#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lys s LYS 57 N 0.00 2.68 0.00 9.51 0.00 -1.26 -4.21 119.74 126.46 3lys s LYS 57 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 55.97 54.89 3lys s LYS 57 Cb 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 37.83 34.83 3lys s LYS 57 CO 0.00 -0.46 0.00 0.94 0.00 0.00 0.00 175.35 175.83 3lys n GLN 58 N 4.63 0.00 -2.89 1.78 7.27 -1.26 -5.06 117.38 121.85 3lys n GLN 58 Ca -0.16 0.00 -0.40 0.00 0.07 0.00 0.00 57.00 56.51 3lys n GLN 58 Cb 0.46 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 33.06 3lys n GLN 58 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 3lys s GLU 59 N -2.00 4.56 0.25 3.69 2.02 -1.26 -1.38 118.70 124.58 3lys s GLU 59 Ca 0.00 1.20 -0.05 0.00 0.02 0.00 0.00 54.97 56.14 3lys s GLU 59 Cb 0.00 -3.38 0.48 0.00 0.10 0.00 0.00 34.13 31.34 3lys s GLU 59 CO 0.00 0.23 1.64 0.97 0.02 0.00 0.00 175.26 178.12 3lys h ILE 60 N 4.17 0.34 0.44 -1.63 6.09 -1.15 0.01 117.51 125.78 3lys h ILE 60 Ca -0.43 -0.04 -0.02 0.00 -1.37 0.00 0.00 64.86 63.00 3lys h ILE 60 Cb 1.21 0.20 -0.00 0.00 0.47 0.00 0.00 36.82 38.70 3lys h ILE 60 CO 0.72 0.02 -0.24 0.77 -3.07 0.00 0.00 178.15 176.35 3lys h SER 61 N 0.13 -0.58 -0.32 2.19 4.64 -1.84 -1.03 113.55 116.73 3lys h SER 61 Ca 0.44 0.03 0.07 0.00 -0.47 0.00 0.00 61.79 61.85 3lys h SER 61 Cb 0.79 0.16 -0.07 0.00 -0.31 0.00 0.00 62.40 62.97 3lys h SER 61 CO -0.66 -0.39 -0.12 -0.08 -0.87 0.00 0.00 176.83 174.71 3lys h GLU 62 N -0.63 -0.06 -0.38 4.77 4.81 -1.62 -2.15 114.58 119.31 3lys h GLU 62 Ca -0.05 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3lys h GLU 62 Cb 0.50 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 3lys h GLU 62 CO 0.07 -0.04 0.22 -0.92 -0.73 0.00 0.00 179.01 177.61 3lys h TYR 63 N -0.06 0.40 -0.68 0.92 5.03 -0.95 -2.11 116.97 119.52 3lys h TYR 63 Ca 0.16 0.01 0.13 0.00 2.58 0.00 0.00 58.73 61.62 3lys h TYR 63 Cb 0.31 -0.13 -0.09 0.00 1.55 0.00 0.00 36.73 38.37 3lys h TYR 63 CO -0.34 0.23 0.19 0.35 -1.32 0.00 0.00 178.16 177.28 3lys h PHE 64 N 0.44 0.32 0.18 -3.82 3.04 -0.53 0.40 116.94 116.96 3lys h PHE 64 Ca 0.15 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.13 3lys h PHE 64 Cb 0.02 -0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.49 3lys h PHE 64 CO -0.08 -0.01 -0.09 -0.22 -2.02 0.00 0.00 178.31 175.89 3lys h LYS 65 N 0.32 -0.23 -0.52 1.11 3.64 -1.20 -2.80 116.57 116.88 3lys h LYS 65 Ca 0.37 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.86 3lys h LYS 65 Cb 0.57 0.05 -0.11 0.00 -0.41 0.00 0.00 32.23 32.33 3lys h LYS 65 CO -0.42 -0.11 -0.27 0.22 -2.27 0.00 0.00 179.45 176.60 3lys h ASP 66 N -0.30 -0.95 0.00 4.20 1.82 -0.41 -1.46 116.42 119.32 3lys h ASP 66 Ca -0.02 0.20 0.00 0.00 -0.39 0.00 0.00 57.03 56.81 3lys h ASP 66 Cb 0.24 0.49 0.00 0.00 0.68 0.00 0.00 39.33 40.73 3lys h ASP 66 CO 0.04 -0.28 0.00 1.87 -1.61 0.00 0.00 179.24 179.26 3lys n TRP 67 N -5.42 0.00 0.00 0.28 -0.00 0.12 -2.74 117.44 109.68 3lys n TRP 67 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.54 3lys n TRP 67 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.65 3lys n TRP 67 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 3lys n GLU 69 N 0.02 0.00 -0.09 5.87 1.02 -0.55 -1.47 120.64 125.45 3lys n GLU 69 Ca 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 3lys n GLU 69 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 3lys n GLU 69 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3lys n LEU 70 N 0.00 1.84 -0.34 -4.62 4.77 -1.11 -4.33 117.00 113.21 3lys n LEU 70 Ca 0.00 0.53 0.11 0.00 -0.03 0.00 0.00 56.01 56.62 3lys n LEU 70 Cb 0.00 -0.90 -0.02 0.00 -2.33 0.00 0.00 43.42 40.18 3lys n LEU 70 CO 0.00 -0.16 0.22 -1.22 -1.33 0.00 0.00 177.39 174.90 3lys n TYR 71 N -4.53 0.00 -0.02 -1.77 4.02 -0.54 -4.68 117.16 109.64 3lys n TYR 71 Ca -0.18 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.66 3lys n TYR 71 Cb 0.45 -0.01 -0.02 0.00 -0.02 0.00 0.00 39.34 39.75 3lys n TYR 71 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 3lys n LYS 72 N -0.49 0.09 0.00 -0.72 3.00 -1.26 -4.79 118.16 114.00 3lys n LYS 72 Ca 0.08 0.04 0.00 0.00 -0.00 0.00 0.00 58.31 58.43 3lys n LYS 72 Cb 0.42 -0.68 0.00 0.00 0.00 0.00 0.00 35.03 34.77 3lys n LYS 72 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 3lys n LYS 73 N -3.17 0.00 0.00 1.64 0.00 -1.26 -0.88 118.16 114.49 3lys n LYS 73 Ca -0.09 0.00 0.15 0.00 0.00 0.00 0.00 58.31 58.38 3lys n LYS 73 Cb 0.56 0.00 0.89 0.00 0.00 0.00 0.00 35.03 36.48 3lys n LYS 73 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3lys n ASN 74 N 0.00 0.00 0.10 3.14 3.02 -1.26 -3.59 115.26 116.67 3lys n ASN 74 Ca 0.00 -0.83 -0.24 0.00 -0.03 0.00 0.00 54.58 53.48 3lys n ASN 74 Cb 0.00 -0.05 -0.15 0.00 -0.61 0.00 0.00 39.78 38.97 3lys n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3lys h ALA 75 N 3.85 0.00 -1.83 5.41 0.00 -1.32 -3.47 119.26 121.90 3lys h ALA 75 Ca 0.00 -1.00 -0.44 0.00 0.00 0.00 0.00 54.91 53.47 3lys h ALA 75 Cb 0.05 0.32 0.02 0.00 0.00 0.00 0.00 17.79 18.18 3lys h ALA 75 CO 0.00 0.84 -0.19 -1.50 0.00 0.00 0.00 179.25 178.40 3lys s ILE 76 N -2.58 3.59 0.77 0.00 1.10 -0.13 -5.07 121.20 118.89 3lys s ILE 76 Ca -0.13 -0.78 -0.16 0.00 -0.51 0.00 0.00 60.65 59.08 3lys s ILE 76 Cb 0.05 -3.28 -0.02 0.00 0.15 0.00 0.00 42.46 39.35 3lys s ILE 76 CO 0.89 -0.15 0.54 -0.67 -2.11 0.00 0.00 174.94 173.43 3lys n ASP 77 N -1.95 -1.25 -0.73 4.50 4.64 -1.26 -4.79 116.55 115.71 3lys n ASP 77 Ca 0.03 0.55 0.00 0.00 -1.38 0.00 0.00 54.79 53.99 3lys n ASP 77 Cb 0.58 -1.23 0.00 0.00 -1.04 0.00 0.00 41.12 39.44 3lys n ASP 77 CO 0.00 0.00 0.00 1.21 -0.82 0.00 0.00 177.20 177.59 3lys n GLU 78 N -0.99 0.53 0.00 -0.67 4.07 -1.26 -1.47 120.64 120.86 3lys n GLU 78 Ca 0.10 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 3lys n GLU 78 Cb 0.51 -1.25 0.00 0.00 -0.06 0.00 0.00 31.44 30.63 3lys n GLU 78 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 3lys n THR 80 N 0.46 0.00 0.24 6.31 -1.04 -1.26 -2.73 114.28 116.26 3lys n THR 80 Ca 0.00 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.10 3lys n THR 80 Cb 0.20 0.00 0.62 0.00 -1.82 0.00 0.00 70.33 69.33 3lys n THR 80 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 3lys h TYR 81 N 0.00 0.00 -0.90 -1.42 3.20 -1.57 -1.56 116.97 114.73 3lys h TYR 81 Ca 0.00 0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.01 3lys h TYR 81 Cb 0.00 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 38.20 3lys h TYR 81 CO 0.00 0.15 0.58 0.87 -1.64 0.00 0.00 178.16 178.12 3lys h LYS 82 N 0.00 0.71 -0.47 1.82 1.79 -1.80 -1.38 116.57 117.25 3lys h LYS 82 Ca -0.00 -0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.44 3lys h LYS 82 Cb 0.32 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 30.78 3lys h LYS 82 CO 0.02 0.47 0.30 0.78 -1.08 0.00 0.00 179.45 179.94 3lys h GLY 83 N 0.73 0.66 1.60 3.86 0.00 -1.61 -0.96 103.07 107.36 3lys h GLY 83 Ca 0.45 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.47 3lys h GLY 83 CO -0.21 0.22 -0.17 -0.97 0.00 0.00 0.00 176.54 175.40 3lys h TYR 84 N 0.60 0.52 -0.52 5.60 -1.99 -1.37 0.11 116.97 119.93 3lys h TYR 84 Ca 0.18 -0.09 -0.10 0.00 2.00 0.00 0.00 58.73 60.72 3lys h TYR 84 Cb -0.04 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 38.54 3lys h TYR 84 CO -0.05 0.63 -0.07 0.93 -0.00 0.00 0.00 178.16 179.60 3lys h GLU 85 N 0.44 0.94 0.10 4.88 5.08 -0.83 0.17 114.58 125.36 3lys h GLU 85 Ca 0.08 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.12 3lys h GLU 85 Cb 0.55 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3lys h GLU 85 CO 0.04 0.97 -0.05 0.37 -1.00 0.00 0.00 179.01 179.34 3lys h GLN 86 N 0.85 -0.13 -0.87 2.33 5.75 -0.64 -0.94 115.11 121.47 3lys h GLN 86 Ca 0.14 0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.75 3lys h GLN 86 Cb 0.60 0.03 -0.06 0.00 1.07 0.00 0.00 27.48 29.12 3lys h GLN 86 CO 0.04 0.16 0.56 1.15 -2.65 0.00 0.00 178.83 178.09 3lys h THR 87 N -0.42 0.97 0.34 2.39 2.02 -0.63 0.24 112.91 117.82 3lys h THR 87 Ca -0.01 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 3lys h THR 87 Cb 0.35 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 3lys h THR 87 CO 0.02 0.16 -0.16 0.25 0.37 0.00 0.00 175.52 176.15 3lys h LEU 88 N 0.85 -0.39 -0.15 2.58 5.85 -0.36 0.25 115.31 123.96 3lys h LEU 88 Ca 0.40 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 59.16 3lys h LEU 88 Cb 0.41 0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.47 3lys h LEU 88 CO -0.17 -0.25 -0.36 0.50 -0.34 0.00 0.00 178.44 177.82 3lys h LYS 89 N -0.49 -0.41 -0.48 1.25 3.64 0.25 -0.70 116.57 119.62 3lys h LYS 89 Ca -0.05 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.46 3lys h LYS 89 Cb 0.37 0.09 -0.09 0.00 -0.41 0.00 0.00 32.23 32.19 3lys h LYS 89 CO 0.08 -0.27 -0.15 1.88 -2.27 0.00 0.00 179.45 178.71 3lys h TYR 90 N -0.43 -0.35 -0.72 1.91 0.99 -0.46 -0.01 116.97 117.90 3lys h TYR 90 Ca 0.09 0.05 0.13 0.00 2.00 0.00 0.00 58.73 61.00 3lys h TYR 90 Cb 0.58 0.23 -0.09 0.00 1.00 0.00 0.00 36.73 38.45 3lys h TYR 90 CO -0.45 -0.24 0.28 1.25 -0.00 0.00 0.00 178.16 179.00 3lys h LEU 91 N -0.04 0.26 -1.61 3.88 5.85 0.38 0.08 115.31 124.11 3lys h LEU 91 Ca 0.23 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 3lys h LEU 91 Cb 0.40 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3lys h LEU 91 CO -0.52 0.11 0.07 0.11 -0.34 0.00 0.00 178.44 177.87 3lys h LYS 92 N 0.43 0.31 0.00 1.25 1.57 0.37 -3.32 116.57 117.18 3lys h LYS 92 Ca 0.38 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 3lys h LYS 92 Cb 0.56 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.81 3lys h LYS 92 CO -0.38 0.29 0.00 2.41 -0.57 0.00 0.00 179.45 181.20 3lys n THR 93 N -4.42 0.00 0.00 -0.16 -1.04 -0.10 -3.69 114.28 104.88 3lys n THR 93 Ca 0.00 0.41 0.00 0.00 -2.04 0.00 0.00 64.05 62.42 3lys n THR 93 Cb 0.14 -0.91 0.00 0.00 -1.82 0.00 0.00 70.33 67.74 3lys n THR 93 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3lys n TYR 94 N -1.03 0.00 0.00 -1.42 4.01 -0.53 -5.03 117.16 113.16 3lys n TYR 94 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3lys n TYR 94 Cb 0.00 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 3lys n TYR 94 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3lys n PRO 96 N 0.73 0.00 0.00 -0.72 -0.04 -1.24 -5.01 135.00 128.72 3lys n PRO 96 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3lys n PRO 96 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3lys n PRO 96 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3lys n ASN 97 N 0.00 1.69 -4.66 3.54 3.02 -1.26 -4.70 115.26 112.89 3lys n ASN 97 Ca 0.00 -1.24 -0.42 0.00 -0.03 0.00 0.00 54.58 52.88 3lys n ASN 97 Cb 0.00 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 