#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cf4 n GLN 2 N 0.00 -4.82 -0.28 3.17 7.27 -1.26 -4.64 117.38 116.82 1cf4 n GLN 2 Ca 0.00 3.51 0.00 0.00 0.07 0.00 0.00 57.00 60.58 1cf4 n GLN 2 Cb 0.00 -3.89 0.00 0.00 2.41 0.00 0.00 30.24 28.76 1cf4 n GLN 2 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 1cf4 n THR 3 N 0.07 0.00 -3.71 1.69 -1.04 -1.26 -4.93 114.28 105.10 1cf4 n THR 3 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 1cf4 n THR 3 Cb 0.00 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 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 -0.52 0.04 -0.09 12.58 -0.00 -1.26 -4.39 121.20 127.55 1cf4 s ILE 4 Ca 0.00 -0.73 0.00 0.00 -0.00 0.00 0.00 60.65 59.92 1cf4 s ILE 4 Cb 0.00 -1.47 -0.03 0.00 -0.00 0.00 0.00 42.46 40.97 1cf4 s ILE 4 CO 0.00 -0.17 -0.08 -0.54 -0.00 0.00 0.00 174.94 174.15 1cf4 s LYS 5 N -3.86 2.98 -0.09 0.37 1.02 -1.26 -4.64 119.74 114.26 1cf4 s LYS 5 Ca 0.08 -0.59 -0.01 0.00 0.02 0.00 0.00 55.97 55.47 1cf4 s LYS 5 Cb -0.00 -2.63 -0.03 0.00 -0.52 0.00 0.00 37.83 34.65 1cf4 s LYS 5 CO -0.05 0.51 -0.03 0.00 -0.92 0.00 0.00 175.35 174.86 1cf4 s VAL 7 N -0.70 0.09 -0.04 0.00 1.01 -1.26 -2.47 120.40 117.03 1cf4 s VAL 7 Ca 0.11 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1cf4 s VAL 7 Cb -0.12 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1cf4 s VAL 7 CO 0.02 -0.43 0.12 0.68 0.00 0.00 0.00 175.10 175.49 1cf4 s VAL 8 N -3.83 -0.00 -0.06 2.92 -7.23 -1.26 -3.24 120.40 107.70 1cf4 s VAL 8 Ca 0.04 0.00 -0.03 0.00 -1.81 0.00 0.00 61.98 60.19 1cf4 s VAL 8 Cb 0.03 -0.17 0.04 0.00 0.56 0.00 0.00 36.38 36.83 1cf4 s VAL 8 CO -0.11 0.00 0.14 0.68 -0.31 0.00 0.00 175.10 175.50 1cf4 s VAL 9 N 0.07 -0.04 0.00 1.32 -7.23 -1.25 -4.94 120.40 108.32 1cf4 s VAL 9 Ca -0.00 0.16 0.00 0.00 -1.81 0.00 0.00 61.98 60.33 1cf4 s VAL 9 Cb -0.01 -0.22 0.00 0.00 0.56 0.00 0.00 36.38 36.71 1cf4 s VAL 9 CO 0.00 0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 1cf4 n GLY 10 N 4.09 0.94 0.11 2.32 0.00 -1.26 -4.16 105.19 107.23 1cf4 n GLY 10 Ca -0.25 -0.93 0.04 0.00 0.00 0.00 0.00 46.02 44.88 1cf4 n GLY 10 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1cf4 h ASP 11 N 0.00 0.00 -3.00 1.61 1.82 -1.96 -3.48 116.42 111.42 1cf4 h ASP 11 Ca 0.00 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 56.06 1cf4 h ASP 11 Cb 0.00 0.00 0.17 0.00 0.68 0.00 0.00 39.33 40.18 1cf4 h ASP 11 CO 0.00 0.39 -0.39 0.61 -1.61 0.00 0.00 179.24 178.23 1cf4 n GLY 12 N 1.29 -1.50 0.09 -0.78 0.00 -1.25 -4.76 105.19 98.28 1cf4 n GLY 12 Ca -0.04 -0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.79 0.63 0.00 4.61 0.00 -1.26 -4.72 120.51 117.98 1cf4 n ALA 13 Ca 0.11 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1cf4 n ALA 13 Cb 0.48 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.78 1cf4 n ALA 13 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1cf4 n VAL 14 N -4.53 0.00 0.00 0.00 0.24 -1.26 -4.95 118.33 107.83 1cf4 n VAL 14 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1cf4 n VAL 14 Cb 0.45 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 1cf4 n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1cf4 n GLY 15 N 0.00 2.07 0.12 7.63 0.00 -1.26 -4.52 105.19 109.23 1cf4 n GLY 15 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1cf4 n GLY 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1cf4 n LYS 16 N -0.97 0.57 0.00 1.61 3.00 -1.26 -4.55 118.16 116.56 1cf4 n LYS 16 Ca 0.00 0.47 0.00 0.00 -0.00 0.00 0.00 58.31 58.78 1cf4 n LYS 16 Cb 0.00 -1.66 0.00 0.00 0.00 0.00 0.00 35.03 33.37 1cf4 n LYS 16 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1cf4 n THR 17 N -4.37 0.00 0.00 3.15 5.66 -1.26 -4.24 114.28 113.22 1cf4 n THR 17 Ca -0.40 0.44 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 1cf4 n THR 17 Cb 0.75 -1.43 0.00 0.00 -1.55 0.00 0.00 70.33 68.11 1cf4 n THR 17 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1cf4 h LEU 19 N 0.00 0.58 -0.45 0.00 4.07 -1.86 1.23 115.31 118.87 1cf4 h LEU 19 Ca 0.00 0.14 -0.02 0.00 0.08 0.00 0.00 57.88 58.08 1cf4 h LEU 19 Cb 0.00 0.06 -0.00 0.00 1.08 0.00 0.00 40.66 41.79 1cf4 h LEU 19 CO 0.00 0.03 -0.07 -0.07 -1.08 0.00 0.00 178.44 177.25 1cf4 h LEU 20 N 0.47 0.00 0.03 1.67 -0.00 -0.53 -2.56 115.31 114.39 1cf4 h LEU 20 Ca 0.67 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 58.54 1cf4 h LEU 20 Cb 1.44 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.10 1cf4 h LEU 20 CO -0.47 0.07 -0.02 0.40 -0.00 0.00 0.00 178.44 178.42 1cf4 h ILE 21 N 0.00 0.00 -0.54 1.22 1.08 1.19 -0.15 117.51 120.30 1cf4 h ILE 21 Ca -0.00 -0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.56 1cf4 h ILE 21 Cb 0.90 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.62 1cf4 h ILE 21 CO 0.01 0.00 0.37 0.28 -0.69 0.00 0.00 178.15 178.12 1cf4 h SER 22 N -0.05 0.30 0.12 1.72 0.02 -1.62 1.54 113.55 115.58 1cf4 h SER 22 Ca -0.00 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1cf4 h SER 22 Cb 0.04 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 1cf4 h SER 22 CO 0.01 0.18 -0.08 0.22 -1.14 0.00 0.00 176.83 176.02 1cf4 h TYR 23 N 0.34 -0.22 0.02 3.45 3.20 -1.29 -3.34 116.97 119.13 1cf4 h TYR 23 Ca 0.25 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.01 1cf4 h TYR 23 Cb 0.54 0.08 0.01 0.00 1.54 0.00 0.00 36.73 38.90 1cf4 h TYR 23 CO -0.00 -0.12 -0.45 1.15 -1.64 0.00 0.00 178.16 177.10 1cf4 h THR 24 N -0.19 1.51 -1.58 1.81 2.02 -0.86 -3.47 112.91 112.16 1cf4 h THR 24 Ca -0.02 -2.10 0.00 0.00 0.77 0.00 0.00 66.41 65.06 1cf4 h THR 24 Cb 0.15 2.