#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 0.61 0.19 3.17 2.00 -1.23 -5.03 119.66 119.37 1cf4 s GLN 2 Ca 0.00 1.26 0.01 0.00 -2.00 0.00 0.00 55.36 54.63 1cf4 s GLN 2 Cb 0.00 0.47 -0.00 0.00 0.80 0.00 0.00 33.01 34.27 1cf4 s GLN 2 CO 0.00 -0.16 0.02 -2.37 -0.50 0.00 0.00 175.29 172.28 1cf4 n THR 3 N 4.80 0.00 -3.65 -0.34 5.66 -1.26 -4.75 114.28 114.73 1cf4 n THR 3 Ca -0.16 -0.95 -0.12 0.00 -3.05 0.00 0.00 64.05 59.77 1cf4 n THR 3 Cb 0.54 0.24 -0.06 0.00 -1.55 0.00 0.00 70.33 69.51 1cf4 n THR 3 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1cf4 s ILE 4 N -1.87 0.06 -0.40 1.09 -0.00 -1.26 -4.65 121.20 114.17 1cf4 s ILE 4 Ca 0.03 -0.48 0.02 0.00 -0.00 0.00 0.00 60.65 60.22 1cf4 s ILE 4 Cb 0.00 -1.01 0.11 0.00 -0.00 0.00 0.00 42.46 41.57 1cf4 s ILE 4 CO 0.02 -0.27 0.15 -1.59 -0.00 0.00 0.00 174.94 173.25 1cf4 s LYS 5 N -2.82 1.37 0.26 0.37 -2.85 -1.26 -4.58 119.74 110.23 1cf4 s LYS 5 Ca -0.03 -1.89 -0.01 0.00 -1.00 0.00 0.00 55.97 53.04 1cf4 s LYS 5 Cb -0.00 -2.76 -0.04 0.00 -2.06 0.00 0.00 37.83 32.97 1cf4 s LYS 5 CO -0.05 -1.04 0.46 0.00 0.10 0.00 0.00 175.35 174.82 1cf4 s VAL 7 N -2.04 2.46 -0.29 0.00 1.01 -1.24 -2.08 120.40 118.23 1cf4 s VAL 7 Ca 0.39 -2.38 -0.05 0.00 0.00 0.00 0.00 61.98 59.94 1cf4 s VAL 7 Cb -0.10 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 34.01 1cf4 s VAL 7 CO 0.31 -0.39 0.04 0.54 0.00 0.00 0.00 175.10 175.61 1cf4 s VAL 8 N -2.47 3.65 -0.04 2.92 0.11 -1.24 -2.66 120.40 120.66 1cf4 s VAL 8 Ca 0.29 -0.83 0.01 0.00 -2.93 0.00 0.00 61.98 58.52 1cf4 s VAL 8 Cb -0.05 -2.90 0.02 0.00 -1.53 0.00 0.00 36.38 31.92 1cf4 s VAL 8 CO 0.15 0.08 -0.04 -0.69 -3.33 0.00 0.00 175.10 171.27 1cf4 s VAL 9 N 1.44 0.51 -5.00 2.04 1.01 -0.55 -4.66 120.40 115.19 1cf4 s VAL 9 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.88 1cf4 s VAL 9 Cb -0.17 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.67 1cf4 s VAL 9 CO 0.01 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1cf4 n GLY 10 N 4.04 0.15 0.00 4.51 0.00 -1.26 -3.26 105.19 109.36 1cf4 n GLY 10 Ca -0.25 -1.20 0.01 0.00 0.00 0.00 0.00 46.02 44.57 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 1.71 0.00 1.61 8.00 -1.24 -4.73 116.55 121.90 1cf4 n ASP 11 Ca 0.00 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.16 1cf4 n ASP 11 Cb 0.00 1.02 0.00 0.00 -0.02 0.00 0.00 41.12 42.12 1cf4 n ASP 11 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cf4 n GLY 12 N 1.53 -1.11 0.01 0.44 0.00 -1.23 -4.62 105.19 100.21 1cf4 n GLY 12 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1cf4 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cf4 n ALA 13 N -3.00 2.87 -1.75 4.61 0.00 -1.26 -4.80 120.51 117.17 1cf4 n ALA 13 Ca 0.00 -0.46 -0.16 0.00 0.00 0.00 0.00 53.44 52.82 1cf4 n ALA 13 Cb 0.00 -0.66 -0.05 0.00 0.00 0.00 0.00 19.45 18.74 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 -2.10 -0.26 -3.69 0.00 0.31 -1.26 -4.97 118.33 106.36 1cf4 n VAL 14 Ca -0.03 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.19 1cf4 n VAL 14 Cb 0.48 -1.92 -0.09 0.00 -0.91 0.00 0.00 33.84 31.39 1cf4 n VAL 14 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1cf4 s GLY 15 N -2.64 -0.40 0.00 2.92 0.00 -1.26 -4.89 107.32 101.05 1cf4 s GLY 15 Ca 0.00 1.61 0.13 0.00 0.00 0.00 0.00 44.72 46.46 1cf4 s GLY 15 CO 0.00 1.58 1.36 0.28 0.00 0.00 0.00 173.10 176.32 1cf4 n LYS 16 N 3.61 1.53 -0.11 2.90 5.02 -1.26 -3.85 118.16 126.00 1cf4 n LYS 16 Ca -0.18 -0.82 -0.23 0.00 -2.02 0.00 0.00 58.31 55.05 1cf4 n LYS 16 Cb 0.56 -1.26 -0.11 0.00 -0.02 0.00 0.00 35.03 34.20 1cf4 n LYS 16 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1cf4 n THR 17 N 0.11 1.55 -0.33 -0.18 -2.24 -1.26 -4.49 114.28 107.43 1cf4 n THR 17 Ca 0.11 -0.44 0.16 0.00 -2.27 0.00 0.00 64.05 61.61 1cf4 n THR 17 Cb 0.22 -1.72 0.31 0.00 -2.10 0.00 0.00 70.33 67.04 1cf4 n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cf4 h LEU 19 N 0.00 -0.41 -0.99 0.00 4.07 -1.80 0.22 115.31 116.41 1cf4 h LEU 19 Ca 0.61 0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.70 1cf4 h LEU 19 Cb 1.29 0.28 0.00 0.00 1.08 0.00 0.00 40.66 43.31 1cf4 h LEU 19 CO -0.89 -0.15 0.00 -0.07 -1.08 0.00 0.00 178.44 176.25 1cf4 h LEU 20 N -0.00 0.00 0.00 1.67 -0.00 -0.53 -2.38 115.31 114.07 1cf4 h LEU 20 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 1cf4 h LEU 20 Cb 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 1cf4 h LEU 20 CO -0.46 0.00 0.00 -0.38 -0.00 0.00 0.00 178.44 177.60 1cf4 n ILE 21 N -3.00 0.00 0.27 1.22 2.08 0.72 -2.15 119.36 118.50 1cf4 n ILE 21 Ca 0.02 1.11 0.12 0.00 0.56 0.00 0.00 62.75 64.56 1cf4 n ILE 21 Cb 0.36 -2.08 0.77 0.00 -0.75 0.00 0.00 39.64 37.94 1cf4 n ILE 21 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 1cf4 h SER 22 N 0.00 0.00 0.64 4.38 0.87 -1.50 1.34 113.55 119.28 1cf4 h SER 22 Ca 0.00 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 1cf4 h SER 22 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1cf4 h SER 22 CO 0.00 0.04 -0.35 0.22 -0.53 0.00 0.00 176.83 176.21 1cf4 h TYR 23 N 0.00 -0.92 0.08 2.24 3.20 -1.46 -3.34 116.97 116.76 1cf4 h TYR 23 Ca -0.00 -0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.69 1cf4 h TYR 23 Cb 0.09 0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.68 1cf4 h TYR 23 CO 0.00 -0.54 -0.78 1.15 -1.64 0.00 0.00 178.16 176.34 1cf4 h THR 24 N -0.91 1.40 -2.61 1.81 2.02 -1.27 -3.48 112.91 109.87 1cf4 h THR 24 Ca -0.09 -2.41 0.00 0.00 0.77 0.00 0.00 66.41 64.68 1cf4 h THR 24 Cb 0.72 3.02 0.00 0.00 -1.74 0.00 0.00 68.15 70.15 1cf4 h THR 24 CO 0.12 0.64 0.00 0.35 0.37 0.00 0.00 175.52 176.99 1cf4 n THR 25 N -4.25 0.00 -2.13 3.16 -2.24 0.46 -5.08 114.28 104.20 1cf4 n THR 25 Ca -0.18 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.58 1cf4 n THR 25 Cb 0.73 -0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 68.17 1cf4 n THR 25 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1cf4 n ASN 26 N 0.00 -0.26 -4.09 3.42 5.03 -1.24 -3.97 115.26 114.15 1cf4 n ASN 26 Ca 0.00 -1.86 -0.43 0.00 0.87 0.00 0.00 54.58 53.16 1cf4 n ASN 26 Cb 0.00 0.06 0.01 0.00 -1.02 0.00 0.00 39.78 38.83 1cf4 n ASN 26 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1cf4 