#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j4x h VAL 9 N 0.00 0.49 -0.31 2.46 2.07 -1.97 0.59 116.25 119.59 1j4x h VAL 9 Ca 0.00 -0.43 -0.15 0.00 0.82 0.00 0.00 66.70 66.94 1j4x h VAL 9 Cb 0.00 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1j4x h VAL 9 CO 0.00 0.09 -0.38 1.56 0.02 0.00 0.00 177.57 178.86 1j4x h GLN 10 N 0.00 0.80 -1.00 1.57 1.08 -2.00 -0.15 115.11 115.41 1j4x h GLN 10 Ca -0.00 -0.45 0.17 0.00 -1.45 0.00 0.00 58.65 56.91 1j4x h GLN 10 Cb 0.28 0.03 -0.10 0.00 -0.05 0.00 0.00 27.48 27.65 1j4x h GLN 10 CO 0.01 1.08 0.62 -0.44 -0.95 0.00 0.00 178.83 179.15 1j4x h ASP 11 N 0.57 0.81 0.03 1.46 5.19 -0.34 -1.26 116.42 122.89 1j4x h ASP 11 Ca 0.04 0.08 -0.23 0.00 -0.62 0.00 0.00 57.03 56.29 1j4x h ASP 11 Cb 0.97 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 40.41 1j4x h ASP 11 CO 0.09 0.35 -0.88 -0.07 -3.12 0.00 0.00 179.24 175.61 1j4x h LEU 12 N 0.82 0.81 -0.86 1.55 3.38 -0.28 -3.17 115.31 117.56 1j4x h LEU 12 Ca 0.54 -0.58 0.10 0.00 0.09 0.00 0.00 57.88 58.04 1j4x h LEU 12 Cb 0.77 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 41.20 1j4x h LEU 12 CO -0.33 1.37 0.50 0.78 0.09 0.00 0.00 178.44 180.85 1j4x h ASN 13 N 0.41 0.71 0.48 -0.43 2.35 0.13 -0.25 115.58 118.98 1j4x h ASN 13 Ca -0.08 0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 55.59 1j4x h ASN 13 Cb 1.50 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.77 1j4x h ASN 13 CO 0.17 0.39 -0.60 0.44 -1.65 0.00 0.00 177.43 176.19 1j4x h ASP 14 N 0.82 0.14 -0.67 5.81 3.32 -1.52 0.42 116.42 124.73 1j4x h ASP 14 Ca 0.42 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.31 1j4x h ASP 14 Cb 0.40 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 1j4x h ASP 14 CO -0.26 0.70 0.11 -0.07 -1.72 0.00 0.00 179.24 178.00 1j4x h LEU 15 N 0.09 1.07 -0.29 1.55 3.38 -1.14 -2.78 115.31 117.19 1j4x h LEU 15 Ca -0.01 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.62 1j4x h LEU 15 Cb 1.07 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1j4x h LEU 15 CO 0.08 1.05 -0.42 -0.07 0.09 0.00 0.00 178.44 179.18 1j4x h LEU 16 N 1.04 0.00 0.00 1.67 3.38 -0.61 -3.46 115.31 117.32 1j4x h LEU 16 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1j4x h LEU 16 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1j4x h LEU 16 CO 0.01 0.42 0.00 -1.54 0.09 0.00 0.00 178.44 177.42 1j4x n SER 17 N -3.28 0.00 -2.45 -0.43 3.41 0.14 -4.55 113.62 106.46 1j4x n SER 17 Ca 0.02 -0.31 -0.12 0.00 -0.26 0.00 0.00 58.87 58.20 1j4x n SER 17 Cb 0.65 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.64 1j4x n SER 17 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1j4x n ASP 18 N -0.93 3.18 0.00 4.04 5.75 -0.91 -4.92 116.55 122.75 1j4x n ASP 18 Ca 0.00 -2.86 0.00 0.00 -0.01 0.00 0.00 54.79 51.92 1j4x n ASP 18 Cb 0.00 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 39.67 1j4x n ASP 18 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1j4x n GLY 19 N -0.64 0.66 3.15 6.12 0.00 -1.26 -4.82 105.19 108.40 1j4x n GLY 19 Ca 0.25 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.24 1j4x n GLY 19 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j4x s SER 20 N -2.47 -0.62 0.00 1.61 0.15 -1.26 -4.94 113.70 106.17 1j4x s SER 20 Ca 0.00 0.39 0.00 0.00 0.70 0.00 0.00 55.95 57.04 1j4x s SER 20 Cb 0.00 1.52 0.00 0.00 -1.71 0.00 0.00 66.02 65.83 1j4x s SER 20 CO 0.00 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.93 1j4x n GLY 21 N 5.46 3.16 3.43 9.45 0.00 -1.26 -5.05 105.19 120.38 1j4x n GLY 21 Ca -0.06 -0.94 -0.44 0.00 0.00 0.00 0.00 46.02 44.58 1j4x n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j4x s TYR 23 N 2.23 2.07 0.21 0.00 1.51 -1.26 -2.15 117.35 119.95 1j4x s TYR 23 Ca 0.11 0.30 0.03 0.00 -1.01 0.00 0.00 57.07 56.49 1j4x s TYR 23 Cb -0.21 -3.63 -0.05 0.00 -0.11 0.00 0.00 41.96 37.96 1j4x s TYR 23 CO 0.10 -2.09 0.01 0.45 -1.11 0.00 0.00 175.55 172.91 1j4x s SER 24 N -4.74 1.50 0.11 2.29 0.15 -1.26 -4.93 113.70 106.82 1j4x s SER 24 Ca 0.68 -1.22 0.09 0.00 0.70 0.00 0.00 55.95 56.20 1j4x s SER 24 Cb -0.07 0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.28 1j4x s SER 24 CO 0.49 -0.56 -0.18 -0.76 1.20 0.00 0.00 173.24 173.42 1j4x s LEU 25 N -3.25 2.67 -0.46 3.45 1.02 -1.26 -4.39 118.68 116.46 1j4x s LEU 25 Ca 0.28 -0.55 -0.42 0.00 0.02 0.00 0.00 54.13 53.46 1j4x s LEU 25 Cb 0.06 -1.53 -0.18 0.00 0.02 0.00 0.00 46.19 44.56 1j4x s LEU 25 CO 0.07 0.19 1.71 -2.65 0.02 0.00 0.00 176.35 175.69 1j4x n PRO 26 N 0.88 0.00 0.06 1.29 -0.02 -1.23 -4.78 135.00 131.20 1j4x n PRO 26 Ca -0.16 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.43 1j4x n PRO 26 Cb 0.53 -1.38 0.43 0.00 -0.02 0.00 0.00 33.50 33.05 1j4x n PRO 26 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1j4x n SER 27 N 5.22 0.36 -3.54 2.55 3.41 -1.26 -4.80 113.62 115.56 1j4x n SER 27 Ca 0.39 0.58 -0.14 0.00 -0.26 0.00 0.00 58.87 59.44 1j4x n SER 27 Cb -0.05 -0.66 -0.05 0.00 -0.26 0.00 0.00 64.21 63.20 1j4x n SER 27 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j4x s GLN 28 N -3.14 0.86 0.00 4.33 -2.07 -1.26 -5.09 119.66 113.29 1j4x s GLN 28 Ca 0.07 0.12 0.02 0.00 -1.82 0.00 0.00 55.36 53.75 1j4x s GLN 28 Cb 0.11 0.40 0.12 0.00 -1.09 0.00 0.00 33.01 32.55 1j4x s GLN 28 CO 0.38 -0.29 0.57 -0.35 -1.32 0.00 0.00 175.29 174.28 1j4x n PRO 29 N 0.66 0.07 -3.60 9.60 -0.04 -1.26 -4.77 135.00 135.66 1j4x n PRO 29 Ca -0.14 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.21 1j4x n PRO 29 Cb 0.58 -1.46 -0.06 0.00 -0.04 0.00 0.00 33.50 32.52 1j4x n PRO 29 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1j4x s ASN 31 N -0.41 -0.89 -0.36 0.00 0.02 -0.51 -4.96 114.94 107.84 1j4x s ASN 31 Ca -0.00 1.47 -0.29 0.00 -1.02 0.00 0.00 52.86 53.02 1j4x s ASN 31 Cb -0.03 1.39 0.02 0.00 0.02 0.00 0.00 41.25 42.66 1j4x s ASN 31 CO -0.01 -0.24 1.10 -0.70 0.02 0.00 0.00 177.10 177.27 1j4x s GLU 32 N 1.35 3.97 0.15 -0.60 2.12 -1.26 -0.45 118.70 123.99 1j4x s GLU 32 Ca -0.08 0.95 0.23 0.00 0.36 0.00 0.00 54.97 56.44 1j4x s GLU 32 Cb -0.05 -3.79 0.21 0.00 0.26 0.00 