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1cf4 h THR 24 CO 0.01 0.59 0.00 0.35 0.37 0.00 0.00 175.52 176.84 1cf4 n THR 25 N -4.35 0.00 -2.04 3.16 -2.24 0.53 -5.07 114.28 104.27 1cf4 n THR 25 Ca -0.11 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1cf4 n THR 25 Cb 0.61 -0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 68.01 1cf4 n THR 25 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1cf4 n ASN 26 N 0.00 -0.22 -4.21 3.42 2.04 -1.25 -4.37 115.26 110.68 1cf4 n ASN 26 Ca 0.00 -1.51 -0.40 0.00 -0.44 0.00 0.00 54.58 52.22 1cf4 n ASN 26 Cb 0.00 0.04 -0.09 0.00 -2.53 0.00 0.00 39.78 37.20 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 0.00 2.44 -0.07 -3.83 3.01 -1.26 -4.94 119.74 115.10 1cf4 s LYS 27 Ca 0.03 -1.76 -0.04 0.00 -1.01 0.00 0.00 55.97 53.19 1cf4 s LYS 27 Cb 0.03 -3.89 -0.01 0.00 -1.01 0.00 0.00 37.83 32.95 1cf4 s LYS 27 CO -0.01 -1.18 -0.07 0.35 0.51 0.00 0.00 175.35 174.95 1cf4 h PHE 28 N 8.42 0.00 -0.18 3.18 3.57 -1.97 -3.40 116.94 126.57 1cf4 h PHE 28 Ca -0.21 0.00 -0.42 0.00 3.53 0.00 0.00 57.97 60.87 1cf4 h PHE 28 Cb 1.07 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.76 1cf4 h PHE 28 CO 0.63 0.00 1.35 -0.35 -2.23 0.00 0.00 178.31 177.71 1cf4 n PRO 29 N -3.44 2.81 0.00 6.41 -0.04 -1.26 -4.54 135.00 134.94 1cf4 n PRO 29 Ca -0.03 -1.71 0.00 0.00 -0.04 0.00 0.00 63.50 61.72 1cf4 n PRO 29 Cb 0.10 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 1cf4 n PRO 29 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1cf4 n SER 30 N 2.67 0.00 -3.69 3.54 3.41 -1.26 -5.07 113.62 113.21 1cf4 n SER 30 Ca 0.57 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 59.07 1cf4 n SER 30 Cb 0.60 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.43 1cf4 n SER 30 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1cf4 s GLU 31 N 0.00 0.29 -0.66 4.33 2.02 -1.26 -5.10 118.70 118.31 1cf4 s GLU 31 Ca 0.00 0.76 -0.10 0.00 0.02 0.00 0.00 54.97 55.65 1cf4 s GLU 31 Cb 0.00 0.01 0.17 0.00 0.10 0.00 0.00 34.13 34.41 1cf4 s GLU 31 CO 0.00 -0.20 0.55 0.71 0.02 0.00 0.00 175.26 176.35 1cf4 s TYR 32 N 1.76 3.54 0.19 1.61 1.51 -1.26 -4.66 117.35 120.03 1cf4 s TYR 32 Ca -0.06 -2.11 0.00 0.00 -1.01 0.00 0.00 57.07 53.88 1cf4 s TYR 32 Cb -0.10 -3.57 0.00 0.00 -0.11 0.00 0.00 41.96 38.18 1cf4 s TYR 32 CO -0.11 -0.95 0.00 1.33 -1.11 0.00 0.00 175.55 174.71 1cf4 n VAL 33 N 4.16 0.00 -0.65 0.71 0.24 -1.26 -5.00 118.33 116.53 1cf4 n VAL 33 Ca 0.05 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.18 1cf4 n VAL 33 Cb 0.42 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.75 1cf4 n VAL 33 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1cf4 n PRO 34 N -2.83 1.70 -0.47 7.34 -0.04 -1.26 -4.13 135.00 135.30 1cf4 n PRO 34 Ca 0.00 -1.13 0.07 0.00 -0.04 0.00 0.00 63.50 62.40 1cf4 n PRO 34 Cb 0.00 -2.21 0.17 0.00 -0.04 0.00 0.00 33.50 31.42 1cf4 n PRO 34 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1cf4 n THR 35 N 3.74 1.91 1.42 0.52 5.66 -1.26 -4.69 114.28 121.58 1cf4 n THR 35 Ca 0.36 -2.70 0.15 0.00 -3.05 0.00 0.00 64.05 58.81 1cf4 n THR 35 Cb 0.25 -0.15 0.75 0.00 -1.55 0.00 0.00 70.33 69.62 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 -1.10 0.00 -0.48 1.08 0.31 -1.26 -3.49 118.33 113.39 1cf4 n VAL 36 Ca 0.17 -0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.40 1cf4 n VAL 36 Cb 0.70 -0.46 0.18 0.00 -0.91 0.00 0.00 33.84 33.35 1cf4 n VAL 36 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 1cf4 n PHE 37 N -1.26 1.92 0.30 3.52 -1.74 -1.26 -4.31 117.46 114.62 1cf4 n PHE 37 Ca 0.14 -1.12 0.17 0.00 -0.56 0.00 0.00 57.45 56.08 1cf4 n PHE 37 Cb 0.24 -0.62 0.66 0.00 1.52 0.00 0.00 39.48 41.28 1cf4 n PHE 37 CO 0.00 0.00 0.00 0.38 -0.56 0.00 0.00 176.76 176.58 1cf4 h ASP 38 N 1.43 0.00 -0.73 5.98 3.04 -1.93 -2.47 116.42 121.75 1cf4 h ASP 38 Ca 0.29 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.08 1cf4 h ASP 38 Cb 2.05 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.34 1cf4 h ASP 38 CO 0.63 0.00 0.00 -3.20 -2.04 0.00 0.00 179.24 174.63 1cf4 n ASN 39 N -2.97 4.19 -3.97 4.15 5.15 -1.26 -4.57 115.26 115.98 1cf4 n ASN 39 Ca 0.01 -2.11 0.00 0.00 -0.60 0.00 0.00 54.58 51.88 1cf4 n ASN 39 Cb 0.30 -0.52 0.00 0.00 -0.53 0.00 0.00 39.78 39.03 1cf4 n ASN 39 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1cf4 n TYR 40 N 1.56 -0.91 -4.39 1.20 9.36 -0.93 -4.93 117.16 118.12 1cf4 n TYR 40 Ca 0.25 0.00 -0.26 0.00 3.32 0.00 0.00 57.90 61.21 1cf4 n TYR 40 Cb 0.69 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 39.30 1cf4 n TYR 40 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1cf4 s ALA 41 N -2.07 2.76 -0.04 2.98 0.00 -1.26 -4.81 121.76 119.32 1cf4 s ALA 41 Ca 0.00 -1.66 -0.01 0.00 0.00 0.00 0.00 51.96 50.29 1cf4 s ALA 41 Cb 0.00 -0.46 0.03 0.00 0.00 0.00 0.00 23.12 22.69 1cf4 s ALA 41 CO 0.00 0.39 0.06 0.14 0.00 0.00 0.00 175.76 176.35 1cf4 s VAL 42 N -1.95 -0.09 -0.58 0.00 -7.23 -1.26 -5.11 120.40 104.18 1cf4 s VAL 42 Ca 0.25 0.29 -0.24 0.00 -1.81 0.00 0.00 61.98 60.47 1cf4 s VAL 42 Cb -0.07 -0.13 0.04 0.00 0.56 0.00 0.00 36.38 36.78 1cf4 s VAL 42 CO 0.13 0.12 0.99 0.28 -0.31 0.00 0.00 175.10 176.32 1cf4 s THR 43 N 1.52 4.29 0.02 5.32 -1.32 -1.26 -4.73 115.64 119.48 1cf4 s THR 43 Ca -0.04 0.25 -0.27 0.00 -1.21 0.00 0.00 61.69 60.42 1cf4 s THR 43 Cb -0.12 -4.61 0.09 0.00 -1.51 0.00 0.00 72.50 66.35 1cf4 s THR 43 CO -0.03 -1.24 0.80 -0.69 -2.21 0.00 0.00 174.62 171.24 1cf4 s VAL 44 N 4.20 0.00 -0.23 5.08 1.01 -1.26 -5.12 120.40 124.08 1cf4 s VAL 44 Ca 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 62.25 1cf4 s VAL 44 Cb -0.12 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.26 1cf4 s VAL 44 CO 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 175.10 175.23 1cf4 s MET 45 N -2.93 3.24 -1.11 2.72 0.23 -1.26 -3.20 119.30 117.00 1cf4 s MET 45 Ca 0.02 -0.71 -0.21 0.00 -1.03 0.00 0.00 55.69 53.75 1cf4 s MET 45 Cb -0.01 -3.00 0.05 0.00 -1.53 0.00 0.00 34.83 30.34 1cf4 s MET 45 CO -0.07 -0.25 1.56 0.42 -2.03 0.00 0.00 175.02 174.64 1cf4 s ILE 46 N 1.44 3.97 0.00 3.16 -1.09 -0.95 -4.80 121.20 122.93 1cf4 s ILE 46 Ca 0.05 -1.11 0.00 0.00 -2.23 0.00 0.00 60.65 57.36 1cf4 s ILE 46 Cb -0.15 -5.07 0.00 0.00 -1.58 0.00 0.00 42.46 35.66 1cf4 s ILE 46 CO -0.04 -1.93 0.00 0.61 -1.23 0.00 0.00 174.94 172.35 1cf4 n GLY 47 N 6.42 0.00 0.00 6.18 0.00 -1.26 -4.14 105.19 112.39 1cf4 n GLY 47 Ca 0.38 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.77 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 -1.98 3.62 -0.02 0.00 -1.26 -4.95 105.19 100.60 1cf4 n GLY 48 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 2.08 -0.69 1.61 -1.05 -1.26 -5.01 118.70 114.38 1cf4 s GLU 49 Ca 0.00 -1.71 -0.28 0.00 -0.15 0.00 0.00 54.97 52.83 1cf4 s GLU 49 Cb 0.00 -1.95 -0.13 0.00 -0.44 0.00 0.00 34.13 31.61 1cf4 s GLU 49 CO 0.00 0.18 2.52 -2.30 0.95 0.00 0.00 175.26 176.61 1cf4 n PRO 50 N -0.92 0.62 -3.32 -4.83 -0.02 -1.26 -3.57 135.00 121.70 1cf4 n PRO 50 Ca -0.04 0.01 0.02 0.00 -2.02 0.00 0.00 63.50 61.47 1cf4 n PRO 50 Cb 0.62 -2.