n LYS 27 N 0.13 3.96 -0.08 3.52 5.02 -1.26 -4.74 118.16 124.71 1cf4 n LYS 27 Ca -0.13 -4.20 -0.14 0.00 -2.02 0.00 0.00 58.31 51.82 1cf4 n LYS 27 Cb 0.79 -2.68 -0.09 0.00 -0.02 0.00 0.00 35.03 33.03 1cf4 n LYS 27 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1cf4 h PHE 28 N 5.94 0.00 -1.48 2.13 3.57 -1.95 -3.42 116.94 121.73 1cf4 h PHE 28 Ca 0.26 0.00 -0.72 0.00 3.53 0.00 0.00 57.97 61.04 1cf4 h PHE 28 Cb 0.70 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 39.31 1cf4 h PHE 28 CO 1.03 0.93 1.84 -0.35 -2.23 0.00 0.00 178.31 179.53 1cf4 n PRO 29 N -4.54 3.29 0.00 6.41 -0.04 -1.26 -4.65 135.00 134.20 1cf4 n PRO 29 Ca -0.19 -3.54 0.00 0.00 -0.04 0.00 0.00 63.50 59.73 1cf4 n PRO 29 Cb 0.48 -3.23 0.00 0.00 -0.04 0.00 0.00 33.50 30.72 1cf4 n PRO 29 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1cf4 n SER 30 N 6.62 0.00 -3.64 3.54 7.64 -1.26 -5.17 113.62 121.35 1cf4 n SER 30 Ca 0.43 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 60.21 1cf4 n SER 30 Cb 0.43 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.56 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 0.62 0.73 -0.73 1.43 -1.05 -1.26 -5.11 118.70 113.33 1cf4 s GLU 31 Ca 0.00 1.12 -0.16 0.00 -0.15 0.00 0.00 54.97 55.77 1cf4 s GLU 31 Cb 0.00 0.22 0.16 0.00 -0.44 0.00 0.00 34.13 34.08 1cf4 s GLU 31 CO 0.00 -0.13 0.75 0.71 0.95 0.00 0.00 175.26 177.54 1cf4 s TYR 32 N 1.18 3.39 0.22 4.83 2.02 -1.26 -4.73 117.35 122.99 1cf4 s TYR 32 Ca -0.06 -1.52 0.00 0.00 -0.37 0.00 0.00 57.07 55.11 1cf4 s TYR 32 Cb -0.05 -3.93 0.00 0.00 -0.40 0.00 0.00 41.96 37.58 1cf4 s TYR 32 CO -0.12 -1.14 0.00 0.28 -1.57 0.00 0.00 175.55 173.00 1cf4 n VAL 33 N 4.82 0.33 0.27 0.71 0.31 -1.26 -4.83 118.33 118.67 1cf4 n VAL 33 Ca 0.04 0.11 0.16 0.00 -0.01 0.00 0.00 64.34 64.64 1cf4 n VAL 33 Cb 0.45 -0.81 0.76 0.00 -0.91 0.00 0.00 33.84 33.32 1cf4 n VAL 33 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1cf4 h PRO 34 N 0.00 0.00 -3.64 5.55 0.11 -2.02 -3.25 132.00 128.74 1cf4 h PRO 34 Ca 0.00 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.66 1cf4 h PRO 34 Cb 0.03 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.16 1cf4 h PRO 34 CO 0.00 0.00 2.62 2.41 -0.21 0.00 0.00 178.00 182.82 1cf4 n THR 35 N -3.08 2.42 0.00 -1.15 -1.04 -1.26 -3.59 114.28 106.57 1cf4 n THR 35 Ca 0.01 -1.57 0.00 0.00 -2.04 0.00 0.00 64.05 60.45 1cf4 n THR 35 Cb 0.48 -2.20 0.00 0.00 -1.82 0.00 0.00 70.33 66.79 1cf4 n THR 35 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1cf4 n VAL 36 N 4.56 0.00 -0.65 12.58 3.14 -1.23 -4.63 118.33 132.11 1cf4 n VAL 36 Ca 0.47 0.00 0.50 0.00 -2.96 0.00 0.00 64.34 62.35 1cf4 n VAL 36 Cb 0.20 -0.20 0.81 0.00 -1.06 0.00 0.00 33.84 33.59 1cf4 n VAL 36 CO 0.00 0.00 0.00 0.15 -6.46 0.00 0.00 176.83 170.52 1cf4 h PHE 37 N 0.00 0.04 0.00 1.45 3.57 -1.89 -3.44 116.94 116.68 1cf4 h PHE 37 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1cf4 h PHE 37 Cb 0.39 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.12 1cf4 h PHE 37 CO 0.00 -0.02 0.00 -3.47 -2.23 0.00 0.00 178.31 172.59 1cf4 n ASP 38 N -4.03 0.00 -2.69 0.41 -0.08 -1.26 -4.43 116.55 104.48 1cf4 n ASP 38 Ca 0.42 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 53.47 1cf4 n ASP 38 Cb 1.89 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 45.27 1cf4 n ASP 38 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1cf4 n ASN 39 N 1.31 6.33 -4.78 1.67 4.05 -1.26 -3.67 115.26 118.91 1cf4 n ASN 39 Ca 0.00 -2.45 -0.41 0.00 0.45 0.00 0.00 54.58 52.17 1cf4 n ASN 39 Cb 0.00 -1.36 -0.00 0.00 1.23 0.00 0.00 39.78 39.65 1cf4 n ASN 39 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 1cf4 s TYR 40 N 1.86 2.59 -0.27 1.20 2.02 -1.26 -4.96 117.35 118.54 1cf4 s TYR 40 Ca 0.61 1.16 -0.20 0.00 -0.37 0.00 0.00 57.07 58.28 1cf4 s TYR 40 Cb 0.22 -4.02 -0.02 0.00 -0.40 0.00 0.00 41.96 37.74 1cf4 s TYR 40 CO -0.03 -3.01 0.60 0.00 -1.57 0.00 0.00 175.55 171.54 1cf4 s ALA 41 N -1.09 3.59 -0.05 3.71 0.00 -1.26 -4.63 121.76 122.02 1cf4 s ALA 41 Ca 0.53 -0.53 -0.01 0.00 0.00 0.00 0.00 51.96 51.95 1cf4 s ALA 41 Cb -0.47 -3.01 0.03 0.00 0.00 0.00 0.00 23.12 19.68 1cf4 s ALA 41 CO 0.63 -0.85 0.01 0.14 0.00 0.00 0.00 175.76 175.69 1cf4 s VAL 42 N 2.47 0.22 -0.60 0.00 -7.23 -1.26 -5.10 120.40 108.90 1cf4 s VAL 42 Ca 0.24 0.17 -0.25 0.00 -1.81 0.00 0.00 61.98 60.33 1cf4 s VAL 42 Cb -0.15 -0.38 0.04 0.00 0.56 0.00 0.00 36.38 36.45 1cf4 s VAL 42 CO 0.09 0.21 1.05 0.28 -0.31 0.00 0.00 175.10 176.42 1cf4 s THR 43 N 1.70 4.20 -0.01 5.32 -1.32 -1.26 -4.50 115.64 119.77 1cf4 s THR 43 Ca 0.00 0.34 -0.08 0.00 -1.21 0.00 0.00 61.69 60.74 1cf4 s THR 43 Cb -0.13 -4.66 0.01 0.00 -1.51 0.00 0.00 72.50 66.21 1cf4 s THR 43 CO -0.03 -1.32 0.15 -0.69 -2.21 0.00 0.00 174.62 170.52 1cf4 s VAL 44 N 4.44 0.07 -0.68 5.08 1.01 -1.26 -5.05 120.40 124.01 1cf4 s VAL 44 Ca 0.33 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.57 1cf4 s VAL 44 Cb -0.11 -0.41 0.14 0.00 0.00 0.00 0.00 36.38 35.99 1cf4 s VAL 44 CO 0.19 -0.31 0.74 -0.32 0.00 0.00 0.00 175.10 175.39 1cf4 s MET 45 N -1.13 3.23 -1.11 2.72 -2.45 -1.26 -0.88 119.30 118.42 1cf4 s MET 45 Ca -0.12 -1.71 -0.19 0.00 -1.25 0.00 0.00 55.69 52.42 1cf4 s MET 45 Cb -0.06 -4.39 0.09 0.00 1.25 0.00 0.00 34.83 31.71 1cf4 s MET 45 CO 0.02 -1.48 1.47 0.42 1.05 0.00 0.00 175.02 176.49 1cf4 s ILE 46 N 1.92 4.29 0.00 10.11 -1.09 -0.83 -4.74 121.20 130.87 1cf4 s ILE 46 Ca 0.14 -1.52 0.00 0.00 -2.23 0.00 0.00 60.65 57.04 1cf4 s ILE 46 Cb -0.20 -5.02 0.00 0.00 -1.58 0.00 0.00 42.46 35.66 1cf4 s ILE 46 CO 0.00 -1.84 0.00 0.61 -1.23 0.00 0.00 174.94 172.49 1cf4 n GLY 47 N 5.80 0.00 0.00 6.18 0.00 -1.26 -3.98 105.19 111.92 1cf4 n GLY 47 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 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 1.31 1.10 3.22 -0.02 0.00 -1.26 -3.54 105.19 106.00 1cf4 n GLY 48 Ca 0.00 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 1cf4 n GLY 48 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1cf4 s GLU 49 N 0.00 3.06 -0.86 1.61 -1.05 -1.26 -4.94 118.70 115.26 1cf4 s GLU 49 Ca 0.00 -0.87 -0.21 0.00 -0.15 0.00 0.00 54.97 53.74 1cf4 s GLU 49 Cb 0.00 -2.32 -0.22 0.00 -0.44 