#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cf4 s GLN 2 N 0.00 0.19 0.20 2.12 0.74 -1.26 -5.05 119.66 116.59 1cf4 s GLN 2 Ca 0.00 0.32 0.01 0.00 0.05 0.00 0.00 55.36 55.74 1cf4 s GLN 2 Cb 0.00 0.04 0.01 0.00 1.10 0.00 0.00 33.01 34.16 1cf4 s GLN 2 CO 0.00 -0.04 0.05 2.41 -0.55 0.00 0.00 175.29 177.16 1cf4 n THR 3 N 3.25 0.00 -3.81 -0.34 -1.04 -1.26 -4.98 114.28 106.10 1cf4 n THR 3 Ca -0.17 -0.90 -0.10 0.00 -2.04 0.00 0.00 64.05 60.84 1cf4 n THR 3 Cb 0.57 0.03 -0.05 0.00 -1.82 0.00 0.00 70.33 69.05 1cf4 n THR 3 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 1cf4 s ILE 4 N -1.50 0.06 0.17 12.58 -0.00 -1.26 -4.87 121.20 126.39 1cf4 s ILE 4 Ca 0.04 -0.99 0.03 0.00 -0.00 0.00 0.00 60.65 59.73 1cf4 s ILE 4 Cb -0.00 -1.55 -0.03 0.00 -0.00 0.00 0.00 42.46 40.87 1cf4 s ILE 4 CO 0.02 -0.29 0.29 -0.75 -0.00 0.00 0.00 174.94 174.21 1cf4 s LYS 5 N -3.89 3.38 -0.00 0.37 2.47 -1.26 -4.44 119.74 116.36 1cf4 s LYS 5 Ca 0.10 -0.67 0.07 0.00 -1.56 0.00 0.00 55.97 53.91 1cf4 s LYS 5 Cb 0.02 -2.91 -0.02 0.00 -1.46 0.00 0.00 37.83 33.45 1cf4 s LYS 5 CO -0.05 0.49 -0.23 0.00 0.16 0.00 0.00 175.35 175.72 1cf4 s VAL 7 N -0.71 0.13 0.15 0.00 1.01 -1.26 0.11 120.40 119.83 1cf4 s VAL 7 Ca 0.11 -1.04 0.11 0.00 0.00 0.00 0.00 61.98 61.16 1cf4 s VAL 7 Cb -0.10 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1cf4 s VAL 7 CO 0.01 -0.58 -0.24 -0.69 0.00 0.00 0.00 175.10 173.60 1cf4 s VAL 8 N -3.79 2.39 -0.23 2.92 1.01 -1.26 -3.99 120.40 117.45 1cf4 s VAL 8 Ca 0.04 -1.83 -0.13 0.00 0.00 0.00 0.00 61.98 60.06 1cf4 s VAL 8 Cb 0.04 -2.10 0.07 0.00 0.00 0.00 0.00 36.38 34.39 1cf4 s VAL 8 CO -0.11 0.01 0.56 -0.69 0.00 0.00 0.00 175.10 174.87 1cf4 s VAL 9 N -1.32 -0.01 0.00 2.92 1.01 -0.68 -4.91 120.40 117.41 1cf4 s VAL 9 Ca 0.17 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.20 1cf4 s VAL 9 Cb -0.09 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1cf4 s VAL 9 CO 0.08 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1cf4 n GLY 10 N 4.29 0.02 0.61 4.51 0.00 -1.26 -3.79 105.19 109.57 1cf4 n GLY 10 Ca -0.21 -1.85 0.06 0.00 0.00 0.00 0.00 46.02 44.02 1cf4 n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cf4 n ASP 11 N 0.00 1.68 -4.77 1.61 8.00 -1.20 -5.03 116.55 116.83 1cf4 n ASP 11 Ca 0.00 -3.45 -0.31 0.00 0.71 0.00 0.00 54.79 51.73 1cf4 n ASP 11 Cb 0.00 -0.47 -0.07 0.00 -0.02 0.00 0.00 41.12 40.56 1cf4 n ASP 11 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1cf4 s GLY 12 N -2.94 2.87 -0.12 0.44 0.00 -0.87 -4.65 107.32 102.05 1cf4 s GLY 12 Ca 0.35 -0.70 0.16 0.00 0.00 0.00 0.00 44.72 44.53 1cf4 s GLY 12 CO -0.06 -2.14 0.16 0.00 0.00 0.00 0.00 173.10 171.06 1cf4 n ALA 13 N -1.32 1.93 -1.51 3.20 0.00 -1.26 -4.87 120.51 116.67 1cf4 n ALA 13 Ca -0.15 -0.89 -0.30 0.00 0.00 0.00 0.00 53.44 52.10 1cf4 n ALA 13 Cb 0.66 -0.27 -0.17 0.00 0.00 0.00 0.00 19.45 19.68 1cf4 n ALA 13 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1cf4 n VAL 14 N -2.46 -0.01 0.00 0.00 0.31 -1.26 0.12 118.33 115.02 1cf4 n VAL 14 Ca -0.20 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 1cf4 n VAL 14 Cb 0.86 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 33.23 1cf4 n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1cf4 n GLY 15 N 6.03 1.32 0.00 2.92 0.00 -1.26 -4.73 105.19 109.48 1cf4 n GLY 15 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.65 1cf4 n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cf4 n LYS 16 N 0.00 2.16 -0.10 1.61 5.02 0.31 -4.64 118.16 122.52 1cf4 n LYS 16 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1cf4 n LYS 16 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 34.98 1cf4 n LYS 16 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1cf4 h THR 17 N 0.00 1.26 -0.66 -0.18 1.35 -1.93 -3.30 112.91 109.45 1cf4 h THR 17 Ca 0.00 -0.98 0.07 0.00 -0.55 0.00 0.00 66.41 64.95 1cf4 h THR 17 Cb 0.00 1.29 -0.09 0.00 -1.73 0.00 0.00 68.15 67.63 1cf4 h THR 17 CO 0.00 0.32 -0.36 0.00 -0.25 0.00 0.00 175.52 175.23 1cf4 h LEU 19 N 0.00 -0.43 -0.92 0.00 3.38 -1.80 1.30 115.31 116.85 1cf4 h LEU 19 Ca 0.14 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 1cf4 h LEU 19 Cb 0.30 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1cf4 h LEU 19 CO -0.63 -0.06 -0.36 -0.07 0.09 0.00 0.00 178.44 177.41 1cf4 h LEU 20 N -0.03 0.00 0.08 1.67 -0.00 -1.47 -2.02 115.31 113.55 1cf4 h LEU 20 Ca 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.90 1cf4 h LEU 20 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.76 1cf4 h LEU 20 CO -0.17 0.36 -0.04 0.40 -0.00 0.00 0.00 178.44 178.99 1cf4 h ILE 21 N 0.00 0.00 -0.13 1.22 1.08 0.30 0.21 117.51 120.19 1cf4 h ILE 21 Ca -0.00 -0.10 0.04 0.00 -0.39 0.00 0.00 64.86 64.41 1cf4 h ILE 21 Cb 0.90 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.64 1cf4 h ILE 21 CO 0.05 0.00 0.14 -1.28 -0.69 0.00 0.00 178.15 176.37 1cf4 h SER 22 N -0.21 0.00 0.00 1.72 0.87 0.15 1.33 113.55 117.41 1cf4 h SER 22 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1cf4 h SER 22 Cb 0.09 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1cf4 h SER 22 CO 0.02 0.00 -0.00 0.22 -0.53 0.00 0.00 176.83 176.54 1cf4 h TYR 23 N 0.00 0.00 -0.05 2.24 3.20 -1.41 -3.41 116.97 117.54 1cf4 h TYR 23 Ca 0.06 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1cf4 h TYR 23 Cb 0.34 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 1cf4 h TYR 23 CO 0.00 0.00 -0.06 1.15 -1.64 0.00 0.00 178.16 177.61 1cf4 h THR 24 N -0.15 1.39 -0.53 1.81 2.02 -0.54 -3.45 112.91 113.47 1cf4 h THR 24 Ca 0.00 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 65.92 1cf4 h THR 24 Cb 0.00 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 1cf4 h THR 24 CO 0.00 0.34 0.00 0.41 0.37 0.00 0.00 175.52 176.64 1cf4 n THR 25 N -4.73 0.00 -2.76 3.16 -1.04 0.45 -5.03 114.28 104.33 1cf4 n THR 25 Ca -0.08 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.92 1cf4 n THR 25 Cb 0.30 -1.06 0.09 0.00 -1.82 0.00 0.00 70.33 67.85 1cf4 n THR 25 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1cf4 n ASN 26 N 0.00 0.09 -3.88 8.00 2.04 -1.23 -4.68 115.26 115.60 1cf4 n ASN 26 Ca 0.00 -2.12 -0.22 0.00 -0.44 0.00 0.00 54.58 51.80 1cf4 n ASN 26 Cb 0.00 0.09 -0.17 0.00 -2.53 