#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ju4 n ASN 2 N 0.00 0.00 0.02 6.12 5.15 -1.26 -5.07 115.26 120.22 2ju4 n ASN 2 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2ju4 n ASN 2 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2ju4 n LEU 3 N 0.00 -0.01 -4.70 1.20 -0.00 -1.26 -5.06 117.00 107.17 2ju4 n LEU 3 Ca 0.00 0.08 -0.41 0.00 -0.00 0.00 0.00 56.01 55.68 2ju4 n LEU 3 Cb 0.00 0.06 -0.03 0.00 -0.00 0.00 0.00 43.42 43.45 2ju4 n LEU 3 CO 0.00 -0.55 0.61 -0.70 -0.00 0.00 0.00 177.39 176.75 2ju4 s GLU 4 N -1.17 4.48 -0.07 1.96 2.56 -1.26 -4.96 118.70 120.24 2ju4 s GLU 4 Ca 0.00 1.23 -0.41 0.00 0.00 0.00 0.00 54.97 55.79 2ju4 s GLU 4 Cb 0.00 -3.48 -0.20 0.00 2.00 0.00 0.00 34.13 32.45 2ju4 s GLU 4 CO 0.00 -0.09 1.19 -2.30 -0.56 0.00 0.00 175.26 173.50 2ju4 n PRO 5 N 4.17 0.12 -1.87 4.30 -0.02 -1.26 -4.92 135.00 135.52 2ju4 n PRO 5 Ca 0.04 0.05 -0.31 0.00 -2.02 0.00 0.00 63.50 61.25 2ju4 n PRO 5 Cb 0.51 -1.56 0.02 0.00 -0.02 0.00 0.00 33.50 32.44 2ju4 n PRO 5 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2ju4 s PRO 6 N 0.55 3.35 0.05 0.52 0.04 -1.26 -5.09 135.00 133.17 2ju4 s PRO 6 Ca 0.93 0.95 0.01 0.00 0.04 0.00 0.00 61.00 62.93 2ju4 s PRO 6 Cb -1.27 -2.05 -0.03 0.00 0.04 0.00 0.00 34.50 31.19 2ju4 s PRO 6 CO 0.60 -0.77 -0.06 0.15 0.04 0.00 0.00 177.00 176.96 2ju4 s LYS 7 N -4.74 0.57 0.66 4.56 3.01 -1.26 -5.13 119.74 117.41 2ju4 s LYS 7 Ca 0.58 -0.92 -0.17 0.00 -1.01 0.00 0.00 55.97 54.46 2ju4 s LYS 7 Cb -0.13 -0.15 -0.02 0.00 -1.01 0.00 0.00 37.83 36.52 2ju4 s LYS 7 CO 0.48 -0.00 1.00 0.00 0.51 0.00 0.00 175.35 177.34 2ju4 n ALA 8 N 0.99 0.13 -1.00 5.17 0.00 -1.26 -5.15 120.51 119.39 2ju4 n ALA 8 Ca -0.20 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2ju4 n ALA 8 Cb 0.57 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.88 2ju4 n ALA 8 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2ju4 n GLU 9 N -1.48 0.00 -0.01 0.00 0.00 -1.26 -5.26 120.64 112.63 2ju4 n GLU 9 Ca 0.14 0.00 -0.00 0.00 0.00 0.00 0.00 57.16 57.30 2ju4 n GLU 9 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.93 2ju4 n GLU 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2ju4 n ARG 11 N -0.31 -0.22 0.11 3.44 1.74 -1.26 -5.25 116.66 114.91 2ju4 n ARG 11 Ca 0.00 -0.02 0.10 0.00 -0.77 0.00 0.00 57.85 57.17 2ju4 n ARG 11 Cb 0.00 -0.03 0.01 0.00 -1.02 0.00 0.00 32.46 31.42 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2ju4 h SER 12 N -1.57 0.00 -4.76 0.55 0.02 -2.06 -3.50 113.55 102.23 2ju4 h SER 12 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ju4 h SER 12 Cb 0.