38.83 3lys n ASN 97 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3lys s VAL 98 N 0.19 3.67 0.02 2.41 1.01 -1.26 -4.94 120.40 121.49 3lys s VAL 98 Ca 0.00 0.82 -0.23 0.00 0.00 0.00 0.00 61.98 62.57 3lys s VAL 98 Cb 0.00 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 3lys s VAL 98 CO 0.00 -0.07 0.70 -0.76 0.00 0.00 0.00 175.10 174.97 3lys s LEU 99 N 3.91 4.42 0.45 3.92 1.02 -1.26 -0.59 118.68 130.55 3lys s LEU 99 Ca 0.71 1.33 0.23 0.00 0.02 0.00 0.00 54.13 56.42 3lys s LEU 99 Cb -0.32 -3.12 1.23 0.00 0.02 0.00 0.00 46.19 44.01 3lys s LEU 99 CO 0.28 0.03 1.83 -0.29 0.02 0.00 0.00 176.35 178.21 3lys h ILE 100 N 4.20 0.57 -0.00 -0.59 6.09 -1.53 0.38 117.51 126.62 3lys h ILE 100 Ca -0.44 -0.09 0.00 0.00 -1.37 0.00 0.00 64.86 62.96 3lys h ILE 100 Cb 1.20 0.28 0.00 0.00 0.47 0.00 0.00 36.82 38.78 3lys h ILE 100 CO 0.71 0.05 -0.01 -1.54 -3.07 0.00 0.00 178.15 174.28 3lys n SER 101 N -4.45 0.11 -0.03 2.19 3.41 -1.26 -3.30 113.62 110.28 3lys n SER 101 Ca 0.22 -0.59 0.04 0.00 -0.26 0.00 0.00 58.87 58.27 3lys n SER 101 Cb 0.87 -0.13 -0.13 0.00 -0.26 0.00 0.00 64.21 64.56 3lys n SER 101 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3lys n GLU 102 N -1.08 0.78 -1.74 4.33 1.02 0.13 -4.98 120.64 119.10 3lys n GLU 102 Ca 0.18 -0.11 -0.42 0.00 -0.02 0.00 0.00 57.16 56.79 3lys n GLU 102 Cb 0.19 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 3lys n GLU 102 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3lys n ILE 103 N -2.22 1.07 -4.36 -3.67 5.41 -1.02 -4.99 119.36 109.57 3lys n ILE 103 Ca -0.09 -0.27 -0.19 0.00 1.00 0.00 0.00 62.75 63.20 3lys n ILE 103 Cb 0.60 -1.91 -0.10 0.00 -0.71 0.00 0.00 39.64 37.52 3lys n ILE 103 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3lys s THR 104 N -0.07 1.52 0.48 1.39 -4.23 -1.26 -4.91 115.64 108.55 3lys s THR 104 Ca 0.64 -2.13 0.25 0.00 -1.18 0.00 0.00 61.69 59.26 3lys s THR 104 Cb -0.51 -2.21 0.43 0.00 1.34 0.00 0.00 72.50 71.54 3lys s THR 104 CO 0.49 -0.46 1.88 0.00 -0.54 0.00 0.00 174.62 175.99 3lys h ALA 105 N 2.47 2.52 0.02 3.99 0.00 -1.95 -0.43 119.26 125.88 3lys h ALA 105 Ca -0.39 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 3lys h ALA 105 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3lys h ALA 105 CO 0.64 -0.78 -0.15 0.77 0.00 0.00 0.00 179.25 179.73 3lys h SER 106 N 0.19 0.11 -0.12 0.00 0.02 -1.95 -2.42 113.55 109.38 3lys h SER 106 Ca 0.43 -0.90 0.03 0.00 -0.84 0.00 0.00 61.79 60.52 3lys h SER 106 Cb 1.41 -0.03 -0.06 0.00 0.14 0.00 0.00 62.40 63.85 3lys h SER 106 CO -0.09 1.00 -0.51 0.28 -1.14 0.00 0.00 176.83 176.37 3lys h SER 107 N -0.77 -1.61 -0.29 3.07 0.02 -1.58 0.27 113.55 112.66 3lys h SER 107 Ca -0.02 0.19 0.06 0.00 -0.84 0.00 0.00 61.79 61.18 3lys h SER 107 Cb 1.04 0.63 -0.06 0.00 0.14 0.00 0.00 62.40 64.15 3lys h SER 107 CO 0.03 -0.48 -0.09 0.22 -1.14 0.00 0.00 176.83 175.38 3lys h TYR 108 N -0.57 -0.19 -0.99 3.45 5.03 -1.26 0.30 116.97 122.73 3lys h TYR 108 Ca 0.04 0.03 0.07 0.00 2.58 0.00 0.00 58.73 61.45 3lys h TYR 108 Cb 0.68 0.13 -0.07 0.00 1.55 0.00 0.00 36.73 39.02 3lys h TYR 108 CO -0.55 -0.14 0.64 0.37 -1.32 0.00 0.00 178.16 177.15 3lys h GLN 109 N -0.02 1.12 -0.28 1.82 5.75 -0.89 0.47 115.11 123.08 3lys h GLN 109 Ca 0.14 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.52 3lys h GLN 109 Cb 0.24 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 3lys h GLN 109 CO -0.31 0.74 -0.05 -0.09 -2.65 0.00 0.00 178.83 176.47 3lys h ARG 110 N 1.15 0.54 -0.80 1.69 2.43 0.93 0.21 114.38 120.53 3lys h ARG 110 Ca 0.43 