#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4u h SER 2 N 0.00 -0.01 -2.76 1.61 4.64 -2.15 -3.41 113.55 111.47 1x4u h SER 2 Ca 0.00 0.14 -0.58 0.00 -0.47 0.00 0.00 61.79 60.89 1x4u h SER 2 Cb 0.00 0.20 0.08 0.00 -0.31 0.00 0.00 62.40 62.37 1x4u h SER 2 CO 0.00 -0.04 0.65 -1.20 -0.87 0.00 0.00 176.83 175.37 1x4u n SER 3 N -5.17 2.90 -3.81 4.97 7.64 -1.26 -5.00 113.62 113.91 1x4u n SER 3 Ca 0.13 1.14 -0.15 0.00 1.01 0.00 0.00 58.87 61.00 1x4u n SER 3 Cb 0.44 -1.45 -0.16 0.00 -1.01 0.00 0.00 64.21 62.03 1x4u n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x4u s GLY 4 N 0.31 0.14 -0.29 0.23 0.00 -1.26 -5.13 107.32 101.31 1x4u s GLY 4 Ca 0.67 0.20 -0.16 0.00 0.00 0.00 0.00 44.72 45.44 1x4u s GLY 4 CO 0.50 0.53 0.99 -0.45 0.00 0.00 0.00 173.10 174.67 1x4u s SER 5 N 0.86 -0.50 -0.17 1.64 0.15 -1.26 -5.15 113.70 109.27 1x4u s SER 5 Ca -0.08 0.77 -0.04 0.00 0.70 0.00 0.00 55.95 57.30 1x4u s SER 5 Cb -0.11 1.29 0.08 0.00 -1.71 0.00 0.00 66.02 65.57 1x4u s SER 5 CO -0.02 -0.12 0.22 -0.94 1.20 0.00 0.00 173.24 173.58 1x4u s SER 6 N 1.56 1.09 0.30 5.45 1.04 -1.26 -5.15 113.70 116.73 1x4u s SER 6 Ca -0.08 0.02 -0.15 0.00 0.48 0.00 0.00 55.95 56.22 1x4u s SER 6 Cb -0.04 0.42 -0.09 0.00 0.10 0.00 0.00 66.02 66.41 1x4u s SER 6 CO -0.15 -0.30 0.71 -0.83 0.98 0.00 0.00 173.24 173.66 1x4u s GLY 7 N 2.34 2.36 0.74 7.32 0.00 -1.26 -5.07 107.32 113.75 1x4u s GLY 7 Ca 0.05 0.02 -0.11 0.00 0.00 0.00 0.00 44.72 44.68 1x4u s GLY 7 CO -0.10 0.23 1.08 1.09 0.00 0.00 0.00 173.10 175.40 1x4u s ARG 8 N -2.86 2.54 0.00 2.90 1.70 -1.26 -5.08 118.95 116.89 1x4u s ARG 8 Ca 0.52 0.82 0.01 0.00 -0.47 0.00 0.00 55.73 56.61 1x4u s ARG 8 Cb -0.11 -1.96 -0.01 0.00 -0.57 0.00 0.00 34.95 32.31 1x4u s ARG 8 CO 0.18 -1.35 -0.04 1.52 -1.08 0.00 0.00 175.30 174.53 1x4u s TYR 9 N -3.09 0.39 0.04 5.89 -0.85 -1.26 -5.16 117.35 113.31 1x4u s TYR 9 Ca 0.59 -0.13 -0.01 0.00 -0.52 0.00 0.00 57.07 57.01 1x4u s TYR 9 Cb -0.14 -0.25 0.01 0.00 0.38 0.00 0.00 41.96 41.96 1x4u s TYR 9 CO 0.55 -0.02 0.04 -0.35 -1.52 0.00 0.00 175.55 174.25 1x4u n PRO 10 N 2.77 -1.10 -2.13 -3.49 -0.04 -1.26 -4.87 135.00 124.88 1x4u n PRO 10 Ca -0.14 -0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 62.83 1x4u n PRO 10 Cb 0.58 -0.06 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1x4u n PRO 10 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1x4u n THR 11 N -2.60 3.81 -0.31 0.52 -1.04 -1.26 -4.77 114.28 108.63 1x4u n THR 11 Ca 