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.43 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 10.78 -0.54 -0.06 6.00 6.14 -1.19 -4.93 117.35 133.54 1cf4 s TYR 51 Ca 1.14 0.88 0.03 0.00 0.64 0.00 0.00 57.07 59.76 1cf4 s TYR 51 Cb -0.64 0.30 -0.02 0.00 0.42 0.00 0.00 41.96 42.02 1cf4 s TYR 51 CO 0.36 -0.27 -0.14 0.95 0.64 0.00 0.00 175.55 177.09 1cf4 s THR 52 N 2.43 3.09 -0.38 4.34 -4.23 -1.23 -2.23 115.64 117.43 1cf4 s THR 52 Ca -0.01 -0.70 -0.28 0.00 -1.18 0.00 0.00 61.69 59.51 1cf4 s THR 52 Cb -0.06 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.55 1cf4 s THR 52 CO -0.16 0.58 1.66 -1.48 -0.54 0.00 0.00 174.62 174.68 1cf4 s LEU 53 N -0.59 3.51 -0.66 4.79 2.34 -1.26 -4.90 118.68 121.91 1cf4 s LEU 53 Ca 0.08 1.05 -0.26 0.00 0.06 0.00 0.00 54.13 55.06 1cf4 s LEU 53 Cb -0.11 -3.44 -0.10 0.00 -0.56 0.00 0.00 46.19 41.98 1cf4 s LEU 53 CO 0.01 -1.66 2.36 -0.83 -1.06 0.00 0.00 176.35 175.16 1cf4 s GLY 54 N 5.46 -0.56 -0.48 -3.48 0.00 -1.26 -4.82 107.32 102.18 1cf4 s GLY 54 Ca 0.72 -0.49 -0.43 0.00 0.00 0.00 0.00 44.72 44.52 1cf4 s GLY 54 CO 0.32 4.11 2.10 1.04 0.00 0.00 0.00 173.10 180.67 1cf4 n LEU 55 N 16.98 0.99 -4.54 0.66 7.99 -1.26 -4.81 117.00 133.01 1cf4 n LEU 55 Ca 0.41 0.69 -0.42 0.00 -0.01 0.00 0.00 56.01 56.68 1cf4 n LEU 55 Cb 0.49 -0.95 -0.03 0.00 -0.11 0.00 0.00 43.42 42.81 1cf4 n LEU 55 CO 0.62 -0.76 0.90 0.12 -1.51 0.00 0.00 177.39 176.76 1cf4 s PHE 56 N 5.90 2.67 0.35 -1.77 5.36 -1.03 -4.20 117.98 125.26 1cf4 s PHE 56 Ca 1.17 0.09 0.03 0.00 -0.96 0.00 0.00 56.93 57.27 1cf4 s PHE 56 Cb -1.41 -4.29 -0.04 0.00 -0.34 0.00 0.00 43.02 36.94 1cf4 s PHE 56 CO 0.65 -1.52 0.12 -0.51 -1.46 0.00 0.00 175.22 172.50 1cf4 s ASP 57 N 3.02 2.25 -0.04 6.13 1.01 -1.26 -4.18 116.67 123.60 1cf4 s ASP 57 Ca 0.34 -1.56 -0.07 0.00 0.71 0.00 0.00 52.55 51.97 1cf4 s ASP 57 Cb -0.11 0.33 0.01 0.00 1.01 0.00 0.00 42.92 44.17 1cf4 s ASP 57 CO 0.20 -0.84 0.16 0.42 0.21 0.00 0.00 175.17 175.32 1cf4 s THR 58 N -3.37 0.03 -0.04 -1.27 -4.23 -1.26 -4.77 115.64 100.73 1cf4 s THR 58 Ca 0.31 -0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 60.53 1cf4 s THR 58 Cb 0.05 -0.32 0.03 0.00 1.34 0.00 0.00 72.50 73.60 1cf4 s THR 58 CO 0.16 -0.15 0.06 0.00 -0.54 0.00 0.00 174.62 174.15 1cf4 s ALA 59 N -0.49 0.08 -1.19 3.99 0.00 -1.26 -5.04 121.76 117.84 1cf4 s ALA 59 Ca -0.06 0.33 -0.14 0.00 0.00 0.00 0.00 51.96 52.09 1cf4 s ALA 59 Cb -0.04 -0.46 -0.06 0.00 0.00 0.00 0.00 23.12 22.57 1cf4 s ALA 59 CO 0.01 -0.29 2.26 0.41 0.00 0.00 0.00 175.76 178.15 1cf4 n GLY 60 N 4.70 3.62 2.62 0.00 0.00 -1.26 -4.39 105.19 110.47 1cf4 n GLY 60 Ca -0.17 -1.34 -0.23 0.00 0.00 0.00 0.00 46.02 44.28 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 5.65 0.00 -0.21 0.99 7.99 -1.09 -4.94 117.00 125.39 1cf4 n LEU 61 Ca 0.55 -2.31 0.01 0.00 -0.01 0.00 0.00 56.01 54.25 1cf4 n LEU 61 Cb 0.31 0.32 0.12 0.00 -0.11 0.00 0.00 43.42 44.06 1cf4 n LEU 61 CO 0.90 -0.33 0.96 -0.33 -1.51 0.00 0.00 177.39 177.08 1cf4 h GLU 62 N 0.00 0.35 -0.99 3.23 4.39 -1.99 -0.25 114.58 119.32 1cf4 h GLU 62 Ca -0.30 -0.02 0.21 0.00 0.34 0.00 0.00 59.36 59.60 1cf4 h GLU 62 Cb 0.92 -0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 29.40 1cf4 h GLU 62 CO 0.49 0.23 0.62 -0.44 -1.16 0.00 0.00 179.01 178.75 1cf4 h ASP 63 N 0.36 0.62 -2.30 1.42 5.19 -1.96 -3.34 116.42 116.40 1cf4 h ASP 63 Ca 0.32 0.08 -0.41 0.00 -0.62 0.00 0.00 57.03 56.41 1cf4 h ASP 63 Cb 0.44 -0.02 -0.35 0.00 0.18 0.00 0.00 39.33 39.58 1cf4 h ASP 63 CO -0.35 0.19 -0.70 -0.31 -3.12 0.00 0.00 179.24 174.95 1cf4 s TYR 64 N -5.67 -0.14 -0.04 4.55 2.02 -0.14 -5.00 117.35 112.94 1cf4 s TYR 64 Ca -0.10 -0.60 -0.05 0.00 -0.37 0.00 0.00 57.07 55.94 1cf4 s TYR 64 Cb 0.25 -0.59 -0.28 0.00 -0.40 0.00 0.00 41.96 40.93 1cf4 s TYR 64 CO 0.80 -0.90 0.70 0.38 -1.57 0.00 0.00 175.55 174.96 1cf4 h ASP 65 N 7.94 0.45 -0.30 2.29 3.04 -1.60 -2.89 116.42 125.35 1cf4 h ASP 65 Ca -0.09 -0.71 0.00 0.00 -3.24 0.00 0.00 57.03 52.99 1cf4 h ASP 65 Cb 1.05 -0.15 0.00 0.00 -1.04 0.00 0.00 39.33 39.19 1cf4 h ASP 65 CO 0.32 1.61 0.00 -2.11 -2.04 0.00 0.00 179.24 177.02 1cf4 n ARG 66 N -3.48 2.31 -1.85 4.15 -4.01 -1.26 -4.91 116.66 107.61 1cf4 n ARG 66 Ca -0.22 -1.97 -0.42 0.00 -1.04 0.00 0.00 57.85 54.20 1cf4 n ARG 66 Cb 1.06 -1.48 -0.02 0.00 -3.04 0.00 0.00 32.46 28.97 1cf4 n ARG 66 CO 0.00 0.00 0.00 -1.17 -3.04 0.00 0.00 177.63 173.42 1cf4 s LEU 67 N -1.57 4.36 -0.34 2.89 0.20 -1.26 -4.91 118.68 118.05 1cf4 s LEU 67 Ca 0.36 2.83 0.04 0.00 0.69 0.00 0.00 54.13 58.05 1cf4 s LEU 67 Cb 0.21 -3.62 0.33 0.00 -0.43 0.00 0.00 46.19 42.68 1cf4 s LEU 67 CO 0.30 -0.86 1.37 -2.11 -0.29 0.00 0.00 176.35 174.77 1cf4 n ARG 68 N 2.72 0.26 0.22 1.98 1.85 -1.26 -4.87 116.66 117.57 1cf4 n ARG 68 Ca 0.10 -0.87 0.10 0.00 -1.00 0.00 0.00 57.85 56.18 1cf4 n ARG 68 Cb 0.38 -0.27 0.40 0.00 -1.05 0.00 0.00 32.46 31.93 1cf4 n ARG 68 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 1cf4 h PRO 69 N 2.26 0.00 -0.00 2.89 0.13 -1.96 -3.05 132.00 132.27 1cf4 h PRO 69 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1cf4 h PRO 69 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1cf4 h PRO 69 CO 0.01 0.21 0.04 1.37 -0.23 0.00 0.00 178.00 179.40 1cf4 h LEU 70 N 0.00 0.00 -0.85 1.56 8.10 -1.96 -2.49 115.31 119.67 1cf4 h LEU 70 Ca -0.00 0.00 0.17 0.00 0.11 0.00 0.00 57.88 58.16 1cf4 h LEU 70 Cb 0.82 0.00 -0.10 0.00 -0.44 0.00 0.00 40.66 40.94 1cf4 h LEU 70 CO 0.03 0.00 0.40 0.77 -4.11 0.00 0.00 178.44 175.53 1cf4 h SER 71 N 0.00 0.42 0.00 0.17 4.64 -1.94 -3.36 113.55 113.49 1cf4 h SER 71 Ca 0.00 0.11 -0.21 0.00 -0.47 0.00 0.00 61.79 61.22 1cf4 