0.00 0.00 39.78 37.17 1cf4 n ASN 26 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1cf4 s LYS 27 N -1.89 0.95 0.14 -3.83 1.02 -1.26 -4.97 119.74 109.90 1cf4 s LYS 27 Ca 0.18 -0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.06 1cf4 s LYS 27 Cb 0.38 -1.00 0.00 0.00 -0.52 0.00 0.00 37.83 36.70 1cf4 s LYS 27 CO -0.08 -0.13 0.00 0.34 -0.92 0.00 0.00 175.35 174.56 1cf4 n PHE 28 N 4.32 -2.87 -1.17 3.18 7.35 -1.26 -4.00 117.46 123.00 1cf4 n PHE 28 Ca -0.20 0.48 -0.29 0.00 -0.76 0.00 0.00 57.45 56.69 1cf4 n PHE 28 Cb 0.51 1.50 -0.08 0.00 0.35 0.00 0.00 39.48 41.75 1cf4 n PHE 28 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1cf4 n PRO 29 N -2.75 3.03 0.00 -7.13 -0.02 -1.26 -4.22 135.00 122.65 1cf4 n PRO 29 Ca 0.00 -1.74 0.00 0.00 -2.02 0.00 0.00 63.50 59.74 1cf4 n PRO 29 Cb 0.00 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 30.98 1cf4 n PRO 29 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1cf4 n SER 30 N 3.22 0.00 -3.60 2.55 7.64 -1.26 -5.17 113.62 117.00 1cf4 n SER 30 Ca 0.65 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 60.42 1cf4 n SER 30 Cb 0.46 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.64 1cf4 n SER 30 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1cf4 s GLU 31 N 0.00 1.33 -0.37 1.43 -1.05 -1.26 -5.13 118.70 113.64 1cf4 s GLU 31 Ca 0.00 -0.68 0.01 0.00 -0.15 0.00 0.00 54.97 54.15 1cf4 s GLU 31 Cb 0.00 0.55 0.12 0.00 -0.44 0.00 0.00 34.13 34.36 1cf4 s GLU 31 CO 0.00 -0.57 0.17 0.71 0.95 0.00 0.00 175.26 176.52 1cf4 s TYR 32 N -3.81 1.76 0.14 4.83 1.51 -1.26 -4.89 117.35 115.63 1cf4 s TYR 32 Ca 0.05 -2.05 0.00 0.00 -1.01 0.00 0.00 57.07 54.06 1cf4 s TYR 32 Cb -0.01 -1.73 0.00 0.00 -0.11 0.00 0.00 41.96 40.11 1cf4 s TYR 32 CO -0.08 -0.83 0.00 0.28 -1.11 0.00 0.00 175.55 173.81 1cf4 n VAL 33 N 4.19 0.27 -0.78 0.71 0.31 -1.26 -4.90 118.33 116.87 1cf4 n VAL 33 Ca 0.04 0.09 -0.22 0.00 -0.01 0.00 0.00 64.34 64.24 1cf4 n VAL 33 Cb 0.38 -0.87 -0.03 0.00 -0.91 0.00 0.00 33.84 32.42 1cf4 n VAL 33 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1cf4 n PRO 34 N -3.19 2.16 -0.18 5.55 -0.02 -1.26 -4.16 135.00 133.90 1cf4 n PRO 34 Ca 0.00 -1.45 0.09 0.00 -2.02 0.00 0.00 63.50 60.12 1cf4 n PRO 34 Cb 0.07 -2.42 0.15 0.00 -0.02 0.00 0.00 33.50 31.27 1cf4 n PRO 34 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1cf4 n THR 35 N 4.00 1.90 1.42 3.45 5.66 -1.26 -4.65 114.28 124.80 1cf4 n THR 35 Ca 0.46 -2.39 0.14 0.00 -3.05 0.00 0.00 64.05 59.21 1cf4 n THR 35 Cb 0.18 -0.22 0.64 0.00 -1.55 0.00 0.00 70.33 69.38 1cf4 n THR 35 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1cf4 n VAL 36 N -1.34 0.00 -0.25 1.08 0.31 -1.26 -4.03 118.33 112.84 1cf4 n VAL 36 Ca 0.16 -0.05 0.33 0.00 -0.01 0.00 0.00 64.34 64.77 1cf4 n VAL 36 Cb 0.65 -0.16 0.68 0.00 -0.91 0.00 0.00 33.84 34.10 1cf4 n VAL 36 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1cf4 h PHE 37 N 0.47 0.00 -2.22 3.52 0.04 -1.95 -3.44 116.94 113.36 1cf4 h PHE 37 Ca 0.00 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.55 1cf4 h PHE 37 Cb 0.34 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.50 1cf4 h PHE 37 CO 0.00 0.00 -0.31 -3.47 -0.60 0.00 0.00 178.31 173.93 1cf4 n ASP 38 N -3.78 -3.88 -2.95 2.17 -0.08 -1.26 -4.14 116.55 102.63 1cf4 n ASP 38 Ca 0.23 -0.10 -0.04 0.00 -1.51 0.00 0.00 54.79 53.37 1cf4 n ASP 38 Cb 1.28 -2.91 0.00 0.00 2.34 0.00 0.00 41.12 41.84 1cf4 n ASP 38 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1cf4 n ASN 39 N -0.39 -7.36 -3.13 1.67 5.03 -1.26 -3.44 115.26 106.38 1cf4 n ASN 39 Ca -0.09 0.87 -0.18 0.00 0.87 0.00 0.00 54.58 56.05 1cf4 n ASN 39 Cb 0.58 -3.86 0.17 0.00 -1.02 0.00 0.00 39.78 35.65 1cf4 n ASN 39 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1cf4 n TYR 40 N 0.69 -3.05 -2.98 3.10 0.18 -1.26 -4.19 117.16 109.65 1cf4 n TYR 40 Ca 0.01 -0.48 -0.25 0.00 1.88 0.00 0.00 57.90 59.06 1cf4 n TYR 40 Cb 0.27 -0.73 -0.00 0.00 -0.38 0.00 0.00 39.34 38.50 1cf4 n TYR 40 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1cf4 s ALA 41 N -2.06 3.55 -0.08 -3.48 0.00 -1.26 -4.06 121.76 114.37 1cf4 s ALA 41 Ca 0.39 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.64 1cf4 s ALA 41 Cb -0.07 -2.35 0.01 0.00 0.00 0.00 0.00 23.12 20.72 1cf4 s ALA 41 CO 0.33 -0.23 -0.14 0.14 0.00 0.00 0.00 175.76 175.87 1cf4 s VAL 42 N -2.55 1.29 -0.58 0.00 -7.23 -1.26 -5.01 120.40 105.06 1cf4 s VAL 42 Ca 0.44 -0.55 -0.24 0.00 -1.81 0.00 0.00 61.98 59.82 1cf4 s VAL 42 Cb -0.10 -1.18 0.04 0.00 0.56 0.00 0.00 36.38 35.71 1cf4 s VAL 42 CO 0.41 0.39 0.99 0.42 -0.31 0.00 0.00 175.10 177.00 1cf4 s THR 43 N 0.79 4.31 0.30 5.32 -4.23 -1.26 -4.69 115.64 116.17 1cf4 s THR 43 Ca -0.12 0.27 -0.10 0.00 -1.18 0.00 0.00 61.69 60.56 1cf4 s THR 43 Cb -0.16 -4.60 0.04 0.00 1.34 0.00 0.00 72.50 69.13 1cf4 s THR 43 CO 0.02 -1.22 0.57 1.33 -0.54 0.00 0.00 174.62 174.78 1cf4 n VAL 44 N 6.22 0.00 -3.92 2.29 0.24 -1.26 -5.12 118.33 116.77 1cf4 n VAL 44 Ca 0.02 -0.90 -0.28 0.00 -2.04 0.00 0.00 64.34 61.14 1cf4 n VAL 44 Cb 0.47 0.79 -0.16 0.00 -1.47 0.00 0.00 33.84 33.47 1cf4 n VAL 44 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cf4 s MET 45 N -2.18 1.64 -1.07 7.34 0.23 -1.26 -3.14 119.30 120.86 1cf4 s MET 45 Ca 0.14 -0.50 -0.21 0.00 -1.03 0.00 0.00 55.69 54.10 1cf4 s MET 45 Cb -0.03 -1.96 0.07 0.00 -1.53 0.00 0.00 34.83 31.38 1cf4 s MET 45 CO 0.11 -0.37 1.45 0.42 -2.03 0.00 0.00 175.02 174.60 1cf4 s ILE 46 N 1.60 4.14 0.00 3.16 1.01 -1.25 -4.81 121.20 125.06 1cf4 s ILE 46 Ca 0.02 -1.20 0.00 0.00 0.00 0.00 0.00 60.65 59.47 1cf4 s ILE 46 Cb -0.14 -5.03 0.00 0.00 0.01 0.00 0.00 42.46 37.29 1cf4 s ILE 46 CO -0.08 -1.87 0.00 0.61 0.00 0.00 0.00 174.94 173.59 1cf4 n GLY 47 N 6.26 0.14 0.00 6.18 0.00 -1.26 -4.22 105.19 112.28 1cf4 n GLY 47 Ca 0.35 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.92 1cf4 n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cf4 n GLY 48 N 0.00 -1.46 3.54 -0.02 0.00 -1.26 -4.95 105.19 101.05 1cf4 n GLY 48 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1cf4 n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cf4 s GLU 49 N 0.00 1.82 -0.62 1.61 2.02 -1.26 -5.04 118.70 117.23 1cf4 s GLU 49 Ca 0.00 -1.90 -0.28 0.00 0.02 