#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k83 n ALA 73 N 0.00 -1.98 -3.48 7.82 0.00 -1.26 -4.84 120.51 116.76 1k83 n ALA 73 Ca 0.00 0.49 -0.14 0.00 0.00 0.00 0.00 53.44 53.79 1k83 n ALA 73 Cb 0.00 -1.48 -0.15 0.00 0.00 0.00 0.00 19.45 17.81 1k83 n ALA 73 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1k83 s ILE 74 N -5.30 -0.01 0.55 0.00 1.01 -1.02 -4.66 121.20 111.77 1k83 s ILE 74 Ca 0.00 0.13 -0.20 0.00 0.00 0.00 0.00 60.65 60.58 1k83 s ILE 74 Cb 0.00 -0.09 -0.06 0.00 0.01 0.00 0.00 42.46 42.32 1k83 s ILE 74 CO 0.00 0.07 1.00 -0.81 0.00 0.00 0.00 174.94 175.20 1k83 n PRO 75 N 3.84 1.08 0.24 2.79 -0.04 -1.26 -4.71 135.00 136.93 1k83 n PRO 75 Ca -0.23 0.41 0.08 0.00 -0.04 0.00 0.00 63.50 63.72 1k83 n PRO 75 Cb 0.53 -2.17 0.42 0.00 -0.04 0.00 0.00 33.50 32.25 1k83 n PRO 75 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1k83 h LYS 76 N 0.83 0.00 -6.22 0.54 3.64 -2.01 -3.36 116.57 109.99 1k83 h LYS 76 Ca -0.48 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.30 1k83 h LYS 76 Cb 1.35 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 33.09 1k83 h LYS 76 CO 0.53 0.00 -0.59 -0.51 -2.27 0.00 0.00 179.45 176.60 1k83 s ASP 77 N -3.59 5.39 0.00 4.20 1.01 -1.26 -4.44 116.67 117.97 1k83 s ASP 77 Ca -0.02 -0.13 0.00 0.00 0.71 0.00 0.00 52.55 53.11 1k83 s ASP 77 Cb 0.04 -1.38 0.00 0.00 1.01 0.00 0.00 42.92 42.60 1k83 s ASP 77 CO 0.14 0.11 0.00 0.00 0.21 0.00 0.00 175.17 175.63 1k83 n GLN 78 N -0.03 0.00 -2.41 8.23 6.02 -1.26 -5.01 117.38 122.92 1k83 n GLN 78 Ca -0.09 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.47 1k83 n GLN 78 Cb 0.54 -2.01 -0.02 0.00 1.02 0.00 0.00 30.24 29.76 1k83 n GLN 78 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1k83 s ARG 79 N -0.28 4.19 0.00 -1.09 0.52 -1.26 -4.85 118.95 116.19 1k83 s ARG 79 Ca 0.00 1.63 0.24 0.00 -0.52 0.00 0.00 55.73 57.08 1k83 s ARG 79 Cb 0.00 -3.78 0.29 0.00 0.52 0.00 0.00 34.95 31.98 1k83 s ARG 79 CO 0.00 -0.76 1.29 0.00 0.02 0.00 0.00 175.30 175.85 1k83 n ALA 80 N 6.74 3.11 -1.12 2.13 0.00 -1.26 -4.95 120.51 125.17 1k83 n ALA 80 Ca 0.14 -0.59 -0.30 0.00 0.00 0.00 0.00 53.44 52.69 1k83 n ALA 80 Cb 0.45 -0.90 0.15 0.00 0.00 0.00 0.00 19.45 19.15 1k83 n ALA 80 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1k83 s THR 81 N -2.32 2.55 0.43 0.00 2.01 -1.26 -4.96 115.64 112.08 1k83 s THR 81 Ca 0.24 0.18 -0.26 0.00 0.31 0.00 0.00 61.69 62.16 1k83 s THR 81 Cb 0.19 -2.60 -0.09 0.00 0.01 0.00 0.00 72.50 70.01 1k83 s THR 81 CO 0.47 -0.23 1.43 -0.89 -0.69 0.00 0.00 174.62 174.71 1k83 s THR 82 N -2.88 2.13 -0.72 -0.82 2.01 -1.26 -4.89 115.64 109.22 1k83 s THR 82 Ca 0.64 0.12 0.26 0.00 0.31 0.00 0.00 61.69 63.02 1k83 s THR 82 Cb -0.19 -3.07 0.29 0.00 0.01 0.00 0.00 72.50 69.54 1k83 s THR 82 CO 0.58 0.02 1.77 -2.65 -0.69 0.00 0.00 174.62 173.65 1k83 n PRO 83 N -0.01 0.26 -3.40 4.92 -0.02 -1.26 -4.81 