0.00 0.00 34.13 31.15 1cf4 s GLU 49 CO 0.00 0.17 2.16 -2.30 0.95 0.00 0.00 175.26 176.25 1cf4 n PRO 50 N 3.55 0.00 -3.63 -4.83 -0.02 -1.26 -4.38 135.00 124.43 1cf4 n PRO 50 Ca -0.19 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.22 1cf4 n PRO 50 Cb 0.53 -1.15 -0.06 0.00 -0.02 0.00 0.00 33.50 32.80 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 5.26 -0.27 0.07 6.00 6.14 -0.06 -4.91 117.35 129.59 1cf4 s TYR 51 Ca 1.15 0.61 0.03 0.00 0.64 0.00 0.00 57.07 59.50 1cf4 s TYR 51 Cb -0.97 0.43 -0.03 0.00 0.42 0.00 0.00 41.96 41.81 1cf4 s TYR 51 CO 0.44 -0.16 -0.08 0.99 0.64 0.00 0.00 175.55 177.38 1cf4 s THR 52 N -0.21 0.70 -0.09 4.34 2.01 -1.18 -1.97 115.64 119.24 1cf4 s THR 52 Ca 0.04 -1.44 -0.13 0.00 0.31 0.00 0.00 61.69 60.47 1cf4 s THR 52 Cb -0.04 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.34 1cf4 s THR 52 CO -0.08 -0.54 0.31 -0.22 -0.69 0.00 0.00 174.62 173.40 1cf4 s LEU 53 N -2.17 4.37 0.40 4.42 2.96 -1.26 -4.97 118.68 122.43 1cf4 s LEU 53 Ca -0.00 0.69 -0.26 0.00 -0.22 0.00 0.00 54.13 54.34 1cf4 s LEU 53 Cb -0.04 -2.41 -0.09 0.00 0.50 0.00 0.00 46.19 44.15 1cf4 s LEU 53 CO -0.01 0.25 1.33 -0.83 -1.32 0.00 0.00 176.35 175.77 1cf4 s GLY 54 N -0.46 2.94 0.15 7.98 0.00 -1.26 -4.91 107.32 111.75 1cf4 s GLY 54 Ca 0.19 1.29 -0.30 0.00 0.00 0.00 0.00 44.72 45.90 1cf4 s GLY 54 CO 0.08 1.89 1.08 1.08 0.00 0.00 0.00 173.10 177.23 1cf4 s LEU 55 N -2.34 4.48 -0.49 0.66 2.01 -1.24 -4.71 118.68 117.04 1cf4 s LEU 55 Ca 0.56 2.02 -0.26 0.00 0.01 0.00 0.00 54.13 56.46 1cf4 s LEU 55 Cb -0.39 -3.60 0.03 0.00 0.01 0.00 0.00 46.19 42.24 1cf4 s LEU 55 CO 0.51 -0.21 0.97 -0.36 1.01 0.00 0.00 176.35 178.27 1cf4 s PHE 56 N -0.06 2.86 -0.00 0.29 0.40 -0.88 -4.17 117.98 116.41 1cf4 s PHE 56 Ca 0.50 0.32 -0.01 0.00 -0.60 0.00 0.00 56.93 57.14 1cf4 s PHE 56 Cb -0.28 -4.08 -0.00 0.00 0.51 0.00 0.00 43.02 39.17 1cf4 s PHE 56 CO 0.33 -1.21 0.01 -0.51 0.70 0.00 0.00 175.22 174.54 1cf4 s ASP 57 N 2.47 0.03 0.40 1.36 1.01 -1.26 -3.71 116.67 116.97 1cf4 s ASP 57 Ca 0.37 -0.07 0.06 0.00 0.71 0.00 0.00 52.55 53.62 1cf4 s ASP 57 Cb -0.10 0.05 0.06 0.00 1.01 0.00 0.00 42.92 43.94 1cf4 s ASP 57 CO 0.25 -0.07 0.52 0.35 0.21 0.00 0.00 175.17 176.43 1cf4 n THR 58 N 2.76 0.00 -2.88 -1.27 -2.24 -1.26 -4.23 114.28 105.17 1cf4 n THR 58 Ca -0.14 -1.35 0.00 0.00 -2.27 0.00 0.00 64.05 60.28 1cf4 n THR 58 Cb 0.59 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 1cf4 n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cf4 n ALA 59 N -2.50 0.00 -2.74 6.98 0.00 -1.26 -4.51 120.51 116.48 1cf4 n ALA 59 Ca -0.10 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.31 1cf4 n ALA 59 Cb 0.42 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.95 1cf4 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cf4 n GLY 60 N 0.00 1.76 0.00 0.00 0.00 -1.23 -4.58 105.19 101.14 1cf4 n GLY 60 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1cf4 n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1cf4 n LEU 61 N -0.80 0.00 -0.27 0.99 4.77 -1.18 -4.86 117.00 115.65 1cf4 n LEU 61 Ca -0.02 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.04 1cf4 n LEU 61 Cb 0.83 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 42.14 1cf4 n LEU 61 CO 0.01 0.00 0.96 -0.33 -1.33 0.00 0.00 177.39 176.71 1cf4 h GLU 62 N 0.00 0.30 -0.35 3.23 4.39 -2.02 -2.34 114.58 117.79 1cf4 h GLU 62 Ca 0.00 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.72 1cf4 h GLU 62 Cb 0.00 -0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 28.51 1cf4 h GLU 62 CO 0.00 0.20 -0.50 0.22 -1.16 0.00 0.00 179.01 177.77 1cf4 h ASP 63 N 0.31 -1.66 -3.52 1.42 3.58 -1.95 -3.44 116.42 111.16 1cf4 h ASP 63 Ca 0.46 0.22 0.02 0.00 0.42 0.00 0.00 57.03 58.14 1cf4 h ASP 63 Cb 0.82 0.68 -0.24 0.00 1.72 0.00 0.00 39.33 42.31 1cf4 h ASP 63 CO -0.52 -0.36 0.30 -0.72 -2.88 0.00 0.00 179.24 175.05 1cf4 s TYR 64 N -5.35 -0.63 -0.02 0.28 -0.85 -0.88 -5.07 117.35 104.83 1cf4 s TYR 64 Ca -0.13 1.52 -0.01 0.00 -0.52 0.00 0.00 57.07 57.93 1cf4 s TYR 64 Cb 0.07 0.33 -0.00 0.00 0.38 0.00 0.00 41.96 42.74 1cf4 s TYR 64 CO 0.54 -0.30 -0.02 -0.44 -1.52 0.00 0.00 175.55 173.81 1cf4 h ASP 65 N 4.68 0.00 0.52 -0.18 5.19 -1.81 -3.13 116.42 121.70 1cf4 h ASP 65 Ca -0.29 0.00 -0.29 0.00 -0.62 0.00 0.00 57.03 55.83 1cf4 h ASP 65 Cb 1.17 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.65 1cf4 h ASP 65 CO 0.09 0.12 -1.60 0.08 -3.12 0.00 0.00 179.24 174.81 1cf4 h ARG 66 N -0.18 0.07 0.00 3.56 -0.00 -1.96 -3.41 114.38 112.46 1cf4 h ARG 66 Ca 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 59.98 59.85 1cf4 h ARG 66 Cb 0.06 0.05 0.00 0.00 -0.00 0.00 0.00 29.97 30.08 1cf4 h ARG 66 CO 0.00 0.77 0.00 1.28 -0.00 0.00 0.00 179.97 182.02 1cf4 n LEU 67 N -3.22 0.00 0.11 0.08 4.32 -1.26 -4.92 117.00 112.12 1cf4 n LEU 67 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.83 1cf4 n LEU 67 Cb 1.03 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.83 1cf4 n LEU 67 CO 0.46 0.00 0.00 0.54 -1.22 0.00 0.00 177.39 177.17 1cf4 n ARG 68 N 1.23 0.00 -0.32 3.23 1.74 -1.26 -4.98 116.66 116.29 1cf4 n ARG 68 Ca 0.00 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.00 1cf4 n ARG 68 Cb 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.36 1cf4 n ARG 68 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1cf4 n PRO 69 N -2.96 -0.33 -0.15 5.56 -0.02 -1.26 0.16 135.00 135.99 1cf4 n PRO 69 Ca 0.00 1.16 0.28 0.00 -2.02 0.00 0.00 63.50 62.92 1cf4 n PRO 69 Cb 0.00 -1.71 0.65 0.00 -0.02 0.00 0.00 33.50 32.42 1cf4 n PRO 69 CO 0.00 0.00 0.00 1.37 1.98 0.00 0.00 175.50 178.85 1cf4 h LEU 70 N 0.00 0.00 -0.47 2.45 8.10 -1.94 1.26 115.31 124.70 1cf4 h LEU 70 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.11 1cf4 h LEU 70 Cb 0.31 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.53 1cf4 h LEU 70 CO -0.71 0.00 -0.52 -0.24 -4.11 0.00 0.00 178.44 172.86 1cf4 n SER 71 N -3.65 1.26 -4.11 0.17 2.88 0.41 -4.94 113.62 105.64 1cf4 n SER 71 Ca 0.19 -1.01 -0.14 0.00 -1.33 0.00 0.00 58.87 56.58 1cf4 n SER 71 Cb 1.16 0.45 -0.11 0.00 -0.75 0.00 0.00 64.21 64.95 1cf4 n SER 71 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1cf4 s TYR 72 N -2.68 0.87 -0.23 