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 2ju4 h SER 12 CO 0.00 0.06 -0.97 0.00 -1.14 0.00 0.00 176.83 174.78 2ju4 n ALA 13 N -2.19 -2.19 0.31 3.77 0.00 -1.26 -4.52 120.51 114.43 2ju4 n ALA 13 Ca -0.00 0.82 0.07 0.00 0.00 0.00 0.00 53.44 54.32 2ju4 n ALA 13 Cb 0.58 -2.02 0.36 0.00 0.00 0.00 0.00 19.45 18.36 2ju4 n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ju4 h THR 14 N 4.28 0.00 -5.41 0.00 1.03 -2.07 -3.45 112.91 107.29 2ju4 h THR 14 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.29 2ju4 h THR 14 Cb 0.26 0.29 -0.05 0.00 -1.07 0.00 0.00 68.15 67.59 2ju4 h THR 14 CO 0.00 0.00 -1.09 -1.14 -0.01 0.00 0.00 175.52 173.28 2ju4 n ARG 15 N -2.57 -3.16 0.00 0.00 0.63 -1.26 -4.95 116.66 105.35 2ju4 n ARG 15 Ca -0.01 2.55 0.00 0.00 -0.92 0.00 0.00 57.85 59.47 2ju4 n ARG 15 Cb 0.68 -4.05 0.00 0.00 0.45 0.00 0.00 32.46 29.54 2ju4 n ARG 15 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 2ju4 n VAL 16 N 1.40 0.00 -0.21 5.15 3.14 -1.26 -4.91 118.33 121.64 2ju4 n VAL 16 Ca -0.15 0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.23 2ju4 n VAL 16 Cb 0.31 0.00 0.25 0.00 -1.06 0.00 0.00 33.84 33.34 2ju4 n VAL 16 CO 0.00 0.00 0.00 0.24 -6.46 0.00 0.00 176.83 170.61 2ju4 h MET 17 N 0.00 0.97 0.00 1.45 2.86 -2.00 -3.41 114.93 114.81 2ju4 h MET 17 Ca 0.00 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2ju4 h MET 17 Cb 0.02 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.46 2ju4 h MET 17 CO 0.00 0.64 0.00 0.41 1.06 0.00 0.00 176.91 179.02 2ju4 n GLY 18 N -1.42 0.00 7.00 8.32 0.00 -1.26 -5.09 105.19 112.74 2ju4 n GLY 18 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2ju4 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ju4 n GLY 19 N 0.00 0.87 0.00 -0.02 0.00 -1.26 -4.91 105.19 99.86 2ju4 n GLY 19 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2ju4 n GLY 19 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ju4 n PRO 20 N 0.00 0.00 -3.56 1.61 -0.02 -1.26 -4.90 135.00 126.87 2ju4 n PRO 20 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.37 2ju4 n PRO 20 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.43 2ju4 n PRO 20 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2ju4 s THR 22 N 0.00 0.00 0.00 3.45 -1.32 -1.26 -5.16 115.64 111.35 2ju4 s THR 22 Ca 0.00 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 2ju4 s THR 22 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 2ju4 s THR 22 CO 0.00 0.00 0.00 -2.65 -2.21 0.00 0.00 174.62 169.76 2ju4 n PRO 23 N 0.60 0.00 0.00 7.08 -0.02 -1.26 -4.79 135.00 136.61 2ju4 n PRO 23 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 2ju4 n PRO 23 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.06 2ju4 n PRO 23 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2ju4 n ARG 24 N 0.00 0.00 -2.05 -0.52 1.85 -1.26 -4.57 116.66 110.11 2ju4 n ARG 24 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2ju4 n ARG 24 Cb 0.00 -0.09 0.00 0.00 -1.05 0.00 0.00 32.46 31.32 2ju4 n ARG 24 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2ju4 n LYS 25 N 0.00 -5.48 -2.21 2.89 4.76 -1.26 -4.57 118.16 112.29 2ju4 n LYS 25 Ca 0.00 3.89 -0.04 0.00 -2.87 0.00 0.00 58.31 59.29 2ju4 n LYS 25 Cb 0.00 -4.25 0.02 0.00 -1.84 0.00 0.00 35.03 28.96 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ju4 