135.00 130.69 1k83 n PRO 83 Ca 0.04 0.23 -0.32 0.00 -2.02 0.00 0.00 63.50 61.43 1k83 n PRO 83 Cb 0.41 -1.81 -0.05 0.00 -0.02 0.00 0.00 33.50 32.03 1k83 n PRO 83 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1k83 s TYR 84 N -3.11 3.42 -0.01 6.00 1.51 -1.26 -1.54 117.35 122.36 1k83 s TYR 84 Ca 0.10 0.89 -0.23 0.00 -1.01 0.00 0.00 57.07 56.82 1k83 s TYR 84 Cb 0.12 -2.27 -0.05 0.00 -0.11 0.00 0.00 41.96 39.65 1k83 s TYR 84 CO 0.59 0.26 0.69 1.41 -1.11 0.00 0.00 175.55 177.39 1k83 s MET 85 N -2.84 4.42 0.65 -0.62 -2.45 -0.54 -4.80 119.30 113.13 1k83 s MET 85 Ca 0.48 0.91 -0.12 0.00 -1.25 0.00 0.00 55.69 55.70 1k83 s MET 85 Cb -0.11 -3.39 -0.01 0.00 1.25 0.00 0.00 34.83 32.57 1k83 s MET 85 CO 0.21 0.23 1.05 0.95 1.05 0.00 0.00 175.02 178.51 1k83 s THR 86 N 0.20 4.12 0.31 10.11 -4.23 -1.26 -4.80 115.64 120.09 1k83 s THR 86 Ca 0.36 0.76 0.37 0.00 -1.18 0.00 0.00 61.69 62.00 1k83 s THR 86 Cb -0.19 -3.48 0.40 0.00 1.34 0.00 0.00 72.50 70.57 1k83 s THR 86 CO 0.20 -0.82 2.12 0.07 -0.54 0.00 0.00 174.62 175.64 1k83 h LYS 87 N -0.34 0.00 0.14 3.99 2.10 -1.96 -1.42 116.57 119.08 1k83 h LYS 87 Ca -0.45 0.00 -0.29 0.00 -2.00 0.00 0.00 60.65 57.92 1k83 h LYS 87 Cb 1.21 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.56 1k83 h LYS 87 CO 0.58 0.01 -1.26 1.88 -2.00 0.00 0.00 179.45 178.66 1k83 h TYR 88 N 0.00 0.76 -0.35 0.07 -1.99 -1.99 -2.67 116.97 110.80 1k83 h TYR 88 Ca -0.00 -0.51 -0.07 0.00 2.00 0.00 0.00 58.73 60.14 1k83 h TYR 88 Cb 0.34 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.01 1k83 h TYR 88 CO 0.00 1.38 -0.07 0.93 -0.00 0.00 0.00 178.16 180.40 1k83 h GLU 89 N 0.17 0.67 -0.40 4.88 5.08 -1.78 0.32 114.58 123.52 1k83 h GLU 89 Ca -0.17 -0.25 0.04 0.00 -1.00 0.00 0.00 59.36 57.98 1k83 h GLU 89 Cb 1.95 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 31.12 1k83 h GLU 89 CO 0.22 0.82 0.18 -0.09 -1.00 0.00 0.00 179.01 179.15 1k83 h ARG 90 N 0.47 0.36 -0.64 2.33 2.43 -1.33 0.12 114.38 118.12 1k83 h ARG 90 Ca 0.09 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 1k83 h ARG 90 Cb 0.56 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 1k83 h ARG 90 CO 0.03 0.24 0.12 0.00 -1.51 0.00 0.00 179.97 178.85 1k83 h ALA 91 N 1.23 1.02 0.03 2.80 0.00 -1.18 -0.13 119.26 123.02 1k83 h ALA 91 Ca 0.18 -0.25 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 1k83 h ALA 91 Cb 0.11 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 17.67 1k83 h ALA 91 CO -0.14 0.63 -1.07 -0.09 0.00 0.00 0.00 179.25 178.58 1k83 h ARG 92 N 0.97 0.56 0.24 0.00 2.43 -0.49 -1.59 114.38 116.49 1k83 h ARG 92 Ca 0.20 -0.65 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 1k83 h ARG 92 Cb 0.39 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1k83 h ARG 92 CO 0.01 1.26 -0.12 0.82 -1.51 0.00 0.00 179.97 180.43 1k83 h ILE 93 N 0.29 0.81 -0.89 1.20 2.04 -0.70 0.11 117.51 120.37 1k83 h ILE 93 Ca -0.13 -0.40 0.10 0.00 1.00 0.00 0.00 64.86 65.43 1k83 h ILE 93 Cb 1.72 1.05 -0.07 0.00 -0.74 0.00 0.00 36.82 38.78 1k83 h ILE 93 CO 0.20 0.09 0.58 -0.07 0.00 0.00 0.00 178.15 178.94 1k83 h LEU 94 N -0.53 0.80 -0.44 1.44 3.38 -1.08 0.12 115.31 119.00 1k83 h LEU 94 Ca -0.03 0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 1k83 h LEU 94 Cb 0.40 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1k83 h LEU 94 CO 0.05 0.46 -0.62 1.23 0.09 0.00 0.00 178.44 179.66 1k83 h GLY 95 N 0.88 0.62 1.05 0.83 0.00 -1.07 -0.65 103.07 104.73 1k83 h GLY 95 Ca 0.42 -0.78 -0.14 0.00 0.00 0.00 0.00 47.33 46.83 1k83 h GLY 95 CO -0.18 0.69 -0.33 -0.84 0.00 0.00 0.00 176.54 175.88 1k83 h THR 96 N 0.42 1.28 -0.10 4.70 2.02 0.31 -2.35 112.91 119.20 1k83 h THR 96 Ca -0.01 -1.50 -0.04 0.00 0.77 0.00 0.00 66.41 65.63 1k83 h THR 96 Cb 1.18 1.47 -0.00 0.00 -1.74 0.00 0.00 68.15 69.06 1k83 h THR 96 CO 0.12 0.49 -0.08 -0.09 0.37 0.00 0.00 175.52 176.33 1k83 h ARG 97 N 0.62 0.23 -0.89 6.66 9.65 -0.82 -2.85 114.38 126.98 1k83 h ARG 97 Ca 0.06 -0.12 0.15 0.00 -1.10 0.00 0.00 59.98 58.97 1k83 h ARG 97 Cb 0.92 0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.43 1k83 h ARG 97 CO 0.08 0.63 0.57 0.00 2.80 0.00 0.00 179.97 184.06 1k83 h ALA 98 N 0.59 1.87 -0.46 2.80 0.00 -1.10 0.07 119.26 123.03 1k83 h ALA 98 Ca 0.02 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1k83 h ALA 98 Cb 0.58 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1k83 h ALA 98 CO 0.02 -0.11 0.08 1.25 0.00 0.00 0.00 179.25 180.49 1k83 h LEU 99 N 0.66 0.72 -0.18 0.00 5.85 -1.33 0.29 115.31 121.33 1k83 h LEU 99 Ca 0.45 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 1k83 h LEU 99 Cb 0.76 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1k83 h LEU 99 CO -0.20 0.80 0.05 1.56 -0.34 0.00 0.00 178.44 180.30 1k83 h GLN 100 N 0.62 0.29 -0.66 1.25 4.20 -0.82 -2.15 115.11 117.84 1k83 h GLN 100 Ca 0.14 -0.07 0.04 0.00 0.06 0.00 0.00 58.65 58.82 1k83 h GLN 100 Cb 0.38 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.08 1k83 h GLN 100 CO 0.01 0.41 0.43 0.82 -0.67 0.00 0.00 178.83 179.83 1k83 h ILE 101 N 0.11 1.07 0.00 2.54 2.04 -1.01 0.57 117.51 122.83 1k83 h ILE 101 Ca 0.06 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1k83 h ILE 101 Cb 0.25 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1k83 h ILE 101 CO -0.00 0.14 0.00 -1.54 0.00 0.00 0.00 178.15 176.75 1k83 n SER 102 N -4.46 0.55 -1.52 1.72 3.41 0.08 -2.39 113.62 111.00 1k83 n SER 102 Ca 0.08 0.63 -0.12 0.00 -0.26 0.00 0.00 58.87 59.20 1k83 n SER 102 Cb 0.15 -0.75 0.18 0.00 -0.26 0.00 0.00 64.21 63.53 1k83 n SER 102 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1k83 n MET 103 N -2.10 2.08 -2.44 4.33 2.81 0.13 -4.93 117.12 117.00 1k83 n MET 103 Ca 0.03 -3.23 -0.20 0.00 -1.81 0.00 0.00 57.70 52.49 1k83 n MET 103 Cb 0.24 -1.95 -0.00 0.00 -0.71 0.00 0.00 