0.66 2.02 0.43 -4.78 117.35 113.64 1cf4 s TYR 72 Ca 0.17 -0.55 -0.07 0.00 -0.37 0.00 0.00 57.07 56.25 1cf4 s TYR 72 Cb 0.18 -0.50 -0.24 0.00 -0.40 0.00 0.00 41.96 41.00 1cf4 s TYR 72 CO 0.64 -0.05 3.53 -0.35 -1.57 0.00 0.00 175.55 177.76 1cf4 n PRO 73 N 1.16 2.24 0.12 -1.71 -0.04 -1.26 -4.44 135.00 131.06 1cf4 n PRO 73 Ca -0.21 -1.18 -0.03 0.00 -0.04 0.00 0.00 63.50 62.05 1cf4 n PRO 73 Cb 0.55 -2.11 0.11 0.00 -0.04 0.00 0.00 33.50 32.02 1cf4 n PRO 73 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 1cf4 h GLN 74 N 3.27 0.03 0.00 0.54 -0.00 -1.96 -3.45 115.11 113.54 1cf4 h GLN 74 Ca 0.29 -0.03 -0.27 0.00 -0.00 0.00 0.00 58.65 58.64 1cf4 h GLN 74 Cb 1.34 0.01 0.13 0.00 -0.00 0.00 0.00 27.48 28.96 1cf4 h GLN 74 CO 0.45 0.71 0.10 -2.37 -0.00 0.00 0.00 178.83 177.71 1cf4 n THR 75 N -3.74 0.00 -0.01 1.86 5.66 -1.26 -5.01 114.28 111.78 1cf4 n THR 75 Ca -0.01 -0.35 0.02 0.00 -3.05 0.00 0.00 64.05 60.66 1cf4 n THR 75 Cb 0.67 -1.20 -0.06 0.00 -1.55 0.00 0.00 70.33 68.20 1cf4 n THR 75 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1cf4 n ASP 76 N -4.22 3.35 -3.45 1.09 2.03 -1.26 -4.97 116.55 109.13 1cf4 n ASP 76 Ca 0.10 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.32 1cf4 n ASP 76 Cb 0.40 1.21 -0.09 0.00 -0.72 0.00 0.00 41.12 41.92 1cf4 n ASP 76 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1cf4 s VAL 77 N -2.44 -0.58 0.93 5.18 1.01 -1.26 -4.13 120.40 119.10 1cf4 s VAL 77 Ca -0.03 0.00 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 1cf4 s VAL 77 Cb 0.04 -0.75 0.18 0.00 0.00 0.00 0.00 36.38 35.86 1cf4 s VAL 77 CO 0.29 -0.07 1.28 -0.36 0.00 0.00 0.00 175.10 176.25 1cf4 s PHE 78 N 2.54 1.78 -0.20 5.22 0.40 0.45 -3.64 117.98 124.53 1cf4 s PHE 78 Ca 0.08 0.34 -0.04 0.00 -0.60 0.00 0.00 56.93 56.71 1cf4 s PHE 78 Cb -0.14 -3.97 0.08 0.00 0.51 0.00 0.00 43.02 39.50 1cf4 s PHE 78 CO -0.14 -2.47 0.16 -1.17 0.70 0.00 0.00 175.22 172.30 1cf4 s LEU 79 N -5.80 0.13 -0.72 -0.37 1.98 -1.09 -3.35 118.68 109.46 1cf4 s LEU 79 Ca 0.72 -0.50 -0.18 0.00 -2.89 0.00 0.00 54.13 51.27 1cf4 s LEU 79 Cb -0.05 0.06 0.12 0.00 0.66 0.00 0.00 46.19 46.99 1cf4 s LEU 79 CO 0.52 -0.35 0.84 0.68 -1.89 0.00 0.00 176.35 176.15 1cf4 s VAL 80 N 2.23 4.87 0.91 1.68 -7.23 -1.13 -1.49 120.40 120.24 1cf4 s VAL 80 Ca 0.05 -1.30 -0.13 0.00 -1.81 0.00 0.00 61.98 58.79 1cf4 s VAL 80 Cb -0.16 -4.58 0.18 0.00 0.56 0.00 0.00 36.38 32.38 1cf4 s VAL 80 CO -0.14 -1.24 1.26 0.00 -0.31 0.00 0.00 175.10 174.67 1cf4 n PHE 82 N -3.57 -0.04 -3.74 0.00 -1.74 -1.26 -3.54 117.46 103.57 1cf4 n PHE 82 Ca 0.15 -0.19 -0.12 0.00 -0.56 0.00 0.00 57.45 56.73 1cf4 n PHE 82 Cb 0.60 0.08 -0.12 0.00 1.52 0.00 0.00 39.48 41.56 1cf4 n PHE 82 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1cf4 s SER 83 N -2.03 -0.36 0.16 5.98 1.04 -1.26 -4.39 113.70 112.84 1cf4 s SER 83 Ca 0.11 0.67 -0.26 0.00 0.48 0.00 0.00 55.95 56.95 1cf4 s SER 83 Cb -0.00 0.61 0.02 0.00 0.10 0.00 0.00 66.02 66.75 1cf4 s SER 83 CO -0.01 -0.15 1.57 -0.37 0.98 0.00 0.00 173.24 175.26 1cf4 h VAL 84 N 5.22 0.09 -1.59 5.02 -1.51 -1.86 -3.38 116.25 118.24 1cf4 h VAL 84 Ca -0.33 0.00 -0.64 0.00 -1.23 0.00 0.00 66.70 64.50 1cf4 h VAL 84 Cb 1.18 0.09 -0.00 0.00 -2.13 0.00 0.00 31.29 30.42 1cf4 h VAL 84 CO 0.32 0.00 1.33 1.33 -1.23 0.00 0.00 177.57 179.32 1cf4 n VAL 85 N -5.40 0.34 -3.68 7.19 0.24 -1.26 -3.05 118.33 112.70 1cf4 n VAL 85 Ca 0.01 -0.26 -0.10 0.00 -2.04 0.00 0.00 64.34 61.95 1cf4 n VAL 85 Cb 0.35 -1.93 -0.11 0.00 -1.47 0.00 0.00 33.84 30.69 1cf4 n VAL 85 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1cf4 s SER 86 N 6.52 -0.34 -0.84 -1.34 0.01 -1.26 -5.02 113.70 111.43 1cf4 s SER 86 Ca 1.02 0.90 -0.04 0.00 1.31 0.00 0.00 55.95 59.14 1cf4 s SER 86 Cb -0.69 0.97 0.14 0.00 0.21 0.00 0.00 66.02 66.65 1cf4 s SER 86 CO 0.47 -0.21 2.47 -0.81 0.41 0.00 0.00 173.24 175.57 1cf4 n PRO 87 N 4.77 3.46 -1.27 12.44 -0.04 -1.26 -4.33 135.00 148.76 1cf4 n PRO 87 Ca -0.17 -3.07 0.00 0.00 -0.04 0.00 0.00 63.50 60.22 1cf4 n PRO 87 Cb 0.53 -2.35 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 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 0.90 -1.97 -0.05 3.54 2.88 -1.26 -4.36 113.62 113.30 1cf4 n SER 88 Ca 0.54 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 58.05 1cf4 n SER 88 Cb 0.39 -0.45 -0.14 0.00 -0.75 0.00 0.00 64.21 63.25 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 1.80 0.25 -0.32 -3.46 2.88 -1.26 -4.15 113.62 109.35 1cf4 n SER 89 Ca 0.00 0.11 0.04 0.00 -1.33 0.00 0.00 58.87 57.69 1cf4 n SER 89 Cb 0.18 0.97 0.19 0.00 -0.75 0.00 0.00 64.21 64.80 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 0.99 -0.32 0.66 3.57 -1.92 0.23 116.94 120.15 1cf4 h PHE 90 Ca -0.33 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.04 1cf4 h PHE 90 Cb 1.82 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 40.24 1cf4 h PHE 90 CO 0.00 0.42 -0.44 0.93 -2.23 0.00 0.00 178.31 176.98 1cf4 h GLU 91 N 0.90 0.82 -0.25 1.11 3.07 -2.00 -1.63 114.58 116.61 1cf4 h GLU 91 Ca 0.43 -0.46 -0.06 0.00 -0.50 0.00 0.00 59.36 58.78 1cf4 h GLU 91 Cb 0.38 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1cf4 h GLU 91 CO -0.24 1.09 -0.07 -0.91 -1.40 0.00 0.00 179.01 177.48 1cf4 h ASN 92 N 0.66 0.50 -0.07 1.42 2.35 -1.45 -2.71 115.58 116.28 1cf4 h ASN 92 Ca 0.04 -0.37 -0.01 0.00 -0.55 0.00 0.00 56.30 55.41 1cf4 h ASN 92 Cb 1.02 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 39.25 1cf4 h ASN 92 CO 0.10 0.76 0.01 1.62 -1.65 0.00 0.00 177.43 178.27 1cf4 h VAL 93 N 0.23 1.23 0.09 2.81 3.04 -0.61 -1.65 116.25 121.39 1cf4 h VAL 93 Ca 0.06 -0.70 0.01 0.00 -1.01 0.00 0.00 66.70 65.06 1cf4 h VAL 93 Cb 0.55 1.57 -0.03 0.00 -2.01 0.00 0.00 31.29 31.37 1cf4 h VAL 93 CO 0.03 0.19 -0.36 0.50 -1.01 0.00 0.00 177.57 176.92 1cf4 h LYS 94 N -0.15 -0.50 -1.00 4.17 3.11 -1.33 1.37 116.57 122.24 1cf4 h LYS 94 Ca 0.02 0.03 0.17 0.00 -2.81 0.00 0.00 60.65 58.06 1cf4 h LYS 94 Cb 0.30 0.11 -0.10 0.00 -1.00 0.00 0.00 32.23 31.55 1cf4 h LYS 94 CO 0.00 -0.33 0.62 1.49 -2.81 0.00 0.00 179.45 178.42 1cf4 h GLU 95 N -0.52 0.81 -0.30 1.90 4.81 -1.55 0.62 114.58 120.36 1cf4 h GLU 95 Ca -0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1cf4 