0.00 34.13 30.77 1j4x s GLU 32 CO -0.15 -1.03 1.22 -0.39 -0.54 0.00 0.00 175.26 174.36 1j4x h VAL 33 N 5.87 0.00 -2.31 3.70 -1.51 -1.05 -3.47 116.25 117.49 1j4x h VAL 33 Ca -0.21 -0.66 -0.07 0.00 -1.23 0.00 0.00 66.70 64.52 1j4x h VAL 33 Cb 1.06 1.21 -0.22 0.00 -2.13 0.00 0.00 31.29 31.21 1j4x h VAL 33 CO 1.06 0.00 -0.01 0.42 -1.23 0.00 0.00 177.57 177.81 1j4x s THR 34 N -3.23 0.00 -0.34 7.19 -4.23 -1.12 -4.59 115.64 109.32 1j4x s THR 34 Ca 0.04 -0.03 -0.31 0.00 -1.18 0.00 0.00 61.69 60.20 1j4x s THR 34 Cb 0.12 -0.84 -0.13 0.00 1.34 0.00 0.00 72.50 72.99 1j4x s THR 34 CO 0.75 -0.02 1.11 -2.65 -0.54 0.00 0.00 174.62 173.27 1j4x n PRO 35 N 2.40 0.00 0.00 3.99 -0.02 -1.26 0.91 135.00 141.01 1j4x n PRO 35 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 1j4x n PRO 35 Cb 0.56 -1.01 0.00 0.00 -0.02 0.00 0.00 33.50 33.03 1j4x n PRO 35 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1j4x n ARG 36 N 2.92 0.00 -3.51 -0.52 1.74 -1.26 -4.98 116.66 111.04 1j4x n ARG 36 Ca 0.22 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.89 1j4x n ARG 36 Cb -0.04 -0.73 -0.10 0.00 -1.02 0.00 0.00 32.46 30.57 1j4x n ARG 36 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1j4x s ILE 37 N -0.84 5.16 -0.13 0.55 1.01 0.26 -2.40 121.20 124.80 1j4x s ILE 37 Ca 0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 60.65 60.11 1j4x s ILE 37 Cb 0.00 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1j4x s ILE 37 CO 0.00 -0.18 -0.05 -0.31 0.00 0.00 0.00 174.94 174.41 1j4x s TYR 38 N 1.68 3.00 -0.24 3.97 1.51 -0.68 -0.37 117.35 126.22 1j4x s TYR 38 Ca 0.05 -0.22 -0.03 0.00 -1.01 0.00 0.00 57.07 55.85 1j4x s TYR 38 Cb -0.18 -1.89 0.00 0.00 -0.11 0.00 0.00 41.96 39.78 1j4x s TYR 38 CO 0.10 0.06 -0.04 0.08 -1.11 0.00 0.00 175.55 174.64 1j4x s VAL 39 N 0.05 3.27 0.00 0.71 1.01 0.41 -0.18 120.40 125.68 1j4x s VAL 39 Ca -0.00 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1j4x s VAL 39 Cb -0.13 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.69 1j4x s VAL 39 CO 0.03 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.06 1j4x n GLY 40 N 4.77 4.02 0.00 4.51 0.00 -1.21 -1.43 105.19 115.85 1j4x n GLY 40 Ca -0.17 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1j4x n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1j4x n ASN 41 N -2.11 1.33 -0.06 1.61 0.23 -0.68 -3.52 115.26 112.06 1j4x n ASN 41 Ca 0.00 -0.73 -0.12 0.00 -0.53 0.00 0.00 54.58 53.20 1j4x n ASN 41 Cb 0.00 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 37.63 1j4x n ASN 41 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1j4x h ALA 42 N 0.70 -0.62 -0.43 -2.53 0.00 -1.11 -3.05 119.26 112.20 1j4x h ALA 42 Ca 0.00 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1j4x h ALA 42 Cb 0.00 0.92 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 1j4x h ALA 42 CO 0.00 -0.96 -0.34 0.66 0.00 0.00 0.00 179.25 178.61 1j4x h SER 43 N -0.44 -1.13 -0.26 0.00 4.64 -1.91 0.22 113.55 114.67 1j4x h SER 43 Ca 0.09 0.20 0.06 0.00 -0.47 0.00 0.00 61.79 61.67 1j4x h SER 43 Cb 0.62 0.53 -0.06 0.00 -0.31 0.00 0.00 62.40 63.19 1j4x h SER 43 CO -0.50 -0.32 -0.11 0.58 -0.87 0.00 0.00 176.83 175.61 1j4x h VAL 44 N -0.25 0.64 -0.62 0.95 2.07 -1.87 0.77 116.25 117.95 1j4x h VAL 44 Ca 0.18 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.83 1j4x h VAL 44 Cb 0.55 0.64 -0.10 0.00 -1.52 0.00 0.00 31.29 30.86 1j4x h VAL 44 CO -0.57 0.00 0.01 0.00 0.02 0.00 0.00 177.57 177.04 1j4x h ALA 45 N 1.16 0.63 -0.39 1.67 0.00 -1.25 0.27 119.26 121.34 1j4x h ALA 45 Ca 0.13 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1j4x h ALA 45 Cb 0.27 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1j4x h ALA 45 CO -0.30 -0.39 0.00 0.00 0.00 0.00 0.00 179.25 178.56 1j4x n GLN 46 N -5.27 2.60 -3.89 0.00 10.64 0.70 -4.53 117.38 117.62 1j4x n GLN 46 Ca 0.09 -1.69 -0.28 0.00 -1.83 0.00 0.00 57.00 53.28 1j4x n GLN 46 Cb 0.36 -1.62 -0.12 0.00 -0.86 0.00 0.00 30.24 28.00 1j4x n GLN 46 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1j4x s ASP 47 N -0.75 4.88 0.22 2.61 2.15 0.24 -4.98 116.67 121.03 1j4x s ASP 47 Ca 0.30 -3.85 -0.09 0.00 0.43 0.00 0.00 52.55 49.35 1j4x s ASP 47 Cb 0.19 -1.65 0.32 0.00 -0.30 0.00 0.00 42.92 41.48 1j4x s ASP 47 CO 0.15 -0.09 1.73 0.40 -0.17 0.00 0.00 175.17 177.19 1j4x h ILE 48 N 4.40 0.70 0.00 4.11 2.04 -1.80 -0.43 117.51 126.52 1j4x h ILE 48 Ca 0.14 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.88 1j4x h ILE 48 Cb 0.76 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1j4x h ILE 48 CO 0.72 0.06 0.00 -2.65 0.00 0.00 0.00 178.15 176.29 1j4x n PRO 49 N -5.05 0.15 -0.07 2.37 -0.02 -1.26 -1.81 135.00 129.31 1j4x n PRO 49 Ca 0.10 0.18 -0.22 0.00 -2.02 0.00 0.00 63.50 61.54 1j4x n PRO 49 Cb 0.32 -1.50 -0.12 0.00 -0.02 0.00 0.00 33.50 32.18 1j4x n PRO 49 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1j4x n LYS 50 N -1.27 0.66 -0.17 -0.52 4.81 -0.20 -3.32 118.16 118.14 1j4x n LYS 50 Ca 0.05 0.37 0.17 0.00 -0.87 0.00 0.00 58.31 58.04 1j4x n LYS 50 Cb 0.08 -1.68 0.53 0.00 0.02 0.00 0.00 35.03 33.98 1j4x n LYS 50 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1j4x h LEU 51 N -0.47 0.35 0.48 3.14 3.38 -1.08 0.99 115.31 122.09 1j4x h LEU 51 Ca -0.44 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 1j4x h LEU 51 Cb 1.69 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.40 1j4x h LEU 51 CO -0.10 0.17 -0.23 1.56 0.09 0.00 0.00 178.44 179.92 1j4x h GLN 52 N 0.36 -0.63 -0.22 1.13 4.20 -1.48 0.21 115.11 118.69 1j4x h GLN 52 Ca 0.39 0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.15 1j4x h GLN 52 Cb 0.97 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 1j4x h GLN 52 CO -0.12 -0.33 0.15 -0.22 -0.67 0.00 0.00 178.83 177.65 1j4x h LYS 53 N -0.90 0.24 0.00 1.46 3.64 -1.21 2.28 116.57 122.08 1j4x h LYS 53 Ca -0.07 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1j4x h LYS 53 Cb 0.59 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1j4x h LYS 53 CO 0.11 0.16 0.00 1.28 -2.27 0.00 0.00 179.45 178.73 1j4x n LEU 54 N -4.50 0.00 -2.25 