33.22 30.79 1k83 n MET 103 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1k83 n ASN 104 N -1.09 -5.69 -4.80 7.83 3.02 -1.01 -4.97 115.26 108.54 1k83 n ASN 104 Ca 0.42 -0.05 -0.35 0.00 -0.03 0.00 0.00 54.58 54.57 1k83 n ASN 104 Cb 1.14 -4.70 -0.06 0.00 -0.61 0.00 0.00 39.78 35.55 1k83 n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k83 s ALA 105 N -3.01 3.22 0.35 5.41 0.00 -0.79 -4.98 121.76 121.97 1k83 s ALA 105 Ca 0.03 0.38 -0.25 0.00 0.00 0.00 0.00 51.96 52.12 1k83 s ALA 105 Cb -0.01 -3.07 -0.13 0.00 0.00 0.00 0.00 23.12 19.91 1k83 s ALA 105 CO 0.04 0.21 0.80 -2.30 0.00 0.00 0.00 175.76 174.51 1k83 n PRO 106 N 0.20 0.94 -4.06 0.00 -0.02 -1.26 -4.60 135.00 126.20 1k83 n PRO 106 Ca 0.03 0.34 -0.26 0.00 -2.02 0.00 0.00 63.50 61.58 1k83 n PRO 106 Cb 0.52 -1.68 -0.05 0.00 -0.02 0.00 0.00 33.50 32.26 1k83 n PRO 106 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1k83 s VAL 107 N -1.24 4.60 -0.66 -1.45 1.01 -1.26 -4.91 120.40 116.49 1k83 s VAL 107 Ca 0.62 -1.05 0.14 0.00 0.00 0.00 0.00 61.98 61.69 1k83 s VAL 107 Cb -0.66 -3.36 0.43 0.00 0.00 0.00 0.00 36.38 32.79 1k83 s VAL 107 CO 0.58 -0.12 1.36 0.49 0.00 0.00 0.00 175.10 177.41 1k83 n PHE 108 N -0.43 0.75 -4.29 5.22 3.01 -1.26 -5.04 117.46 115.42 1k83 n PHE 108 Ca -0.08 -0.65 -0.19 0.00 1.01 0.00 0.00 57.45 57.53 1k83 n PHE 108 Cb 0.55 -0.16 -0.08 0.00 -0.01 0.00 0.00 39.48 39.78 1k83 n PHE 108 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1k83 s VAL 109 N -1.78 0.02 -0.51 -4.37 1.01 -1.26 -5.00 120.40 108.52 1k83 s VAL 109 Ca 0.33 -2.00 -0.20 0.00 0.00 0.00 0.00 61.98 60.11 1k83 s VAL 109 Cb 0.23 -2.49 0.05 0.00 0.00 0.00 0.00 36.38 34.17 1k83 s VAL 109 CO 0.14 0.00 0.67 -0.62 0.00 0.00 0.00 175.10 175.29 1k83 s ASP 110 N -3.38 6.25 -1.06 3.32 -1.08 -1.26 -4.97 116.67 114.49 1k83 s ASP 110 Ca 0.40 -0.78 -0.24 0.00 -0.52 0.00 0.00 52.55 51.42 1k83 s ASP 110 Cb 0.03 -2.31 -0.08 0.00 -1.46 0.00 0.00 42.92 39.09 1k83 s ASP 110 CO 0.27 -0.93 1.96 -0.76 0.52 0.00 0.00 175.17 176.23 1k83 s LEU 111 N 2.84 3.06 -0.02 -1.34 1.02 -1.26 -4.77 118.68 118.21 1k83 s LEU 111 Ca 0.18 -1.21 -0.03 0.00 0.02 0.00 0.00 54.13 53.09 1k83 s LEU 111 Cb -0.18 -2.58 -0.11 0.00 0.02 0.00 0.00 46.19 43.34 1k83 s LEU 111 CO 0.14 -3.04 1.84 -0.62 0.02 0.00 0.00 176.35 174.68 1k83 n GLU 112 N 8.51 0.87 0.00 1.70 1.02 -1.26 -4.12 120.64 127.36 1k83 n GLU 112 Ca 0.43 -0.45 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1k83 n GLU 112 Cb 0.47 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 1k83 n GLU 112 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1k83 n GLY 113 N 2.81 1.54 3.62 0.62 0.00 -1.26 -5.09 105.19 107.44 1k83 n GLY 113 Ca 0.19 -0.29 -0.45 0.00 0.00 0.00 0.00 46.02 45.46 1k83 n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1k83 n GLU 114 N 0.00 1.56 0.00 1.61 -0.58 -1.26 -4.88 120.64 117.09 1k83 n GLU 114 