n GLY 26 N 1.52 -0.25 3.15 0.72 0.00 -1.26 -4.66 105.19 104.42 2ju4 n GLY 26 Ca 0.00 0.09 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 2ju4 n GLY 26 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ju4 n PRO 27 N -1.88 -3.08 -1.64 1.61 -0.02 -1.26 -4.39 135.00 124.35 2ju4 n PRO 27 Ca -0.02 -1.57 -0.49 0.00 -2.02 0.00 0.00 63.50 59.41 2ju4 n PRO 27 Cb 0.53 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.46 2ju4 n PRO 27 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2ju4 n PRO 28 N -4.61 1.76 0.00 0.52 -0.02 -1.26 -4.82 135.00 126.57 2ju4 n PRO 28 Ca 0.14 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2ju4 n PRO 28 Cb 0.53 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2ju4 n PRO 28 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2ju4 n LYS 29 N 3.29 0.00 -2.61 -0.52 4.76 -1.26 -5.14 118.16 116.68 2ju4 n LYS 29 Ca 0.18 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.61 2ju4 n LYS 29 Cb 0.25 0.00 0.07 0.00 -1.84 0.00 0.00 35.03 33.51 2ju4 n LYS 29 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2ju4 n LYS 31 N -1.00 1.42 -2.75 1.97 5.02 -1.26 -5.12 118.16 116.44 2ju4 n LYS 31 Ca 0.00 -2.53 -0.17 0.00 -2.02 0.00 0.00 58.31 53.60 2ju4 n LYS 31 Cb 0.00 -0.73 -0.03 0.00 -0.02 0.00 0.00 35.03 34.25 2ju4 n LYS 31 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ju4 n GLN 32 N -0.82 -0.89 0.00 1.97 -0.00 -1.26 -4.82 117.38 111.56 2ju4 n GLN 32 Ca -0.03 0.05 0.00 0.00 -0.00 0.00 0.00 57.00 57.02 2ju4 n GLN 32 Cb 0.85 -1.82 0.00 0.00 -0.00 0.00 0.00 30.24 29.27 2ju4 n GLN 32 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2ju4 n ARG 33 N -1.95 0.00 -3.83 2.61 3.00 -1.26 -4.80 116.66 110.43 2ju4 n ARG 33 Ca 0.03 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.52 2ju4 n ARG 33 Cb 0.19 0.00 0.03 0.00 0.00 0.00 0.00 32.46 32.68 2ju4 n ARG 33 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2ju4 n GLN 34 N 0.00 -1.04 -0.19 -0.14 0.00 -1.26 -4.81 117.38 109.94 2ju4 n GLN 34 Ca 0.00 0.33 0.00 0.00 -0.00 0.00 0.00 57.00 57.33 2ju4 n GLN 34 Cb 0.00 -3.65 0.09 0.00 0.00 0.00 0.00 30.24 26.68 2ju4 n GLN 34 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 2ju4 h THR 35 N -2.12 0.55 -0.34 1.69 2.02 -1.99 -3.37 112.91 109.34 2ju4 h THR 35 Ca -0.68 -0.05 -0.15 0.00 0.77 0.00 0.00 66.41 66.31 2ju4 h THR 35 Cb 1.38 0.40 -0.15 0.00 -1.74 0.00 0.00 68.15 68.04 2ju4 h THR 35 CO 0.50 0.03 -0.38 0.54 0.37 0.00 0.00 175.52 176.58 2ju4 n ARG 36 N -5.24 0.52 0.00 6.66 1.74 -1.26 -5.21 116.66 113.87 2ju4 n ARG 36 Ca 0.08 -1.55 0.00 0.00 -0.77 0.00 0.00 57.85 55.61 2ju4 n ARG 36 Cb 0.33 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 30.68 2ju4 n ARG 36 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ju4 n GLN 37 N 2.16 0.00 -2.77 5.56 3.00 -1.26 -5.06 117.38 119.02 2ju4 n GLN 37 Ca 0.11 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.99 2ju4 n GLN 37 Cb 0.62 