5.20 4.77 0.33 -4.85 117.00 115.69 1j4x n LEU 54 Ca 0.01 0.41 -0.17 0.00 -0.03 0.00 0.00 56.01 56.22 1j4x n LEU 54 Cb 0.11 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 40.78 1j4x n LEU 54 CO 0.35 -0.06 -0.21 0.61 -1.33 0.00 0.00 177.39 176.75 1j4x n GLY 55 N 1.02 -0.12 3.75 -0.72 0.00 0.77 -4.92 105.19 104.97 1j4x n GLY 55 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1j4x n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j4x s ILE 56 N -2.79 3.85 0.00 -0.61 -1.09 0.08 -4.34 121.20 116.30 1j4x s ILE 56 Ca 0.00 1.85 0.00 0.00 -2.23 0.00 0.00 60.65 60.27 1j4x s ILE 56 Cb 0.00 -4.18 0.00 0.00 -1.58 0.00 0.00 42.46 36.70 1j4x s ILE 56 CO 0.00 0.44 0.20 0.35 -1.23 0.00 0.00 174.94 174.70 1j4x n THR 57 N 1.43 0.00 -3.89 2.92 -2.24 0.79 -4.64 114.28 108.65 1j4x n THR 57 Ca -0.01 -0.48 -0.14 0.00 -2.27 0.00 0.00 64.05 61.15 1j4x n THR 57 Cb 0.46 1.01 -0.15 0.00 -2.10 0.00 0.00 70.33 69.56 1j4x n THR 57 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1j4x s HIS 58 N -0.56 0.10 0.02 4.78 3.76 -0.68 -0.28 115.29 122.44 1j4x s HIS 58 Ca 0.00 0.02 0.07 0.00 -0.15 0.00 0.00 55.06 55.00 1j4x s HIS 58 Cb 0.00 -0.14 -0.03 0.00 1.11 0.00 0.00 32.58 33.52 1j4x s HIS 58 CO 0.00 -0.04 -0.19 0.08 -0.85 0.00 0.00 174.74 173.74 1j4x s VAL 59 N 0.38 2.70 -0.23 -0.90 1.01 0.24 0.81 120.40 124.40 1j4x s VAL 59 Ca -0.03 -1.11 -0.02 0.00 0.00 0.00 0.00 61.98 60.82 1j4x s VAL 59 Cb -0.05 -2.09 0.07 0.00 0.00 0.00 0.00 36.38 34.31 1j4x s VAL 59 CO -0.01 0.42 0.04 -0.22 0.00 0.00 0.00 175.10 175.33 1j4x s LEU 60 N -1.19 1.61 -0.44 3.92 2.96 -0.77 -1.04 118.68 123.72 1j4x s LEU 60 Ca 0.13 -1.09 -0.20 0.00 -0.22 0.00 0.00 54.13 52.74 1j4x s LEU 60 Cb -0.10 -0.73 0.03 0.00 0.50 0.00 0.00 46.19 45.88 1j4x s LEU 60 CO 0.03 -0.33 0.63 0.21 -1.32 0.00 0.00 176.35 175.57 1j4x s ASN 61 N 1.75 6.31 0.00 3.68 3.84 -0.24 -0.28 114.94 129.99 1j4x s ASN 61 Ca 0.02 -0.41 0.23 0.00 0.21 0.00 0.00 52.86 52.91 1j4x s ASN 61 Cb -0.17 -2.31 0.79 0.00 -0.55 0.00 0.00 41.25 39.01 1j4x s ASN 61 CO -0.13 -0.78 1.58 0.00 -2.79 0.00 0.00 177.10 174.99 1j4x n ALA 62 N 6.22 2.53 -2.48 1.71 0.00 0.12 -0.25 120.51 128.35 1j4x n ALA 62 Ca -0.02 -0.54 -0.17 0.00 0.00 0.00 0.00 53.44 52.70 1j4x n ALA 62 Cb 0.48 -1.08 0.02 0.00 0.00 0.00 0.00 19.45 18.87 1j4x n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j4x n ALA 63 N 0.42 4.23 -2.07 0.00 0.00 -1.15 -3.39 120.51 118.55 1j4x n ALA 63 Ca 0.17 -3.65 -0.42 0.00 0.00 0.00 0.00 53.44 49.54 1j4x n ALA 63 Cb 0.37 -0.65 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 1j4x n ALA 63 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1j4x s GLU 64 N -3.49 4.24 0.00 0.00 2.12 0.53 -0.94 118.70 121.16 1j4x s GLU 64 Ca 0.40 2.15 0.00 0.00 0.36 0.00 0.00 54.97 57.88 1j4x s GLU 64 Cb 0.41 -3.58 0.00 0.00 0.26 0.00 0.00 34.13 31.21 1j4x s GLU 64 CO -0.06 -0.66 0.00 0.41 -0.54 0.00 0.00 175.26 174.42 1j4x n GLY 65 N 3.82 -1.65 0.27 -1.50 0.00 -1.11 -4.13 105.19 100.89 1j4x n GLY 65 Ca 0.14 -1.24 0.08 0.00 0.00 0.00 0.00 46.02 45.00 1j4x n GLY 65 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1j4x n ARG 66 N -0.17 1.94 -2.42 1.61 1.85 -1.26 -0.91 116.66 117.31 1j4x n ARG 66 Ca 0.00 -2.48 -0.25 0.00 -1.00 0.00 0.00 57.85 54.13 1j4x n ARG 66 Cb 0.00 -1.50 0.11 0.00 -1.05 0.00 0.00 32.46 30.01 1j4x n ARG 66 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 1j4x s SER 67 N -2.34 4.33 0.42 2.89 1.04 -1.26 -4.93 113.70 113.85 1j4x s SER 67 Ca 0.30 -0.08 0.29 0.00 0.48 0.00 0.00 55.95 56.94 1j4x s SER 67 Cb 0.25 -0.35 1.47 0.00 0.10 0.00 0.00 66.02 67.49 1j4x s SER 67 CO 0.05 -1.88 1.89 2.19 0.98 0.00 0.00 173.24 176.47 1j4x h PHE 68 N -0.66 0.00 -0.52 5.02 -0.00 -2.03 -2.24 116.94 116.52 1j4x h PHE 68 Ca -0.40 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.57 1j4x h PHE 68 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.22 1j4x h PHE 68 CO -0.20 0.00 0.00 -1.33 -0.00 0.00 0.00 178.31 176.78 1j4x n MET 69 N -2.56 3.38 -4.48 6.09 2.81 -1.26 -5.00 117.12 116.10 1j4x n MET 69 Ca -0.01 -2.69 -0.23 0.00 -1.81 0.00 0.00 57.70 52.96 1j4x n MET 69 Cb 0.11 -1.74 -0.11 0.00 -0.71 0.00 0.00 33.22 30.78 1j4x n MET 69 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 1j4x s HIS 70 N -1.81 2.08 -0.26 2.03 3.76 -0.84 -4.75 115.29 115.49 1j4x s HIS 70 Ca 0.43 -0.78 0.00 0.00 -0.15 0.00 0.00 55.06 54.56 1j4x s HIS 70 Cb 0.28 -1.31 0.04 0.00 1.11 0.00 0.00 32.58 32.70 1j4x s HIS 70 CO 0.20 0.22 -0.08 0.08 -0.85 0.00 0.00 174.74 174.31 1j4x s VAL 71 N -3.05 2.56 -1.45 -0.90 1.01 -0.12 -4.66 120.40 113.79 1j4x s VAL 71 Ca 0.33 -1.32 -0.10 0.00 0.00 0.00 0.00 61.98 60.89 1j4x s VAL 71 Cb 0.07 -2.39 0.04 0.00 0.00 0.00 0.00 36.38 34.10 1j4x s VAL 71 CO 0.15 0.08 2.42 -3.20 0.00 0.00 0.00 175.10 174.55 1j4x n ASN 72 N 4.57 6.38 -2.05 3.32 2.85 -0.09 -2.73 115.26 127.51 1j4x n ASN 72 Ca -0.15 -2.86 -0.00 0.00 -0.11 0.00 0.00 54.58 51.45 1j4x n ASN 72 Cb 0.45 -1.54 0.00 0.00 1.24 0.00 0.00 39.78 39.93 1j4x n ASN 72 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1j4x n THR 73 N 3.68 0.00 0.00 -0.44 -2.24 -1.26 -5.02 114.28 109.00 1j4x n THR 73 Ca 0.60 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 62.35 1j4x n THR 73 Cb 0.31 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.81 1j4x n THR 73 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1j4x n ASN 74 N -2.47 0.00 0.00 3.42 6.94 -1.26 -4.83 115.26 117.06 1j4x n ASN 74 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1j4x n ASN 74 Cb 0.01 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.43 1j4x n ASN 74 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1j4x n ALA 75 N -0.48 0.00 0.28 -2.53 0.00 -1.26 -0.84 120.51 115.68 1j4x n ALA 75 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 1j4x n ALA 75 Cb 0.00 0.32 0.89 0.00 0.00 0.00 0.00 19.45 20.65 1j4x n ALA 75 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1j4x h ASN 76 N 0.00 0.00 -0.79 0.00 -0.00 -1.97 0.58 115.58 113.40 1j4x h ASN 76 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 