h SER 71 Cb 0.08 0.06 -0.14 0.00 -0.31 0.00 0.00 62.40 62.09 1cf4 h SER 71 CO -0.00 0.13 -0.47 0.00 -0.87 0.00 0.00 176.83 175.62 1cf4 n TYR 72 N -4.95 -3.24 -2.56 4.77 4.19 -0.96 -4.77 117.16 109.65 1cf4 n TYR 72 Ca 0.18 -1.71 -0.34 0.00 3.31 0.00 0.00 57.90 59.34 1cf4 n TYR 72 Cb 0.50 1.55 -0.04 0.00 0.49 0.00 0.00 39.34 41.84 1cf4 n TYR 72 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1cf4 s PRO 73 N 0.67 3.86 -0.01 2.98 0.04 -1.10 -4.97 135.00 136.47 1cf4 s PRO 73 Ca 0.32 1.37 0.21 0.00 0.04 0.00 0.00 61.00 62.93 1cf4 s PRO 73 Cb 0.23 -2.14 0.62 0.00 0.04 0.00 0.00 34.50 33.24 1cf4 s PRO 73 CO -0.24 -0.38 1.52 0.94 0.04 0.00 0.00 177.00 178.87 1cf4 n GLN 74 N -0.86 2.84 -0.61 4.56 0.00 -1.26 -4.80 117.38 117.25 1cf4 n GLN 74 Ca 0.09 -2.63 -0.22 0.00 -0.00 0.00 0.00 57.00 54.24 1cf4 n GLN 74 Cb 0.52 -1.57 0.14 0.00 0.00 0.00 0.00 30.24 29.33 1cf4 n GLN 74 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 1cf4 n THR 75 N 1.48 0.00 -0.03 1.69 5.66 -1.26 -4.96 114.28 116.86 1cf4 n THR 75 Ca 0.23 -0.09 0.01 0.00 -3.05 0.00 0.00 64.05 61.16 1cf4 n THR 75 Cb 0.63 -0.45 -0.09 0.00 -1.55 0.00 0.00 70.33 68.87 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 -0.73 2.35 -4.03 1.09 2.03 -1.26 -5.01 116.55 110.99 1cf4 n ASP 76 Ca 0.04 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.18 1cf4 n ASP 76 Cb 0.43 1.21 -0.14 0.00 -0.72 0.00 0.00 41.12 41.90 1cf4 n ASP 76 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1cf4 s VAL 77 N -2.58 0.63 0.40 5.18 0.11 -1.26 -4.39 120.40 118.49 1cf4 s VAL 77 Ca -0.05 -0.60 0.04 0.00 -2.93 0.00 0.00 61.98 58.44 1cf4 s VAL 77 Cb 0.06 -0.58 -0.04 0.00 -1.53 0.00 0.00 36.38 34.28 1cf4 s VAL 77 CO 0.47 0.00 0.06 -0.36 -3.33 0.00 0.00 175.10 171.94 1cf4 s PHE 78 N -0.57 1.96 -0.22 1.54 0.40 -1.15 -4.49 117.98 115.45 1cf4 s PHE 78 Ca -0.01 -1.03 -0.03 0.00 -0.60 0.00 0.00 56.93 55.26 1cf4 s PHE 78 Cb -0.05 -1.38 0.10 0.00 0.51 0.00 0.00 43.02 42.20 1cf4 s PHE 78 CO 0.00 0.02 0.26 -1.17 0.70 0.00 0.00 175.22 175.03 1cf4 s LEU 79 N -3.64 -0.22 -0.34 -0.37 2.96 -1.20 -3.78 118.68 112.09 1cf4 s LEU 79 Ca 0.25 -0.17 -0.14 0.00 -0.22 0.00 0.00 54.13 53.85 1cf4 s LEU 79 Cb 0.05 0.54 -0.02 0.00 0.50 0.00 0.00 46.19 47.26 1cf4 s LEU 79 CO 0.13 -0.33 0.29 0.68 -1.32 0.00 0.00 176.35 175.80 1cf4 s VAL 80 N 2.37 5.24 0.39 1.68 -7.23 -0.90 -3.92 120.40 118.02 1cf4 s VAL 80 Ca 0.08 -0.10 0.08 0.00 -1.81 0.00 0.00 61.98 60.23 1cf4 s VAL 80 Cb -0.16 -3.76 -0.03 0.00 0.56 0.00 0.00 36.38 33.00 1cf4 s VAL 80 CO -0.14 -0.04 0.30 0.00 -0.31 0.00 0.00 175.10 174.90 1cf4 s PHE 82 N -2.44 -0.46 0.21 0.00 -0.12 -1.26 -3.75 117.98 110.15 1cf4 s PHE 82 Ca 0.44 1.03 -0.25 0.00 -0.05 0.00 0.00 56.93 58.10 1cf4 s PHE 82 Cb -0.03 0.36 -0.08 0.00 -0.63 0.00 0.00 43.02 42.64 1cf4 s PHE 82 CO 0.26 -0.23 0.82 -1.54 -0.05 0.00 0.00 175.22 174.48 1cf4 s SER 83 N 0.66 7.38 0.49 1.98 1.04 -1.26 -4.88 113.70 119.11 1cf4 s SER 83 Ca -0.01 1.69 0.18 0.00 0.48 0.00 0.00 55.95 58.28 1cf4 s SER 83 Cb -0.04 -2.52 1.21 0.00 0.10 0.00 0.00 66.02 64.77 1cf4 s SER 83 CO -0.11 0.14 2.04 -0.37 0.98 0.00 0.00 173.24 175.92 1cf4 h VAL 84 N 3.12 0.88 -3.16 5.02 -1.51 -1.85 -3.39 116.25 115.37 1cf4 h VAL 84 Ca -0.47 -0.06 -0.57 0.00 -1.23 0.00 0.00 66.70 64.37 1cf4 h VAL 84 Cb 1.20 0.70 -0.06 0.00 -2.13 0.00 0.00 31.29 31.00 1cf4 h VAL 84 CO 0.66 0.03 0.88 0.68 -1.23 0.00 0.00 177.57 178.60 1cf4 s VAL 85 N -5.19 4.39 -0.12 7.19 -7.23 -1.26 -0.91 120.40 117.28 1cf4 s VAL 85 Ca -0.06 1.63 -0.16 0.00 -1.81 0.00 0.00 61.98 61.58 1cf4 s VAL 85 Cb 0.19 -4.25 0.04 0.00 0.56 0.00 0.00 36.38 32.91 1cf4 s VAL 85 CO 0.72 -0.37 0.41 -0.44 -0.31 0.00 0.00 175.10 175.11 1cf4 s SER 86 N 1.95 -0.40 -0.81 4.85 0.01 -1.26 -5.02 113.70 113.01 1cf4 s SER 86 Ca 0.50 0.67 -0.04 0.00 1.31 0.00 0.00 55.95 58.39 1cf4 s SER 86 Cb -0.16 0.72 0.14 0.00 0.21 0.00 0.00 66.02 66.93 1cf4 s SER 86 CO 0.16 -0.24 2.49 -0.81 0.41 0.00 0.00 173.24 175.24 1cf4 n PRO 87 N 2.38 3.38 -1.27 12.44 -0.04 -1.26 -4.36 135.00 146.27 1cf4 n PRO 87 Ca -0.15 -3.03 -0.09 0.00 -0.04 0.00 0.00 63.50 60.19 1cf4 n PRO 87 Cb 0.57 -2.34 -0.04 0.00 -0.04 0.00 0.00 33.50 31.65 1cf4 n PRO 87 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1cf4 n SER 88 N 0.89 -4.14 0.01 3.54 7.64 -1.26 -4.32 113.62 115.97 1cf4 n SER 88 Ca 0.53 0.23 0.08 0.00 1.01 0.00 0.00 58.87 60.72 1cf4 n SER 88 Cb 0.40 -2.46 -0.13 0.00 -1.01 0.00 0.00 64.21 61.01 1cf4 n SER 88 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1cf4 n SER 89 N 0.45 0.24 -0.08 6.43 7.64 -1.26 -4.49 113.62 122.56 1cf4 n SER 89 Ca -0.09 0.10 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 1cf4 n SER 89 Cb 0.31 1.43 -0.08 0.00 -1.01 0.00 0.00 64.21 64.85 1cf4 n SER 89 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1cf4 h PHE 90 N 0.00 -1.51 -1.01 1.43 3.57 -1.90 0.71 116.94 118.23 1cf4 h PHE 90 Ca -0.08 0.07 0.23 0.00 3.53 0.00 0.00 57.97 61.72 1cf4 h PHE 90 Cb 1.19 0.70 -0.11 0.00 2.79 0.00 0.00 35.95 40.52 1cf4 h PHE 90 CO 0.00 -0.50 0.61 1.05 -2.23 0.00 0.00 178.31 177.24 1cf4 h GLU 91 N -0.45 0.60 -0.15 1.11 4.11 -2.01 0.27 114.58 118.06 1cf4 h GLU 91 Ca 0.08 -0.04 -0.14 0.00 0.07 0.00 0.00 59.36 59.33 1cf4 h GLU 91 Cb 0.63 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1cf4 h GLU 91 CO -0.52 0.40 -0.46 -0.97 0.07 0.00 0.00 179.01 177.53 1cf4 h ASN 92 N 0.62 0.66 0.02 3.06 -1.24 -1.15 -2.45 115.58 115.10 1cf4 h ASN 92 Ca 0.61 -0.60 0.01 0.00 0.71 0.00 0.00 56.30 57.03 1cf4 h ASN 92 Cb 1.14 -0.19 -0.04 0.00 0.73 0.00 0.00 38.32 39.97 1cf4 h ASN 92 CO -0.40 1.14 -0.35 0.58 -1.29 0.00 0.00 177.43 177.11 1cf4 h VAL 93 N 0.21 0.00 -0.95 2.57 2.07 0.24 0.56 116.25 120.95 1cf4 h VAL 93 Ca -0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.55 1cf4 h VAL 93 Cb 1.09 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.80 1cf4 h VAL 93 CO 0.10 0.00 0.62 0.11 0.02 0.00 0.00 177.57 178.42 1cf4 h LYS 94 N -0.46 1.13 0.00 1.57 6.56 -1.50 1.32 116.57 125.19 1cf4 h LYS 94 Ca 0.00 -0.07 -0.03 0.00 -1.06 0.00 0.00 60.65 59.49 1cf4 h LYS 