 4.77 -0.89 -4.89 117.00 104.78 1y77 n LEU 151 Ca 0.00 0.64 -0.39 0.00 -0.03 0.00 0.00 56.01 56.23 1y77 n LEU 151 Cb 0.00 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.53 1y77 n LEU 151 CO 0.00 -0.79 0.65 -0.63 -1.33 0.00 0.00 177.39 175.28 1y77 s ILE 152 N 0.71 4.12 -0.51 -0.08 1.01 -0.90 -4.78 121.20 120.77 1y77 s ILE 152 Ca 0.53 2.00 0.01 0.00 0.00 0.00 0.00 60.65 63.19 1y77 s ILE 152 Cb -0.75 -4.23 0.13 0.00 0.01 0.00 0.00 42.46 37.62 1y77 s ILE 152 CO 0.37 0.40 0.28 -0.69 0.00 0.00 0.00 174.94 175.30 1y77 s VAL 153 N -1.31 3.01 0.00 2.92 1.01 -1.26 -1.37 120.40 123.40 1y77 s VAL 153 Ca 0.44 -2.88 0.00 0.00 0.00 0.00 0.00 61.98 59.53 1y77 s VAL 153 Cb -0.24 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.09 1y77 s VAL 153 CO 0.29 -0.78 0.00 -0.67 0.00 0.00 0.00 175.10 173.94 1y77 n ASP 154 N 3.61 0.00 0.00 3.32 -0.08 -1.26 -5.08 116.55 117.06 1y77 n ASP 154 Ca 0.05 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 1y77 n ASP 154 Cb 0.37 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.83 1y77 n ASP 154 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50