56.30 56.28 1j4x h ASN 76 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 38.28 1j4x h ASN 76 CO 0.00 0.00 0.42 0.15 -0.00 0.00 0.00 177.43 178.00 1j4x h PHE 77 N 0.00 1.12 -0.00 4.14 3.57 -1.38 -1.94 116.94 122.44 1j4x h PHE 77 Ca 0.04 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1j4x h PHE 77 Cb 0.56 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.95 1j4x h PHE 77 CO 0.00 0.79 -0.30 0.66 -2.23 0.00 0.00 178.31 177.22 1j4x n TYR 78 N -4.33 0.00 -1.74 0.41 4.01 0.20 -4.89 117.16 110.82 1j4x n TYR 78 Ca 0.08 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.46 1j4x n TYR 78 Cb 0.12 -0.24 0.07 0.00 -0.31 0.00 0.00 39.34 38.98 1j4x n TYR 78 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1j4x s LYS 79 N -2.78 2.55 -1.75 -0.72 2.20 -0.73 -3.54 119.74 114.97 1j4x s LYS 79 Ca 0.18 2.02 -0.16 0.00 -0.36 0.00 0.00 55.97 57.64 1j4x s LYS 79 Cb 0.19 -1.85 0.16 0.00 -1.51 0.00 0.00 37.83 34.81 1j4x s LYS 79 CO 0.59 -1.59 0.50 -3.47 -0.36 0.00 0.00 175.35 171.03 1j4x n ASP 80 N -1.95 -1.47 0.00 1.43 2.03 -1.26 -4.62 116.55 110.71 1j4x n ASP 80 Ca 0.15 -1.19 0.00 0.00 0.52 0.00 0.00 54.79 54.27 1j4x n ASP 80 Cb 0.48 -1.93 0.00 0.00 -0.72 0.00 0.00 41.12 38.95 1j4x n ASP 80 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1j4x n SER 81 N -2.62 0.22 -3.08 1.67 3.41 -1.24 -5.05 113.62 106.93 1j4x n SER 81 Ca -0.01 -1.03 -0.14 0.00 -0.26 0.00 0.00 58.87 57.42 1j4x n SER 81 Cb 0.53 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.49 1j4x n SER 81 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j4x n GLY 82 N -0.02 0.07 2.80 5.00 0.00 -1.24 -5.02 105.19 106.79 1j4x n GLY 82 Ca 0.00 0.42 -0.19 0.00 0.00 0.00 0.00 46.02 46.25 1j4x n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j4x s ILE 83 N -1.07 0.22 0.08 -0.61 1.01 -1.23 -5.00 121.20 114.60 1j4x s ILE 83 Ca 0.14 0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.60 1j4x s ILE 83 Cb -0.01 -0.34 -0.05 0.00 0.01 0.00 0.00 42.46 42.07 1j4x s ILE 83 CO 0.32 0.18 1.02 -0.89 0.00 0.00 0.00 174.94 175.57 1j4x s THR 84 N 1.32 4.46 0.06 2.92 2.01 0.62 -4.70 115.64 122.33 1j4x s THR 84 Ca -0.05 1.91 0.09 0.00 0.31 0.00 0.00 61.69 63.95 1j4x s THR 84 Cb -0.13 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.12 1j4x s THR 84 CO -0.02 0.23 -0.24 -0.47 -0.69 0.00 0.00 174.62 173.43 1j4x s TYR 85 N 0.42 2.40 -0.14 4.92 5.04 -1.26 -0.59 117.35 128.14 1j4x s TYR 85 Ca 0.50 -0.36 -0.06 0.00 -2.44 0.00 0.00 57.07 54.72 1j4x s TYR 85 Cb -0.24 -1.39 0.06 0.00 0.35 0.00 0.00 41.96 40.74 1j4x s TYR 85 CO 0.30 0.21 0.31 -1.17 -1.34 0.00 0.00 175.55 173.85 1j4x s LEU 86 N -1.47 -0.18 0.18 6.97 2.96 -0.21 -4.96 118.68 121.97 1j4x s LEU 86 Ca 0.13 0.69 0.04 0.00 -0.22 0.00 0.00 54.13 54.77 1j4x s LEU 86 Cb -0.10 0.91 -0.04 0.00 0.50 0.00 0.00 46.19 47.46 1j4x s LEU 86 CO 0.04 -0.22 0.24 -0.83 -1.32 0.00 0.00 176.35 174.26 1j4x s GLY 87 N 2.08 1.60 -0.18 7.98 0.00 -1.26 -1.08 107.32 116.46 1j4x s GLY 87 Ca -0.03 -1.16 -0.07 0.00 0.00 0.00 0.00 44.72 43.46 1j4x s GLY 87 CO -0.10 -1.17 0.38 -0.42 0.00 0.00 0.00 173.10 171.79 1j4x s ILE 88 N -1.83 -0.53 -1.25 0.90 1.01 0.65 -4.88 121.20 115.28 1j4x s ILE 88 Ca 0.33 0.19 -0.13 0.00 0.00 0.00 0.00 60.65 61.04 1j4x s ILE 88 Cb -0.10 -0.61 0.15 0.00 0.01 0.00 0.00 42.46 41.92 1j4x s ILE 88 CO 0.27 0.08 1.61 0.29 0.00 0.00 0.00 174.94 177.18 1j4x n LYS 89 N 5.25 3.39 -3.71 2.79 5.02 -1.26 -0.35 118.16 129.29 1j4x n LYS 89 Ca -0.10 -3.66 -0.20 0.00 -2.02 0.00 0.00 58.31 52.33 1j4x n LYS 89 Cb 0.50 -3.08 -0.01 0.00 -0.02 0.00 0.00 35.03 32.42 1j4x n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j4x s ALA 90 N 1.65 4.08 -0.12 7.82 0.00 -1.22 -4.89 121.76 129.08 1j4x s ALA 90 Ca 0.44 -1.36 -0.00 0.00 0.00 0.00 0.00 51.96 51.03 1j4x s ALA 90 Cb 0.02 -1.68 0.02 0.00 0.00 0.00 0.00 23.12 21.48 1j4x s ALA 90 CO 0.01 0.10 -0.09 -0.80 0.00 0.00 0.00 175.76 174.97 1j4x s ASN 91 N -4.08 2.28 -1.14 0.00 0.02 -1.26 -4.72 114.94 106.04 1j4x s ASN 91 Ca 0.40 -0.34 -0.14 0.00 -1.02 0.00 0.00 52.86 51.76 1j4x s ASN 91 Cb -0.09 -0.91 -0.07 0.00 0.02 0.00 0.00 41.25 40.20 1j4x s ASN 91 CO 0.30 -0.10 2.23 -0.67 0.02 0.00 0.00 177.10 178.87 1j4x n ASP 92 N 4.90 4.51 -4.02 -1.22 2.03 -1.26 -4.49 116.55 117.00 1j4x n ASP 92 Ca -0.13 -2.62 -0.10 0.00 0.52 0.00 0.00 54.79 52.45 1j4x n ASP 92 Cb 0.50 -1.34 -0.11 0.00 -0.72 0.00 0.00 41.12 39.45 1j4x n ASP 92 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1j4x s THR 93 N 3.65 0.30 0.65 5.18 -4.23 -1.26 -5.03 115.64 114.91 1j4x s THR 93 Ca 0.52 -1.05 0.38 0.00 -1.18 0.00 0.00 61.69 60.36 1j4x s THR 93 Cb 0.14 -0.50 0.39 0.00 1.34 0.00 0.00 72.50 73.87 1j4x s THR 93 CO -0.01 -0.49 2.21 1.56 -0.54 0.00 0.00 174.62 177.36 1j4x h GLN 94 N 4.46 0.00 -0.18 3.99 4.20 -1.94 -2.54 115.11 123.10 1j4x h GLN 94 Ca -0.34 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.34 1j4x h GLN 94 Cb 1.20 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.98 1j4x h GLN 94 CO 0.43 0.00 -0.01 0.93 -0.67 0.00 0.00 178.83 179.51 1j4x h GLU 95 N 0.00 0.32 -6.03 1.46 3.07 -1.96 -3.41 114.58 108.03 1j4x h GLU 95 Ca 0.01 -0.10 -0.77 0.00 -0.50 0.00 0.00 59.36 57.99 1j4x h GLU 95 Cb 0.24 -0.03 0.05 0.00 -0.84 0.00 0.00 28.75 28.18 1j4x h GLU 95 CO -0.00 0.54 0.06 0.34 -1.40 0.00 0.00 179.01 178.55 1j4x n PHE 96 N -4.71 0.66 -3.37 4.33 7.35 -0.96 -4.91 117.46 115.85 1j4x n PHE 96 Ca -0.05 1.01 -0.41 0.00 -0.76 0.00 0.00 57.45 57.25 1j4x n PHE 96 Cb 0.23 -2.11 -0.02 0.00 0.35 0.00 0.00 39.48 37.93 1j4x n PHE 96 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1j4x n ASN 97 N 1.62 5.20 0.24 -2.13 5.15 -1.26 -4.76 115.26 119.32 1j4x n ASN 97 Ca 0.20 -3.17 0.12 0.00 -0.60 0.00 0.00 54.58 51.12 1j4x n ASN 97 Cb 0.10 -1.21 0.50 0.00 -0.53 0.00 0.00 39.78 38.64 1j4x n ASN 97 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1j4x h LEU 98 N 6.04 0.00 0.00 1.20 5.85 -1.93 -2.16 115.31 124.31 1j4x h LEU 98 Ca 0.18 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1j4x h LEU 98 Cb 0.79 