0.00 0.00 54.97 52.81 1cf4 s GLU 49 Cb 0.00 -1.73 -0.11 0.00 0.10 0.00 0.00 34.13 32.38 1cf4 s GLU 49 CO 0.00 0.17 2.48 -2.30 0.02 0.00 0.00 175.26 175.63 1cf4 n PRO 50 N -0.78 0.77 -3.15 0.39 -0.02 -1.26 -3.75 135.00 127.21 1cf4 n PRO 50 Ca -0.05 0.03 0.05 0.00 -2.02 0.00 0.00 63.50 61.51 1cf4 n PRO 50 Cb 0.63 -2.84 -0.01 0.00 -0.02 0.00 0.00 33.50 31.26 1cf4 n PRO 50 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1cf4 s TYR 51 N 10.94 -0.61 0.15 6.00 6.14 -1.19 -4.97 117.35 133.81 1cf4 s TYR 51 Ca 1.10 0.54 0.09 0.00 0.64 0.00 0.00 57.07 59.43 1cf4 s TYR 51 Cb -0.53 0.17 -0.04 0.00 0.42 0.00 0.00 41.96 41.99 1cf4 s TYR 51 CO 0.34 -0.34 -0.20 0.99 0.64 0.00 0.00 175.55 176.99 1cf4 s THR 52 N 2.95 1.86 -0.41 4.34 2.01 -1.26 -3.99 115.64 121.13 1cf4 s THR 52 Ca 0.08 -1.84 -0.03 0.00 0.31 0.00 0.00 61.69 60.22 1cf4 s THR 52 Cb -0.08 -1.81 0.11 0.00 0.01 0.00 0.00 72.50 70.73 1cf4 s THR 52 CO -0.15 -0.23 0.20 -0.76 -0.69 0.00 0.00 174.62 172.99 1cf4 s LEU 53 N -2.48 5.24 1.01 4.42 1.43 -1.26 -4.91 118.68 122.13 1cf4 s LEU 53 Ca 0.14 -2.04 -0.18 0.00 -1.03 0.00 0.00 54.13 51.02 1cf4 s LEU 53 Cb -0.07 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 1cf4 s LEU 53 CO 0.06 -0.54 -0.44 0.61 0.23 0.00 0.00 176.35 176.28 1cf4 n GLY 54 N 4.58 -3.10 3.83 -3.19 0.00 -1.26 -4.66 105.19 101.38 1cf4 n GLY 54 Ca -0.02 -0.64 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 1cf4 n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cf4 s LEU 55 N 3.39 3.73 -0.25 0.99 1.02 -1.26 -4.25 118.68 122.06 1cf4 s LEU 55 Ca 0.47 1.63 -0.09 0.00 0.02 0.00 0.00 54.13 56.16 1cf4 s LEU 55 Cb -0.12 -4.52 -0.04 0.00 0.02 0.00 0.00 46.19 41.53 1cf4 s LEU 55 CO 0.71 -0.54 0.11 0.12 0.02 0.00 0.00 176.35 176.78 1cf4 s PHE 56 N -2.46 3.17 0.29 0.29 5.36 0.30 -4.34 117.98 120.60 1cf4 s PHE 56 Ca 0.60 -0.12 0.05 0.00 -0.96 0.00 0.00 56.93 56.50 1cf4 s PHE 56 Cb -0.10 -2.26 -0.06 0.00 -0.34 0.00 0.00 43.02 40.26 1cf4 s PHE 56 CO 0.25 -0.18 -0.00 -0.51 -1.46 0.00 0.00 175.22 173.32 1cf4 s ASP 57 N 1.41 2.44 -0.14 6.13 1.11 -1.22 -4.15 116.67 122.24 1cf4 s ASP 57 Ca 0.06 -1.27 -0.07 0.00 0.18 0.00 0.00 52.55 51.45 1cf4 s ASP 57 Cb -0.15 -0.10 0.06 0.00 1.07 0.00 0.00 42.92 43.79 1cf4 s ASP 57 CO 0.06 -0.48 0.34 0.42 1.18 0.00 0.00 175.17 176.68 1cf4 s THR 58 N -3.20 -0.10 -0.28 -1.27 -4.23 -1.26 -4.66 115.64 100.64 1cf4 s THR 58 Ca 0.32 0.13 -0.02 0.00 -1.18 0.00 0.00 61.69 60.94 1cf4 s THR 58 Cb 0.06 -0.52 0.12 0.00 1.34 0.00 0.00 72.50 73.51 1cf4 s THR 58 CO 0.13 0.05 0.24 0.00 -0.54 0.00 0.00 174.62 174.50 1cf4 s ALA 59 N 1.49 -0.12 -1.11 3.99 0.00 -1.26 -4.99 121.76 119.76 1cf4 s ALA 59 Ca -0.08 -0.51 -0.23 0.00 0.00 0.00 0.00 51.96 51.14 1cf4 s ALA 59 Cb -0.10 -1.64 -0.06 0.00 0.00 0.00 0.00 23.12 21.32 1cf4 s ALA 59 CO -0.11 -1.66 1.91 0.20 0.00 0.00 0.00 175.76 176.11 1cf4 s GLY 60 N 2.28 0.29 0.00 0.00 0.00 -1.26 -4.36 107.32 104.26 1cf4 s GLY 60 Ca 0.09 -2.03 0.00 0.00 0.00 0.00 0.00 44.72 42.78 1cf4 s GLY 60 CO -0.33 3.47 0.00 1.04 0.00 0.00 0.00 173.10 177.28 1cf4 n LEU 61 N 13.78 0.00 -0.09 0.66 4.32 -1.11 -4.96 117.00 129.60 1cf4 n LEU 61 Ca 0.44 0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 56.33 1cf4 n LEU 61 Cb 0.47 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 42.11 1cf4 n LEU 61 CO 0.66 0.00 -1.10 -0.62 -1.22 0.00 0.00 177.39 175.11 1cf4 n GLU 62 N 0.00 0.68 0.11 3.23 -0.58 -1.26 -4.64 120.64 118.18 1cf4 n GLU 62 Ca 0.00 0.02 -0.05 0.00 -0.42 0.00 0.00 57.16 56.71 1cf4 n GLU 62 Cb 0.00 -1.55 -0.02 0.00 -0.57 0.00 0.00 31.44 29.30 1cf4 n GLU 62 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 1cf4 h ASP 63 N 0.00 -0.28 -3.56 1.62 1.82 -1.96 -3.44 116.42 110.63 1cf4 h ASP 63 Ca -0.52 0.01 -0.65 0.00 -0.39 0.00 0.00 57.03 55.48 1cf4 h ASP 63 Cb 2.23 0.07 -0.24 0.00 0.68 0.00 0.00 39.33 42.07 1cf4 h ASP 63 CO 0.03 0.02 -0.65 -0.31 -1.61 0.00 0.00 179.24 176.72 1cf4 s TYR 64 N -2.66 3.05 -0.17 0.28 1.51 -1.26 -5.00 117.35 113.11 1cf4 s TYR 64 Ca -0.05 -0.53 -0.18 0.00 -1.01 0.00 0.00 57.07 55.30 1cf4 s TYR 64 Cb 0.00 -2.19 -0.15 0.00 -0.11 0.00 0.00 41.96 39.52 1cf4 s TYR 64 CO 0.14 -0.38 0.20 0.22 -1.11 0.00 0.00 175.55 174.62 1cf4 h ASP 65 N 8.11 0.00 -0.60 2.29 3.58 -1.85 -2.95 116.42 125.00 1cf4 h ASP 65 Ca -0.39 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 56.64 1cf4 h ASP 65 Cb 1.17 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.22 1cf4 h ASP 65 CO 0.59 1.13 0.00 -2.11 -2.88 0.00 0.00 179.24 175.97 1cf4 n ARG 66 N -4.54 2.53 -1.40 0.28 -4.01 -1.26 -4.89 116.66 103.36 1cf4 n ARG 66 Ca -0.19 -2.37 -0.54 0.00 -1.04 0.00 0.00 57.85 53.71 1cf4 n ARG 66 Cb 0.48 -1.52 -0.09 0.00 -3.04 0.00 0.00 32.46 28.29 1cf4 n ARG 66 CO 0.00 0.00 0.00 -0.11 -3.04 0.00 0.00 177.63 174.48 1cf4 n LEU 67 N 1.45 1.73 -2.98 2.89 0.00 -1.26 -4.85 117.00 113.98 1cf4 n LEU 67 Ca 0.22 0.54 -0.16 0.00 0.00 0.00 0.00 56.01 56.61 1cf4 n LEU 67 Cb 0.57 -1.14 -0.01 0.00 0.00 0.00 0.00 43.42 42.83 1cf4 n LEU 67 CO 0.15 -0.72 -0.06 0.54 0.00 0.00 0.00 177.39 177.31 1cf4 n ARG 68 N 7.80 0.71 0.11 1.96 1.74 -1.26 -4.75 116.66 122.96 1cf4 n ARG 68 Ca 0.44 -2.49 -0.20 0.00 -0.77 0.00 0.00 57.85 54.84 1cf4 n ARG 68 Cb 0.14 -1.36 -0.15 0.00 -1.02 0.00 0.00 32.46 30.07 1cf4 n ARG 68 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1cf4 h PRO 69 N 4.12 0.37 0.00 5.56 0.13 -1.98 -3.27 132.00 136.93 1cf4 h PRO 69 Ca -0.02 -0.63 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 1cf4 h PRO 69 Cb 0.96 0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1cf4 h PRO 69 CO 0.38 1.29 0.05 1.37 -0.23 0.00 0.00 178.00 180.86 1cf4 h LEU 70 N 0.10 0.00 -0.83 1.56 8.10 -1.93 -2.97 115.31 119.34 1cf4 h LEU 70 Ca -0.21 0.00 0.16 0.00 0.11 0.00 0.00 57.88 57.95 1cf4 h LEU 70 Cb 2.06 0.00 -0.16 0.00 -0.44 0.00 0.00 40.66 42.12 1cf4 h LEU 70 CO 0.22 0.00 -0.22 -1.28 -4.11 0.00 0.00 178.44 173.05 1cf4 h SER 71 N 0.00 -0.83 -0.07 0.17 0.87 -1.99 -3.36 113.55 108.34 1cf4 h SER 71 Ca 0.00 0.25 -0.17 0.00 -1.23 0.00 0.00 61.79 60.64 1cf4 h SER 71 Cb 0.11 0.53 -0.14 0.00 -0.44 0.00 0.00 62.40 62.46 1cf4 h SER 71 CO 0.00 -0.28 -0.35 0.00 -0.53 0.00 0.00 176.83 175.67 1cf4 n TYR 72 N -5.53 -2.52 -1.94 2.24 0.18 -1.13 -4.97 117.16 103.50 1cf4 n TYR 72 Ca 0.12 -1.40 -0.34 0.00 1.88 0.00 0.00 57.90 58.16 1cf4 n TYR 72 Cb 0.42 1.42 0.03 0.00 -0.38 0.00 0.00 39.34 40.82 1cf4 n TYR 72 CO 0.00 0.00 0.00 -2.14 -2.08 0.00 0.00 176.86 172.64 1cf4 s PRO 73 N 0.55 3.01 -0.01 -3.48 0.02 -1.21 -4.97 135.00 128.93 1cf4 s PRO 73 Ca 0.30 1.45 0.20 0.00 0.02 0.00 0.00 61.00 62.97 1cf4 s PRO 73 Cb 0.21 -1.97 0.59 0.00 0.02 0.00 0.00 34.50 33.34 1cf4 s PRO 73 CO -0.19 -1.09 1.49 0.94 -0.33 0.00 0.00 177.00 177.82 1cf4 n GLN 74 N -2.03 2.81 -0.32 5.54 -0.06 -1.26 -4.86 117.38 117.21 1cf4 n GLN 74 Ca 0.11 -2.56 -0.27 0.00 -2.00 0.00 0.00 57.00 52.27 1cf4 n GLN 74 Cb 0.52 -1.53 0.26 0.00 -4.06 0.00 0.00 30.24 25.43 1cf4 n GLN 74 CO 0.00 0.00 0.00 -2.37 -0.20 0.00 0.00 177.06 174.49 1cf4 n THR 75 N 1.40 0.00 0.02 1.69 5.66 -1.26 -4.99 114.28 116.80 1cf4 n THR 75 Ca 0.22 -0.06 0.02 0.00 -3.05 0.00 0.00 64.05 61.18 1cf4 n THR 75 Cb 0.60 -0.87 -0.03 0.00 -1.55 0.00 0.00 70.33 68.47 1cf4 n THR 75 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1cf4 n ASP 76 N -4.68 3.49 -3.98 1.09 8.00 -1.26 -4.88 116.55 114.33 1cf4 n ASP 76 Ca 0.11 -0.08 -0.31 0.00 0.71 0.00 0.00 54.79 55.22 1cf4 n ASP 76 Cb 0.54 1.18 -0.13 0.00 -0.02 0.00 0.00 41.12 42.68 1cf4 n ASP 76 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1cf4 s VAL 77 N -2.20 2.72 -0.20 2.53 -7.23 -1.26 -3.43 120.40 111.32 1cf4 s VAL 77 Ca -0.01 -3.18 -0.28 0.00 -1.81 0.00 0.00 61.98 56.70 1cf4 s VAL 77 Cb 0.03 -2.88 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1cf4 s VAL 77 CO 0.19 -0.79 0.98 -0.36 -0.31 0.00 0.00 175.10 174.81 1cf4 s PHE 78 N -0.14 3.38 -0.50 2.82 0.40 -0.38 -4.78 117.98 118.77 1cf4 s PHE 78 Ca 0.16 1.43 -0.26 0.00 -0.60 0.00 0.00 56.93 57.66 1cf4 s PHE 78 Cb -0.25 -3.19 0.03 0.00 0.51 0.00 0.00 43.02 40.12 1cf4 s PHE 78 CO -0.01 -0.38 1.02 -1.17 0.70 0.00 0.00 175.22 175.37 1cf4 s LEU 79 N 2.76 3.86 -0.43 -0.37 1.98 -1.26 -1.99 118.68 123.23 1cf4 s LEU 79 Ca 0.43 0.09 -0.06 0.00 -2.89 0.00 0.00 54.13 51.70 1cf4 s LEU 79 Cb -0.16 -3.19 0.11 0.00 0.66 0.00 0.00 46.19 43.61 1cf4 s LEU 79 CO 0.10 -1.20 0.26 0.68 -1.89 0.00 0.00 176.35 174.29 1cf4 s VAL 80 N 4.14 3.71 0.06 1.68 -7.23 -0.95 -1.68 120.40 120.12 1cf4 s VAL 80 Ca 0.39 -1.88 0.06 0.00 -1.81 0.00 0.00 61.98 58.74 1cf4 s VAL 80 Cb -0.09 -3.47 -0.04 0.00 0.56 0.00 0.00 36.38 33.34 1cf4 s VAL 80 CO 0.26 -0.69 -0.12 0.00 -0.31 0.00 0.00 175.10 174.24 1cf4 s PHE 82 N -1.07 -0.56 0.06 0.00 -0.12 -1.26 -2.04 117.98 112.98 1cf4 s PHE 82 Ca 0.18 1.27 -0.28 0.00 -0.05 0.00 0.00 56.93 58.05 1cf4 s PHE 82 Cb -0.11 0.23 -0.05 0.00 -0.63 0.00 0.00 43.02 42.46 1cf4 s PHE 82 CO 0.09 -0.36 0.88 -1.12 -0.05 0.00 0.00 175.22 174.67 1cf4 s SER 83 N -0.18 7.35 0.00 1.98 0.01 -1.26 -4.88 113.70 116.73 1cf4 s SER 83 Ca -0.04 1.62 -0.01 0.00 1.31 0.00 0.00 55.95 58.83 1cf4 s SER 83 Cb -0.03 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.66 1cf4 s SER 83 CO 0.03 -0.08 1.02 0.58 0.41 0.00 0.00 173.24 175.20 1cf4 h VAL 84 N 4.26 0.00 -0.13 3.43 2.07 -1.90 -3.40 116.25 120.58 1cf4 h VAL 84 Ca -0.43 0.00 -0.77 0.00 0.82 0.00 0.00 66.70 66.33 1cf4 h VAL 84 Cb 1.21 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 1cf4 h VAL 84 CO 0.72 0.00 1.30 1.33 0.02 0.00 0.00 177.57 180.94 1cf4 n VAL 85 N -2.69 0.02 -3.69 2.57 0.24 -1.26 -3.98 118.33 109.54 1cf4 n VAL 85 Ca -0.00 -0.02 -0.11 0.00 -2.04 0.00 0.00 64.34 62.17 1cf4 n VAL 85 Cb 0.02 -0.59 -0.09 0.00 -1.47 0.00 0.00 33.84 31.70 1cf4 n VAL 85 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1cf4 s SER 86 N 5.96 -0.61 0.00 -1.34 1.04 -1.26 -5.04 113.70 112.45 1cf4 s SER 86 Ca 1.19 1.08 0.00 0.00 0.48 0.00 0.00 55.95 58.69 1cf4 s SER 86 Cb -1.45 1.01 0.00 0.00 0.10 0.00 0.00 66.02 65.68 1cf4 s SER 86 CO 0.65 -0.20 0.39 -0.81 0.98 0.00 0.00 173.24 174.25 1cf4 n PRO 87 N 3.69 0.00 -0.90 4.02 -0.04 -1.26 -3.06 135.00 137.45 1cf4 n PRO 87 Ca -0.19 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.28 1cf4 n PRO 87 Cb 0.56 -0.88 -0.00 0.00 -0.04 0.00 0.00 33.50 33.14 1cf4 n PRO 87 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1cf4 n SER 88 N -0.41 0.23 0.04 3.54 2.88 -1.26 -3.06 113.62 115.59 1cf4 n SER 88 Ca 0.00 -1.87 0.08 0.00 -1.33 0.00 0.00 58.87 55.75 1cf4 n SER 88 Cb 0.00 -0.15 -0.08 0.00 -0.75 0.00 0.00 64.21 63.23 1cf4 n SER 88 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1cf4 n SER 89 N 0.17 0.57 -0.21 -3.46 2.88 -1.26 -4.32 113.62 107.99 1cf4 n SER 89 Ca -0.01 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 1cf4 n SER 89 Cb 0.83 0.85 0.09 0.00 -0.75 0.00 0.00 64.21 65.22 1cf4 n SER 89 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1cf4 h PHE 90 N 0.00 -0.18 -0.95 0.66 3.57 -1.88 0.20 116.94 118.36 1cf4 h PHE 90 Ca -0.07 0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.53 1cf4 h PHE 90 Cb 1.20 0.17 -0.06 0.00 2.79 0.00 0.00 35.95 40.06 1cf4 h PHE 90 CO 0.00 -0.22 0.61 1.05 -2.23 0.00 0.00 178.31 177.53 1cf4 h GLU 91 N 0.06 1.12 0.00 1.11 4.11 -1.97 -1.69 114.58 117.31 1cf4 h GLU 91 Ca 0.31 -0.07 -0.00 0.00 0.07 0.00 0.00 59.36 59.68 1cf4 h GLU 91 Cb 0.50 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1cf4 h GLU 91 CO -0.59 0.74 -0.00 -0.91 0.07 0.00 0.00 179.01 178.32 1cf4 h ASN 92 N 1.15 -0.00 -0.29 3.06 2.35 -1.07 -2.80 115.58 117.98 1cf4 h ASN 92 Ca 0.40 -0.37 0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1cf4 h ASN 92 Cb 0.10 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.40 1cf4 h ASN 92 CO -0.15 0.37 -0.21 0.58 -1.65 0.00 0.00 177.43 176.37 1cf4 h VAL 93 N -0.37 0.44 -0.09 2.81 2.07 -0.40 0.55 116.25 121.25 1cf4 h VAL 93 Ca -0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1cf4 h VAL 93 Cb 0.37 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 30.52 1cf4 h VAL 93 CO 0.00 0.00 -0.30 0.50 0.02 0.00 0.00 177.57 177.79 1cf4 h LYS 94 N -0.19 -0.38 0.00 1.57 3.64 -1.34 1.29 116.57 121.16 1cf4 h LYS 94 Ca 0.15 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1cf4 h LYS 94 Cb 0.42 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1cf4 h LYS 94 CO -0.40 -0.25 0.00 0.39 -2.27 0.00 0.00 179.45 176.92 1cf4 n GLU 95 N -5.40 