0.01 -3.67 0.07 0.00 -2.04 0.00 0.00 64.05 58.42 1x4u n THR 11 Cb 0.02 -2.49 0.22 0.00 -1.82 0.00 0.00 70.33 66.26 1x4u n THR 11 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1x4u h ASN 12 N 6.35 0.67 -3.65 8.00 7.08 -2.06 -3.41 115.58 128.56 1x4u h ASN 12 Ca 0.49 0.07 -0.52 0.00 -3.08 0.00 0.00 56.30 53.26 1x4u h ASN 12 Cb 0.70 -0.05 0.04 0.00 -2.08 0.00 0.00 38.32 36.94 1x4u h ASN 12 CO 1.70 0.32 0.62 0.21 -2.08 0.00 0.00 177.43 178.19 1x4u s ASN 13 N -5.52 6.91 0.29 6.14 3.84 -1.26 -5.03 114.94 120.31 1x4u s ASN 13 Ca -0.12 2.50 0.02 0.00 0.21 0.00 0.00 52.86 55.47 1x4u s ASN 13 Cb 0.22 -2.63 -0.03 0.00 -0.55 0.00 0.00 41.25 38.26 1x4u s ASN 13 CO 0.79 -0.47 0.28 0.72 -2.79 0.00 0.00 177.10 175.63 1x4u s PHE 14 N -0.60 1.38 0.00 0.43 -0.12 -1.26 -5.00 117.98 112.81 1x4u s PHE 14 Ca 0.52 -1.46 0.00 0.00 -0.05 0.00 0.00 56.93 55.93 1x4u s PHE 14 Cb -0.37 -0.51 0.00 0.00 -0.63 0.00 0.00 43.02 41.51 1x4u s PHE 14 CO 0.44 -0.85 0.00 0.41 -0.05 0.00 0.00 175.22 175.17 1x4u n GLY 15 N -0.49 3.05 3.50 1.99 0.00 -1.26 -5.13 105.19 106.84 1x4u n GLY 15 Ca 0.04 -0.40 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 1x4u n GLY 15 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x4u s ASN 16 N 0.00 3.08 1.00 1.61 0.02 -1.26 -4.37 114.94 115.01 1x4u s ASN 16 Ca 0.00 -1.28 -0.17 0.00 -1.02 0.00 0.00 52.86 50.39 1x4u s ASN 16 Cb 0.00 -0.23 -0.13 0.00 0.02 0.00 0.00 41.25 40.91 1x4u s ASN 16 CO 0.00 -0.42 -0.73 0.00 0.02 0.00 0.00 177.10 175.97 1x4u n THR 18 N -2.66 1.46 0.00 0.00 -1.04 -1.10 -3.33 114.28 107.60 1x4u n THR 18 Ca -0.01 -1.16 0.00 0.00 -2.04 0.00 0.00 64.05 60.84 1x4u n THR 18 Cb 0.57 0.28 0.00 0.00 -1.82 0.00 0.00 70.33 69.36 1x4u n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1x4u n GLY 19 N 0.99 0.00 0.05 3.41 0.00 -1.26 -4.86 105.19 103.52 1x4u n GLY 19 Ca 0.22 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.27 1x4u n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4u n SER 21 N -0.66 0.60 -4.48 0.00 7.64 -1.21 -4.86 113.62 110.65 1x4u n SER 21 Ca 0.04 -1.10 -0.43 0.00 1.01 0.00 0.00 58.87 58.39 1x4u n SER 21 Cb 0.41 -1.36 -0.09 0.00 -1.01 0.00 0.00 64.21 62.16 1x4u n SER 21 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x4u s ALA 22 N -4.17 3.43 0.34 -0.43 0.00 -1.26 -4.68 121.76 114.99 1x4u s ALA 22 Ca 0.02 -1.54 -0.29 0.00 0.00 0.00 0.00 51.96 50.16 1x4u s ALA 22 Cb -0.01 -3.04 -0.11 0.00 0.00 0.00 0.00 23.12 19.96 1x4u s ALA 22 CO 