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.82 1j4x h LEU 98 CO 1.02 0.16 0.00 -1.54 -0.34 0.00 0.00 178.44 177.74 1j4x n SER 99 N -3.30 0.00 0.07 1.25 3.41 -1.26 -1.21 113.62 112.58 1j4x n SER 99 Ca 0.00 -0.56 0.12 0.00 -0.26 0.00 0.00 58.87 58.17 1j4x n SER 99 Cb 0.41 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.39 1j4x n SER 99 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j4x n ALA 100 N -0.79 2.79 -0.22 7.33 0.00 -0.81 -4.13 120.51 124.68 1j4x n ALA 100 Ca 0.05 -0.28 0.08 0.00 0.00 0.00 0.00 53.44 53.29 1j4x n ALA 100 Cb 0.02 -1.08 0.21 0.00 0.00 0.00 0.00 19.45 18.60 1j4x n ALA 100 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1j4x n TYR 101 N -2.39 0.63 0.05 0.00 4.02 -0.35 -4.76 117.16 114.36 1j4x n TYR 101 Ca 0.01 -0.49 -0.12 0.00 -0.01 0.00 0.00 57.90 57.29 1j4x n TYR 101 Cb 0.50 -0.02 -0.08 0.00 -0.02 0.00 0.00 39.34 39.73 1j4x n TYR 101 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 1j4x h PHE 102 N 2.86 -1.19 0.02 -0.72 0.04 -1.72 0.36 116.94 116.59 1j4x h PHE 102 Ca 0.00 0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.81 1j4x h PHE 102 Cb 0.82 0.52 -0.02 0.00 2.20 0.00 0.00 35.95 39.47 1j4x h PHE 102 CO 0.32 -0.44 -0.23 0.93 -0.60 0.00 0.00 178.31 178.29 1j4x h GLU 103 N -0.52 -0.29 -0.88 1.51 4.39 -1.90 0.53 114.58 117.42 1j4x h GLU 103 Ca 0.01 0.02 0.16 0.00 0.34 0.00 0.00 59.36 59.88 1j4x h GLU 103 Cb 0.55 0.07 -0.16 0.00 -0.10 0.00 0.00 28.75 29.11 1j4x h GLU 103 CO -0.26 -0.19 -0.28 -2.13 -1.16 0.00 0.00 179.01 174.98 1j4x n ARG 104 N -3.76 -0.14 0.38 2.33 0.63 -1.13 0.21 116.66 115.18 1j4x n ARG 104 Ca -0.03 1.37 -0.16 0.00 -0.92 0.00 0.00 57.85 58.11 1j4x n ARG 104 Cb 0.17 -2.04 -0.08 0.00 0.45 0.00 0.00 32.46 30.96 1j4x n ARG 104 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1j4x h ALA 105 N 1.50 -0.99 -0.36 5.13 0.00 -0.43 -2.38 119.26 121.73 1j4x h ALA 105 Ca 0.37 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1j4x h ALA 105 Cb 0.59 0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 1j4x h ALA 105 CO -0.90 -0.95 -0.01 0.00 0.00 0.00 0.00 179.25 177.40 1j4x h ALA 106 N -1.12 0.32 -1.00 0.00 0.00 0.17 0.04 119.26 117.67 1j4x h ALA 106 Ca -0.10 0.11 0.22 0.00 0.00 0.00 0.00 54.91 55.14 1j4x h ALA 106 Cb 0.77 0.19 -0.10 0.00 0.00 0.00 0.00 17.79 18.66 1j4x h ALA 106 CO 0.17 -0.41 0.62 -0.44 0.00 0.00 0.00 179.25 179.19 1j4x h ASP 107 N 0.09 0.62 -0.05 0.00 5.19 0.24 0.36 116.42 122.87 1j4x h ASP 107 Ca 0.18 0.09 -0.12 0.00 -0.62 0.00 0.00 57.03 56.55 1j4x h ASP 107 Cb 0.25 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 39.75 1j4x h ASP 107 CO -0.31 0.18 -0.45 0.15 -3.12 0.00 0.00 179.24 175.69 1j4x h PHE 108 N 0.58 0.55 -0.87 4.55 3.57 -0.51 -2.66 116.94 122.15 1j4x h PHE 108 Ca 0.58 -0.26 0.06 0.00 3.53 0.00 0.00 57.97 61.87 1j4x h PHE 108 Cb 1.16 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.77 1j4x h PHE 108 CO -0.00 1.05 0.57 0.82 -2.23 0.00 0.00 178.31 178.51 1j4x h ILE 109 N -0.11 1.08 -0.29 1.41 2.04 -0.32 0.42 117.51 121.74 1j4x h ILE 109 Ca -0.04 -0.34 -0.12 0.00 1.00 0.00 0.00 64.86 65.35 1j4x h ILE 109 Cb 1.13 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1j4x h ILE 109 CO 0.09 0.18 -0.34 0.44 0.00 0.00 0.00 178.15 178.53 1j4x h ASP 110 N 1.00 0.65 0.52 1.72 3.32 -0.89 -0.56 116.42 122.18 1j4x h ASP 110 Ca 0.37 -0.27 -0.18 0.00 0.02 0.00 0.00 57.03 56.97 1j4x h ASP 110 Cb 0.16 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1j4x h ASP 110 CO -0.13 0.94 -0.79 1.56 -1.72 0.00 0.00 179.24 179.10 1j4x h GLN 111 N 0.53 0.20 0.66 3.56 7.50 -1.00 -2.31 115.11 124.25 1j4x h GLN 111 Ca 0.06 -0.19 -0.02 0.00 0.50 0.00 0.00 58.65 58.99 1j4x h GLN 111 Cb 0.83 0.05 -0.01 0.00 0.05 0.00 0.00 27.48 28.40 1j4x h GLN 111 CO 0.07 0.89 -0.48 0.00 -1.50 0.00 0.00 178.83 177.81 1j4x h ALA 112 N 1.05 -1.16 -0.78 3.87 0.00 0.23 -3.07 119.26 119.39 1j4x h ALA 112 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1j4x h ALA 112 Cb 1.38 0.63 -0.04 0.00 0.00 0.00 0.00 17.79 19.76 1j4x h ALA 112 CO 0.12 -1.18 0.50 -0.07 0.00 0.00 0.00 179.25 178.62 1j4x h LEU 113 N -1.09 0.92 -1.97 0.00 3.38 -1.09 -3.16 115.31 112.30 1j4x h LEU 113 Ca -0.08 -0.04 0.40 0.00 0.09 0.00 0.00 57.88 58.25 1j4x h LEU 113 Cb 0.90 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.37 1j4x h LEU 113 CO 0.04 0.68 1.02 0.00 0.09 0.00 0.00 178.44 180.27 1j4x h ALA 114 N 1.48 3.31 -2.36 1.53 0.00 -1.31 -3.40 119.26 118.51 1j4x h ALA 114 Ca 0.29 -0.05 -0.48 0.00 0.00 0.00 0.00 54.91 54.67 1j4x h ALA 114 Cb -0.09 0.10 0.04 0.00 0.00 0.00 0.00 17.79 17.84 1j4x h ALA 114 CO -0.06 -1.73 0.39 -0.65 0.00 0.00 0.00 179.25 177.20 1j4x s GLN 115 N -4.90 3.68 0.51 0.00 -1.52 -1.19 -4.94 119.66 111.29 1j4x s GLN 115 Ca -0.05 1.37 0.30 0.00 -1.95 0.00 0.00 55.36 55.03 1j4x s GLN 115 Cb 0.24 -2.07 1.07 0.00 -0.22 0.00 0.00 33.01 32.02 1j4x s GLN 115 CO 0.81 -0.54 1.88 0.87 -0.25 0.00 0.00 175.29 178.06 1j4x h LYS 116 N 1.35 0.00 -0.55 2.91 6.56 -1.91 -2.68 116.57 122.25 1j4x h LYS 116 Ca -0.49 0.00 -0.38 0.00 -1.06 0.00 0.00 60.65 58.72 1j4x h LYS 116 Cb 1.23 0.00 -0.25 0.00 -0.57 0.00 0.00 32.23 32.63 1j4x h LYS 116 CO 0.58 0.05 -0.33 0.27 -2.06 0.00 0.00 179.45 177.97 1j4x n ASN 117 N -3.15 4.07 -4.66 0.86 6.94 -1.26 -5.01 115.26 113.06 1j4x n ASN 117 Ca 0.01 -3.79 -0.43 0.00 -0.02 0.00 0.00 54.58 50.35 1j4x n ASN 117 Cb 0.38 -0.54 -0.02 0.00 -2.36 0.00 0.00 39.78 37.23 1j4x n ASN 117 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1j4x s GLY 118 N -2.99 1.64 -0.10 4.83 0.00 -1.01 -4.84 107.32 104.84 1j4x s GLY 118 Ca 0.49 0.29 0.01 0.00 0.00 0.00 0.00 44.72 45.50 1j4x s GLY 118 CO 0.00 2.37 -0.09 0.50 0.00 0.00 0.00 173.10 175.88 1j4x s ARG 119 N 3.45 1.62 -0.14 2.90 0.52 -1.26 -4.62 118.95 121.41 1j4x s ARG 119 Ca 0.50 -0.32 -0.02 0.00 -0.52 0.00 0.00 55.73 55.37 1j4x s ARG 119 Cb -0.18 -1.54 -0.02 0.00 0.52 0.00 0.00 34.95 33.73 1j4x s ARG 119 CO 0.12 -0.16 -0.08 0.54 0.02 0.00 0.00 175.30 175.73 1j4x s VAL 120 N 1.33 3.48 -0.45 3.52 0.11 -1.01 0.28 