0.93 -0.00 1.90 1.02 -0.92 -2.57 120.64 115.60 1cf4 n GLU 95 Ca -0.04 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.13 1cf4 n GLU 95 Cb 0.31 -1.34 -0.04 0.00 -0.02 0.00 0.00 31.44 30.35 1cf4 n GLU 95 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1cf4 n LYS 96 N -0.84 0.64 -0.11 3.49 4.81 0.19 -4.60 118.16 121.73 1cf4 n LYS 96 Ca 0.15 -0.04 -0.22 0.00 -0.87 0.00 0.00 58.31 57.33 1cf4 n LYS 96 Cb 0.07 -1.09 -0.10 0.00 0.02 0.00 0.00 35.03 33.93 1cf4 n LYS 96 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 1cf4 n TRP 97 N -1.63 0.62 -0.26 5.64 7.02 0.42 -3.78 117.44 125.48 1cf4 n TRP 97 Ca -0.01 0.27 0.06 0.00 -1.02 0.00 0.00 57.50 56.81 1cf4 n TRP 97 Cb 0.13 -1.01 0.20 0.00 -2.42 0.00 0.00 31.31 28.21 1cf4 n TRP 97 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 1cf4 h VAL 98 N -1.00 0.55 0.00 -0.99 2.07 -1.69 0.38 116.25 115.56 1cf4 h VAL 98 Ca -0.42 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1cf4 h VAL 98 Cb 1.32 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1cf4 h VAL 98 CO -0.25 0.06 0.00 -0.65 0.02 0.00 0.00 177.57 176.75 1cf4 h PRO 99 N 0.33 0.00 0.00 1.57 0.11 -1.81 -3.05 132.00 129.15 1cf4 h PRO 99 Ca 0.43 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.39 1cf4 h PRO 99 Cb 0.73 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 1cf4 h PRO 99 CO -0.48 0.00 -1.01 0.39 -0.21 0.00 0.00 178.00 176.68 1cf4 n GLU 100 N -2.53 0.52 0.24 1.05 1.02 0.59 -2.57 120.64 118.95 1cf4 n GLU 100 Ca 0.03 0.55 0.18 0.00 -0.02 0.00 0.00 57.16 57.90 1cf4 n GLU 100 Cb 0.36 -1.72 0.87 0.00 -0.02 0.00 0.00 31.44 30.93 1cf4 n GLU 100 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1cf4 h ILE 101 N -1.00 0.35 0.06 -3.67 3.07 -0.52 -2.06 117.51 113.74 1cf4 h ILE 101 Ca -0.23 0.00 -0.27 0.00 1.55 0.00 0.00 64.86 65.91 1cf4 h ILE 101 Cb 1.02 0.83 -0.02 0.00 -0.27 0.00 0.00 36.82 38.38 1cf4 h ILE 101 CO -0.14 0.00 -1.47 0.71 -1.05 0.00 0.00 178.15 176.20 1cf4 h THR 102 N 0.00 0.88 -0.99 0.16 1.35 -1.69 -3.29 112.91 109.33 1cf4 h THR 102 Ca 0.07 -2.28 0.27 0.00 -0.55 0.00 0.00 66.41 63.91 1cf4 h THR 102 Cb 0.47 2.45 -0.06 0.00 -1.73 0.00 0.00 68.15 69.28 1cf4 h THR 102 CO -0.00 0.58 0.68 0.45 -0.25 0.00 0.00 175.52 176.98 1cf4 h HIS 103 N -0.53 0.28 0.00 4.73 3.86 -1.11 0.59 115.15 122.98 1cf4 h HIS 103 Ca -0.35 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 58.73 1cf4 h HIS 103 Cb 1.61 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 29.98 1cf4 h HIS 103 CO 0.10 0.05 -0.68 0.45 0.86 0.00 0.00 177.93 178.71 1cf4 h HIS 104 N 0.19 0.00 -1.81 2.45 3.86 -1.61 -3.43 115.15 114.81 1cf4 h HIS 104 Ca 0.51 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.54 1cf4 h HIS 104 Cb 1.65 0.00 -0.29 0.00 1.06 0.00 0.00 27.41 29.83 1cf4 h HIS 104 CO -0.00 0.68 -0.51 0.00 0.86 0.00 0.00 177.93 178.96 1cf4 n PRO 106 N 5.36 0.89 -2.23 0.00 -0.02 -1.04 -3.52 135.00 134.45 1cf4 n PRO 106 Ca -0.02 0.22 -0.01 0.00 -2.02 0.00 0.00 63.50 61.68 1cf4 n PRO 106 Cb 0.50 -2.36 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 1cf4 n PRO 106 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1cf4 n LYS 107 N 8.19 -2.40 -3.71 -0.52 4.01 -1.26 -5.07 118.16 117.41 1cf4 n LYS 107 Ca 0.44 2.06 -0.22 0.00 -0.51 0.00 0.00 58.31 60.08 1cf4 n LYS 107 Cb 0.21 -3.66 -0.18 0.00 -0.51 0.00 0.00 35.03 30.89 1cf4 n LYS 107 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1cf4 s THR 108 N -0.83 0.10 0.76 -0.18 -4.23 -1.23 -5.12 115.64 104.92 1cf4 s THR 108 Ca -0.06 0.26 -0.15 0.00 -1.18 0.00 0.00 61.69 60.57 1cf4 s THR 108 Cb 0.00 -0.34 0.06 0.00 1.34 0.00 0.00 72.50 73.56 1cf4 s THR 108 CO 0.49 0.19 1.23 -2.84 -0.54 0.00 0.00 174.62 173.14 1cf4 s PRO 109 N 2.08 1.91 -0.05 3.99 0.02 -1.22 -4.86 135.00 136.87 1cf4 s PRO 109 Ca 0.05 1.83 -0.17 0.00 0.02 0.00 0.00 61.00 62.72 1cf4 s PRO 109 Cb -0.12 -1.80 0.03 0.00 0.02 0.00 0.00 34.50 32.63 1cf4 s PRO 109 CO -0.04 -2.03 0.39 -0.59 -0.33 0.00 0.00 177.00 174.40 1cf4 s PHE 110 N -1.96 -0.31 0.27 6.54 -0.12 -1.20 -1.25 117.98 119.95 1cf4 s PHE 110 Ca 0.75 0.57 0.09 0.00 -0.05 0.00 0.00 56.93 58.29 1cf4 s PHE 110 Cb -0.31 0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.20 1cf4 s PHE 110 CO 0.47 -0.39 0.08 -1.17 -0.05 0.00 0.00 175.22 174.17 1cf4 s LEU 111 N -0.98 3.41 0.26 -1.99 0.20 -0.84 -1.16 118.68 117.58 1cf4 s LEU 111 Ca -0.10 -0.53 0.09 0.00 0.69 0.00 0.00 54.13 54.28 1cf4 s LEU 111 Cb -0.04 -1.93 -0.05 0.00 -0.43 0.00 0.00 46.19 43.74 1cf4 s LEU 111 CO 0.04 -0.05 -0.15 -0.76 -0.29 0.00 0.00 176.35 175.14 1cf4 s LEU 112 N -3.76 2.57 0.01 -0.68 2.01 -0.11 -2.25 118.68 116.48 1cf4 s LEU 112 Ca 0.33 -1.07 0.00 0.00 0.01 0.00 0.00 54.13 53.40 1cf4 s LEU 112 Cb -0.06 -0.85 -0.01 0.00 0.01 0.00 0.00 46.19 45.28 1cf4 s LEU 112 CO 0.22 -0.12 -0.02 -0.69 1.01 0.00 0.00 176.35 176.75 1cf4 s VAL 113 N -2.78 0.08 -0.49 -1.59 1.01 -1.26 -4.17 120.40 111.20 1cf4 s VAL 113 Ca 0.27 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 61.94 1cf4 s VAL 113 Cb -0.01 -0.13 0.13 0.00 0.00 0.00 0.00 36.38 36.36 1cf4 s VAL 113 CO 0.11 -0.17 0.23 -0.83 0.00 0.00 0.00 175.10 174.45 1cf4 s GLY 114 N -0.53 2.35 0.00 4.51 0.00 -1.11 -4.66 107.32 107.87 1cf4 s GLY 114 Ca -0.05 -3.13 0.03 0.00 0.00 0.00 0.00 44.72 41.57 1cf4 s GLY 114 CO -0.00 1.00 1.05 -1.30 0.00 0.00 0.00 173.10 173.85 1cf4 n THR 115 N 3.35 0.95 -0.28 0.90 -2.24 -1.24 -1.19 114.28 114.53 1cf4 n THR 115 Ca 0.05 -0.98 0.04 0.00 -2.27 0.00 0.00 64.05 60.90 1cf4 n THR 115 Cb 0.34 0.53 0.11 0.00 -2.10 0.00 0.00 70.33 69.21 1cf4 n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cf4 n GLN 116 N -0.18 2.79 0.25 -0.78 1.13 -1.26 -4.53 117.38 114.81 1cf4 n GLN 116 Ca 0.03 -1.99 0.15 0.00 -1.94 0.00 0.00 57.00 53.25 1cf4 n GLN 116 Cb 0.29 -1.26 0.81 0.00 0.11 0.00 0.00 30.24 30.19 1cf4 n GLN 116 CO 0.00 0.00 0.00 -0.84 -1.44 0.00 0.00 177.06 174.78 1cf4 h ILE 117 N 1.13 0.00 0.00 5.09 -2.65 -1.86 0.16 117.51 119.39 1cf4 h ILE 117 Ca 0.00 0.00 0.00 0.00 1.03 0.00 0.00 64.86 65.89 1cf4 h ILE 117 Cb 0.76 0.66 0.00 0.00 -2.05 0.00 0.00 36.82 36.19 1cf4 h ILE 117 CO 0.03 0.00 -1.72 -0.67 0.03 0.00 0.00 178.15 175.81 1cf4 n ASP 118 N -2.61 0.29 -0.03 2.16 2.03 -1.26 -4.39 116.55 112.74 1cf4 n ASP 118 Ca -0.02 -0.27 -0.12 0.00 0.52 0.00 0.00 54.79 54.90 1cf4 n ASP 118 Cb 0.13 1.73 -0.14 0.00 -0.72 0.00 0.00 41.12 42.12 1cf4 n ASP 118 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1cf4 n LEU 119 N -2.05 1.24 -0.31 -2.67 4.32 0.36 -4.14 117.00 113.75 1cf4 n LEU 119 Ca -0.02 0.30 -0.00 0.00 -0.02 0.00 0.00 56.01 56.27 1cf4 n LEU 119 Cb 0.50 -0.11 0.06 0.00 -1.62 0.00 0.00 43.42 42.25 1cf4 n LEU 119 CO 0.45 0.53 0.64 0.08 -1.22 0.00 0.00 177.39 177.86 1cf4 h ARG 120 N 0.02 -0.04 -0.58 3.23 0.11 -1.18 0.31 114.38 116.25 1cf4 h ARG 120 Ca -0.36 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.69 1cf4 h ARG 120 Cb 2.04 0.01 -0.03 0.00 1.11 0.00 0.00 29.97 33.11 1cf4 h ARG 120 CO 0.07 -0.03 0.22 -0.44 0.10 0.00 0.00 179.97 179.89 1cf4 h ASP 121 N -0.04 0.82 -0.46 0.08 3.32 -1.82 -3.42 116.42 114.90 1cf4 h ASP 121 Ca 0.35 -0.18 -0.55 0.00 0.02 0.00 0.00 57.03 56.66 1cf4 h ASP 121 Cb 0.60 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.89 1cf4 h ASP 121 CO -0.88 0.78 1.63 -0.67 -1.72 0.00 0.00 179.24 178.38 1cf4 n ASP 122 N -4.46 1.00 0.00 6.45 2.03 0.11 -4.75 116.55 116.93 1cf4 n ASP 122 Ca 0.03 0.15 0.06 0.00 0.52 0.00 0.00 54.79 55.55 1cf4 n ASP 122 Cb 0.18 -1.09 0.31 0.00 -0.72 0.00 0.00 41.12 39.79 1cf4 n ASP 122 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1cf4 n PRO 123 N 8.42 0.13 0.16 -0.67 -0.04 -1.26 -3.13 135.00 138.60 1cf4 n PRO 123 Ca 0.55 0.20 -0.06 0.00 -0.04 0.00 0.00 63.50 64.15 1cf4 n PRO 123 Cb 0.15 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.08 1cf4 n PRO 123 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1cf4 h SER 124 N 0.00 -0.35 -0.06 3.54 0.87 -1.91 0.14 113.55 115.77 1cf4 h SER 124 Ca 0.00 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1cf4 h SER 124 Cb 0.15 0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1cf4 h SER 124 CO 0.00 -0.21 0.04 0.74 -0.53 0.00 0.00 176.83 176.87 1cf4 h THR 125 N -0.50 1.04 -1.08 2.23 2.02 -1.90 -1.57 112.91 113.15 1cf4 h THR 125 Ca -0.04 -0.10 0.30 0.00 0.77 0.00 0.00 66.41 67.34 1cf4 h THR 125 Cb 0.32 1.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.62 1cf4 h THR 125 CO 0.07 0.03 0.69 -0.29 0.37 0.00 0.00 175.52 176.39 1cf4 h ILE 126 N 0.05 0.43 -0.77 3.11 6.09 -1.60 1.57 117.51 126.40 1cf4 h ILE 126 Ca 0.02 -0.12 -0.03 0.00 -1.37 0.00 0.00 64.86 63.36 1cf4 h ILE 126 Cb 0.02 0.05 -0.04 0.00 0.47 0.00 0.00 36.82 37.33 1cf4 h ILE 126 CO -0.00 0.06 0.36 -0.08 -3.07 0.00 0.00 178.15 175.42 1cf4 h GLU 127 N 0.35 1.12 -0.26 2.19 4.81 0.29 1.11 114.58 124.20 1cf4 h GLU 127 Ca 0.65 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.65 1cf4 h GLU 127 Cb 1.69 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.86 1cf4 h GLU 127 CO -0.36 0.88 -0.11 0.87 -0.73 0.00 0.00 179.01 179.56 1cf4 h LYS 128 N 1.10 0.42 -0.42 1.92 6.56 0.24 -1.33 116.57 125.06 1cf4 h LYS 128 Ca 0.26 -0.11 -0.14 0.00 -1.06 0.00 0.00 60.65 59.61 1cf4 h LYS 128 Cb 0.14 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.74 1cf4 h LYS 128 CO -0.03 0.54 -0.27 -0.07 -2.06 0.00 0.00 179.45 177.56 1cf4 h LEU 129 N 0.40 0.96 -1.86 2.94 4.07 0.11 -2.69 115.31 119.24 1cf4 h LEU 129 Ca 0.08 -0.42 0.42 0.00 0.08 0.00 0.00 57.88 58.03 1cf4 h LEU 129 Cb 0.44 -0.27 -0.07 0.00 1.08 0.00 0.00 40.66 41.84 1cf4 h LEU 129 CO 0.02 1.18 1.02 0.00 -1.08 0.00 0.00 178.44 179.58 1cf4 h ALA 130 N 0.81 3.23 -0.62 1.53 0.00 0.24 1.26 119.26 125.71 1cf4 h ALA 130 Ca 0.09 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 55.16 1cf4 h ALA 130 Cb 0.85 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1cf4 h ALA 130 CO 0.07 -1.69 0.57 0.87 0.00 0.00 0.00 179.25 179.07 1cf4 h LYS 131 N 0.05 0.00 0.00 0.00 1.79 -1.34 -3.03 116.57 114.03 1cf4 h LYS 131 Ca 0.72 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.19 1cf4 h LYS 131 Cb 2.72 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 33.37 1cf4 h LYS 131 CO -0.09 0.00 -0.84 0.09 -1.08 0.00 0.00 179.45 177.54 1cf4 n ASN 132 N -3.88 3.79 0.00 0.86 5.03 0.38 -5.10 115.26 116.34 1cf4 n ASN 132 Ca 0.12 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.57 1cf4 n ASN 132 Cb 0.80 0.22 0.00 0.00 -1.02 0.00 0.00 39.78 39.79 1cf4 n ASN 132 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1cf4 n LYS 133 N -2.02 0.00 0.00 3.52 5.02 0.16 -4.78 118.16 120.06 1cf4 n LYS 133 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1cf4 n LYS 133 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.43 1cf4 n LYS 133 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cf4 n GLN 134 N -0.29 0.00 -3.20 1.97 -0.00 -1.17 -3.70 117.38 110.98 1cf4 n GLN 134 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.00 57.01 1cf4 n GLN 134 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 30.24 30.23 1cf4 n GLN 134 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1cf4 s LYS 135 N -0.88 0.75 -0.43 2.61 -0.14 -1.17 -4.94 119.74 115.54 1cf4 s LYS 135 Ca 0.00 -0.10 -0.27 0.00 -1.36 0.00 0.00 55.97 54.25 1cf4 s LYS 135 Cb 0.00 0.09 -0.05 0.00 -1.68 0.00 0.00 37.83 36.19 1cf4 s LYS 135 CO 0.00 -1.16 2.24 -1.25 -0.76 0.00 0.00 175.35 174.42 1cf4 s PRO 136 N 2.07 2.51 -0.58 -1.68 0.04 -1.26 -4.33 135.00 131.77 1cf4 s PRO 136 Ca 0.15 1.45 -0.36 0.00 0.04 0.00 0.00 61.00 62.27 1cf4 s PRO 136 Cb -0.06 -4.48 -0.16 0.00 0.04 0.00 0.00 34.50 29.84 1cf4 s PRO 136 CO -0.12 -2.82 2.32 -0.89 0.04 0.00 0.00 177.00 175.54 1cf4 n ILE 137 N 7.79 0.05 -2.13 0.56 2.08 -1.26 -4.86 119.36 121.60 1cf4 n ILE 137 Ca 0.32 -0.16 -0.40 0.00 0.56 0.00 0.00 62.75 63.07 1cf4 n ILE 137 Cb 0.51 -1.07 -0.02 0.00 -0.75 0.00 0.00 39.64 38.31 1cf4 n ILE 137 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1cf4 s THR 138 N 7.75 2.76 0.56 1.39 -4.23 -1.26 -4.83 115.64 117.77 1cf4 s THR 138 Ca 1.19 0.72 0.49 0.00 -1.18 0.00 0.00 61.69 62.91 1cf4 s THR 138 Cb -1.11 -3.45 0.72 0.00 1.34 0.00 0.00 72.50 70.00 1cf4 s THR 138 CO 0.53 0.14 1.57 -0.65 -0.54 0.00 0.00 174.62 175.67 1cf4 h PRO 139 N 3.10 0.00 -0.60 3.99 0.10 -2.00 1.41 132.00 138.00 1cf4 h PRO 139 Ca -0.49 0.00 -0.07 0.00 0.10 0.00 0.00 66.00 65.54 1cf4 h PRO 139 Cb 1.23 0.00 -0.02 0.00 0.10 0.00 0.00 31.00 32.31 