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3lys h ARG 110 Cb 0.18 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.66 3lys h ARG 110 CO -0.18 0.73 0.48 0.00 -1.51 0.00 0.00 179.97 179.49 3lys h ALA 111 N 0.79 1.01 -0.69 2.80 0.00 0.44 -0.66 119.26 122.95 3lys h ALA 111 Ca 0.07 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3lys h ALA 111 Cb 0.53 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3lys h ALA 111 CO 0.03 0.48 0.23 -0.07 0.00 0.00 0.00 179.25 179.92 3lys h LEU 112 N 1.09 0.98 0.35 0.00 4.07 0.26 -2.25 115.31 119.81 3lys h LEU 112 Ca 0.29 -0.17 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 3lys h LEU 112 Cb -0.04 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.45 3lys h LEU 112 CO -0.05 0.90 -0.17 0.78 -1.08 0.00 0.00 178.44 178.82 3lys h ASN 113 N 1.02 -0.40 -0.98 -0.43 2.35 0.28 -1.77 115.58 115.65 3lys h ASN 113 Ca 0.23 -0.13 0.27 0.00 -0.55 0.00 0.00 56.30 56.12 3lys h ASN 113 Cb 0.27 0.10 -0.14 0.00 0.05 0.00 0.00 38.32 38.60 3lys h ASN 113 CO -0.01 -0.08 0.54 0.50 -1.65 0.00 0.00 177.43 176.73 3lys h LYS 114 N -0.74 0.42 -0.59 0.81 1.63 -1.07 0.20 116.57 117.23 3lys h LYS 114 Ca -0.05 -0.03 -0.10 0.00 -0.85 0.00 0.00 60.65 59.63 3lys h LYS 114 Cb 0.50 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.02 3lys h LYS 114 CO 0.08 0.28 -0.02 0.35 -3.45 0.00 0.00 179.45 176.69 3lys h PHE 115 N 0.44 1.16 0.00 1.91 3.04 -1.15 -3.04 116.94 119.29 3lys h PHE 115 Ca 0.66 -0.21 -0.02 0.00 3.98 0.00 0.00 57.97 62.39 3lys h PHE 115 Cb 1.37 -0.30 -0.00 0.00 2.56 0.00 0.00 35.95 39.58 3lys h PHE 115 CO -0.04 1.03 -0.09 0.00 -2.02 0.00 0.00 178.31 177.19 3lys h ALA 116 N 0.98 1.28 -0.05 2.41 0.00 0.30 -2.68 119.26 121.48 3lys h ALA 116 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3lys h ALA 116 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3lys h ALA 116 CO 0.03 0.11 0.00 -0.85 0.00 0.00 0.00 179.25 178.54 3lys n GLU 117 N -3.59 1.29 -0.08 0.00 0.28 -1.06 -3.15 120.64 114.33 3lys n GLU 117 Ca -0.02 -0.26 0.00 0.00 -0.16 0.00 0.00 57.16 56.72 3lys n GLU 117 Cb 0.21 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.62 3lys n GLU 117 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 3lys n THR 118 N -0.02 0.00 -3.91 3.84 -2.24 -1.03 -5.12 114.28 105.79 3lys n THR 118 Ca 0.02 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.71 3lys n THR 118 Cb 0.27 0.17 -0.09 0.00 -2.10 0.00 0.00 70.33 68.58 3lys n THR 118 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3lys s HIS 119 N 0.00 0.16 0.73 4.78 3.76 -1.11 -5.13 115.29 118.49 3lys s HIS 119 Ca 0.00 -0.42 -0.11 0.00 -0.15 0.00 0.00 55.06 54.38 3lys s HIS 119 Cb 0.00 -0.12 0.03 0.00 1.11 0.00 0.00 32.58 33.60 3lys s HIS 119 CO 0.00 -0.35 1.07 0.00 -0.85 0.00 0.00 174.74 174.61 3lys s ALA 120 N -2.32 2.53 0.09 -1.40 0.00 -1.26 -4.17 121.76 115.23 3lys s ALA 120 Ca -0.07 0.04 -0.33 0.00 0.00 0.00 0.00 51.96 51.60 3lys s ALA 120 Cb -0.03 -3.17 -0.14 0.00 0.00 0.00 0.00 23.12 19.78 3lys s ALA 120 CO -0.03 -1.40 1.59 -0.22 0.00 0.00 0.00 175.76 175.70 3lys h LYS 121 N -0.85 -0.79 -0.90 0.00 3.64 -1.81 0.20 116.57 116.05 3lys h LYS 121 Ca -0.44 0.05 0.21 0.00 -1.27 0.00 0.00 60.65 59.20 3lys h LYS 121 Cb 1.22 0.18 -0.12 0.00 -0.41 0.00 0.00 32.23 33.11 3lys h LYS 121 CO 0.57 -0.53 0.43 0.00 -2.27 0.00 0.00 179.45 177.65 3lys h ALA 122 N -0.46 1.46 0.05 5.00 0.00 -1.93 0.13 119.26 123.51 3lys h ALA 122 Ca -0.03 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3lys h ALA 122 Cb 0.74 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3lys h ALA 122 CO -0.08 -0.29 -0.02 1.03 0.00 0.00 0.00 179.25 179.89 3lys h SER 123 N 0.46 -0.06 -0.78 0.00 0.87 -1.73 -2.23 113.55 110.09 3lys h SER 123 Ca 0.56 -0.35 0.03 0.00 -1.23 0.00 0.00 61.79 60.80 3lys h SER 123 Cb 1.02 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.95 3lys h SER 123 CO -0.49 0.32 0.51 0.00 -0.53 0.00 0.00 176.83 176.65 3lys h THR 124 N -0.45 1.13 -0.23 2.23 1.03 0.19 -2.31 112.91 114.49 3lys h THR 124 Ca -0.01 -0.33 0.00 0.00 -0.01 0.00 0.00 66.41 66.07 3lys h THR 124 Cb 0.40 0.08 -0.01 0.00 -1.07 0.00 0.00 68.15 67.55 3lys h THR 124 CO 0.01 0.18 0.14 0.50 -0.01 0.00 0.00 175.52 176.34 3lys h LYS 125 N 0.97 0.29 -0.93 0.00 3.64 -0.64 -2.19 116.57 117.72 3lys h LYS 125 Ca 0.31 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.75 3lys h LYS 125 Cb 0.03 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.72 3lys h LYS 125 CO -0.09 0.19 0.58 0.78 -2.27 0.00 0.00 179.45 178.64 3lys h GLY 126 N 0.30 1.43 0.87 5.01 0.00 -0.87 -0.22 103.07 109.59 3lys h GLY 126 Ca 0.09 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 3lys h GLY 126 CO -0.03 0.25 -0.46 -2.75 0.00 0.00 0.00 176.54 173.55 3lys h PHE 127 N 1.01 -1.22 0.03 5.60 3.57 -1.02 -2.18 116.94 122.74 3lys h PHE 127 Ca 0.42 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.91 3lys h PHE 127 Cb 0.26 0.43 -0.02 0.00 2.79 0.00 0.00 35.95 39.40 3lys h PHE 127 CO -0.02 -0.70 -0.26 1.25 -2.23 0.00 0.00 178.31 176.35 3lys h HIS 128 N -1.17 -0.74 -0.87 0.41 2.76 -1.04 -1.16 115.15 113.33 3lys h HIS 128 Ca -0.11 0.02 0.14 0.00 -2.20 0.00 0.00 60.37 58.22 3lys h HIS 128 Cb 0.93 0.32 -0.14 0.00 1.55 0.00 0.00 27.41 30.07 3lys h HIS 128 CO -0.08 -0.28 -0.38 0.00 -1.30 0.00 0.00 177.93 175.89 3lys h THR 129 N -0.34 0.05 -0.53 6.26 1.03 -1.09 0.23 112.91 118.53 3lys h THR 129 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 66.41 66.43 3lys h THR 129 Cb 0.36 0.05 -0.04 0.00 -1.07 0.00 0.00 68.15 67.45 3lys h THR 129 CO -0.15 0.00 0.31 0.03 -0.01 0.00 0.00 175.52 175.70 3lys h ARG 130 N -0.05 0.60 -0.54 0.00 3.08 -1.10 -1.25 114.38 115.11 3lys h ARG 130 Ca 0.30 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 3lys h ARG 130 Cb 0.58 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.47 3lys h ARG 130 CO -0.89 0.40 0.31 0.28 -1.07 0.00 0.00 179.97 178.99 3lys h VAL 131 N 0.62 1.18 -0.29 2.04 2.07 0.22 -2.77 116.25 119.31 3lys h VAL 131 Ca 0.21 -0.44 0.07 0.00 0.82 0.00 0.00 66.70 67.37 3lys h VAL 131 Cb 0.03 0.48 -0.07 0.00 -1.52 0.00 0.00 31.29 30.21 3lys h VAL 131 CO -0.10 0.19 -0.18 -0.09 0.02 0.00 0.00 177.57 177.40 3lys h ARG 132 N 0.73 -0.15 -0.99 1.57 2.43 0.07 -1.38 114.38 116.66 3lys h ARG 132 Ca 0.19 0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.51 3lys h ARG 132 Cb 0.03 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.52 3lys h ARG 132 CO -0.03 -0.10 0.61 0.00 -1.51 0.00 0.00 179.97 178.94 3lys h ALA 133 N 1.02 1.52 0.00 2.80 0.00 -0.98 -0.08 119.26 123.54 3lys h ALA 133 Ca 0.15 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 3lys h ALA 133 Cb 0.39 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3lys h ALA 133 CO -0.38 0.14 -0.36 0.66 0.00 0.00 0.00 179.25 179.30 3lys h SER 134 N 0.91 0.00 0.58 0.00 4.64 -1.03 -2.57 113.55 116.08 3lys h SER 134 Ca 0.51 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.66 3lys h SER 134 Cb 0.