120.40 127.66 1j4x s VAL 120 Ca -0.02 -0.51 -0.12 0.00 -2.93 0.00 0.00 61.98 58.40 1j4x s VAL 120 Cb -0.14 -2.50 0.08 0.00 -1.53 0.00 0.00 36.38 32.30 1j4x s VAL 120 CO -0.04 0.51 0.33 -0.22 -3.33 0.00 0.00 175.10 172.35 1j4x s LEU 121 N 0.33 5.43 -0.26 2.54 2.96 0.24 -1.69 118.68 128.22 1j4x s LEU 121 Ca -0.07 -1.47 -0.19 0.00 -0.22 0.00 0.00 54.13 52.18 1j4x s LEU 121 Cb -0.15 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.44 1j4x s LEU 121 CO 0.04 -0.61 0.58 -0.69 -1.32 0.00 0.00 176.35 174.36 1j4x s VAL 122 N 1.52 5.02 0.23 1.68 1.01 0.75 -1.85 120.40 128.75 1j4x s VAL 122 Ca 0.04 0.99 -0.02 0.00 0.00 0.00 0.00 61.98 62.99 1j4x s VAL 122 Cb -0.24 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1j4x s VAL 122 CO 0.04 0.03 0.20 -1.38 0.00 0.00 0.00 175.10 173.99 1j4x s HIS 123 N 2.43 1.13 0.00 5.22 -0.00 0.61 -3.29 115.29 121.39 1j4x s HIS 123 Ca 0.24 -1.33 0.00 0.00 -0.00 0.00 0.00 55.06 53.97 1j4x s HIS 123 Cb -0.15 -0.47 0.00 0.00 -0.00 0.00 0.00 32.58 31.95 1j4x s HIS 123 CO 0.09 -0.73 0.00 -1.13 -0.00 0.00 0.00 174.74 172.97 1j4x n SER 124 N -0.47 0.50 -0.05 7.38 3.41 -1.23 0.12 113.62 123.29 1j4x n SER 124 Ca 0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.60 1j4x n SER 124 Cb 0.65 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.59 1j4x n SER 124 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1j4x h ARG 125 N 0.00 0.00 0.00 4.33 9.65 -1.86 -2.90 114.38 123.60 1j4x h ARG 125 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1j4x h ARG 125 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1j4x h ARG 125 CO 0.00 0.00 -1.60 0.39 2.80 0.00 0.00 179.97 181.56 1j4x n GLU 126 N -4.00 0.47 -2.56 0.20 4.71 -1.26 -1.73 120.64 116.47 1j4x n GLU 126 Ca -0.05 -0.11 -0.06 0.00 -0.01 0.00 0.00 57.16 56.94 1j4x n GLU 126 Cb 0.17 -1.55 0.03 0.00 -1.01 0.00 0.00 31.44 29.08 1j4x n GLU 126 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1j4x n GLY 127 N 1.32 -0.60 0.00 0.62 0.00 -1.24 -4.39 105.19 100.90 1j4x n GLY 127 Ca -0.01 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1j4x n GLY 127 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1j4x n TYR 128 N -2.15 0.00 0.00 1.61 9.36 -1.26 -4.83 117.16 119.89 1j4x n TYR 128 Ca -0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.19 1j4x n TYR 128 Cb 0.55 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.26 1j4x n TYR 128 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1j4x n SER 129 N -0.29 0.00 -0.25 2.98 2.88 -1.26 -2.30 113.62 115.39 1j4x n SER 129 Ca 0.00 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.59 1j4x n SER 129 Cb 0.00 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.61 1j4x n SER 129 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1j4x h ARG 130 N 0.00 0.13 0.69 -1.46 3.08 -1.95 -1.21 114.38 113.65 1j4x h ARG 130 Ca 0.00 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1j4x h ARG 130 Cb 0.00 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.03 1j4x h ARG 130 CO 0.00 0.08 -0.33 0.66 -1.07 0.00 0.00 179.97 179.31 1j4x h SER 131 N 0.13 -0.78 -0.86 7.04 4.64 -1.90 -2.88 113.55 118.94 1j4x h SER 131 Ca 0.40 0.01 0.14 0.00 -0.47 0.00 0.00 61.79 61.86 1j4x h SER 131 Cb 0.70 0.20 -0.07 0.00 -0.31 0.00 0.00 62.40 62.92 1j4x h SER 131 CO -0.62 -0.41 0.56 -0.65 -0.87 0.00 0.00 176.83 174.84 1j4x h PRO 132 N -1.20 0.65 -0.31 4.77 0.11 -1.83 -2.48 132.00 131.71 1j4x h PRO 132 Ca -0.09 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 66.02 1j4x h PRO 132 Cb 0.72 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.64 1j4x h PRO 132 CO 0.15 0.43 0.05 1.15 -0.21 0.00 0.00 178.00 179.57 1j4x h THR 133 N 0.67 0.83 0.48 -1.15 2.02 -1.19 0.65 112.91 115.24 1j4x h THR 133 Ca 0.43 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.53 1j4x h THR 133 Cb 0.69 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1j4x h THR 133 CO -0.19 0.03 -0.28 -0.07 0.37 0.00 0.00 175.52 175.39 1j4x h LEU 134 N 0.15 -0.69 -0.96 2.58 3.38 -1.22 -1.58 115.31 116.98 1j4x h LEU 134 Ca 0.15 0.03 0.15 0.00 0.09 0.00 0.00 57.88 58.30 1j4x h LEU 134 Cb 0.17 0.19 -0.16 0.00 0.09 0.00 0.00 40.66 40.95 1j4x h LEU 134 CO -0.20 -0.44 -0.37 0.52 0.09 0.00 0.00 178.44 178.05 1j4x n VAL 135 N -4.06 -0.50 -0.19 1.22 0.31 -1.09 0.11 118.33 114.13 1j4x n VAL 135 Ca -0.09 2.24 -0.01 0.00 -0.01 0.00 0.00 64.34 66.48 1j4x n VAL 135 Cb 0.29 -2.97 0.09 0.00 -0.91 0.00 0.00 33.84 30.34 1j4x n VAL 135 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1j4x h ILE 136 N 0.00 0.78 -0.05 2.52 2.04 0.47 0.44 117.51 123.71 1j4x h ILE 136 Ca 0.34 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 66.02 1j4x h ILE 136 Cb 0.58 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1j4x h ILE 136 CO -0.95 0.07 -0.19 0.00 0.00 0.00 0.00 178.15 177.08 1j4x h ALA 137 N 1.40 1.59 -0.07 1.87 0.00 0.18 -1.86 119.26 122.37 1j4x h ALA 137 Ca 0.29 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1j4x h ALA 137 Cb 0.34 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1j4x h ALA 137 CO -0.29 0.30 -0.41 -0.92 0.00 0.00 0.00 179.25 177.93 1j4x h TYR 138 N 0.08 0.17 -0.15 0.00 3.20 0.12 -2.70 116.97 117.70 1j4x h TYR 138 Ca 0.02 -0.04 -0.17 0.00 3.14 0.00 0.00 58.73 61.67 1j4x h TYR 138 Cb 0.38 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1j4x h TYR 138 CO 0.00 0.54 -0.61 -0.07 -1.64 0.00 0.00 178.16 176.38 1j4x h LEU 139 N 0.12 0.57 -0.20 2.82 3.38 -0.63 -1.77 115.31 119.60 1j4x h LEU 139 Ca 0.01 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 1j4x h LEU 139 Cb 0.78 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1j4x h LEU 139 CO 0.06 1.04 0.01 0.24 0.09 0.00 0.00 178.44 179.89 1j4x h MET 140 N 0.37 0.34 0.00 1.13 2.86 -1.24 0.62 114.93 119.02 1j4x h MET 140 Ca -0.01 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1j4x h MET 140 Cb 1.16 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.78 1j4x h MET 140 CO 0.11 0.52 -0.78 0.00 1.06 0.00 0.00 176.91 177.83 1j4x n MET 141 N -4.71 0.22 -0.00 1.72 0.00 -1.06 -3.20 117.12 