0.86 -1.58 1.54 0.99 0.00 0.00 0.00 175.76 177.56 1x4u s THR 23 N 2.09 2.05 -0.40 0.00 2.01 -1.26 -2.82 115.64 117.31 1x4u s THR 23 Ca 0.11 0.05 -0.12 0.00 0.31 0.00 0.00 61.69 62.04 1x4u s THR 23 Cb -0.17 -3.03 0.04 0.00 0.01 0.00 0.00 72.50 69.35 1x4u s THR 23 CO 0.13 0.01 0.26 -0.36 -0.69 0.00 0.00 174.62 173.97 1x4u s PHE 24 N -0.63 3.26 0.00 4.92 0.08 -1.26 -4.74 117.98 119.61 1x4u s PHE 24 Ca 0.57 -0.98 0.00 0.00 0.12 0.00 0.00 56.93 56.65 1x4u s PHE 24 Cb -0.47 -2.64 0.00 0.00 -0.57 0.00 0.00 43.02 39.34 1x4u s PHE 24 CO 0.57 -0.69 0.00 0.43 -0.10 0.00 0.00 175.22 175.43 1x4u n SER 25 N 5.04 0.00 0.00 1.36 7.64 -1.24 -4.92 113.62 121.50 1x4u n SER 25 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 1x4u n SER 25 Cb 0.45 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1x4u n SER 25 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1x4u n VAL 26 N -1.86 0.00 -0.01 0.44 0.24 -1.26 -4.91 118.33 110.96 1x4u n VAL 26 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 1x4u n VAL 26 Cb 0.00 -0.40 -0.00 0.00 -1.47 0.00 0.00 33.84 31.96 1x4u n VAL 26 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1x4u h LEU 27 N 0.00 -0.05 -9.72 1.34 -0.00 -1.94 -3.45 115.31 101.48 1x4u h LEU 27 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 57.88 57.37 1x4u h LEU 27 Cb 0.46 0.01 -0.03 0.00 -0.00 0.00 0.00 40.66 41.10 1x4u h LEU 27 CO 0.00 0.32 0.26 -0.75 -0.00 0.00 0.00 178.44 178.27 1x4u s LYS 28 N -1.62 4.69 -0.19 1.13 2.47 -1.26 -5.05 119.74 119.91 1x4u s LYS 28 Ca -0.01 1.31 -0.02 0.00 -1.56 0.00 0.00 55.97 55.69 1x4u s LYS 28 Cb 0.00 -3.28 -0.01 0.00 -1.46 0.00 0.00 37.83 33.08 1x4u s LYS 28 CO 0.02 0.52 -0.08 -1.59 0.16 0.00 0.00 175.35 174.39 1x4u s LYS 29 N -1.06 3.35 -0.67 4.03 0.00 -1.26 -3.70 119.74 120.44 1x4u s LYS 29 Ca 0.39 -0.65 -0.26 0.00 0.00 0.00 0.00 55.97 55.44 1x4u s LYS 29 Cb -0.24 -2.87 -0.11 0.00 0.00 0.00 0.00 37.83 34.60 1x4u s LYS 29 CO 0.29 -0.08 2.42 -2.13 0.00 0.00 0.00 175.35 175.84 1x4u n ARG 30 N 4.42 0.75 -1.87 1.78 0.63 -1.26 -4.29 116.66 116.82 1x4u n ARG 30 Ca -0.18 -0.46 -0.30 0.00 -0.92 0.00 0.00 57.85 55.98 1x4u n ARG 30 Cb 0.51 -3.53 0.19 0.00 0.45 0.00 0.00 32.46 30.08 1x4u n ARG 30 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1x4u s ARG 31 N 8.63 0.56 -0.06 -0.14 0.52 0.34 -4.83 118.95 123.98 1x4u s ARG 31 Ca 0.96 -0.36 0.02 0.00 -0.52 0.00 0.00 55.73 55.83 1x4u s ARG 31 Cb -0.17 -1.83 0.02 0.00 0.52 0.00 0.00 34.95 