1cf4 h PRO 139 CO 0.64 0.00 0.08 0.93 0.10 0.00 0.00 178.00 179.75 1cf4 h GLU 140 N 0.00 1.00 0.26 1.05 3.07 -1.98 -2.31 114.58 115.66 1cf4 h GLU 140 Ca 0.91 -0.28 -0.01 0.00 -0.50 0.00 0.00 59.36 59.48 1cf4 h GLU 140 Cb 3.70 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 31.50 1cf4 h GLU 140 CO -0.01 0.95 -0.17 1.15 -1.40 0.00 0.00 179.01 179.53 1cf4 h THR 141 N 0.90 0.00 -0.64 1.13 2.02 0.16 0.98 112.91 117.45 1cf4 h THR 141 Ca 0.18 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.49 1cf4 h THR 141 Cb 0.44 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.74 1cf4 h THR 141 CO 0.01 0.00 -0.10 0.00 0.37 0.00 0.00 175.52 175.80 1cf4 h ALA 142 N -1.62 0.50 -0.29 6.16 0.00 -1.61 1.40 119.26 123.81 1cf4 h ALA 142 Ca -0.03 0.23 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1cf4 h ALA 142 Cb 0.33 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1cf4 h ALA 142 CO 0.03 -0.42 -0.04 1.49 0.00 0.00 0.00 179.25 180.31 1cf4 h GLU 143 N 0.04 0.46 -0.05 0.00 4.81 -1.32 0.60 114.58 119.13 1cf4 h GLU 143 Ca 0.32 -0.10 -0.08 0.00 -0.13 0.00 0.00 59.36 59.37 1cf4 h GLU 143 Cb 0.51 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1cf4 h GLU 143 CO -0.62 0.52 -0.27 -0.22 -0.73 0.00 0.00 179.01 177.68 1cf4 h LYS 144 N 0.44 0.27 -0.48 1.92 3.64 0.55 -2.22 116.57 120.68 1cf4 h LYS 144 Ca 0.09 -0.23 -0.13 0.00 -1.27 0.00 0.00 60.65 59.11 1cf4 h LYS 144 Cb 0.35 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1cf4 h LYS 144 CO 0.01 0.88 -0.22 1.25 -2.27 0.00 0.00 179.45 179.11 1cf4 h LEU 145 N -0.27 1.03 -1.26 5.20 5.85 0.18 1.27 115.31 127.31 1cf4 h LEU 145 Ca -0.02 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.28 1cf4 h LEU 145 Cb 0.94 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1cf4 h LEU 145 CO 0.06 1.20 0.21 0.00 -0.34 0.00 0.00 178.44 179.56 1cf4 h ALA 146 N 0.87 1.42 0.00 1.25 0.00 0.16 -2.75 119.26 120.22 1cf4 h ALA 146 Ca 0.11 -0.13 -0.29 0.00 0.00 0.00 0.00 54.91 54.60 1cf4 h ALA 146 Cb 0.80 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1cf4 h ALA 146 CO 0.07 0.45 -1.71 0.54 0.00 0.00 0.00 179.25 178.60 1cf4 n ARG 147 N -4.35 0.63 -0.17 0.00 1.74 -0.84 0.16 116.66 113.83 1cf4 n ARG 147 Ca 0.04 0.29 0.28 0.00 -0.77 0.00 0.00 57.85 57.70 1cf4 n ARG 147 Cb 0.15 -1.79 0.72 0.00 -1.02 0.00 0.00 32.46 30.52 1cf4 n ARG 147 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1cf4 h ASP 148 N 0.00 0.00 0.00 0.55 3.58 0.19 0.16 116.42 120.90 1cf4 h ASP 148 Ca -0.28 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.16 1cf4 h ASP 148 Cb 2.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 43.05 1cf4 h ASP 148 CO 0.08 0.00 -0.13 0.18 -2.88 0.00 0.00 179.24 176.49 1cf4 n LEU 149 N -4.19 2.04 -3.92 2.28 4.77 -1.18 -5.00 117.00 111.82 1cf4 n LEU 149 Ca 0.18 -2.87 -0.27 0.00 -0.03 0.00 0.00 56.01 53.02 1cf4 n LEU 149 Cb 0.96 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 41.67 1cf4 n LEU 149 CO 0.38 0.71 -0.21 0.29 -1.33 0.00 0.00 177.39 177.23 1cf4 n LYS 150 N -1.18 -2.74 0.00 3.23 5.02 0.55 -4.93 118.16 118.10 1cf4 n LYS 150 Ca 0.14 0.39 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 1cf4 n LYS 150 Cb 0.66 -4.35 0.00 0.00 -0.02 0.00 0.00 35.03 31.32 1cf4 n LYS 150 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cf4 n ALA 151 N -4.39 0.00 0.03 7.82 0.00 0.42 -4.83 120.51 119.55 1cf4 n ALA 151 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1cf4 n ALA 151 Cb 0.66 0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.12 1cf4 n ALA 151 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1cf4 n VAL 152 N -0.35 0.00 -3.62 0.00 0.31 -0.31 -3.25 118.33 111.11 1cf4 n VAL 152 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1cf4 n VAL 152 Cb 0.00 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.87 1cf4 n VAL 152 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1cf4 s LYS 153 N -1.16 0.42 -0.27 5.55 -0.14 -1.26 -4.93 119.74 117.94 1cf4 s LYS 153 Ca 0.00 0.31 -0.03 0.00 -1.36 0.00 0.00 55.97 54.90 1cf4 s LYS 153 Cb 0.00 0.20 0.09 0.00 -1.68 0.00 0.00 37.83 36.44 1cf4 s LYS 153 CO 0.00 -0.09 0.10 -0.47 -0.76 0.00 0.00 175.35 174.13 1cf4 s TYR 154 N -0.34 0.96 0.38 3.18 5.04 -1.26 -0.93 117.35 124.39 1cf4 s TYR 154 Ca 0.03 -1.16 0.08 0.00 -2.44 0.00 0.00 57.07 53.58 1cf4 s TYR 154 Cb -0.03 -1.22 -0.02 0.00 0.35 0.00 0.00 41.96 41.04 1cf4 s TYR 154 CO -0.06 -0.78 0.36 0.08 -1.34 0.00 0.00 175.55 173.81 1cf4 s VAL 155 N 1.88 3.07 -0.28 3.14 1.01 -1.26 -4.82 120.40 123.13 1cf4 s VAL 155 Ca 0.07 -1.32 -0.21 0.00 0.00 0.00 0.00 61.98 60.52 1cf4 s VAL 155 Cb -0.17 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 1cf4 s VAL 155 CO -0.25 -0.07 0.65 -0.70 0.00 0.00 0.00 175.10 174.72 1cf4 s GLU 156 N -4.09 4.01 0.21 2.72 2.12 -1.26 -2.76 118.70 119.64 1cf4 s GLU 156 Ca 0.46 0.45 0.01 0.00 0.36 0.00 0.00 54.97 56.25 1cf4 s GLU 156 Cb -0.05 -3.69 -0.00 0.00 0.26 0.00 0.00 34.13 30.65 1cf4 s GLU 156 CO 0.28 -0.51 0.24 0.00 -0.54 0.00 0.00 175.26 174.73 1cf4 s SER 158 N -2.34 -0.57 -0.05 0.00 0.01 -1.26 -3.67 113.70 105.82 1cf4 s SER 158 Ca 0.20 0.10 0.03 0.00 1.31 0.00 0.00 55.95 57.59 1cf4 s SER 158 Cb 0.00 0.58 -0.05 0.00 0.21 0.00 0.00 66.02 66.76 1cf4 s SER 158 CO 0.14 -0.90 -0.01 0.00 0.41 0.00 0.00 173.24 172.88 1cf4 n ALA 159 N -0.15 1.88 0.09 1.44 0.00 -1.26 -3.28 120.51 119.23 1cf4 n ALA 159 Ca -0.17 -0.29 -0.16 0.00 0.00 0.00 0.00 53.44 52.82 1cf4 n ALA 159 Cb 0.64 0.22 -0.14 0.00 0.00 0.00 0.00 19.45 20.17 1cf4 n ALA 159 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1cf4 h LEU 160 N 0.00 0.39 0.00 0.00 -0.00 -1.92 -3.38 115.31 110.40 1cf4 h LEU 160 Ca -0.13 -0.45 -0.06 0.00 -0.00 0.00 0.00 57.88 57.24 1cf4 h LEU 160 Cb 1.26 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.78 1cf4 h LEU 160 CO -0.00 1.36 -1.41 1.07 -0.00 0.00 0.00 178.44 179.45 1cf4 n THR 161 N -3.50 0.23 -1.93 0.15 5.66 -1.26 -5.10 114.28 108.53 1cf4 n THR 161 Ca -0.10 -0.23 -0.01 0.00 -3.05 0.00 0.00 64.05 60.66 1cf4 n THR 161 Cb 1.03 -0.20 -0.01 0.00 -1.55 0.00 0.00 70.33 69.59 1cf4 n THR 161 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1cf4 n GLN 162 N -2.00 -1.48 -1.26 1.09 0.00 -1.20 -5.00 117.38 