94 Cb 0.48 -0.26 -0.00 0.00 -0.57 0.00 0.00 32.23 31.88 1cf4 h LYS 94 CO -0.22 0.75 -0.15 0.93 -2.06 0.00 0.00 179.45 178.69 1cf4 h GLU 95 N 1.17 0.00 0.00 3.15 4.39 -0.86 -2.51 114.58 119.92 1cf4 h GLU 95 Ca 0.39 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.93 1cf4 h GLU 95 Cb 0.06 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.68 1cf4 h GLU 95 CO -0.13 0.15 -2.16 1.63 -1.16 0.00 0.00 179.01 177.34 1cf4 n LYS 96 N -3.68 0.68 0.29 2.33 5.02 0.19 -4.37 118.16 118.61 1cf4 n LYS 96 Ca -0.02 -0.12 -0.13 0.00 -2.02 0.00 0.00 58.31 56.02 1cf4 n LYS 96 Cb 0.27 -1.52 -0.07 0.00 -0.02 0.00 0.00 35.03 33.70 1cf4 n LYS 96 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1cf4 h TRP 97 N 0.00 -0.71 -0.62 2.13 -0.00 0.19 -2.39 115.95 114.54 1cf4 h TRP 97 Ca -0.23 -0.02 0.11 0.00 -0.00 0.00 0.00 58.89 58.75 1cf4 h TRP 97 Cb 1.53 0.23 -0.12 0.00 -0.00 0.00 0.00 29.16 30.81 1cf4 h TRP 97 CO 0.00 -0.40 -0.31 0.28 -0.00 0.00 0.00 178.44 178.01 1cf4 h VAL 98 N -1.13 0.18 0.00 1.49 2.07 -1.70 0.48 116.25 117.65 1cf4 h VAL 98 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1cf4 h VAL 98 Cb 0.63 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1cf4 h VAL 98 CO 0.13 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.91 1cf4 n PRO 99 N -5.44 0.18 0.04 1.57 -0.04 -1.24 -2.06 135.00 128.00 1cf4 n PRO 99 Ca 0.05 0.44 -0.16 0.00 -0.04 0.00 0.00 63.50 63.79 1cf4 n PRO 99 Cb 0.36 -1.86 -0.14 0.00 -0.04 0.00 0.00 33.50 31.81 1cf4 n PRO 99 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1cf4 h GLU 100 N 0.00 0.21 0.05 0.54 5.08 0.39 -2.65 114.58 118.20 1cf4 h GLU 100 Ca 0.00 -0.36 -0.23 0.00 -1.00 0.00 0.00 59.36 57.78 1cf4 h GLU 100 Cb 0.31 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1cf4 h GLU 100 CO 0.00 1.03 -1.03 0.82 -1.00 0.00 0.00 179.01 178.82 1cf4 h ILE 101 N 0.06 1.54 0.00 3.13 2.04 -0.72 -1.55 117.51 122.01 1cf4 h ILE 101 Ca -0.29 -2.95 -0.04 0.00 1.00 0.00 0.00 64.86 62.58 1cf4 h ILE 101 Cb 2.02 2.72 -0.01 0.00 -0.74 0.00 0.00 36.82 40.81 1cf4 h ILE 101 CO 0.13 0.86 -0.62 0.71 0.00 0.00 0.00 178.15 179.23 1cf4 h THR 102 N 0.08 0.22 0.00 -0.27 1.35 -1.51 -1.14 112.91 111.64 1cf4 h THR 102 Ca -0.07 -1.35 -0.15 0.00 -0.55 0.00 0.00 66.41 64.29 1cf4 h THR 102 Cb 1.73 1.91 -0.02 0.00 -1.73 0.00 0.00 68.15 70.04 1cf4 h THR 102 CO 0.16 0.13 -0.88 -0.74 -0.25 0.00 0.00 175.52 173.93 1cf4 h HIS 103 N 0.00 0.00 0.00 4.73 -0.00 -1.51 -3.39 115.15 114.98 1cf4 h HIS 103 Ca -0.02 0.00 -0.21 0.00 -0.00 0.00 0.00 60.37 60.14 1cf4 h HIS 103 Cb 1.15 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.53 1cf4 h HIS 103 CO 0.00 1.16 -1.01 0.45 -0.00 0.00 0.00 177.93 178.52 1cf4 h HIS 104 N -1.00 0.00 -3.92 5.26 3.86 -1.44 -3.46 115.15 114.45 1cf4 h HIS 104 Ca -0.23 0.00 -0.68 0.00 -1.16 0.00 0.00 60.37 58.30 1cf4 h HIS 104 Cb 1.10 0.00 -0.21 0.00 1.06 0.00 0.00 27.41 29.35 1cf4 h HIS 104 CO 0.09 0.98 -0.82 0.00 0.86 0.00 0.00 177.93 179.04 1cf4 n PRO 106 N 1.24 1.92 -3.14 0.00 -0.04 -1.26 -3.80 135.00 129.92 1cf4 n PRO 106 Ca -0.16 -1.42 -0.05 0.00 -0.04 0.00 0.00 63.50 61.83 1cf4 n PRO 106 Cb 0.52 -2.45 0.02 0.00 -0.04 0.00 0.00 33.50 31.55 1cf4 n PRO 106 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1cf4 n LYS 107 N 4.42 -1.53 -3.40 0.54 4.76 -1.25 -5.00 118.16 116.70 1cf4 n LYS 107 Ca 0.42 1.31 -0.34 0.00 -2.87 0.00 0.00 58.31 56.83 1cf4 n LYS 107 Cb 0.14 -5.63 -0.06 0.00 -1.84 0.00 0.00 35.03 27.64 1cf4 n LYS 107 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1cf4 s THR 108 N -3.10 4.91 1.17 -0.18 -4.23 -1.26 -5.04 115.64 107.91 1cf4 s THR 108 Ca 0.11 0.66 -0.13 0.00 -1.18 0.00 0.00 61.69 61.16 1cf4 s THR 108 Cb -0.02 -3.68 0.29 0.00 1.34 0.00 0.00 72.50 70.43 1cf4 s THR 108 CO 0.76 0.13 1.03 -2.84 -0.54 0.00 0.00 174.62 173.16 1cf4 s PRO 109 N -2.26 -0.99 -0.28 3.99 0.02 -1.26 -4.85 135.00 129.36 1cf4 s PRO 109 Ca 0.41 0.87 -0.20 0.00 0.02 0.00 0.00 61.00 62.09 1cf4 s PRO 109 Cb -0.13 -1.54 0.09 0.00 0.02 0.00 0.00 34.50 32.93 1cf4 s PRO 109 CO 0.20 -3.78 0.78 -0.59 -0.33 0.00 0.00 177.00 173.28 1cf4 s PHE 110 N -2.44 -0.84 0.20 6.54 -0.71 -1.25 -2.96 117.98 116.52 1cf4 s PHE 110 Ca 0.69 1.82 0.11 0.00 -1.04 0.00 0.00 56.93 58.51 1cf4 s PHE 110 Cb -0.25 0.44 -0.04 0.00 -1.21 0.00 0.00 43.02 41.96 1cf4 s PHE 110 CO 0.65 -0.41 -0.24 -1.17 -1.34 0.00 0.00 175.22 172.71 1cf4 s LEU 111 N 1.00 2.45 -0.14 -1.99 0.20 -1.25 -3.41 118.68 115.54 1cf4 s LEU 111 Ca -0.05 -0.87 -0.07 0.00 0.69 0.00 0.00 54.13 53.83 1cf4 s LEU 111 Cb -0.05 -1.17 -0.04 0.00 -0.43 0.00 0.00 46.19 44.50 1cf4 s LEU 111 CO -0.11 0.12 0.12 -0.76 -0.29 0.00 0.00 176.35 175.43 1cf4 s LEU 112 N -2.72 4.26 0.10 -0.68 2.01 -1.18 -2.12 118.68 118.35 1cf4 s LEU 112 Ca 0.21 0.37 0.10 0.00 0.01 0.00 0.00 54.13 54.83 1cf4 s LEU 112 Cb -0.08 -2.05 -0.04 0.00 0.01 0.00 0.00 46.19 44.04 1cf4 s LEU 112 CO 0.10 0.35 -0.26 -0.69 1.01 0.00 0.00 176.35 176.86 1cf4 s VAL 113 N -0.64 2.14 -0.24 -1.59 1.01 -1.26 -3.76 120.40 116.06 1cf4 s VAL 113 Ca 0.13 -1.60 -0.01 0.00 0.00 0.00 0.00 61.98 60.50 1cf4 s VAL 113 Cb -0.12 -1.87 0.07 0.00 0.00 0.00 0.00 36.38 34.46 1cf4 s VAL 113 CO 0.02 0.16 0.01 -0.83 0.00 0.00 0.00 175.10 174.47 1cf4 s GLY 114 N -1.75 1.05 0.00 4.51 0.00 -1.15 -4.50 107.32 105.47 1cf4 s GLY 114 Ca 0.12 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.64 1cf4 s GLY 114 CO 0.04 1.25 0.00 -1.30 0.00 0.00 0.00 173.10 173.09 1cf4 n THR 115 N 4.84 0.00 1.83 0.90 -2.24 -1.26 0.19 114.28 118.53 1cf4 n THR 115 Ca -0.08 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.81 1cf4 n THR 115 Cb 0.45 -0.47 0.70 0.00 -2.10 0.00 0.00 70.33 68.90 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 -2.32 0.91 -0.12 -0.78 7.27 -1.26 -3.95 117.38 117.13 1cf4 n GLN 116 Ca 0.00 0.00 0.27 0.00 0.07 0.00 0.00 57.00 57.34 1cf4 n GLN 116 Cb 0.37 -1.40 0.63 0.00 2.41 0.00 0.00 30.24 32.25 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 0.20 0.00 1.69 -2.65 -1.92 1.15 117.51 115.99 1cf4 h ILE 117 Ca 0.00 0.00 -0.10 0.00 1.03 0.00 0.00 64.86 65.79 1cf4 h ILE 