33.48 1x4u s ARG 31 CO 0.17 -2.47 -0.09 -1.12 0.02 0.00 0.00 175.30 171.81 1x4u s SER 32 N -4.81 1.46 0.94 0.23 0.01 -1.26 -1.96 113.70 108.32 1x4u s SER 32 Ca 0.73 -0.23 -0.11 0.00 1.31 0.00 0.00 55.95 57.65 1x4u s SER 32 Cb -0.05 -0.68 0.16 0.00 0.21 0.00 0.00 66.02 65.66 1x4u s SER 32 CO 0.53 -0.01 1.09 0.00 0.41 0.00 0.00 173.24 175.26 1x4u n SER 34 N -4.11 1.31 0.00 0.00 7.64 -0.92 -4.02 113.62 113.53 1x4u n SER 34 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1x4u n SER 34 Cb 0.54 1.05 0.00 0.00 -1.01 0.00 0.00 64.21 64.79 1x4u n SER 34 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1x4u n ASN 35 N -2.45 0.00 -0.09 6.43 5.15 -1.26 -4.60 115.26 118.44 1x4u n ASN 35 Ca -0.20 0.13 -0.08 0.00 -0.60 0.00 0.00 54.58 53.84 1x4u n ASN 35 Cb 0.87 -0.22 0.09 0.00 -0.53 0.00 0.00 39.78 39.99 1x4u n ASN 35 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1x4u n GLY 37 N -0.25 0.91 3.92 0.00 0.00 -1.26 -5.03 105.19 103.48 1x4u n GLY 37 Ca 0.00 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.15 1x4u n GLY 37 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x4u s ASN 38 N -2.88 4.75 0.08 1.61 0.01 -1.26 -4.73 114.94 112.53 1x4u s ASN 38 Ca 0.00 -1.12 -0.24 0.00 -0.71 0.00 0.00 52.86 50.79 1x4u s ASN 38 Cb 0.00 0.28 -0.06 0.00 0.41 0.00 0.00 41.25 41.88 1x4u s ASN 38 CO 0.00 -1.09 0.73 -0.44 -1.51 0.00 0.00 177.10 174.78 1x4u s SER 39 N -4.33 7.23 0.21 -1.22 0.01 -1.26 -1.12 113.70 113.22 1x4u s SER 39 Ca 0.41 1.46 -0.15 0.00 1.31 0.00 0.00 55.95 58.98 1x4u s SER 39 Cb -0.03 -2.45 0.01 0.00 0.21 0.00 0.00 66.02 63.76 1x4u s SER 39 CO 0.25 0.12 0.47 -0.36 0.41 0.00 0.00 173.24 174.14 1x4u s PHE 40 N -0.56 0.13 0.64 2.43 0.08 -0.83 -2.73 117.98 117.15 1x4u s PHE 40 Ca 0.36 -0.49 -0.02 0.00 0.12 0.00 0.00 56.93 56.90 1x4u s PHE 40 Cb -0.21 0.26 0.13 0.00 -0.57 0.00 0.00 43.02 42.63 1x4u s PHE 40 CO 0.23 -0.92 0.88 0.00 -0.10 0.00 0.00 175.22 175.31 1x4u n SER 42 N -3.04 0.06 -0.05 0.00 2.88 -1.26 -1.62 113.62 110.59 1x4u n SER 42 Ca 0.14 -1.26 -0.04 0.00 -1.33 0.00 0.00 58.87 56.39 1x4u n SER 42 Cb 0.50 -0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.85 1x4u n SER 42 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x4u n ARG 43 N -0.84 1.62 -0.06 -1.46 3.00 -1.26 -4.39 116.66 113.27 1x4u n ARG 43 Ca 0.18 -0.03 -0.14 0.00 -0.01 0.00 0.00 57.85 57.86 1x4u n ARG 43 Cb 0.09 -1.33 -0.14 0.00 0.00 0.00 0.00 32.46 31.09 1x4u n ARG 