107.53 1cf4 n GLN 162 Ca -0.06 1.46 -0.02 0.00 -0.00 0.00 0.00 57.00 58.38 1cf4 n GLN 162 Cb 0.45 -2.59 0.12 0.00 0.00 0.00 0.00 30.24 28.21 1cf4 n GLN 162 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1cf4 n LYS 163 N 0.41 1.81 0.00 3.69 5.02 -1.23 -4.78 118.16 123.08 1cf4 n LYS 163 Ca -0.06 -3.30 0.00 0.00 -2.02 0.00 0.00 58.31 52.92 1cf4 n LYS 163 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 1cf4 n LYS 163 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1cf4 n GLY 164 N -0.71 0.96 0.36 0.72 0.00 -1.26 -3.75 105.19 101.50 1cf4 n GLY 164 Ca 0.22 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 1cf4 n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1cf4 h LEU 165 N 0.00 -0.89 -1.73 0.99 6.46 -1.90 -1.99 115.31 116.24 1cf4 h LEU 165 Ca 0.00 0.08 -0.03 0.00 -0.12 0.00 0.00 57.88 57.80 1cf4 h LEU 165 Cb 0.00 0.30 -0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1cf4 h LEU 165 CO 0.00 -0.47 -0.16 0.07 -0.62 0.00 0.00 178.44 177.26 1cf4 h LYS 166 N -0.71 0.00 0.00 1.25 2.10 -1.94 -2.67 116.57 114.60 1cf4 h LYS 166 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1cf4 h LYS 166 Cb 0.63 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 1cf4 h LYS 166 CO -0.05 0.16 0.00 -1.71 -2.00 0.00 0.00 179.45 175.85 1cf4 n ASN 167 N -4.23 0.00 0.11 7.07 2.85 -0.76 0.17 115.26 120.46 1cf4 n ASN 167 Ca -0.02 0.88 -0.12 0.00 -0.11 0.00 0.00 54.58 55.21 1cf4 n ASN 167 Cb 0.23 -0.38 -0.06 0.00 1.24 0.00 0.00 39.78 40.81 1cf4 n ASN 167 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1cf4 h VAL 168 N 0.00 0.55 -0.87 3.44 2.07 -1.55 -1.75 116.25 118.14 1cf4 h VAL 168 Ca 0.00 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.69 1cf4 h VAL 168 Cb 0.00 0.55 -0.07 0.00 -1.52 0.00 0.00 31.29 30.26 1cf4 h VAL 168 CO 0.00 0.00 0.57 0.15 0.02 0.00 0.00 177.57 178.31 1cf4 h PHE 169 N -0.38 0.65 -0.89 1.57 3.57 -1.45 0.14 116.94 120.16 1cf4 h PHE 169 Ca 0.02 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1cf4 h PHE 169 Cb 0.40 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 1cf4 h PHE 169 CO -0.19 0.21 0.50 -0.44 -2.23 0.00 0.00 178.31 176.16 1cf4 h ASP 170 N 0.53 1.10 -0.46 0.41 3.32 0.26 -1.49 116.42 120.09 1cf4 h ASP 170 Ca 0.44 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.40 1cf4 h ASP 170 Cb 0.92 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.17 1cf4 h ASP 170 CO -0.18 0.87 0.28 -0.33 -1.72 0.00 0.00 179.24 178.16 1cf4 h GLU 171 N 1.24 0.64 0.46 3.56 4.39 -0.28 0.41 114.58 124.99 1cf4 h GLU 171 Ca 0.31 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.94 1cf4 h GLU 171 Cb 0.01 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1cf4 h GLU 171 CO -0.05 0.45 -0.22 0.00 -1.16 0.00 0.00 179.01 178.03 1cf4 h ALA 172 N 1.66 -1.07 -0.86 3.43 0.00 -0.90 0.25 119.26 121.77 1cf4 h ALA 172 Ca 0.17 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1cf4 h ALA 172 Cb -0.02 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1cf4 h ALA 172 CO -0.03 -1.02 0.57 -0.84 0.00 0.00 0.00 179.25 177.92 1cf4 h ILE 173 N -0.67 1.21 -0.61 0.00 -0.00 -1.38 -2.50 117.51 113.55 1cf4 h ILE 173 Ca -0.06 -0.39 0.00 0.00 -0.00 0.00 0.00 64.86 64.41 1cf4 h ILE 173 Cb 0.47 -0.04 -0.03 0.00 -0.00 0.00 0.00 36.82 37.22 1cf4 h ILE 173 CO 0.10 0.21 0.39 0.25 -0.00 0.00 0.00 178.15 179.11 1cf4 h LEU 174 N 1.15 0.72 -2.15 0.16 5.85 -0.18 -1.08 115.31 119.77 1cf4 h LEU 174 Ca 0.32 -0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.04 1cf4 h LEU 174 Cb -0.11 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 1cf4 h LEU 174 CO -0.08 0.54 0.30 0.00 -0.34 0.00 0.00 178.44 178.86 1cf4 h ALA 175 N 1.21 1.56 0.14 1.25 0.00 -0.02 0.19 119.26 123.58 1cf4 h ALA 175 Ca 0.22 -0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.79 1cf4 h ALA 175 Cb -0.07 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1cf4 h ALA 175 CO -0.05 -0.36 -1.73 0.00 0.00 0.00 0.00 179.25 177.11 1cf4 h ALA 176 N 1.52 0.30 -0.11 0.00 0.00 -1.17 -3.36 119.26 116.45 1cf4 h ALA 176 Ca 0.06 -1.21 -0.18 0.00 0.00 0.00 0.00 54.91 53.57 1cf4 h ALA 176 Cb 0.65 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1cf4 h ALA 176 CO -0.00 1.17 -0.69 -0.07 0.00 0.00 0.00 179.25 179.66 1cf4 h LEU 177 N 0.08 0.57 -7.65 0.00 3.38 -0.51 -3.45 115.31 107.72 1cf4 h LEU 177 Ca -0.32 -0.36 -0.22 0.00 0.09 0.00 0.00 57.88 57.07 1cf4 h LEU 177 Cb 2.05 -0.17 -0.28 0.00 0.09 0.00 0.00 40.66 42.36 1cf4 h LEU 177 CO 0.15 1.10 -0.64 -0.70 0.09 0.00 0.00 178.44 178.43 1cf4 s GLU 178 N -3.72 0.07 -0.31 1.13 -6.30 0.44 -5.10 118.70 104.92 1cf4 s GLU 178 Ca -0.07 0.10 -0.29 0.00 -2.50 0.00 0.00 54.97 52.22 1cf4 s GLU 178 Cb 0.10 0.02 -0.02 0.00 0.00 0.00 0.00 34.13 34.24 1cf4 s GLU 178 CO 0.85 -0.02 1.67 -1.25 0.02 0.00 0.00 175.26 176.53 1cf4 s PRO 179 N 0.09 3.54 1.04 4.30 0.04 -1.26 -4.11 135.00 138.64 1cf4 s PRO 179 Ca -0.00 1.42 -0.12 0.00 0.04 0.00 0.00 61.00 62.33 1cf4 s PRO 179 Cb -0.01 -4.11 0.22 0.00 0.04 0.00 0.00 34.50 30.63 1cf4 s PRO 179 CO -0.00 -1.61 1.07 -1.25 0.04 0.00 0.00 177.00 175.25 1cf4 s PRO 180 N 5.19 0.04 -0.61 0.56 0.04 -1.26 -4.99 135.00 133.97 1cf4 s PRO 180 Ca 0.74 0.89 -0.13 0.00 0.04 0.00 0.00 61.00 62.54 1cf4 s PRO 180 Cb -0.22 -1.66 0.16 0.00 0.04 0.00 0.00 34.50 32.82 1cf4 s PRO 180 CO 0.32 -3.09 0.53 -1.21 0.04 0.00 0.00 177.00 173.59 1cf4 s GLU 181 N -4.68 3.00 0.00 4.56 8.01 -1.26 -5.07 118.70 123.27 1cf4 s GLU 181 Ca 0.67 -2.01 0.00 0.00 0.01 0.00 0.00 54.97 53.64 1cf4 s GLU 181 Cb -0.22 -4.19 0.00 0.00 -4.31 0.00 0.00 34.13 25.41 1cf4 s GLU 181 CO 0.61 -1.27 0.00 -0.35 0.01 0.00 0.00 175.26 174.26 1cf4 n PRO 182 N 4.65 0.34 -3.13 0.39 -0.04 -1.26 -4.96 135.00 131.00 1cf4 n PRO 182 Ca -0.03 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.99 1cf4 n PRO 182 Cb 0.42 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.87 1cf4 n PRO 182 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1cf4 s LYS 183 N -1.48 3.98 0.00 0.54 1.02 -1.26 -5.19 119.74 117.35 1cf4 s LYS 183 Ca 0.00 -2.65 0.21 0.00 0.02 0.00 0.00 55.97 53.55 1cf4 s LYS 183 Cb 0.00 -4.78 1.24 0.00 -0.52 0.00 0.00 37.83 33.76 1cf4 s LYS 183 CO 0.00 -1.53 1.62 1.63 -0.92 0.00 0.00 175.35 176.15