110.08 1j4x n MET 141 Ca -0.04 0.03 0.05 0.00 0.00 0.00 0.00 57.70 57.73 1j4x n MET 141 Cb 0.21 -1.60 -0.06 0.00 0.00 0.00 0.00 33.22 31.77 1j4x n MET 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1j4x n ARG 142 N -1.90 3.21 -0.70 3.17 5.12 -0.67 -4.57 116.66 120.33 1j4x n ARG 142 Ca 0.03 -0.02 0.05 0.00 -1.93 0.00 0.00 57.85 55.98 1j4x n ARG 142 Cb 0.41 -1.00 0.08 0.00 -1.16 0.00 0.00 32.46 30.79 1j4x n ARG 142 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 1j4x n GLN 143 N -1.34 0.61 -0.80 5.56 -0.06 0.22 -4.98 117.38 116.59 1j4x n GLN 143 Ca 0.01 -2.10 -0.04 0.00 -2.00 0.00 0.00 57.00 52.87 1j4x n GLN 143 Cb 0.17 -0.82 -0.02 0.00 -4.06 0.00 0.00 30.24 25.51 1j4x n GLN 143 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1j4x n LYS 144 N -0.41 -1.59 -2.82 3.69 4.01 -1.18 -4.89 118.16 114.96 1j4x n LYS 144 Ca 0.09 0.33 -0.39 0.00 -0.51 0.00 0.00 58.31 57.83 1j4x n LYS 144 Cb 0.81 -4.03 -0.06 0.00 -0.51 0.00 0.00 35.03 31.24 1j4x n LYS 144 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1j4x s MET 145 N -1.71 4.71 0.53 1.97 -1.94 -1.20 -3.51 119.30 118.16 1j4x s MET 145 Ca 0.00 1.36 -0.18 0.00 -1.71 0.00 0.00 55.69 55.16 1j4x s MET 145 Cb 0.00 -3.16 -0.06 0.00 2.01 0.00 0.00 34.83 33.62 1j4x s MET 145 CO 0.00 0.47 1.04 0.16 -0.01 0.00 0.00 175.02 176.68 1j4x s ASP 146 N -1.29 6.16 0.37 3.03 -4.77 -1.26 -4.22 116.67 114.69 1j4x s ASP 146 Ca 0.42 1.84 0.15 0.00 -3.30 0.00 0.00 52.55 51.66 1j4x s ASP 146 Cb -0.23 -2.54 1.01 0.00 -1.09 0.00 0.00 42.92 40.07 1j4x s ASP 146 CO 0.29 -0.91 1.78 1.62 0.70 0.00 0.00 175.17 178.64 1j4x h VAL 147 N 1.05 0.57 0.00 2.11 3.04 -1.94 0.34 116.25 121.42 1j4x h VAL 147 Ca -0.48 -0.16 -0.04 0.00 -1.01 0.00 0.00 66.70 65.00 1j4x h VAL 147 Cb 1.22 0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.54 1j4x h VAL 147 CO 0.59 0.09 -0.21 0.11 -1.01 0.00 0.00 177.57 177.13 1j4x h LYS 148 N 0.48 0.00 0.27 4.17 1.57 -2.00 -3.04 116.57 118.02 1j4x h LYS 148 Ca 0.58 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.35 1j4x h LYS 148 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1j4x h LYS 148 CO -0.32 0.21 -0.13 0.77 -0.57 0.00 0.00 179.45 179.41 1j4x h SER 149 N 0.00 -0.31 -0.99 0.86 0.02 -0.67 -3.08 113.55 109.39 1j4x h SER 149 Ca -0.00 0.01 0.18 0.00 -0.84 0.00 0.00 61.79 61.13 1j4x h SER 149 Cb 0.53 0.08 -0.10 0.00 0.14 0.00 0.00 62.40 63.05 1j4x h SER 149 CO 0.03 0.01 0.59 0.00 -1.14 0.00 0.00 176.83 176.32 1j4x h ALA 150 N -1.38 1.60 0.21 3.77 0.00 -1.60 -0.70 119.26 121.16 1j4x h ALA 150 Ca -0.04 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1j4x h ALA 150 Cb 0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1j4x h ALA 150 CO 0.06 -0.02 -0.34 1.25 0.00 0.00 0.00 179.25 180.20 1j4x h LEU 151 N 0.78 -0.96 -0.85 0.00 5.85 -1.66 0.11 115.31 118.58 1j4x h LEU 151 Ca 0.56 0.10 0.09 0.00 0.84 0.00 0.00 57.88 59.47 1j4x h LEU 151 Cb 0.81 0.35 -0.07 0.00 0.37 0.00 0.00 40.66 42.12 1j4x h LEU 151 CO -0.37 -0.45 0.50 0.28 -0.34 0.00 0.00 178.44 178.06 1j4x h SER 152 N -0.63 0.72 0.42 1.25 0.02 -1.06 2.07 113.55 116.34 1j4x h SER 152 Ca 0.01 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1j4x h SER 152 Cb 0.62 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1j4x h SER 152 CO -0.14 0.42 -0.20 0.40 -1.14 0.00 0.00 176.83 176.16 1j4x h ILE 153 N 0.84 0.55 -0.29 3.27 1.08 -0.90 0.36 117.51 122.42 1j4x h ILE 153 Ca 0.41 -0.40 0.05 0.00 -0.39 0.00 0.00 64.86 64.52 1j4x h ILE 153 Cb 0.35 0.73 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 1j4x h ILE 153 CO -0.24 0.07 0.01 0.58 -0.69 0.00 0.00 178.15 177.88 1j4x h VAL 154 N -0.81 0.80 -0.70 1.67 2.07 -0.38 -0.13 116.25 118.77 1j4x h VAL 154 Ca -0.06 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.45 1j4x h VAL 154 Cb 0.54 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 1j4x h VAL 154 CO 0.09 0.02 0.46 -0.09 0.02 0.00 0.00 177.57 178.07 1j4x h ARG 155 N 0.09 0.89 -0.18 1.57 9.65 0.35 -0.61 114.38 126.14 1j4x h ARG 155 Ca 0.14 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 58.93 1j4x h ARG 155 Cb 0.17 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 1j4x h ARG 155 CO -0.22 0.59 -0.04 1.96 2.80 0.00 0.00 179.97 185.05 1j4x h GLN 156 N 0.92 0.28 0.00 0.20 4.20 0.32 -2.68 115.11 118.34 1j4x h GLN 156 Ca 0.27 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.83 1j4x h GLN 156 Cb -0.06 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 1j4x h GLN 156 CO -0.08 0.34 -0.71 -0.91 -0.67 0.00 0.00 178.83 176.80 1j4x h ASN 157 N 0.27 0.00 -4.33 1.46 2.35 0.20 -3.46 115.58 112.06 1j4x h ASN 157 Ca 0.06 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.68 1j4x h ASN 157 Cb 0.26 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 38.40 1j4x h ASN 157 CO 0.01 0.43 -0.31 -0.60 -1.65 0.00 0.00 177.43 175.31 1j4x s ARG 158 N -3.01 0.50 -0.34 0.81 3.52 -0.36 -4.85 118.95 115.22 1j4x s ARG 158 Ca 0.02 0.18 -0.29 0.00 -0.13 0.00 0.00 55.73 55.51 1j4x s ARG 158 Cb 0.08 0.23 0.01 0.00 -1.56 0.00 0.00 34.95 33.71 1j4x s ARG 158 CO 0.76 -0.10 1.14 -1.21 -0.81 0.00 0.00 175.30 175.08 1j4x s GLU 159 N -0.46 3.97 0.22 5.12 8.01 -1.26 -4.12 118.70 130.19 1j4x s GLU 159 Ca -0.06 1.04 0.04 0.00 0.01 0.00 0.00 54.97 56.00 1j4x s GLU 159 Cb -0.04 -3.80 -0.05 0.00 -4.31 0.00 0.00 34.13 25.93 1j4x s GLU 159 CO 0.02 -1.04 -0.02 0.96 0.01 0.00 0.00 175.26 175.20 1j4x s ILE 160 N 3.97 1.05 -0.47 -1.63 -4.36 -1.26 -3.52 121.20 114.98 1j4x s ILE 160 Ca 0.49 -2.04 0.07 0.00 -0.26 0.00 0.00 60.65 58.91 1j4x s ILE 160 Cb -0.13 -2.28 0.19 0.00 1.25 0.00 0.00 42.46 41.49 1j4x s ILE 160 CO 0.20 -0.38 0.69 -0.83 0.24 0.00 0.00 174.94 174.86 1j4x s GLY 161 N -3.29 -1.27 0.46 6.27 0.00 -0.97 -4.68 107.32 103.84 1j4x s GLY 161 Ca 0.27 -0.15 -0.22 0.00 0.00 0.00 0.00 44.72 44.63 1j4x s GLY 161 CO 0.08 3.67 1.06 -4.14 0.00 0.00 0.00 173.10 173.77 1j4x s PRO 162 N 1.27 3.89 0.71 2.90 0.02 -1.23 -4.62 135.00 137.95 1j4x s PRO 162 Ca 0.24 1.47 -0.14 0.00 0.02 0.00 0.00 61.00 62.59 1j4x s PRO 162 Cb -0.02 -2.27 0.03 