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 3lys h SER 134 CO -0.30 0.36 -0.76 0.40 -0.87 0.00 0.00 176.83 175.66 3lys h ILE 135 N 0.00 1.48 -0.05 0.95 5.03 -0.47 -3.26 117.51 121.19 3lys h ILE 135 Ca -0.00 -2.44 0.02 0.00 -0.12 0.00 0.00 64.86 62.32 3lys h ILE 135 Cb 0.67 2.32 -0.05 0.00 -3.03 0.00 0.00 36.82 36.73 3lys h ILE 135 CO 0.05 0.71 -0.47 1.56 -0.68 0.00 0.00 178.15 179.32 3lys h GLN 136 N 0.09 -0.53 -0.59 2.37 1.08 -0.93 0.93 115.11 117.53 3lys h GLN 136 Ca -0.02 0.04 0.12 0.00 -1.45 0.00 0.00 58.65 57.34 3lys h GLN 136 Cb 1.34 0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 28.86 3lys h GLN 136 CO 0.11 -0.35 0.40 0.00 -0.95 0.00 0.00 178.83 178.04 3lys h LEU 138 N 0.26 0.53 0.15 0.00 5.85 -0.95 -0.70 115.31 120.45 3lys h LEU 138 Ca 0.28 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 3lys h LEU 138 Cb 0.75 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3lys h LEU 138 CO -0.06 0.57 -0.07 0.40 -0.34 0.00 0.00 178.44 178.94 3lys h ILE 139 N 0.55 0.64 -0.99 4.05 1.08 0.20 -2.24 117.51 120.80 3lys h ILE 139 Ca 0.12 -1.16 0.29 0.00 -0.39 0.00 0.00 64.86 63.72 3lys h ILE 139 Cb 0.29 1.12 -0.14 0.00 -3.07 0.00 0.00 36.82 35.02 3lys h ILE 139 CO 0.00 0.18 0.55 -0.08 -0.69 0.00 0.00 178.15 178.12 3lys h GLU 140 N -0.96 0.38 0.00 2.37 4.22 -0.55 1.94 114.58 121.98 3lys h GLU 140 Ca -0.02 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.40 3lys h GLU 140 Cb 0.46 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3lys h GLU 140 CO 0.03 0.25 0.00 0.39 -2.18 0.00 0.00 179.01 177.51 3lys n GLU 141 N -5.01 0.61 -3.41 1.92 1.02 -0.28 -4.92 120.64 110.56 3lys n GLU 141 Ca 0.29 0.02 -0.17 0.00 -0.02 0.00 0.00 57.16 57.28 3lys n GLU 141 Cb 0.88 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.88 3lys n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3lys n GLY 142 N 0.93 -0.57 0.00 0.62 0.00 0.66 -4.91 105.19 101.92 3lys n GLY 142 Ca 0.17 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.42 3lys n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lys n ARG 143 N -3.91 -0.32 -3.62 1.61 1.74 -0.85 -4.96 116.66 106.35 3lys n ARG 143 Ca -0.23 -0.50 -0.26 0.00 -0.77 0.00 0.00 57.85 56.08 3lys n ARG 143 Cb 0.66 -0.88 -0.17 0.00 -1.02 0.00 0.00 32.46 31.05 3lys n ARG 143 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3lys s LEU 144 N -0.11 0.45 0.06 0.55 2.96 -1.21 -1.70 118.68 119.69 3lys s LEU 144 Ca 0.00 -0.68 -0.13 0.00 -0.22 0.00 0.00 54.13 53.10 3lys s LEU 144 Cb 0.00 -0.29 -0.03 0.00 0.50 0.00 0.00 46.19 46.38 3lys s LEU 144 CO 0.00 -0.35 0.93 0.00 -1.32 0.00 0.00 176.35 175.61 3lys n GLN 145 N 5.25 -0.18 -3.80 1.98 1.13 -1.26 -4.61 117.38 115.89 3lys n GLN 145 Ca -0.07 0.92 -0.12 0.00 -1.94 0.00 0.00 57.00 55.78 3lys n GLN 145 Cb 0.48 -1.36 -0.11 0.00 0.11 0.00 0.00 30.24 29.36 3lys n GLN 145 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 3lys s LYS 146 N -4.34 0.33 -0.47 -1.09 -2.85 -1.26 -5.09 119.74 104.97 3lys s LYS 146 Ca -0.05 0.16 -0.27 0.00 -1.00 0.00 0.00 55.97 54.81 3lys s LYS 146 Cb 0.04 0.15 -0.03 0.00 -2.06 0.00 0.00 37.83 35.94 3lys s LYS 146 CO 0.25 -0.06 1.92 0.34 0.10 0.00 0.00 175.35 177.91 3lys s ASP 147 N -0.23 5.40 0.00 0.03 2.15 -1.26 -4.86 116.67 117.89 3lys s ASP 147 Ca -0.03 0.86 0.15 0.00 0.43 0.00 0.00 52.55 53.96 3lys s ASP 147 Cb -0.03 -2.52 0.70 0.00 -0.30 0.00 0.00 42.92 40.77 3lys s ASP 147 CO 0.01 -2.18 1.47 2.22 -0.17 0.00 0.00 175.17 176.53 3lys n PHE 148 N 12.20 0.00 0.45 -5.34 1.16 -1.26 -1.95 117.46 122.73 3lys n PHE 148 Ca 0.24 0.00 0.07 0.00 -1.87 0.00 0.00 57.45 55.89 3lys n PHE 148 Cb 0.50 -0.42 0.21 0.00 -1.61 0.00 0.00 39.48 38.16 3lys n PHE 148 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 3lys n THR 149 N -1.42 0.69 0.00 1.97 -2.24 -1.26 -4.18 114.28 107.83 3lys n THR 149 Ca 0.05 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 3lys n THR 149 Cb 0.16 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 3lys n THR 149 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 3lys n THR 150 N 0.87 0.00 0.31 4.28 5.66 -0.82 -3.97 114.28 120.61 3lys n THR 150 Ca 0.16 0.05 0.13 0.00 -3.05 0.00 0.00 64.05 61.33 3lys n THR 150 Cb 0.42 -0.99 0.58 0.00 -1.55 0.00 0.00 70.33 68.79 3lys n THR 150 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 3lys h ARG 151 N 0.00 0.00 -0.19 1.09 2.43 -1.85 -2.81 114.38 113.05 3lys h ARG 151 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3lys h ARG 151 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3lys h ARG 151 CO 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 178.46 3lys n ALA 152 N -1.82 1.58 0.00 2.80 0.00 -1.25 -4.15 120.51 117.67 3lys n ALA 152 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3lys n ALA 152 Cb 0.16 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3lys n ALA 152 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3lys n VAL 153 N 0.04 0.00 -2.94 0.00 3.14 -1.06 -4.48 118.33 113.02 3lys n VAL 153 Ca 0.00 0.00 -0.44 0.00 -2.96 0.00 0.00 64.34 60.94 3lys n VAL 153 Cb 0.05 -0.23 -0.03 0.00 -1.06 0.00 0.00 33.84 32.56 3lys n VAL 153 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 3lys s VAL 154 N -1.08 4.66 -0.67 1.55 1.01 -1.26 -4.97 120.40 119.64 3lys s VAL 154 Ca 0.00 -1.26 -0.19 0.00 0.00 0.00 0.00 61.98 60.53 3lys s VAL 154 Cb 0.00 -4.72 0.11 0.00 0.00 0.00 0.00 36.38 31.77 3lys s VAL 154 CO 0.00 -1.45 0.81 -1.59 0.00 0.00 0.00 175.10 172.87 3lys s LYS 155 N 2.95 3.19 1.08 2.72 0.00 -1.26 -4.92 119.74 123.50 3lys s LYS 155 Ca 0.28 -1.41 -0.18 0.00 0.00 0.00 0.00 55.97 54.66 3lys s LYS 155 Cb -0.09 -4.37 0.12 0.00 0.00 0.00 0.00 37.83 33.48 3lys s LYS 155 CO -0.03 -1.60 0.04 0.41 0.00 0.00 0.00 175.35 174.16 3lys n GLY 156 N 5.21 -2.57 0.00 0.59 0.00 -1.26 -4.92 105.19 102.24 3lys n GLY 156 Ca -0.02 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.23 3lys n GLY 156 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3lys n LEU 157 N -1.26 0.00 0.00 0.99 -0.00 -1.26 -4.59 117.00 110.87 3lys n LEU 157 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.04 3lys n LEU 157 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 3lys n LEU 157 CO 0.40 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 179.00 3lys n GLU 158 N 0.00 0.00 0.00 1.47 4.07 -1.26 -4.34 120.64 120.58 3lys n GLU 158 Ca 0.00 0.00 0.06 0.00 -0.06 0.00 0.00 57.16 57.16 3lys n GLU 158 Cb 0.00 0.00 0.30 0.00 -0.06 0.00 0.00 31.44 31.68 3lys n GLU 158 CO 0.00 0.00 0.00 -2.39 -0.06 0.00 0.00 177.13 174.68 3lys n HIS 159 N -1.70 0.00 -3.10 4.31 1.44 -1.26 -4.37 115.22 110.54 3lys n HIS 159 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 3lys n HIS 159 Cb 0.00 -0.33 -0.01 0.00 0.12 0.00 0.00 29.99 29.77 3lys n HIS 159 CO 0.00 0.00 0.00 -3.38 -2.81 0.00 0.00 176.34 170.15 3lys s HIS 160 N -2.67 -1.64 -0.34 -1.40 -3.43 -1.26 -5.04 115.29 99.52 3lys s HIS 160 Ca 0.10 -0.02 0.02 0.00 -0.80 0.00 0.00 55.06 54.36 3lys s HIS 160 Cb 0.08 0.29 0.30 0.00 -1.43 0.00 0.00 32.58 31.82 3lys s HIS 160 CO 0.19 -1.20 1.31 -2.39 -2.00 0.00 0.00 174.74 170.66 3lys n HIS 161 N 4.01 -0.67 -0.60 0.38 1.44 -1.26 -4.94 115.22 113.57 3lys n HIS 161 Ca 0.13 -0.82 0.00 0.00 -2.01 0.00 0.00 57.72 55.02 3lys n HIS 161 Cb 0.56 1.18 0.00 0.00 0.12 0.00 0.00 29.99 31.85 3lys n HIS 161 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11