Ca 0.00 0.55 0.00 0.00 -0.42 0.00 0.00 57.16 57.29 1k83 n GLU 114 Cb 0.00 -2.04 0.00 0.00 -0.57 0.00 0.00 31.44 28.83 1k83 n GLU 114 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1k83 n THR 115 N 0.91 0.00 -3.23 2.62 -2.24 -1.26 -4.90 114.28 106.18 1k83 n THR 115 Ca 0.11 -0.23 -0.41 0.00 -2.27 0.00 0.00 64.05 61.25 1k83 n THR 115 Cb 0.31 1.12 -0.08 0.00 -2.10 0.00 0.00 70.33 69.58 1k83 n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1k83 s ASP 116 N -0.36 6.33 0.05 3.42 -1.08 -1.26 -5.01 116.67 118.76 1k83 s ASP 116 Ca 0.00 0.02 -0.09 0.00 -0.52 0.00 0.00 52.55 51.96 1k83 s ASP 116 Cb 0.00 -2.27 -0.02 0.00 -1.46 0.00 0.00 42.92 39.17 1k83 s ASP 116 CO 0.00 -0.47 1.04 -0.81 0.52 0.00 0.00 175.17 175.45 1k83 n PRO 117 N 5.75 -0.13 -0.31 4.34 -0.04 -1.26 -0.51 135.00 142.83 1k83 n PRO 117 Ca -0.04 1.03 0.08 0.00 -0.04 0.00 0.00 63.50 64.53 1k83 n PRO 117 Cb 0.49 -1.54 0.24 0.00 -0.04 0.00 0.00 33.50 32.65 1k83 n PRO 117 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1k83 h LEU 118 N 0.00 0.60 -1.54 1.53 5.85 -1.89 0.49 115.31 120.35 1k83 h LEU 118 Ca 0.05 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 1k83 h LEU 118 Cb 0.12 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1k83 h LEU 118 CO -0.29 0.25 -0.03 -0.09 -0.34 0.00 0.00 178.44 177.95 1k83 h ARG 119 N 0.67 0.26 0.00 1.25 9.65 -1.37 0.74 114.38 125.58 1k83 h ARG 119 Ca 0.49 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 59.32 1k83 h ARG 119 Cb 0.69 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.22 1k83 h ARG 119 CO -0.36 0.31 -0.00 0.82 2.80 0.00 0.00 179.97 183.54 1k83 h ILE 120 N 0.26 1.62 -0.99 1.20 2.04 0.21 -3.02 117.51 118.83 1k83 h ILE 120 Ca 0.06 -1.89 0.17 0.00 1.00 0.00 0.00 64.86 64.20 1k83 h ILE 120 Cb 0.22 2.90 -0.10 0.00 -0.74 0.00 0.00 36.82 39.11 1k83 h ILE 120 CO 0.01 0.49 0.61 0.00 0.00 0.00 0.00 178.15 179.26 1k83 h ALA 121 N 0.16 1.71 -0.01 1.87 0.00 0.21 0.48 119.26 123.67 1k83 h ALA 121 Ca -0.00 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1k83 h ALA 121 Cb 0.80 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1k83 h ALA 121 CO 0.00 -0.04 -0.23 0.52 0.00 0.00 0.00 179.25 179.51 1k83 h MET 122 N 0.78 0.02 -0.06 0.00 2.86 -0.88 -1.61 114.93 116.04 1k83 h MET 122 Ca 0.54 -0.01 -0.21 0.00 -2.06 0.00 0.00 59.70 57.97 1k83 h MET 122 Cb 0.83 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.49 1k83 h MET 122 CO -0.32 0.25 -0.82 -0.22 1.06 0.00 0.00 176.91 176.85 1k83 h LYS 123 N 0.02 0.48 -0.48 1.72 3.64 0.03 -2.57 116.57 119.40 1k83 h LYS 123 Ca 0.00 -0.43 -0.04 0.00 -1.27 0.00 0.00 60.65 58.91 1k83 h LYS 123 Cb 0.41 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 1k83 h LYS 123 CO 0.03 1.07 0.14 0.93 -2.27 0.00 0.00 179.45 179.35 1k83 h GLU 124 N 0.30 0.75 0.06 1.90 5.08 -0.48 -1.85 114.58 120.34 1k83 h GLU 124 Ca -0.05 