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1x4u n SER 46 N -0.51 4.33 -4.27 0.00 3.41 -1.24 -4.42 113.62 110.92 1x4u n SER 46 Ca 0.47 -3.77 -0.35 0.00 -0.26 0.00 0.00 58.87 54.95 1x4u n SER 46 Cb 0.94 -0.64 -0.14 0.00 -0.26 0.00 0.00 64.21 64.11 1x4u n SER 46 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1x4u s PHE 47 N -3.48 3.04 -0.11 7.33 0.08 -1.18 -4.98 117.98 118.69 1x4u s PHE 47 Ca 0.52 -1.20 -0.24 0.00 0.12 0.00 0.00 56.93 56.12 1x4u s PHE 47 Cb 0.43 -2.11 -0.03 0.00 -0.57 0.00 0.00 43.02 40.74 1x4u s PHE 47 CO 0.01 -0.63 0.76 0.15 -0.10 0.00 0.00 175.22 175.41 1x4u s LYS 48 N 1.42 4.38 0.02 0.44 1.02 -1.26 -0.31 119.74 125.45 1x4u s LYS 48 Ca 0.03 0.94 -0.04 0.00 0.02 0.00 0.00 55.97 56.92 1x4u s LYS 48 Cb -0.16 -3.50 -0.01 0.00 -0.52 0.00 0.00 37.83 33.64 1x4u s LYS 48 CO -0.03 -0.11 0.07 0.14 -0.92 0.00 0.00 175.35 174.51 1x4u s VAL 49 N 1.38 0.12 0.11 3.17 -7.23 0.60 -4.94 120.40 113.61 1x4u s VAL 49 Ca 0.38 -0.97 -0.31 0.00 -1.81 0.00 0.00 61.98 59.27 1x4u s VAL 49 Cb -0.17 -0.64 -0.08 0.00 0.56 0.00 0.00 36.38 36.05 1x4u s VAL 49 CO 0.16 -0.54 1.36 -2.16 -0.31 0.00 0.00 175.10 173.62 1x4u s PRO 50 N -2.05 4.34 -0.05 4.82 0.04 -1.26 -0.92 135.00 139.92 1x4u s PRO 50 Ca -0.10 2.03 -0.13 0.00 0.04 0.00 0.00 61.00 62.85 1x4u s PRO 50 Cb -0.05 -3.26 -0.31 0.00 0.04 0.00 0.00 34.50 30.93 1x4u s PRO 50 CO -0.02 -0.41 0.69 1.57 0.04 0.00 0.00 177.00 178.87 1x4u h LYS 51 N 6.75 0.39 -0.25 4.56 2.10 -1.80 -3.19 116.57 125.13 1x4u h LYS 51 Ca -0.42 -0.66 0.02 0.00 -2.00 0.00 0.00 60.65 57.59 1x4u h LYS 51 Cb 1.21 0.25 -0.03 0.00 -0.90 0.00 0.00 32.23 32.76 1x4u h LYS 51 CO 0.85 1.32 -0.15 0.45 -2.00 0.00 0.00 179.45 179.92 1x4u n SER 52 N -3.68 -0.27 -0.01 7.07 2.88 -1.24 0.18 113.62 118.56 1x4u n SER 52 Ca -0.24 0.92 -0.07 0.00 -1.33 0.00 0.00 58.87 58.16 1x4u n SER 52 Cb 1.04 -0.30 0.11 0.00 -0.75 0.00 0.00 64.21 64.32 1x4u n SER 52 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1x4u h SER 53 N 0.00 0.60 -2.34 -3.46 0.87 -1.86 -3.37 113.55 103.99 1x4u h SER 53 Ca 0.04 -0.26 -0.73 0.00 -1.23 0.00 0.00 61.79 59.61 1x4u h SER 53 Cb 0.10 -0.17 -0.18 0.00 -0.44 0.00 0.00 62.40 61.71 1x4u h SER 53 CO -0.24 0.92 1.12 -0.32 -0.53 0.00 0.00 176.83 177.79 1x4u s MET 54 N -4.29 3.93 0.00 2.24 -2.45 0.13 -4.84 119.30 114.03 1x4u s MET 54 Ca -0.07 -2.35 0.00 0.00 -1.25 0.00 0.00 55.69 52.01 1x4u s MET 54 Cb 0.12 -4.98 0.00 0.00 1.25 0.00 0.00 34.83 31.22 1x4u s MET 54 CO 0.82 -1.74 0.00 