h GLU 95 Cb 0.52 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1cf4 h GLU 95 CO -0.20 0.53 0.00 1.17 -0.73 0.00 0.00 179.01 179.79 1cf4 n LYS 96 N -4.70 1.73 -0.08 1.92 0.00 -0.62 -4.08 118.16 112.32 1cf4 n LYS 96 Ca 0.22 -1.13 -0.09 0.00 0.00 0.00 0.00 58.31 57.31 1cf4 n LYS 96 Cb 0.50 -1.27 -0.03 0.00 0.00 0.00 0.00 35.03 34.23 1cf4 n LYS 96 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.40 179.27 1cf4 n TRP 97 N 0.41 0.67 -0.23 5.64 -0.00 0.46 -3.70 117.44 120.68 1cf4 n TRP 97 Ca 0.11 0.29 -0.01 0.00 -0.00 0.00 0.00 57.50 57.90 1cf4 n TRP 97 Cb 0.28 -0.76 0.11 0.00 -0.00 0.00 0.00 31.31 30.93 1cf4 n TRP 97 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1cf4 h VAL 98 N -1.00 0.94 0.00 5.87 2.07 -1.67 0.16 116.25 122.62 1cf4 h VAL 98 Ca -0.08 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1cf4 h VAL 98 Cb 0.78 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1cf4 h VAL 98 CO -0.05 0.12 0.00 -0.65 0.02 0.00 0.00 177.57 177.01 1cf4 h PRO 99 N 0.66 0.00 0.00 1.57 0.11 -1.80 -3.05 132.00 129.50 1cf4 h PRO 99 Ca 0.31 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.40 1cf4 h PRO 99 Cb 0.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.33 1cf4 h PRO 99 CO -0.20 0.00 -0.59 0.39 -0.21 0.00 0.00 178.00 177.38 1cf4 n GLU 100 N -3.05 0.46 0.05 1.05 -0.58 -0.78 -2.26 120.64 115.53 1cf4 n GLU 100 Ca 0.02 0.52 0.21 0.00 -0.42 0.00 0.00 57.16 57.50 1cf4 n GLU 100 Cb 0.39 -1.69 0.73 0.00 -0.57 0.00 0.00 31.44 30.30 1cf4 n GLU 100 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1cf4 h ILE 101 N -1.00 0.38 0.00 -3.67 2.10 -0.84 0.10 117.51 114.58 1cf4 h ILE 101 Ca -0.03 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.91 1cf4 h ILE 101 Cb 0.59 0.61 0.00 0.00 -1.09 0.00 0.00 36.82 36.93 1cf4 h ILE 101 CO -0.02 0.00 -0.58 0.35 -1.08 0.00 0.00 178.15 176.82 1cf4 n THR 102 N -3.75 1.15 -0.29 2.19 -2.24 -1.15 -2.65 114.28 107.53 1cf4 n THR 102 Ca 0.09 0.25 0.11 0.00 -2.27 0.00 0.00 64.05 62.24 1cf4 n THR 102 Cb 0.69 -2.19 0.28 0.00 -2.10 0.00 0.00 70.33 67.01 1cf4 n THR 102 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1cf4 h HIS 103 N -0.79 0.57 0.00 4.78 -0.00 -1.32 0.95 115.15 119.34 1cf4 h HIS 103 Ca 0.00 0.04 -0.09 0.00 -0.00 0.00 0.00 60.37 60.32 1cf4 h HIS 103 Cb 0.58 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.85 1cf4 h HIS 103 CO -0.25 -0.05 -0.81 0.45 -0.00 0.00 0.00 177.93 177.27 1cf4 h HIS 104 N 0.38 0.00 -1.68 5.26 -0.00 -0.98 -3.41 115.15 114.72 1cf4 h HIS 104 Ca 0.53 0.00 -0.45 0.00 -0.00 0.00 0.00 60.37 60.45 1cf4 h HIS 104 Cb 0.97 0.00 -0.31 0.00 -0.00 0.00 0.00 27.41 28.07 1cf4 h HIS 104 CO -0.16 0.36 -0.86 0.00 -0.00 0.00 0.00 177.93 177.27 1cf4 s PRO 106 N -0.05 3.83 -0.94 0.00 0.02 0.30 -3.55 135.00 134.61 1cf4 s PRO 106 Ca 0.33 2.36 -0.03 0.00 0.02 0.00 0.00 61.00 63.68 1cf4 s PRO 106 Cb 0.10 -2.73 -0.04 0.00 0.02 0.00 0.00 34.50 31.85 1cf4 s PRO 106 CO -0.15 -0.68 0.80 1.63 -0.33 0.00 0.00 177.00 178.27 1cf4 n LYS 107 N -0.01 -3.35 -3.64 5.54 4.76 -1.26 -4.82 118.16 115.39 1cf4 n LYS 107 Ca 0.04 0.73 -0.27 0.00 -2.87 0.00 0.00 58.31 55.94 1cf4 n LYS 107 Cb 0.42 -5.23 -0.16 0.00 -1.84 0.00 0.00 35.03 28.21 1cf4 n LYS 107 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1cf4 s THR 108 N -3.32 0.11 1.03 -0.18 2.01 -1.23 -4.99 115.64 109.07 1cf4 s THR 108 Ca 0.24 -0.41 -0.11 0.00 0.31 0.00 0.00 61.69 61.72 1cf4 s THR 108 Cb -0.03 -0.80 0.21 0.00 0.01 0.00 0.00 72.50 71.90 1cf4 s THR 108 CO 0.62 -0.35 1.09 -2.84 -0.69 0.00 0.00 174.62 172.46 1cf4 s PRO 109 N 2.04 0.08 -0.20 4.92 0.02 -1.26 -4.62 135.00 135.98 1cf4 s PRO 109 Ca 0.03 1.26 -0.18 0.00 0.02 0.00 0.00 61.00 62.13 1cf4 s PRO 109 Cb -0.16 -1.64 0.05 0.00 0.02 0.00 0.00 34.50 32.77 1cf4 s PRO 109 CO -0.14 -3.18 0.52 -0.59 -0.33 0.00 0.00 177.00 173.29 1cf4 s PHE 110 N -2.54 -0.58 0.07 6.54 -0.71 -1.25 0.17 117.98 119.68 1cf4 s PHE 110 Ca 0.68 1.40 0.09 0.00 -1.04 0.00 0.00 56.93 58.06 1cf4 s PHE 110 Cb -0.24 0.20 -0.03 0.00 -1.21 0.00 0.00 43.02 41.74 1cf4 s PHE 110 CO 0.61 -0.28 -0.25 -1.17 -1.34 0.00 0.00 175.22 172.79 1cf4 s LEU 111 N 0.32 2.22 0.22 -1.99 0.20 -1.21 -3.26 118.68 115.18 1cf4 s LEU 111 Ca -0.00 -0.62 -0.03 0.00 0.69 0.00 0.00 54.13 54.16 1cf4 s LEU 111 Cb -0.04 -1.16 -0.05 0.00 -0.43 0.00 0.00 46.19 44.51 1cf4 s LEU 111 CO 0.00 0.20 0.46 -0.76 -0.29 0.00 0.00 176.35 175.95 1cf4 s LEU 112 N -1.48 4.17 0.02 -0.68 2.01 -1.25 -2.83 118.68 118.64 1cf4 s LEU 112 Ca 0.11 0.58 0.02 0.00 0.01 0.00 0.00 54.13 54.84 1cf4 s LEU 112 Cb -0.10 -3.35 -0.02 0.00 0.01 0.00 0.00 46.19 42.73 1cf4 s LEU 112 CO 0.03 -0.08 -0.06 -0.69 1.01 0.00 0.00 176.35 176.56 1cf4 s VAL 113 N -1.90 0.42 -0.29 -1.59 1.01 -1.26 -4.01 120.40 112.78 1cf4 s VAL 113 Ca 0.41 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1cf4 s VAL 113 Cb -0.11 -0.45 0.08 0.00 0.00 0.00 0.00 36.38 35.90 1cf4 s VAL 113 CO 0.28 -0.22 0.02 -0.83 0.00 0.00 0.00 175.10 174.36 1cf4 s GLY 114 N -1.01 1.41 0.01 4.51 0.00 -1.18 -4.68 107.32 106.38 1cf4 s GLY 114 Ca -0.06 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 42.86 1cf4 s GLY 114 CO 0.00 1.15 0.00 -1.30 0.00 0.00 0.00 173.10 172.95 1cf4 n THR 115 N 4.60 0.11 0.41 0.90 -2.24 -1.24 -1.14 114.28 115.69 1cf4 n THR 115 Ca -0.04 0.04 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1cf4 n THR 115 Cb 0.43 -1.48 0.24 0.00 -2.10 0.00 0.00 70.33 67.42 1cf4 n THR 115 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1cf4 n GLN 116 N -3.03 0.04 -0.23 -0.78 7.27 -1.26 -3.38 117.38 116.01 1cf4 n GLN 116 Ca 0.00 0.28 0.31 0.00 0.07 0.00 0.00 57.00 57.66 1cf4 n GLN 116 Cb 0.44 -1.50 0.63 0.00 2.41 0.00 0.00 30.24 32.22 1cf4 n GLN 116 CO 0.00 0.00 0.00 -0.84 0.07 0.00 0.00 177.06 176.29 1cf4 h ILE 117 N 0.00 0.16 0.00 1.69 -0.00 -1.84 1.21 117.51 118.72 1cf4 h ILE 117 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 64.86 64.84 1cf4 h ILE 117 Cb 0.16 0.23 -0.00 0.00 -0.00 0.00 0.00 36.82 37.21 1cf4 h ILE 117 CO 0.00 0.00 -0.11 0.44 -0.00 0.00 0.00 178.15 178.48 1cf4 h ASP 118 N 0.00 0.00 0.43 2.16 5.19 -1.87 -2.32 116.42 120.01 1cf4 h ASP 118 Ca 0.50 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.91 