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1k83 h GLU 124 Cb 1.43 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 1k83 h GLU 124 CO 0.15 0.72 -0.08 1.25 -1.00 0.00 0.00 179.01 180.05 1k83 h LEU 125 N 0.64 -0.20 -0.99 1.33 5.85 -1.30 -0.22 115.31 120.43 1k83 h LEU 125 Ca 0.15 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.99 1k83 h LEU 125 Cb 0.29 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.32 1k83 h LEU 125 CO -0.00 -0.12 0.62 0.00 -0.34 0.00 0.00 178.44 178.60 1k83 h ALA 126 N 0.77 1.43 -0.35 1.25 0.00 -1.37 0.97 119.26 121.96 1k83 h ALA 126 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1k83 h ALA 126 Cb 0.17 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 17.63 1k83 h ALA 126 CO -0.04 0.30 0.18 0.39 0.00 0.00 0.00 179.25 180.08 1k83 n GLU 127 N -4.58 1.88 -3.80 0.00 1.02 -0.71 -4.89 120.64 109.56 1k83 n GLU 127 Ca 0.17 -1.24 -0.30 0.00 -0.02 0.00 0.00 57.16 55.76 1k83 n GLU 127 Cb 0.28 -1.59 -0.06 0.00 -0.02 0.00 0.00 31.44 30.04 1k83 n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1k83 n LYS 128 N -0.02 -0.82 -1.97 3.49 4.76 0.33 -4.81 118.16 119.13 1k83 n LYS 128 Ca 0.20 0.10 -0.26 0.00 -2.87 0.00 0.00 58.31 55.48 1k83 n LYS 128 Cb 0.86 -3.37 0.03 0.00 -1.84 0.00 0.00 35.03 30.70 1k83 n LYS 128 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1k83 n LYS 129 N -3.27 3.49 -3.80 1.97 5.02 -0.19 -4.84 118.16 116.55 1k83 n LYS 129 Ca 0.02 -4.08 -0.36 0.00 -2.02 0.00 0.00 58.31 51.88 1k83 n LYS 129 Cb 0.37 -2.28 -0.12 0.00 -0.02 0.00 0.00 35.03 32.99 1k83 n LYS 129 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1k83 s ILE 130 N -4.69 3.22 -0.57 -0.18 1.01 -1.26 -4.83 121.20 113.90 1k83 s ILE 130 Ca 0.52 -2.03 -0.04 0.00 0.00 0.00 0.00 60.65 59.11 1k83 s ILE 130 Cb 0.42 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 1k83 s ILE 130 CO 0.02 -0.65 1.72 -0.81 0.00 0.00 0.00 174.94 175.21 1k83 n PRO 131 N 4.58 1.32 -4.33 2.79 -0.04 -1.26 -4.45 135.00 133.61 1k83 n PRO 131 Ca -0.03 -1.08 -0.20 0.00 -0.04 0.00 0.00 63.50 62.15 1k83 n PRO 131 Cb 0.42 -2.26 -0.11 0.00 -0.04 0.00 0.00 33.50 31.50 1k83 n PRO 131 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1k83 s LEU 132 N 0.06 2.47 -0.03 1.53 1.43 -1.26 -5.06 118.68 117.82 1k83 s LEU 132 Ca 0.25 -0.90 0.05 0.00 -1.03 0.00 0.00 54.13 52.50 1k83 s LEU 132 Cb 0.07 -0.76 -0.01 0.00 0.03 0.00 0.00 46.19 45.52 1k83 s LEU 132 CO -0.02 -0.08 -0.19 -0.69 0.23 0.00 0.00 176.35 175.60 1k83 s VAL 133 N -2.33 1.50 -0.25 -1.59 1.01 -1.26 -1.38 120.40 116.09 1k83 s VAL 133 Ca 0.17 -0.79 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 1k83 s VAL 133 Cb -0.04 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1k83 s VAL 133 CO 0.06 0.43 0.13 -0.63 0.00 0.00 0.00 175.10 175.09 1k83 s ILE 134 N -0.26 4.99 -0.49 2.22 1.01 0.23 -4.97 121.20 123.94 1k83 s ILE 134 Ca 0.03 0.06 -0.15 0.00 0.00 0.00 