0.41 1.05 0.00 0.00 175.02 175.57 1x4u n GLY 55 N 4.48 0.25 3.80 2.11 0.00 -1.16 -4.55 105.19 110.11 1x4u n GLY 55 Ca 0.32 -1.33 -0.27 0.00 0.00 0.00 0.00 46.02 44.74 1x4u n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4u s ALA 56 N -1.69 3.58 0.53 4.61 0.00 -1.26 -5.01 121.76 122.52 1x4u s ALA 56 Ca 0.00 -1.19 -0.06 0.00 0.00 0.00 0.00 51.96 50.71 1x4u s ALA 56 Cb 0.00 -1.38 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 1x4u s ALA 56 CO 0.00 0.52 0.85 0.95 0.00 0.00 0.00 175.76 178.08 1x4u s THR 57 N -1.72 4.49 0.10 0.00 -4.23 -1.26 -4.43 115.64 108.59 1x4u s THR 57 Ca 0.31 0.21 -0.27 0.00 -1.18 0.00 0.00 61.69 60.76 1x4u s THR 57 Cb -0.10 -3.74 0.08 0.00 1.34 0.00 0.00 72.50 70.08 1x4u s THR 57 CO 0.23 -0.76 1.03 0.00 -0.54 0.00 0.00 174.62 174.59 1x4u s ALA 58 N -2.87 -1.80 0.15 3.99 0.00 -1.26 -4.95 121.76 115.02 1x4u s ALA 58 Ca 0.50 0.33 0.31 0.00 0.00 0.00 0.00 51.96 53.11 1x4u s ALA 58 Cb -0.10 0.55 1.30 0.00 0.00 0.00 0.00 23.12 24.87 1x4u s ALA 58 CO 0.46 -1.01 1.97 -1.00 0.00 0.00 0.00 175.76 176.17 1x4u h PRO 59 N 2.00 0.00 0.00 0.00 0.13 -2.03 -3.19 132.00 128.91 1x4u h PRO 59 Ca -0.25 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.76 1x4u h PRO 59 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1x4u h PRO 59 CO 0.26 0.06 -1.61 0.39 -0.23 0.00 0.00 178.00 176.88 1x4u n GLU 60 N -3.20 1.69 -0.24 0.86 1.02 -1.26 -4.56 120.64 114.94 1x4u n GLU 60 Ca 0.00 -0.04 0.09 0.00 -0.02 0.00 0.00 57.16 57.19 1x4u n GLU 60 Cb 0.32 -1.25 0.35 0.00 -0.02 0.00 0.00 31.44 30.84 1x4u n GLU 60 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x4u h ALA 61 N 0.65 1.74 -0.99 0.62 0.00 -1.92 -2.55 119.26 116.81 1x4u h ALA 61 Ca -0.18 -0.00 0.18 0.00 0.00 0.00 0.00 54.91 54.91 1x4u h ALA 61 Cb 1.22 -0.17 -0.17 0.00 0.00 0.00 0.00 17.79 18.67 1x4u h ALA 61 CO 0.01 0.09 -0.32 1.04 0.00 0.00 0.00 179.25 180.07 1x4u n GLN 62 N -4.52 -0.16 -2.80 0.00 6.02 -1.22 -1.34 117.38 113.37 1x4u n GLN 62 Ca 0.14 1.54 -0.29 0.00 -0.01 0.00 0.00 57.00 58.37 1x4u n GLN 62 Cb 0.34 -2.29 -0.02 0.00 1.02 0.00 0.00 30.24 29.29 1x4u n GLN 62 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1x4u n ARG 63 N -5.54 3.59 -4.48 -1.09 1.85 -0.97 -4.84 116.66 105.18 1x4u n ARG 63 Ca 0.13 -4.75 -0.25 0.00 -1.00 0.00 0.00 57.85 51.98 1x4u n ARG 63 Cb 0.45 -2.28 -0.10 0.00 -1.05 0.00 0.00 32.46 29.48 1x4u n ARG 63 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 1x4u s GLU 64 N -3.63 