1cf4 h ASP 118 Cb 2.50 0.00 0.00 0.00 0.18 0.00 0.00 39.33 42.01 1cf4 h ASP 118 CO -0.01 0.11 -1.55 0.18 -3.12 0.00 0.00 179.24 174.85 1cf4 n LEU 119 N -3.72 0.38 -0.05 1.55 4.32 0.42 -4.19 117.00 115.71 1cf4 n LEU 119 Ca -0.02 0.14 0.25 0.00 -0.02 0.00 0.00 56.01 56.36 1cf4 n LEU 119 Cb 0.22 -0.03 0.68 0.00 -1.62 0.00 0.00 43.42 42.68 1cf4 n LEU 119 CO 0.30 -0.08 1.22 0.08 -1.22 0.00 0.00 177.39 177.70 1cf4 h ARG 120 N 0.00 0.00 0.00 3.23 -0.00 -1.19 1.22 114.38 117.64 1cf4 h ARG 120 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 59.98 59.81 1cf4 h ARG 120 Cb 0.99 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 30.94 1cf4 h ARG 120 CO 0.00 0.00 -0.98 0.22 -0.00 0.00 0.00 179.97 179.21 1cf4 h ASP 121 N 0.00 0.00 -1.44 0.08 3.58 -1.73 -3.45 116.42 113.46 1cf4 h ASP 121 Ca 0.32 0.00 -0.60 0.00 0.42 0.00 0.00 57.03 57.17 1cf4 h ASP 121 Cb 1.68 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.72 1cf4 h ASP 121 CO -0.00 0.71 1.50 -0.67 -2.88 0.00 0.00 179.24 177.90 1cf4 n ASP 122 N -3.17 2.48 0.00 2.28 -0.08 0.42 -4.80 116.55 113.69 1cf4 n ASP 122 Ca -0.03 0.18 0.07 0.00 -1.51 0.00 0.00 54.79 53.49 1cf4 n ASP 122 Cb 0.85 -1.40 0.36 0.00 2.34 0.00 0.00 41.12 43.27 1cf4 n ASP 122 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1cf4 n PRO 123 N 8.55 0.27 -0.01 -0.67 -0.02 -1.26 -2.45 135.00 139.40 1cf4 n PRO 123 Ca 0.38 0.11 -0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1cf4 n PRO 123 Cb 0.35 -1.50 -0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1cf4 n PRO 123 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1cf4 h SER 124 N 0.00 0.00 -0.71 2.55 0.87 -1.93 -2.94 113.55 111.39 1cf4 h SER 124 Ca 0.00 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.65 1cf4 h SER 124 Cb 0.09 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.00 1cf4 h SER 124 CO 0.00 0.12 0.47 0.74 -0.53 0.00 0.00 176.83 177.63 1cf4 h THR 125 N -0.22 0.93 -0.84 2.23 2.02 -1.91 0.83 112.91 115.95 1cf4 h THR 125 Ca 0.00 -0.21 0.07 0.00 0.77 0.00 0.00 66.41 67.05 1cf4 h THR 125 Cb 0.01 0.28 -0.07 0.00 -1.74 0.00 0.00 68.15 66.63 1cf4 h THR 125 CO 0.00 0.11 0.51 -0.29 0.37 0.00 0.00 175.52 176.22 1cf4 h ILE 126 N 0.60 0.99 -0.51 3.11 6.09 -1.62 0.81 117.51 126.98 1cf4 h ILE 126 Ca 0.33 -0.31 -0.01 0.00 -1.37 0.00 0.00 64.86 63.50 1cf4 h ILE 126 Cb 0.47 0.02 -0.03 0.00 0.47 0.00 0.00 36.82 37.75 1cf4 h ILE 126 CO -0.11 0.16 0.30 -0.33 -3.07 0.00 0.00 178.15 175.10 1cf4 h GLU 127 N 0.89 0.69 -0.12 2.19 5.08 -0.64 0.31 114.58 122.99 1cf4 h GLU 127 Ca 0.38 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.63 1cf4 h GLU 127 Cb 0.25 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1cf4 h GLU 127 CO -0.20 0.50 -0.16 0.87 -1.00 0.00 0.00 179.01 179.02 1cf4 h LYS 128 N 0.71 0.19 -0.10 2.33 6.56 -0.58 -1.25 116.57 124.43 1cf4 h LYS 128 Ca 0.18 -0.05 -0.18 0.00 -1.06 0.00 0.00 60.65 59.54 1cf4 h LYS 128 Cb -0.01 -0.03 -0.00 0.00 -0.57 0.00 0.00 32.23 31.62 1cf4 h LYS 128 CO -0.03 0.36 -0.71 -0.07 -2.06 0.00 0.00 179.45 176.94 1cf4 h LEU 129 N 0.18 0.55 -1.55 2.94 3.38 -0.32 -3.06 115.31 117.44 1cf4 h LEU 129 Ca 0.04 -0.35 0.35 0.00 0.09 0.00 0.00 57.88 58.01 1cf4 h LEU 129 Cb 0.39 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 40.89 1cf4 h LEU 129 CO 0.02 1.09 0.81 0.00 0.09 0.00 0.00 178.44 180.45 1cf4 h ALA 130 N 0.90 2.67 -1.13 1.53 0.00 0.15 1.45 119.26 124.83 1cf4 h ALA 130 Ca -0.03 0.05 0.32 0.00 0.00 0.00 0.00 54.91 55.25 1cf4 h ALA 130 Cb 1.28 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 19.10 1cf4 h ALA 130 CO 0.13 -1.13 0.78 0.87 0.00 0.00 0.00 179.25 179.89 1cf4 h LYS 131 N 0.19 0.16 0.00 0.00 1.79 -1.50 -3.05 116.57 114.16 1cf4 h LYS 131 Ca 0.68 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 59.14 1cf4 h LYS 131 Cb 2.12 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 32.73 1cf4 h LYS 131 CO -0.26 0.11 -0.84 0.09 -1.08 0.00 0.00 179.45 177.47 1cf4 n ASN 132 N -4.39 4.08 0.00 0.86 3.02 0.18 -5.08 115.26 113.92 1cf4 n ASN 132 Ca 0.26 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 1cf4 n ASN 132 Cb 1.11 0.37 0.00 0.00 -0.61 0.00 0.00 39.78 40.65 1cf4 n ASN 132 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1cf4 n LYS 133 N -1.83 0.00 0.00 3.52 4.76 0.44 -4.66 118.16 120.39 1cf4 n LYS 133 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1cf4 n LYS 133 Cb 0.42 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.61 1cf4 n LYS 133 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1cf4 n GLN 134 N 0.00 0.00 -2.07 1.97 10.64 -1.19 -3.91 117.38 122.82 1cf4 n GLN 134 Ca 0.00 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 54.74 1cf4 n GLN 134 Cb 0.00 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.35 1cf4 n GLN 134 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1cf4 s LYS 135 N 0.00 3.44 0.44 2.61 -0.14 -1.26 -4.82 119.74 120.02 1cf4 s LYS 135 Ca 0.00 1.39 -0.20 0.00 -1.36 0.00 0.00 55.97 55.80 1cf4 s LYS 135 Cb 0.00 -4.15 -0.10 0.00 -1.68 0.00 0.00 37.83 31.90 1cf4 s LYS 135 CO 0.00 -1.72 0.95 -1.25 -0.76 0.00 0.00 175.35 172.57 1cf4 s PRO 136 N 5.40 4.16 -0.83 -1.68 0.04 -1.26 -4.69 135.00 136.14 1cf4 s PRO 136 Ca 0.76 1.07 -0.25 0.00 0.04 0.00 0.00 61.00 62.62 1cf4 s PRO 136 Cb -0.22 -2.18 0.05 0.00 0.04 0.00 0.00 34.50 32.20 1cf4 s PRO 136 CO 0.33 -0.08 1.27 0.42 0.04 0.00 0.00 177.00 178.99 1cf4 s ILE 137 N -2.27 3.95 0.54 0.56 -1.09 -1.17 -5.00 121.20 116.71 1cf4 s ILE 137 Ca 0.61 -0.20 -0.19 0.00 -2.23 0.00 0.00 60.65 58.64 1cf4 s ILE 137 Cb -0.09 -4.92 -0.06 0.00 -1.58 0.00 0.00 42.46 35.81 1cf4 s ILE 137 CO 0.17 -1.80 1.09 0.42 -1.23 0.00 0.00 174.94 173.59 1cf4 s THR 138 N 5.03 3.46 0.39 2.92 -4.23 -1.26 -4.67 115.64 117.29 1cf4 s THR 138 Ca 0.36 0.86 0.22 0.00 -1.18 0.00 0.00 61.69 61.94 1cf4 s THR 138 Cb -0.07 -3.34 0.40 0.00 1.34 0.00 0.00 72.50 70.84 1cf4 s THR 138 CO 0.05 -0.25 1.66 -0.65 -0.54 0.00 0.00 174.62 174.89 1cf4 h PRO 139 N 1.11 0.21 -0.17 3.99 0.11 -1.97 1.03 132.00 136.31 1cf4 h PRO 139 Ca -0.49 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.50 1cf4 h PRO 139 Cb 1.24 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1cf4 