0.00 60.65 60.59 1k83 s ILE 134 Cb -0.09 -3.34 0.10 0.00 0.01 0.00 0.00 42.46 39.13 1k83 s ILE 134 CO 0.01 0.32 0.42 -0.60 0.00 0.00 0.00 174.94 175.09 1k83 s ARG 135 N 1.37 2.93 -0.25 2.79 3.52 -1.26 -2.10 118.95 125.96 1k83 s ARG 135 Ca 0.06 -1.50 -0.24 0.00 -0.13 0.00 0.00 55.73 53.92 1k83 s ARG 135 Cb -0.15 -4.15 -0.01 0.00 -1.56 0.00 0.00 34.95 29.08 1k83 s ARG 135 CO 0.06 -1.13 0.80 1.03 -0.81 0.00 0.00 175.30 175.24 1k83 s ARG 136 N 1.60 4.17 0.24 5.12 0.52 -0.28 -4.93 118.95 125.38 1k83 s ARG 136 Ca 0.04 0.87 -0.06 0.00 -0.52 0.00 0.00 55.73 56.06 1k83 s ARG 136 Cb -0.26 -3.65 -0.06 0.00 0.52 0.00 0.00 34.95 31.50 1k83 s ARG 136 CO 0.05 -0.51 0.51 0.71 0.02 0.00 0.00 175.30 176.08 1k83 s TYR 137 N 2.79 3.46 0.24 -0.53 1.51 -1.26 -1.06 117.35 122.50 1k83 s TYR 137 Ca 0.33 0.68 0.07 0.00 -1.01 0.00 0.00 57.07 57.14 1k83 s TYR 137 Cb -0.15 -2.12 -0.04 0.00 -0.11 0.00 0.00 41.96 39.55 1k83 s TYR 137 CO 0.08 0.26 0.21 -0.51 -1.11 0.00 0.00 175.55 174.47 1k83 s LEU 138 N -3.16 3.86 0.39 -1.29 1.43 -0.72 -4.97 118.68 114.22 1k83 s LEU 138 Ca 0.44 -0.21 0.14 0.00 -1.03 0.00 0.00 54.13 53.47 1k83 s LEU 138 Cb -0.11 -2.40 0.99 0.00 0.03 0.00 0.00 46.19 44.70 1k83 s LEU 138 CO 0.26 -0.03 1.83 1.55 0.23 0.00 0.00 176.35 180.19 1k83 h PRO 139 N 1.55 0.49 0.00 1.29 0.13 -1.99 -2.10 132.00 131.37 1k83 h PRO 139 Ca -0.49 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1k83 h PRO 139 Cb 1.23 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1k83 h PRO 139 CO 0.61 0.33 0.00 -0.40 -0.23 0.00 0.00 178.00 178.31 1k83 n ASP 140 N -4.58 0.00 0.00 1.44 5.68 -1.26 -4.93 116.55 112.90 1k83 n ASP 140 Ca 0.21 0.47 0.00 0.00 -0.50 0.00 0.00 54.79 54.97 1k83 n ASP 140 Cb 0.67 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 40.16 1k83 n ASP 140 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k83 n GLY 141 N 1.30 1.66 3.28 6.12 0.00 -0.79 -5.03 105.19 111.73 1k83 n GLY 141 Ca 0.07 -0.48 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 1k83 n GLY 141 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k83 n SER 142 N 0.03 -3.37 -3.55 1.61 3.41 -1.26 -2.92 113.62 107.56 1k83 n SER 142 Ca 0.00 -0.62 -0.10 0.00 -0.26 0.00 0.00 58.87 57.89 1k83 n SER 142 Cb 0.00 -1.07 -0.04 0.00 -0.26 0.00 0.00 64.21 62.84 1k83 n SER 142 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1k83 s PHE 143 N -2.20 -0.37 0.20 7.33 -0.12 -1.26 -1.75 117.98 119.81 1k83 s PHE 143 Ca 0.66 0.50 0.09 0.00 -0.05 0.00 0.00 56.93 58.12 1k83 s PHE 143 Cb -0.16 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.67 1k83 s PHE 143 CO 0.59 -0.42 -0.06 -1.21 -0.05 0.00 0.00 175.22 174.07 1k83 s GLU 144 N -1.85 2.17 -0.15 1.99 2.02 -0.22 -2.43 118.70 120.23 1k83 s GLU 144 Ca 0.00 -1.28 0.00 0.00 0.02 0.00 0.00 54.97 53.72 1k83 s GLU 144 Cb -0.01 -2.19 0.03 0.00 0.10 0.00 0.00 34.13 32.06 1k83 s GLU 144 CO -0.02 0.42 -0.12 -0.51 0.02 0.00 0.00 175.26 175.05 1k83 s ASP 145 N -3.04 2.63 0.12 -0.19 1.11 -1.26 -1.12 116.67 114.92 1k83 s ASP 145 Ca 0.27 -0.48 0.10 0.00 0.18 0.00 0.00 52.55 52.61 1k83 s ASP 145 Cb -0.08 -1.10 -0.04 0.00 1.07 0.00 0.00 42.92 42.77 1k83 s ASP 145 CO 0.17 -0.08 -0.25 0.26 1.18 0.00 0.00 175.17 176.44 1k83 s TRP 146 N 1.54 2.15 0.04 4.23 0.52 -0.89 -4.99 118.94 121.53 1k83 s TRP 146 Ca 0.04 -0.39 -0.04 0.00 0.02 0.00 0.00 56.10 55.73 1k83 s TRP 146 Cb -0.13 -1.17 -0.05 0.00 -1.15 0.00 0.00 33.47 30.97 1k83 s TRP 146 CO -0.10 0.29 0.26 -1.54 0.02 0.00 0.00 176.95 175.88 1k83 s SER 147 N -1.99 6.44 0.52 2.95 1.04 -1.26 -0.60 113.70 120.81 1k83 s SER 147 Ca 0.12 0.47 0.26 0.00 0.48 0.00 0.00 55.95 57.27 1k83 s SER 147 Cb -0.10 -2.05 1.39 0.00 0.10 0.00 0.00 66.02 65.36 1k83 s SER 147 CO 0.05 0.21 1.96 0.58 0.98 0.00 0.00 173.24 177.02 1k83 h VAL 148 N 2.65 0.70 0.07 5.02 2.07 -1.46 0.65 116.25 125.95 1k83 h VAL 148 Ca -0.48 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 1k83 h VAL 148 Cb 1.18 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1k83 h VAL 148 CO 0.70 0.01 -0.03 -0.33 0.02 0.00 0.00 177.57 177.93 1k83 h GLU 149 N 0.04 -0.09 0.85 1.57 5.08 -1.80 -3.28 114.58 116.95 1k83 h GLU 149 Ca 0.30 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.63 1k83 h GLU 149 Cb 1.16 0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.44 1k83 h GLU 149 CO -0.02 -0.03 -0.44 0.93 -1.00 0.00 0.00 179.01 178.46 1k83 h GLU 150 N -0.13 -1.14 -5.24 2.33 5.08 -1.28 -3.45 114.58 110.75 1k83 h GLU 150 Ca -0.01 0.08 -0.69 0.00 -1.00 0.00 0.00 59.36 57.74 1k83 h GLU 150 Cb 0.10 0.26 0.04 0.00 0.50 0.00 0.00 28.75 29.66 1k83 h GLU 150 CO 0.02 -0.76 0.06 1.28 -1.00 0.00 0.00 179.01 178.61 1k83 n LEU 151 N -5.25 0.01 -4.73 1.33 4.77 -0.79 -4.91 117.00 107.43 1k83 n LEU 151 Ca -0.15 1.01 -0.40 0.00 -0.03 0.00 0.00 56.01 56.45 1k83 n LEU 151 Cb 0.47 -0.80 -0.05 0.00 -2.33 0.00 0.00 43.42 40.71 1k83 n LEU 151 CO 0.35 -1.65 0.48 -0.63 -1.33 0.00 0.00 177.39 174.61 1k83 s ILE 152 N 0.05 4.86 -0.65 -0.08 1.01 -0.59 -4.82 121.20 120.98 1k83 s ILE 152 Ca 0.80 1.65 -0.09 0.00 0.00 0.00 0.00 60.65 63.01 1k83 s ILE 152 Cb -1.11 -4.13 0.17 0.00 0.01 0.00 0.00 42.46 37.39 1k83 s ILE 152 CO 0.50 0.29 0.52 -0.69 0.00 0.00 0.00 174.94 175.57 1k83 s VAL 153 N 0.42 4.51 -0.06 2.92 1.01 -1.26 -1.47 120.40 126.47 1k83 s VAL 153 Ca 0.41 -2.45 -0.01 0.00 0.00 0.00 0.00 61.98 59.93 1k83 s VAL 153 Cb -0.20 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.32 1k83 s VAL 153 CO 0.22 -0.90 -0.00 -0.62 0.00 0.00 0.00 175.10 173.80 1k83 s ASP 154 N 1.77 1.24 0.00 3.32 -1.08 -1.26 -5.07 116.67 115.59 1k83 s ASP 154 Ca 0.14 -0.07 0.00 0.00 -0.52 0.00 0.00 52.55 52.10 1k83 s ASP 154 Cb -0.19 -0.38 0.00 0.00 -1.46 0.00 0.00 42.92 40.89 1k83 s ASP 154 CO -0.04 -0.16 0.00 0.18 0.52 0.00 0.00 175.17 175.67