1.86 -0.05 2.89 2.56 -0.45 -5.07 118.70 116.82 1x4u s GLU 64 Ca 0.47 -1.86 -0.02 0.00 0.00 0.00 0.00 54.97 53.57 1x4u s GLU 64 Cb 0.29 -1.77 0.04 0.00 2.00 0.00 0.00 34.13 34.68 1x4u s GLU 64 CO -0.15 0.18 0.09 0.95 -0.56 0.00 0.00 175.26 175.77 1x4u s THR 65 N -2.57 -0.12 0.30 -1.70 -4.23 -1.26 -4.13 115.64 101.93 1x4u s THR 65 Ca 0.33 0.30 0.11 0.00 -1.18 0.00 0.00 61.69 61.25 1x4u s THR 65 Cb 0.00 -0.18 -0.05 0.00 1.34 0.00 0.00 72.50 73.61 1x4u s THR 65 CO 0.17 0.13 -0.16 0.68 -0.54 0.00 0.00 174.62 174.89 1x4u s VAL 66 N 1.70 2.35 -0.15 2.29 -7.23 -0.09 -4.91 120.40 114.36 1x4u s VAL 66 Ca -0.02 -2.33 -0.10 0.00 -1.81 0.00 0.00 61.98 57.72 1x4u s VAL 66 Cb -0.12 -2.41 -0.05 0.00 0.56 0.00 0.00 36.38 34.37 1x4u s VAL 66 CO -0.04 -0.34 0.19 -0.36 -0.31 0.00 0.00 175.10 174.24 1x4u s PHE 67 N -2.57 3.51 0.32 2.82 0.08 -1.26 -0.29 117.98 120.59 1x4u s PHE 67 Ca 0.30 0.51 0.03 0.00 0.12 0.00 0.00 56.93 57.90 1x4u s PHE 67 Cb -0.02 -2.14 -0.06 0.00 -0.57 0.00 0.00 43.02 40.24 1x4u s PHE 67 CO 0.15 0.46 0.07 0.14 -0.10 0.00 0.00 175.22 175.95 1x4u s VAL 68 N -0.21 1.00 0.17 -0.44 -7.23 0.58 -2.15 120.40 112.10 1x4u s VAL 68 Ca 0.14 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.18 1x4u s VAL 68 Cb -0.12 -2.71 -0.07 0.00 0.56 0.00 0.00 36.38 34.04 1x4u s VAL 68 CO 0.03 0.00 0.54 0.00 -0.31 0.00 0.00 175.10 175.35 1x4u n ALA 70 N 0.52 -0.53 -0.51 0.00 0.00 -0.11 0.13 120.51 120.01 1x4u n ALA 70 Ca -0.04 0.71 0.42 0.00 0.00 0.00 0.00 53.44 54.53 1x4u n ALA 70 Cb 0.52 -0.06 0.70 0.00 0.00 0.00 0.00 19.45 20.61 1x4u n ALA 70 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1x4u n SER 71 N -4.91 0.18 -0.06 0.00 7.64 -1.26 -0.46 113.62 114.74 1x4u n SER 71 Ca 0.02 1.32 -0.04 0.00 1.01 0.00 0.00 58.87 61.18 1x4u n SER 71 Cb 0.22 -0.65 -0.01 0.00 -1.01 0.00 0.00 64.21 62.75 1x4u n SER 71 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x4u h ASN 73 N -1.00 0.33 -0.55 0.00 -1.24 0.86 1.36 115.58 115.35 1x4u h ASN 73 Ca -0.01 0.22 -0.11 0.00 0.71 0.00 0.00 56.30 57.11 1x4u h ASN 73 Cb 0.38 0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.63 1x4u h ASN 73 CO -0.01 -0.33 -0.07 1.56 -1.29 0.00 0.00 177.43 177.29 1x4u h GLN 74 N 0.06 1.02 -0.16 6.67 1.08 -0.93 -1.30 115.11 121.56 1x4u h GLN 74 Ca 0.83 -0.36 -0.14 0.00 -1.45 0.00 0.00 58.65 57.53 1x4u h GLN 74 Cb 2.28 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 29.64 1x4u h GLN 74 CO -0.66 1.05 -0.46 1.15 -0.95 0.00 