117 Cb 0.00 0.33 -0.01 0.00 -2.05 0.00 0.00 36.82 35.08 1cf4 h ILE 117 CO 0.00 0.00 -0.46 -0.78 0.03 0.00 0.00 178.15 176.94 1cf4 h ASP 118 N 0.00 0.00 1.15 2.16 1.82 -1.96 -3.16 116.42 116.43 1cf4 h ASP 118 Ca 0.40 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.90 1cf4 h ASP 118 Cb 2.11 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 42.10 1cf4 h ASP 118 CO -0.00 0.46 -0.89 -0.07 -1.61 0.00 0.00 179.24 177.12 1cf4 h LEU 119 N 0.00 0.00 -1.80 2.28 4.07 0.11 -3.30 115.31 116.67 1cf4 h LEU 119 Ca -0.00 0.00 0.15 0.00 0.08 0.00 0.00 57.88 58.11 1cf4 h LEU 119 Cb 1.13 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.85 1cf4 h LEU 119 CO 0.06 0.56 0.60 0.08 -1.08 0.00 0.00 178.44 178.66 1cf4 h ARG 120 N 0.00 0.00 0.00 1.13 -0.00 -1.43 1.04 114.38 115.12 1cf4 h ARG 120 Ca -0.07 0.00 -0.16 0.00 -0.00 0.00 0.00 59.98 59.76 1cf4 h ARG 120 Cb 1.49 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 31.43 1cf4 h ARG 120 CO 0.06 0.00 -1.22 0.22 -0.00 0.00 0.00 179.97 179.03 1cf4 h ASP 121 N 0.00 0.00 -2.16 0.08 3.58 -1.74 -3.46 116.42 112.72 1cf4 h ASP 121 Ca 0.25 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 57.13 1cf4 h ASP 121 Cb 1.45 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.50 1cf4 h ASP 121 CO -0.00 0.58 1.41 -0.62 -2.88 0.00 0.00 179.24 177.73 1cf4 s ASP 122 N -5.95 5.72 0.00 2.28 2.15 0.36 -4.83 116.67 116.40 1cf4 s ASP 122 Ca -0.01 1.97 0.12 0.00 0.43 0.00 0.00 52.55 55.06 1cf4 s ASP 122 Cb 0.08 -2.52 0.59 0.00 -0.30 0.00 0.00 42.92 40.78 1cf4 s ASP 122 CO 0.80 -1.74 1.30 -0.81 -0.17 0.00 0.00 175.17 174.55 1cf4 n PRO 123 N 8.45 0.15 0.00 4.34 -0.04 -1.26 -2.44 135.00 144.19 1cf4 n PRO 123 Ca 0.27 0.19 -0.00 0.00 -0.04 0.00 0.00 63.50 63.91 1cf4 n PRO 123 Cb 0.44 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.40 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 -0.02 -0.70 3.54 0.87 -1.91 -2.49 113.55 112.84 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 0.12 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.05 1cf4 h SER 124 CO 0.00 0.05 0.46 0.74 -0.53 0.00 0.00 176.83 177.55 1cf4 h THR 125 N -0.16 0.95 -0.65 2.23 2.02 -1.89 0.47 112.91 115.89 1cf4 h THR 125 Ca -0.00 -0.21 0.05 0.00 0.77 0.00 0.00 66.41 67.01 1cf4 h THR 125 Cb 0.02 0.28 -0.05 0.00 -1.74 0.00 0.00 68.15 66.66 1cf4 h THR 125 CO 0.00 0.11 0.38 -0.29 0.37 0.00 0.00 175.52 176.09 1cf4 h ILE 126 N 0.62 1.01 -0.83 3.11 6.09 -1.60 0.14 117.51 126.06 1cf4 h ILE 126 Ca 0.31 -0.25 0.11 0.00 -1.37 0.00 0.00 64.86 63.67 1cf4 h ILE 126 Cb 0.42 0.23 -0.06 0.00 0.47 0.00 0.00 36.82 37.88 1cf4 h ILE 126 CO -0.11 0.13 0.54 -0.33 -3.07 0.00 0.00 178.15 175.31 1cf4 h GLU 127 N 0.72 0.72 -0.10 2.19 4.39 -0.42 0.73 114.58 122.80 1cf4 h GLU 127 Ca 0.28 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.89 1cf4 h GLU 127 Cb 0.12 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1cf4 h GLU 127 CO -0.15 0.47 -0.15 0.87 -1.16 0.00 0.00 179.01 178.90 1cf4 h LYS 128 N 0.74 0.15 -0.10 2.33 6.56 -0.72 -1.64 116.57 123.89 1cf4 h LYS 128 Ca 0.39 -0.03 -0.19 0.00 -1.06 0.00 0.00 60.65 59.76 1cf4 h LYS 128 Cb 0.50 -0.02 0.01 0.00 -0.57 0.00 0.00 32.23 32.15 1cf4 h LYS 128 CO -0.16 0.30 -0.67 -0.07 -2.06 0.00 0.00 179.45 176.80 1cf4 h LEU 129 N 0.15 0.75 -1.91 2.94 3.38 0.83 -3.07 115.31 118.39 1cf4 h LEU 129 Ca 0.03 -0.66 0.33 0.00 0.09 0.00 0.00 57.88 57.67 1cf4 h LEU 129 Cb 0.35 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 1cf4 h LEU 129 CO 0.02 1.30 0.89 0.00 0.09 0.00 0.00 178.44 180.74 1cf4 h ALA 130 N 0.47 3.05 -0.62 1.53 0.00 0.78 1.54 119.26 126.01 1cf4 h ALA 130 Ca -0.06 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 54.91 1cf4 h ALA 130 Cb 1.32 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.16 1cf4 h ALA 130 CO 0.14 -1.48 0.41 0.87 0.00 0.00 0.00 179.25 179.19 1cf4 h LYS 131 N 0.00 0.45 0.00 0.00 1.79 -1.39 -3.32 116.57 114.10 1cf4 h LYS 131 Ca 0.54 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.99 1cf4 h LYS 131 Cb 2.32 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 32.87 1cf4 h LYS 131 CO -0.01 0.30 -0.78 0.09 -1.08 0.00 0.00 179.45 177.97 1cf4 n ASN 132 N -4.47 3.80 0.00 0.86 3.02 0.22 -5.04 115.26 113.64 1cf4 n ASN 132 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 1cf4 n ASN 132 Cb 0.35 0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 1cf4 n ASN 132 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1cf4 n LYS 133 N -1.75 0.00 0.00 3.52 4.81 0.47 -4.59 118.16 120.61 1cf4 n LYS 133 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1cf4 n LYS 133 Cb 0.39 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.44 1cf4 n LYS 133 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1cf4 n GLN 134 N -1.66 0.00 -2.10 1.64 10.64 -0.85 -4.51 117.38 120.54 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 3.49 0.00 2.61 1.02 -1.26 -4.63 119.74 120.97 1cf4 s LYS 135 Ca 0.00 1.38 0.00 0.00 0.02 0.00 0.00 55.97 57.37 1cf4 s LYS 135 Cb 0.00 -4.12 0.00 0.00 -0.52 0.00 0.00 37.83 33.19 1cf4 s LYS 135 CO 0.00 -1.66 0.00 -0.35 -0.92 0.00 0.00 175.35 172.42 1cf4 n PRO 136 N 8.18 -0.74 -3.80 -1.68 -0.04 -1.26 -4.77 135.00 130.90 1cf4 n PRO 136 Ca 0.21 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.31 1cf4 n PRO 136 Cb 0.47 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.81 1cf4 n PRO 136 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1cf4 s ILE 137 N -0.99 3.26 0.71 0.52 -1.09 -0.09 -5.00 121.20 118.51 1cf4 s ILE 137 Ca 0.00 -2.39 -0.14 0.00 -2.23 0.00 0.00 60.65 55.89 1cf4 s ILE 137 Cb 0.00 -3.22 0.03 0.00 -1.58 0.00 0.00 42.46 37.69 1cf4 s ILE 137 CO 0.00 -0.74 1.14 0.42 -1.23 0.00 0.00 174.94 174.53 1cf4 s THR 138 N 0.73 2.94 0.33 2.92 -4.23 -1.26 -4.62 115.64 112.45 1cf4 s THR 138 Ca 0.11 0.42 0.09 0.00 -1.18 0.00 0.00 61.69 61.13 1cf4 s THR 138 Cb -0.22 -2.92 0.32 0.00 1.34 0.00 0.00 72.50 71.02 1cf4 s THR 138 CO -0.04 -0.29 1.80 1.55 -0.54 0.00 0.00 174.62 177.10 1cf4 h PRO 139 N -0.30 0.67 0.00 3.99 0.13 -1.98 0.36 132.00 134.87 1cf4 h PRO 139 Ca -0.46 