0.00 0.02 0.00 0.00 34.50 32.27 1j4x s PRO 162 CO -0.06 -0.38 1.14 0.54 -0.33 0.00 0.00 177.00 177.92 1j4x s ASN 163 N -1.77 4.57 0.61 2.53 2.20 -1.26 -4.71 114.94 117.10 1j4x s ASN 163 Ca 0.64 2.11 0.31 0.00 -0.94 0.00 0.00 52.86 54.98 1j4x s ASN 163 Cb -0.20 -2.56 1.73 0.00 -2.00 0.00 0.00 41.25 38.22 1j4x s ASN 163 CO 0.24 -2.00 2.10 0.44 -2.94 0.00 0.00 177.10 174.94 1j4x h ASP 164 N -0.35 0.00 0.06 3.54 3.32 -1.96 -1.10 116.42 119.93 1j4x h ASP 164 Ca -0.46 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.58 1j4x h ASP 164 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1j4x h ASP 164 CO 0.51 0.00 -0.03 1.23 -1.72 0.00 0.00 179.24 179.23 1j4x h GLY 165 N 0.00 -0.09 0.85 2.75 0.00 -1.89 0.22 103.07 104.90 1j4x h GLY 165 Ca 0.07 0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.48 1j4x h GLY 165 CO -0.00 -0.03 0.65 0.74 0.00 0.00 0.00 176.54 177.89 1j4x h PHE 166 N -0.49 1.21 0.38 5.60 0.04 -1.62 0.45 116.94 122.50 1j4x h PHE 166 Ca -0.01 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 1j4x h PHE 166 Cb 0.43 -0.40 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 1j4x h PHE 166 CO 0.06 0.68 -0.27 -0.07 -0.60 0.00 0.00 178.31 178.11 1j4x h LEU 167 N 1.23 -0.69 -1.36 1.54 3.38 -0.90 -1.49 115.31 117.02 1j4x h LEU 167 Ca 0.40 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.52 1j4x h LEU 167 Cb 0.04 0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 1j4x h LEU 167 CO -0.14 -0.41 0.52 0.00 0.09 0.00 0.00 178.44 178.50 1j4x h ALA 168 N -0.07 1.78 -0.63 1.53 0.00 0.20 0.00 119.26 122.07 1j4x h ALA 168 Ca -0.03 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1j4x h ALA 168 Cb 0.54 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1j4x h ALA 168 CO 0.01 0.05 0.24 1.96 0.00 0.00 0.00 179.25 181.51 1j4x h GLN 169 N 0.71 0.93 -0.42 0.00 4.20 0.87 -3.04 115.11 118.36 1j4x h GLN 169 Ca 0.37 -0.16 -0.08 0.00 0.06 0.00 0.00 58.65 58.84 1j4x h GLN 169 Cb 0.47 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1j4x h GLN 169 CO -0.14 0.77 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.67 1j4x h LEU 170 N 0.92 0.69 -0.88 1.46 3.38 -0.30 -2.85 115.31 117.74 1j4x h LEU 170 Ca 0.21 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1j4x h LEU 170 Cb 0.20 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1j4x h LEU 170 CO -0.02 0.79 0.19 0.00 0.09 0.00 0.00 178.44 179.49 1j4x h GLN 172 N 0.98 0.55 -0.49 0.00 4.20 -1.48 -1.23 115.11 117.63 1j4x h GLN 172 Ca 0.21 -0.09 0.06 0.00 0.06 0.00 0.00 58.65 58.90 1j4x h GLN 172 Cb 0.30 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.93 1j4x h GLN 172 CO -0.01 0.50 0.19 1.25 -0.67 0.00 0.00 178.83 180.10 1j4x h LEU 173 N 0.48 0.22 -0.71 1.46 5.85 -1.12 -1.76 115.31 119.72 1j4x h LEU 173 Ca 0.13 0.05 0.14 0.00 0.84 0.00 0.00 57.88 59.04 1j4x h LEU 173 Cb 0.14 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 41.09 1j4x h LEU 173 CO -0.02 0.16 0.24 -1.13 -0.34 0.00 0.00 178.44 177.35 1j4x h ASN 174 N 0.38 0.17 0.70 1.25 -1.24 0.14 -1.52 115.58 115.45 1j4x h ASN 174 Ca 0.23 0.12 0.00 0.00 0.71 0.00 0.00 56.30 57.36 1j4x h ASN 174 Cb 0.23 0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.40 1j4x h ASN 174 CO -0.22 0.06 -0.12 0.47 -1.29 0.00 0.00 177.43 176.32 1j4x n ASP 175 N -5.06 0.20 0.19 1.15 8.00 -0.74 0.04 116.55 120.33 1j4x n ASP 175 Ca 0.13 0.03 -0.08 0.00 0.71 0.00 0.00 54.79 55.58 1j4x n ASP 175 Cb 0.40 -0.23 -0.04 0.00 -0.02 0.00 0.00 41.12 41.23 1j4x n ASP 175 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1j4x h ARG 176 N 0.12 -0.53 -0.21 -1.24 2.43 -0.51 -2.89 114.38 111.56 1j4x h ARG 176 Ca 0.00 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1j4x h ARG 176 Cb 0.44 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.04 1j4x h ARG 176 CO 0.00 -0.35 -0.38 -0.07 -1.51 0.00 0.00 179.97 177.66 1j4x h LEU 177 N -1.04 -1.20 -0.90 3.80 3.38 -1.52 0.06 115.31 117.90 1j4x h LEU 177 Ca -0.06 0.17 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1j4x h LEU 177 Cb 0.42 0.51 -0.05 0.00 0.09 0.00 0.00 40.66 41.63 1j4x h LEU 177 CO 0.09 -0.38 0.58 0.00 0.09 0.00 0.00 178.44 178.82 1j4x h ALA 178 N 0.35 1.18 0.00 1.53 0.00 -0.51 1.31 119.26 123.11 1j4x h ALA 178 Ca 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1j4x h ALA 178 Cb 0.58 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1j4x h ALA 178 CO -0.43 0.44 -0.12 1.17 0.00 0.00 0.00 179.25 180.31 1j4x n LYS 179 N -4.52 0.21 -0.19 0.00 4.81 -1.05 -2.55 118.16 114.87 1j4x n LYS 179 Ca 0.11 0.15 0.11 0.00 -0.87 0.00 0.00 58.31 57.81 1j4x n LYS 179 Cb 0.09 -1.72 0.27 0.00 0.02 0.00 0.00 35.03 33.69 1j4x n LYS 179 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1j4x n GLU 180 N -2.07 2.24 -2.84 1.64 1.02 -0.02 -4.88 120.64 115.73 1j4x n GLU 180 Ca 0.05 -1.90 -0.20 0.00 -0.02 0.00 0.00 57.16 55.10 1j4x n GLU 180 Cb 0.41 -1.46 0.03 0.00 -0.02 0.00 0.00 31.44 30.40 1j4x n GLU 180 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j4x n GLY 181 N 1.38 -0.40 0.83 0.62 0.00 -0.75 -4.81 105.19 102.06 1j4x n GLY 181 Ca 0.18 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1j4x n GLY 181 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j4x n LYS 182 N -3.54 2.13 0.00 1.61 4.76 0.44 -4.90 118.16 118.66 1j4x n LYS 182 Ca -0.12 -1.66 0.00 0.00 -2.87 0.00 0.00 58.31 53.66 1j4x n LYS 182 Cb 0.62 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.34 1j4x n LYS 182 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1j4x n LEU 183 N 0.98 0.00 0.00 -0.35 4.77 -1.13 -4.78 117.00 116.50 1j4x n LEU 183 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1j4x n LEU 183 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1j4x n LEU 183 CO 0.15 0.00 0.00 1.17 -1.33 0.00 0.00 177.39 177.38 1j4x n LYS 184 N 0.00 0.00 0.00 3.23 4.81 -1.23 -4.84 118.16 120.13 1j4x n LYS 184 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.48 1j4x n LYS 184 Cb 0.00 0.00 0.25 0.00 0.02 0.00 0.00 35.03 35.30 1j4x n LYS 184 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27