0.00 178.83 178.96 1x4u h THR 75 N 0.90 1.34 -0.04 -0.54 2.02 0.16 -3.22 112.91 113.52 1x4u h THR 75 Ca 0.15 -1.72 -0.00 0.00 0.77 0.00 0.00 66.41 65.60 1x4u h THR 75 Cb 0.64 2.01 -0.00 0.00 -1.74 0.00 0.00 68.15 69.05 1x4u h THR 75 CO 0.04 0.53 0.02 -0.07 0.37 0.00 0.00 175.52 176.41 1x4u h LEU 76 N 0.23 0.05 -3.79 2.58 3.38 -0.56 -2.80 115.31 114.41 1x4u h LEU 76 Ca -0.01 -0.06 -0.29 0.00 0.09 0.00 0.00 57.88 57.60 1x4u h LEU 76 Cb 1.08 -0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.70 1x4u h LEU 76 CO 0.10 0.10 0.19 -0.24 0.09 0.00 0.00 178.44 178.68 1x4u n SER 77 N -5.03 6.06 -0.13 -0.43 2.88 -0.49 -4.13 113.62 112.34 1x4u n SER 77 Ca -0.06 -2.89 -0.26 0.00 -1.33 0.00 0.00 58.87 54.33 1x4u n SER 77 Cb 0.06 -1.19 -0.09 0.00 -0.75 0.00 0.00 64.21 62.24 1x4u n SER 77 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1x4u n LYS 78 N 1.09 0.54 -1.69 -1.46 4.81 -1.06 -4.94 118.16 115.45 1x4u n LYS 78 Ca 0.33 0.23 -0.43 0.00 -0.87 0.00 0.00 58.31 57.56 1x4u n LYS 78 Cb 0.62 -1.41 -0.03 0.00 0.02 0.00 0.00 35.03 34.23 1x4u n LYS 78 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1x4u n SER 79 N -4.04 3.91 0.00 3.14 2.88 -1.26 -4.95 113.62 113.30 1x4u n SER 79 Ca -0.49 1.01 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 1x4u n SER 79 Cb 0.86 -1.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 1x4u n SER 79 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4u n GLY 80 N 4.12 5.44 0.00 0.46 0.00 -1.26 -4.98 105.19 108.97 1x4u n GLY 80 Ca 0.18 -1.26 0.06 0.00 0.00 0.00 0.00 46.02 44.99 1x4u n GLY 80 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4u n PRO 81 N 0.00 0.48 -0.24 1.61 -0.04 -1.26 -4.06 135.00 131.49 1x4u n PRO 81 Ca 0.00 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.58 1x4u n PRO 81 Cb 0.00 -1.36 0.23 0.00 -0.04 0.00 0.00 33.50 32.33 1x4u n PRO 81 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1x4u n SER 82 N -0.86 -0.05 -2.79 3.54 3.41 -1.26 -4.77 113.62 110.84 1x4u n SER 82 Ca 0.08 1.20 -0.15 0.00 -0.26 0.00 0.00 58.87 59.74 1x4u n SER 82 Cb 0.04 -0.45 0.06 0.00 -0.26 0.00 0.00 64.21 63.60 1x4u n SER 82 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1x4u n SER 83 N -4.93 -3.62 0.00 4.04 7.64 -1.26 -5.28 113.62 110.21 1x4u n SER 83 Ca 0.18 -0.43 0.00 0.00 1.01 0.00 0.00 58.87 59.63 1x4u n SER 83 Cb 0.58 -3.88 0.00 0.00 -1.01 0.00 0.00 64.21 59.90 1x4u n SER 83 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64