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 1cf4 h PRO 139 Cb 1.26 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1cf4 h PRO 139 CO 0.52 0.45 -0.14 1.05 -0.23 0.00 0.00 178.00 179.64 1cf4 h GLU 140 N 0.69 0.00 -0.07 0.86 4.11 -1.99 -2.78 114.58 115.41 1cf4 h GLU 140 Ca 0.55 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.93 1cf4 h GLU 140 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1cf4 h GLU 140 CO -0.32 0.14 -0.16 1.15 0.07 0.00 0.00 179.01 179.89 1cf4 h THR 141 N 0.00 1.42 -0.97 -1.06 2.02 -0.62 -2.48 112.91 111.23 1cf4 h THR 141 Ca -0.00 -1.49 0.11 0.00 0.77 0.00 0.00 66.41 65.80 1cf4 h THR 141 Cb 0.35 2.23 -0.08 0.00 -1.74 0.00 0.00 68.15 68.91 1cf4 h THR 141 CO 0.02 0.42 0.62 0.00 0.37 0.00 0.00 175.52 176.94 1cf4 h ALA 142 N 0.47 1.57 -0.40 6.16 0.00 -1.24 -1.39 119.26 124.43 1cf4 h ALA 142 Ca -0.00 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1cf4 h ALA 142 Cb 0.76 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1cf4 h ALA 142 CO 0.03 0.21 -0.16 0.93 0.00 0.00 0.00 179.25 180.26 1cf4 h GLU 143 N 0.96 0.82 0.32 0.00 5.08 -1.51 0.14 114.58 120.38 1cf4 h GLU 143 Ca 0.46 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1cf4 h GLU 143 Cb 0.46 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1cf4 h GLU 143 CO -0.23 0.97 -0.49 0.87 -1.00 0.00 0.00 179.01 179.13 1cf4 h LYS 144 N 0.63 -0.82 -0.56 2.33 1.79 -0.78 -0.52 116.57 118.64 1cf4 h LYS 144 Ca 0.09 0.06 -0.11 0.00 -2.18 0.00 0.00 60.65 58.51 1cf4 h LYS 144 Cb 0.71 0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 31.53 1cf4 h LYS 144 CO 0.05 -0.55 -0.08 1.25 -1.08 0.00 0.00 179.45 179.04 1cf4 h LEU 145 N -0.85 1.04 -0.54 2.94 6.46 -1.50 -0.77 115.31 122.08 1cf4 h LEU 145 Ca -0.04 -0.33 0.11 0.00 -0.12 0.00 0.00 57.88 57.50 1cf4 h LEU 145 Cb 0.78 -0.28 -0.10 0.00 -0.73 0.00 0.00 40.66 40.33 1cf4 h LEU 145 CO -0.15 1.13 -0.15 0.00 -0.62 0.00 0.00 178.44 178.64 1cf4 h ALA 146 N 0.96 0.32 0.00 1.25 0.00 -0.41 0.87 119.26 122.25 1cf4 h ALA 146 Ca 0.15 0.21 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 1cf4 h ALA 146 Cb 0.65 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1cf4 h ALA 146 CO 0.04 -0.46 -0.39 0.00 0.00 0.00 0.00 179.25 178.45 1cf4 h ARG 147 N -0.02 0.00 -1.02 0.00 3.08 -1.02 0.15 114.38 115.55 1cf4 h ARG 147 Ca 0.26 0.00 0.26 0.00 0.07 0.00 0.00 59.98 60.57 1cf4 h ARG 147 Cb 0.41 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.39 1cf4 h ARG 147 CO -0.56 0.39 0.68 0.22 -1.07 0.00 0.00 179.97 179.62 1cf4 h ASP 148 N 0.00 0.35 0.00 7.04 1.82 0.72 0.50 116.42 126.85 1cf4 h ASP 148 Ca -0.00 0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.69 1cf4 h ASP 148 Cb 1.24 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.24 1cf4 h ASP 148 CO 0.05 0.08 -0.13 0.18 -1.61 0.00 0.00 179.24 177.82 1cf4 n LEU 149 N -4.52 2.25 -3.82 2.28 4.77 -1.12 -5.00 117.00 111.84 1cf4 n LEU 149 Ca 0.24 -3.08 -0.33 0.00 -0.03 0.00 0.00 56.01 52.81 1cf4 n LEU 149 Cb 0.90 -0.41 0.02 0.00 -2.33 0.00 0.00 43.42 41.60 1cf4 n LEU 149 CO 0.29 0.79 -0.13 0.29 -1.33 0.00 0.00 177.39 177.31 1cf4 n LYS 150 N -1.27 -1.54 0.00 3.23 5.02 0.17 -4.95 118.16 118.82 1cf4 n LYS 150 Ca 0.15 0.38 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 1cf4 n LYS 150 Cb 0.66 -3.94 0.00 0.00 -0.02 0.00 0.00 35.03 31.72 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 -0.38 7.82 0.00 0.52 -4.99 120.51 119.10 1cf4 n ALA 151 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1cf4 n ALA 151 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 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 -0.37 0.00 0.00 0.00 0.31 -1.22 -4.55 118.33 112.50 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 -1.86 0.00 -3.80 5.55 3.00 -1.26 -5.01 118.16 114.79 1cf4 n LYS 153 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.95 1cf4 n LYS 153 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 34.91 1cf4 n LYS 153 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.40 176.93 1cf4 s TYR 154 N -1.63 3.46 0.59 5.64 5.04 -1.26 -3.09 117.35 126.09 1cf4 s TYR 154 Ca 0.00 -2.14 0.08 0.00 -2.44 0.00 0.00 57.07 52.58 1cf4 s TYR 154 Cb 0.00 -2.85 0.08 0.00 0.35 0.00 0.00 41.96 39.55 1cf4 s TYR 154 CO 0.00 -0.90 0.70 0.28 -1.34 0.00 0.00 175.55 174.29 1cf4 n VAL 155 N 4.64 0.00 -3.29 3.14 0.31 -1.25 -4.90 118.33 116.99 1cf4 n VAL 155 Ca -0.06 -2.07 -0.31 0.00 -0.01 0.00 0.00 64.34 61.89 1cf4 n VAL 155 Cb 0.42 -0.35 -0.05 0.00 -0.91 0.00 0.00 33.84 32.95 1cf4 n VAL 155 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1cf4 s GLU 156 N -4.59 3.81 0.31 5.55 2.02 -1.26 -2.94 118.70 121.59 1cf4 s GLU 156 Ca 0.53 0.33 0.04 0.00 0.02 0.00 0.00 54.97 55.89 1cf4 s GLU 156 Cb -0.04 -2.58 -0.06 0.00 0.10 0.00 0.00 34.13 31.55 1cf4 s GLU 156 CO 0.34 0.23 0.05 0.00 0.02 0.00 0.00 175.26 175.90 1cf4 s SER 158 N -3.45 5.31 0.00 0.00 0.15 -1.26 -3.33 113.70 111.12 1cf4 s SER 158 Ca 0.35 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.89 1cf4 s SER 158 Cb 0.08 -1.35 0.00 0.00 -1.71 0.00 0.00 66.02 63.04 1cf4 s SER 158 CO 0.14 0.14 0.00 0.00 1.20 0.00 0.00 173.24 174.73 1cf4 n ALA 159 N 0.27 0.00 0.00 5.45 0.00 -1.26 -4.81 120.51 120.15 1cf4 n ALA 159 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1cf4 n ALA 159 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1cf4 n ALA 159 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1cf4 n LEU 160 N 0.00 0.76 -0.03 0.00 7.99 -1.26 -4.71 117.00 119.75 1cf4 n LEU 160 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 56.01 56.07 1cf4 n LEU 160 Cb 0.00 0.00 -0.17 0.00 -0.11 0.00 0.00 43.42 43.14 1cf4 n LEU 160 CO 0.00 0.01 -0.83 1.07 -1.51 0.00 0.00 177.39 176.13 1cf4 n THR 161 N -2.28 0.23 -2.00 -5.08 5.66 -1.26 -5.05 114.28 104.50 1cf4 n THR 161 Ca 0.00 -0.56 -0.02 0.00 -3.05 0.00 0.00 64.05 60.42 1cf4 n THR 161 Cb 0.22 -0.08 0.00 0.00 -1.55 0.00 0.00 70.33 68.93 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 -2.34 -0.76 -0.35 1.09 7.27 -1.26 -4.96 117.38 116.06 1cf4 n GLN 162 Ca -0.09 1.03 0.10 0.00 