h PRO 139 CO 0.57 0.14 -0.37 0.93 -0.21 0.00 0.00 178.00 179.07 1cf4 h GLU 140 N 0.22 0.37 0.79 1.05 5.08 -1.98 -2.44 114.58 117.67 1cf4 h GLU 140 Ca 0.75 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.91 1cf4 h GLU 140 Cb 2.03 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 31.28 1cf4 h GLU 140 CO -0.49 0.69 -0.38 1.15 -1.00 0.00 0.00 179.01 178.97 1cf4 h THR 141 N 0.31 0.00 -0.95 1.13 2.02 0.75 -1.98 112.91 114.20 1cf4 h THR 141 Ca 0.03 -0.17 0.16 0.00 0.77 0.00 0.00 66.41 67.21 1cf4 h THR 141 Cb 0.79 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.12 1cf4 h THR 141 CO 0.06 0.00 0.60 0.00 0.37 0.00 0.00 175.52 176.55 1cf4 h ALA 142 N -1.34 1.78 -0.33 6.16 0.00 -1.50 -0.83 119.26 123.20 1cf4 h ALA 142 Ca -0.11 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1cf4 h ALA 142 Cb 0.81 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1cf4 h ALA 142 CO 0.18 -0.07 0.21 1.49 0.00 0.00 0.00 179.25 181.06 1cf4 h GLU 143 N 0.73 0.42 -0.20 0.00 4.57 -1.33 0.62 114.58 119.39 1cf4 h GLU 143 Ca 0.50 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.65 1cf4 h GLU 143 Cb 0.78 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 1cf4 h GLU 143 CO -0.26 0.27 0.12 -0.22 -1.18 0.00 0.00 179.01 177.74 1cf4 h LYS 144 N 0.43 0.28 -0.34 1.92 3.64 -0.39 -1.43 116.57 120.68 1cf4 h LYS 144 Ca 0.12 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.37 1cf4 h LYS 144 Cb -0.04 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1cf4 h LYS 144 CO -0.04 0.26 -0.21 1.25 -2.27 0.00 0.00 179.45 178.44 1cf4 h LEU 145 N 0.23 0.64 0.43 5.20 5.85 -1.11 0.17 115.31 126.72 1cf4 h LEU 145 Ca 0.07 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1cf4 h LEU 145 Cb 0.05 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.91 1cf4 h LEU 145 CO -0.01 0.85 -0.21 0.00 -0.34 0.00 0.00 178.44 178.73 1cf4 h ALA 146 N 1.21 -0.58 0.00 1.25 0.00 0.57 -2.82 119.26 118.89 1cf4 h ALA 146 Ca 0.09 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1cf4 h ALA 146 Cb 0.67 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1cf4 h ALA 146 CO 0.05 -0.81 -0.45 0.00 0.00 0.00 0.00 179.25 178.03 1cf4 h ARG 147 N -0.60 0.00 -0.62 0.00 3.08 -1.25 -2.13 114.38 112.85 1cf4 h ARG 147 Ca -0.06 0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.11 1cf4 h ARG 147 Cb 0.46 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.42 1cf4 h ARG 147 CO 0.10 0.45 0.15 -0.44 -1.07 0.00 0.00 179.97 179.16 1cf4 h ASP 148 N 0.00 0.03 -0.39 7.04 5.19 -0.40 0.20 116.42 128.10 1cf4 h ASP 148 Ca -0.00 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.52 1cf4 h ASP 148 Cb 1.00 0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.66 1cf4 h ASP 148 CO 0.06 0.02 0.00 0.18 -3.12 0.00 0.00 179.24 176.38 1cf4 n LEU 149 N -5.11 4.14 -4.08 1.55 4.77 -1.13 -4.90 117.00 112.23 1cf4 n LEU 149 Ca 0.10 -2.10 -0.31 0.00 -0.03 0.00 0.00 56.01 53.66 1cf4 n LEU 149 Cb 0.34 -0.62 -0.02 0.00 -2.33 0.00 0.00 43.42 40.79 1cf4 n LEU 149 CO 0.17 0.51 -0.09 1.17 -1.33 0.00 0.00 177.39 177.82 1cf4 n LYS 150 N 0.44 -3.53 0.00 3.23 4.81 0.72 -4.92 118.16 118.91 1cf4 n LYS 150 Ca 0.19 0.41 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 1cf4 n LYS 150 Cb 0.87 -4.93 0.00 0.00 0.02 0.00 0.00 35.03 30.99 1cf4 n LYS 150 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1cf4 n ALA 151 N -4.43 0.00 -0.49 3.14 0.00 -0.80 -4.95 120.51 112.97 1cf4 n ALA 151 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1cf4 n ALA 151 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 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 -0.41 0.00 0.00 0.00 0.31 -1.20 -4.52 118.33 112.50 1cf4 n VAL 152 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1cf4 n VAL 152 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1cf4 n VAL 152 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1cf4 n LYS 153 N -1.75 0.00 -3.49 5.55 4.81 -1.26 -4.89 118.16 117.13 1cf4 n LYS 153 Ca 0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 1cf4 n LYS 153 Cb 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 34.95 1cf4 n LYS 153 CO 0.00 0.00 0.00 -0.47 1.17 0.00 0.00 177.40 178.10 1cf4 s TYR 154 N -0.97 3.23 0.35 5.64 5.04 -1.26 -3.83 117.35 125.55 1cf4 s TYR 154 Ca 0.00 -0.43 0.07 0.00 -2.44 0.00 0.00 57.07 54.27 1cf4 s TYR 154 Cb 0.00 -2.55 -0.01 0.00 0.35 0.00 0.00 41.96 39.75 1cf4 s TYR 154 CO 0.00 -0.49 0.45 0.08 -1.34 0.00 0.00 175.55 174.25 1cf4 s VAL 155 N 1.70 3.79 0.26 3.14 1.01 -1.26 -4.83 120.40 124.21 1cf4 s VAL 155 Ca 0.06 -1.07 -0.11 0.00 0.00 0.00 0.00 61.98 60.86 1cf4 s VAL 155 Cb -0.18 -3.30 -0.08 0.00 0.00 0.00 0.00 36.38 32.82 1cf4 s VAL 155 CO 0.10 -0.13 0.60 -1.61 0.00 0.00 0.00 175.10 174.06 1cf4 s GLU 156 N -4.17 3.85 0.00 2.72 0.41 -1.26 -3.10 118.70 117.15 1cf4 s GLU 156 Ca 0.46 0.37 0.00 0.00 -0.41 0.00 0.00 54.97 55.39 1cf4 s GLU 156 Cb -0.09 -2.59 0.00 0.00 -1.78 0.00 0.00 34.13 29.68 1cf4 s GLU 156 CO 0.31 0.27 0.00 0.00 -0.49 0.00 0.00 175.26 175.34 1cf4 s SER 158 N -0.30 -0.63 -0.09 0.00 0.15 -1.25 -3.60 113.70 107.97 1cf4 s SER 158 Ca 0.00 0.54 0.09 0.00 0.70 0.00 0.00 55.95 57.28 1cf4 s SER 158 Cb 0.00 0.55 -0.13 0.00 -1.71 0.00 0.00 66.02 64.73 1cf4 s SER 158 CO 0.00 -0.69 0.06 0.00 1.20 0.00 0.00 173.24 173.81 1cf4 n ALA 159 N 0.59 1.84 0.00 5.45 0.00 -1.26 -3.16 120.51 123.98 1cf4 n ALA 159 Ca -0.18 -0.62 -0.20 0.00 0.00 0.00 0.00 53.44 52.44 1cf4 n ALA 159 Cb 0.59 -0.02 -0.14 0.00 0.00 0.00 0.00 19.45 19.88 1cf4 n ALA 159 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1cf4 h LEU 160 N 0.00 0.33 0.00 0.00 4.07 -1.97 -3.38 115.31 114.36 1cf4 h LEU 160 Ca -0.24 -0.87 -0.16 0.00 0.08 0.00 0.00 57.88 56.70 1cf4 h LEU 160 Cb 1.47 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 43.08 1cf4 h LEU 160 CO 0.01 1.47 -2.06 0.35 -1.08 0.00 0.00 178.44 177.13 1cf4 n THR 161 N -4.11 0.65 -1.83 0.22 -2.24 -1.26 -5.05 114.28 100.66 1cf4 n THR 161 Ca -0.20 -0.66 -0.01 0.00 -2.27 0.00 0.00 64.05 60.91 1cf4 n THR 161 Cb 0.81 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 1cf4 n THR 161 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1cf4 n GLN 162 N -2.52 -0.48 -1.00 -0.78 7.27 -1.20 -4.94 117.38 113.74 1cf4 n GLN 162 Ca -0.15 0.83 -0.21 0.00 0.07 0.00 0.00 57.00 57.54 1cf4 n GLN 162 Cb 0.82 -2.48 0.10 0.00 2.41 0.00 0.00 30.24 31.09 1cf4 n GLN 162 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1cf4 n LYS 163 N -0.68 2.06 0.00 3.69 4.81 -1.19 -4.80 118.16 122.06 1cf4 n LYS 163 Ca 0.02 -2.32 0.00 0.00 -0.87 0.00 0.00 58.31 55.14 1cf4 n LYS 163 Cb 0.23 -1.91 0.00 0.00 0.02 0.00 0.00 35.03 33.37 1cf4 n LYS 163 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1cf4 n GLY 164 N -0.54 2.71 5.00 3.14 0.00 -1.26 -4.10 105.19 110.13 1cf4 n GLY 164 Ca 0.45 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1cf4 n GLY 164 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1cf4 n LEU 165 N 0.00 0.00 0.10 0.99 4.77 -1.26 -4.17 117.00 117.43 1cf4 n LEU 165 Ca 0.00 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.16 1cf4 n LEU 165 Cb 0.00 0.00 0.74 0.00 -2.33 0.00 0.00 43.42 41.83 1cf4 n LEU 165 CO 0.00 0.00 1.16 0.07 -1.33 0.00 0.00 177.39 177.29 1cf4 h LYS 166 N 0.00 0.00 0.00 3.23 5.09 -1.93 -2.62 116.57 120.35 1cf4 h LYS 166 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 1cf4 h LYS 166 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 1cf4 h LYS 166 CO 0.00 0.00 0.00 -1.71 -2.09 0.00 0.00 179.45 175.65 1cf4 n ASN 167 N -4.11 0.00 -0.20 7.07 4.05 -1.26 0.17 115.26 120.98 1cf4 n ASN 167 Ca 0.06 0.87 0.01 0.00 0.45 0.00 0.00 54.58 55.96 1cf4 n ASN 167 Cb 0.48 -0.37 0.11 0.00 1.23 0.00 0.00 39.78 41.23 1cf4 n ASN 167 CO 0.00 0.00 0.00 1.62 -3.05 0.00 0.00 177.26 175.83 1cf4 h VAL 168 N 0.00 0.70 -0.28 3.44 3.04 -1.70 0.49 116.25 121.93 1cf4 h VAL 168 Ca 0.00 -0.11 0.08 0.00 -1.01 0.00 0.00 66.70 65.66 1cf4 h VAL 168 Cb 0.00 0.34 -0.01 0.00 -2.01 0.00 0.00 31.29 29.61 1cf4 h VAL 168 CO 0.00 0.06 0.21 0.15 -1.01 0.00 0.00 177.57 176.98 1cf4 h PHE 169 N 0.33 0.00 0.00 3.17 3.57 -1.24 0.50 116.94 123.27 1cf4 h PHE 169 Ca 0.32 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.73 1cf4 h PHE 169 Cb 0.44 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 1cf4 h PHE 169 CO -0.21 0.00 -0.43 0.22 -2.23 0.00 0.00 178.31 175.66 1cf4 h ASP 170 N 0.00 0.00 1.25 0.41 3.58 0.66 -1.99 116.42 120.33 1cf4 h ASP 170 Ca 0.13 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.51 1cf4 h ASP 170 Cb 0.56 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 1cf4 h ASP 170 CO -0.00 0.43 -0.34 -0.33 -2.88 0.00 0.00 179.24 176.12 1cf4 h GLU 171 N 0.00 0.00 0.22 0.28 4.39 0.53 -2.33 114.58 117.67 1cf4 h GLU 171 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1cf4 h GLU 171 Cb 0.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1cf4 h GLU 171 CO 0.06 0.34 -0.11 0.00 -1.16 0.00 0.00 179.01 178.14 1cf4 h ALA 172 N 1.66 -0.30 -0.10 3.43 0.00 -0.66 -3.27 119.26 120.01 1cf4 h ALA 172 Ca -0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1cf4 h ALA 172 Cb 1.06 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1cf4 h ALA 172 CO 0.04 -0.39 -0.34 -0.84 0.00 0.00 0.00 179.25 177.72 1cf4 h ILE 173 N -0.85 1.27 -1.09 0.00 -2.65 -1.57 -2.80 117.51 109.82 1cf4 h ILE 173 Ca -0.03 -1.31 0.30 0.00 1.03 0.00 0.00 64.86 64.84 1cf4 h ILE 173 Cb 0.51 1.57 -0.07 0.00 -2.05 0.00 0.00 36.82 36.78 1cf4 h ILE 173 CO 0.05 0.39 0.74 0.25 0.03 0.00 0.00 178.15 179.61 1cf4 h LEU 174 N 0.18 0.25 -0.68 0.16 7.12 -1.47 1.55 115.31 122.42 1cf4 h LEU 174 Ca 0.02 0.05 -0.08 0.00 0.13 0.00 0.00 57.88 58.00 1cf4 h LEU 174 Cb 0.69 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.82 1cf4 h LEU 174 CO 0.05 0.04 -0.37 0.00 -0.13 0.00 0.00 178.44 178.03 1cf4 h ALA 175 N 1.54 0.90 0.01 1.25 0.00 -1.56 -3.15 119.26 118.25 1cf4 h ALA 175 Ca 0.58 -0.34 -0.36 0.00 0.00 0.00 0.00 54.91 54.79 1cf4 h ALA 175 Cb 1.82 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.49 1cf4 h ALA 175 CO -0.18 0.47 -2.24 0.00 0.00 0.00 0.00 179.25 177.31 1cf4 n ALA 176 N -2.25 1.45 0.41 0.00 0.00 0.38 -4.19 120.51 116.31 1cf4 n ALA 176 Ca 0.01 -1.13 0.08 0.00 0.00 0.00 0.00 53.44 52.39 1cf4 n ALA 176 Cb 0.56 -0.34 0.33 0.00 0.00 0.00 0.00 19.45 20.00 1cf4 n ALA 176 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1cf4 n LEU 177 N -2.95 0.17 0.00 0.00 4.77 0.44 -4.82 117.00 114.60 1cf4 n LEU 177 Ca -0.32 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1cf4 n LEU 177 Cb 1.10 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1cf4 n LEU 177 CO 0.40 -0.37 0.00 1.21 -1.33 0.00 0.00 177.39 177.30 1cf4 n GLU 178 N -1.70 0.00 -1.44 3.23 2.13 -1.19 -4.96 120.64 116.71 1cf4 n GLU 178 Ca 0.03 0.00 -0.47 0.00 0.66 0.00 0.00 57.16 57.37 1cf4 n GLU 178 Cb 0.16 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 31.78 1cf4 n GLU 178 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1cf4 n PRO 179 N -0.35 0.56 -1.23 5.31 -0.02 -1.26 -4.36 135.00 133.65 1cf4 n PRO 179 Ca 0.00 0.10 -0.29 0.00 -2.02 0.00 0.00 63.50 61.30 1cf4 n PRO 179 Cb 0.00 -2.17 0.19 0.00 -0.02 0.00 0.00 33.50 31.50 1cf4 n PRO 179 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1cf4 s PRO 180 N 7.31 0.14 -0.05 0.52 0.04 -1.26 -5.06 135.00 136.64 1cf4 s PRO 180 Ca 1.17 0.31 -0.02 0.00 0.04 0.00 0.00 61.00 62.50 1cf4 s PRO 180 Cb -0.98 -1.72 0.03 0.00 0.04 0.00 0.00 34.50 31.87 1cf4 s PRO 180 CO 0.48 -2.88 0.10 -1.21 0.04 0.00 0.00 177.00 173.53 1cf4 s GLU 181 N -5.14 0.04 0.00 4.56 2.02 -1.26 -5.12 118.70 113.80 1cf4 s GLU 181 Ca 0.67 0.29 0.00 0.00 0.02 0.00 0.00 54.97 55.94 1cf4 s GLU 181 Cb -0.16 -0.19 0.00 0.00 0.10 0.00 0.00 34.13 33.88 1cf4 s GLU 181 CO 0.56 -0.16 0.00 -0.35 0.02 0.00 0.00 175.26 175.34 1cf4 n PRO 182 N 4.12 0.20 -2.37 0.39 -0.04 -1.26 -4.87 135.00 131.17 1cf4 n PRO 182 Ca -0.26 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.80 1cf4 n PRO 182 Cb 0.52 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.96 1cf4 n PRO 182 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1cf4 n LYS 183 N -0.65 2.82 0.00 0.54 4.76 -1.26 -5.25 118.16 119.12 1cf4 n LYS 183 Ca 0.00 -3.03 0.04 0.00 -2.87 0.00 0.00 58.31 52.45 1cf4 n LYS 183 Cb 0.00 -3.51 0.03 0.00 -1.84 0.00 0.00 35.03 29.71 1cf4 n LYS 183 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66