0.07 0.00 0.00 57.00 58.11 1cf4 n GLN 162 Cb 0.67 -3.00 0.29 0.00 2.41 0.00 0.00 30.24 30.61 1cf4 n GLN 162 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1cf4 n LYS 163 N -0.62 2.58 0.00 3.69 4.76 -1.21 -4.92 118.16 122.44 1cf4 n LYS 163 Ca 0.03 -2.35 0.00 0.00 -2.87 0.00 0.00 58.31 53.12 1cf4 n LYS 163 Cb 0.24 -1.53 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 1cf4 n LYS 163 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1cf4 n GLY 164 N 1.49 3.34 5.00 0.72 0.00 -1.26 -4.70 105.19 109.78 1cf4 n GLY 164 Ca 0.22 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1cf4 n GLY 164 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1cf4 n LEU 165 N 0.00 0.00 0.31 0.99 0.00 -1.26 -4.52 117.00 112.52 1cf4 n LEU 165 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 56.01 56.20 1cf4 n LEU 165 Cb 0.00 0.00 0.99 0.00 0.00 0.00 0.00 43.42 44.41 1cf4 n LEU 165 CO 0.00 0.00 1.16 0.07 0.00 0.00 0.00 177.39 178.62 1cf4 h LYS 166 N 0.00 0.00 0.00 1.96 2.10 -1.90 -2.75 116.57 115.98 1cf4 h LYS 166 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1cf4 h LYS 166 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1cf4 h LYS 166 CO 0.00 0.00 0.00 -1.71 -2.00 0.00 0.00 179.45 175.74 1cf4 n ASN 167 N -3.18 0.00 -0.34 7.07 4.05 -1.26 0.16 115.26 121.76 1cf4 n ASN 167 Ca -0.02 0.89 0.01 0.00 0.45 0.00 0.00 54.58 55.91 1cf4 n ASN 167 Cb 0.24 -0.39 0.14 0.00 1.23 0.00 0.00 39.78 41.01 1cf4 n ASN 167 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 177.26 173.84 1cf4 h VAL 168 N 0.00 1.11 -0.37 3.44 -1.51 -1.56 -1.02 116.25 116.35 1cf4 h VAL 168 Ca 0.00 -0.39 -0.04 0.00 -1.23 0.00 0.00 66.70 65.04 1cf4 h VAL 168 Cb 0.00 -0.12 -0.02 0.00 -2.13 0.00 0.00 31.29 29.02 1cf4 h VAL 168 CO 0.00 0.21 0.04 0.15 -1.23 0.00 0.00 177.57 176.73 1cf4 h PHE 169 N 1.13 0.57 0.00 5.19 3.57 -1.42 -1.17 116.94 124.81 1cf4 h PHE 169 Ca 0.39 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.77 1cf4 h PHE 169 Cb 0.09 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1cf4 h PHE 169 CO -0.01 0.53 -0.36 -0.44 -2.23 0.00 0.00 178.31 175.80 1cf4 h ASP 170 N 0.54 0.00 0.71 0.41 5.19 0.28 -2.53 116.42 121.02 1cf4 h ASP 170 Ca 0.12 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.28 1cf4 h ASP 170 Cb 0.29 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.79 1cf4 h ASP 170 CO 0.01 0.36 -1.13 -0.08 -3.12 0.00 0.00 179.24 175.28 1cf4 h GLU 171 N 0.00 0.20 -0.09 3.56 4.57 -0.35 -0.27 114.58 122.19 1cf4 h GLU 171 Ca -0.00 -0.31 -0.18 0.00 -1.18 0.00 0.00 59.36 57.68 1cf4 h GLU 171 Cb 1.01 0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.71 1cf4 h GLU 171 CO 0.05 1.13 -0.71 0.00 -1.18 0.00 0.00 179.01 178.29 1cf4 h ALA 172 N 0.74 0.60 0.06 2.92 0.00 -1.18 -3.15 119.26 119.25 1cf4 h ALA 172 Ca -0.09 -0.60 -0.26 0.00 0.00 0.00 0.00 54.91 53.96 1cf4 h ALA 172 Cb 1.85 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.56 1cf4 h ALA 172 CO 0.18 0.75 -1.30 -0.84 0.00 0.00 0.00 179.25 178.03 1cf4 h ILE 173 N 0.30 1.39 -0.46 0.00 -0.00 -1.51 -3.34 117.51 113.88 1cf4 h ILE 173 Ca -0.03 -3.07 0.07 0.00 -0.00 0.00 0.00 64.86 61.83 1cf4 h ILE 173 Cb 1.28 2.77 -0.06 0.00 -0.00 0.00 0.00 36.82 40.82 1cf4 h ILE 173 CO 0.12 0.84 0.12 0.25 -0.00 0.00 0.00 178.15 179.49 1cf4 h LEU 174 N 0.03 0.07 -1.73 0.16 5.85 -1.05 -0.02 115.31 118.63 1cf4 h LEU 174 Ca -0.14 0.07 0.25 0.00 0.84 0.00 0.00 57.88 58.90 1cf4 h LEU 174 Cb 1.91 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.99 1cf4 h LEU 174 CO 0.14 0.07 0.81 0.00 -0.34 0.00 0.00 178.44 179.13 1cf4 h ALA 175 N 1.34 2.70 0.06 1.25 0.00 -1.67 0.44 119.26 123.38 1cf4 h ALA 175 Ca 0.23 -0.03 -0.36 0.00 0.00 0.00 0.00 54.91 54.75 1cf4 h ALA 175 Cb 0.27 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1cf4 h ALA 175 CO -0.27 -1.26 -2.12 0.00 0.00 0.00 0.00 179.25 175.60 1cf4 n ALA 176 N -2.45 1.21 0.24 0.00 0.00 -0.15 -4.15 120.51 115.20 1cf4 n ALA 176 Ca 0.18 -0.84 0.11 0.00 0.00 0.00 0.00 53.44 52.90 1cf4 n ALA 176 Cb 1.10 -0.50 0.58 0.00 0.00 0.00 0.00 19.45 20.63 1cf4 n ALA 176 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1cf4 h LEU 177 N 0.03 0.00 -7.00 0.00 3.38 0.76 -3.44 115.31 109.05 1cf4 h LEU 177 Ca -0.45 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.55 1cf4 h LEU 177 Cb 2.02 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 42.56 1cf4 h LEU 177 CO 0.03 0.18 0.02 -0.70 0.09 0.00 0.00 178.44 178.07 1cf4 s GLU 178 N -3.87 0.68 -0.40 1.13 -6.30 0.12 -4.94 118.70 105.11 1cf4 s GLU 178 Ca -0.01 1.23 -0.31 0.00 -2.50 0.00 0.00 54.97 53.38 1cf4 s GLU 178 Cb 0.11 0.23 -0.09 0.00 0.00 0.00 0.00 34.13 34.38 1cf4 s GLU 178 CO 0.61 -0.15 2.30 -2.30 0.02 0.00 0.00 175.26 175.74 1cf4 n PRO 179 N 4.43 1.23 -1.53 4.30 -0.02 -1.26 -4.17 135.00 137.97 1cf4 n PRO 179 Ca -0.19 0.27 -0.30 0.00 -2.02 0.00 0.00 63.50 61.26 1cf4 n PRO 179 Cb 0.58 -2.83 0.20 0.00 -0.02 0.00 0.00 33.50 31.42 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 6.97 0.02 0.00 0.52 0.04 -1.26 -5.09 135.00 136.20 1cf4 s PRO 180 Ca 1.07 -0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.95 1cf4 s PRO 180 Cb -0.58 -1.75 -0.00 0.00 0.04 0.00 0.00 34.50 32.20 1cf4 s PRO 180 CO 0.40 -2.87 -0.01 -1.21 0.04 0.00 0.00 177.00 173.35 1cf4 s GLU 181 N -5.60 0.08 0.00 4.56 2.02 -1.26 -5.15 118.70 113.36 1cf4 s GLU 181 Ca 0.71 -0.12 0.00 0.00 0.02 0.00 0.00 54.97 55.57 1cf4 s GLU 181 Cb -0.08 -0.00 0.00 0.00 0.10 0.00 0.00 34.13 34.15 1cf4 s GLU 181 CO 0.54 -0.00 0.00 -0.35 0.02 0.00 0.00 175.26 175.47 1cf4 n PRO 182 N 2.79 0.31 -0.52 0.39 -0.04 -1.26 -5.04 135.00 131.63 1cf4 n PRO 182 Ca -0.14 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.03 1cf4 n PRO 182 Cb 0.59 0.00 0.27 0.00 -0.04 0.00 0.00 33.50 34.32 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 -1.51 -1.80 0.00 0.54 -0.14 -1.26 -5.25 119.74 110.32 1cf4 s LYS 183 Ca 0.00 0.47 0.00 0.00 -1.36 0.00 0.00 55.97 55.08 1cf4 s LYS 183 Cb 0.00 -1.48 0.00 0.00 -1.68 0.00 0.00 37.83 34.67 1cf4 s LYS 183 CO 0.00 -4.21 0.00 1.63 -0.76 0.00 0.00 175.35 172.01