0.00 0.02 0.00 0.00 0.00 0.00 30.24 30.88 2ju4 n GLN 37 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2ju4 n LYS 39 N 0.00 1.11 -3.12 -1.09 4.01 -1.26 -4.97 118.16 112.84 2ju4 n LYS 39 Ca 0.00 -3.21 -0.17 0.00 -0.51 0.00 0.00 58.31 54.41 2ju4 n LYS 39 Cb 0.00 -1.29 -0.05 0.00 -0.51 0.00 0.00 35.03 33.18 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2ju4 n SER 40 N -0.01 -1.75 -3.80 4.39 2.88 -1.26 -5.05 113.62 109.01 2ju4 n SER 40 Ca 0.12 -2.61 -0.28 0.00 -1.33 0.00 0.00 58.87 54.76 2ju4 n SER 40 Cb 0.79 0.43 -0.12 0.00 -0.75 0.00 0.00 64.21 64.56 2ju4 n SER 40 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2ju4 s LYS 41 N 0.39 2.00 0.58 -1.46 -2.85 -1.26 -2.59 119.74 114.55 2ju4 s LYS 41 Ca 0.32 -2.87 -0.08 0.00 -1.00 0.00 0.00 55.97 52.33 2ju4 s LYS 41 Cb 0.03 -2.96 -0.02 0.00 -2.06 0.00 0.00 37.83 32.82 2ju4 s LYS 41 CO -0.14 -1.26 0.94 -1.25 0.10 0.00 0.00 175.35 173.74 2ju4 s PRO 42 N -0.81 3.37 0.07 1.78 0.04 -1.26 -4.93 135.00 133.26 2ju4 s PRO 42 Ca 0.24 0.41 -0.32 0.00 0.04 0.00 0.00 61.00 61.37 2ju4 s PRO 42 Cb -0.09 -2.20 -0.11 0.00 0.04 0.00 0.00 34.50 32.14 2ju4 s PRO 42 CO -0.12 -0.53 1.87 -0.35 0.04 0.00 0.00 177.00 177.90 2ju4 n PRO 43 N -2.60 2.67 0.00 0.56 -0.04 -1.26 -4.65 135.00 129.69 2ju4 n PRO 43 Ca 0.04 0.97 0.00 0.00 -0.04 0.00 0.00 63.50 64.48 2ju4 n PRO 43 Cb 0.55 -2.87 0.00 0.00 -0.04 0.00 0.00 33.50 31.14 2ju4 n PRO 43 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2ju4 n LYS 44 N 6.18 0.00 0.00 0.54 3.00 -1.26 -5.08 118.16 121.54 2ju4 n LYS 44 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.50 2ju4 n LYS 44 Cb 0.36 -0.17 0.00 0.00 0.00 0.00 0.00 35.03 35.22 2ju4 n LYS 44 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2ju4 n LYS 45 N -1.64 0.00 0.00 1.64 4.81 -1.26 -5.09 118.16 116.62 2ju4 n LYS 45 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2ju4 n LYS 45 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ju4 n GLY 46 N 1.25 0.77 0.02 3.14 0.00 -1.26 -4.84 105.19 104.27 2ju4 n GLY 46 Ca 0.00 -0.60 -0.02 0.00 0.00 0.00 0.00 46.02 45.40 2ju4 n GLY 46 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ju4 n VAL 47 N 0.00 0.27 0.00 1.61 0.24 -1.26 -3.20 118.33 115.99 2ju4 n VAL 47 Ca 0.00 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 2ju4 n VAL 47 Cb 0.00 -0.85 0.00 0.00 -1.47 0.00 0.00 33.84 31.52 2ju4 n VAL 47 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 2ju4 n GLN 48 N -2.24 0.00 -2.68 7.34 7.27 -1.26 -4.64 117.38 121.17 2ju4 n GLN 48 Ca -0.07 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 56.96 2ju4 n GLN 48 Cb 0.62 0.00 0.10 0.00 2.41 0.00 0.00 30.24 33.37 2ju4 n GLN 48 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2ju4 n GLY 49 N 0.00 -0.87 0.00 1.69 0.00 -1.26 -5.28 105.19 99.47 2ju4 n GLY 49 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 2ju4 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ju4 n GLY 51 N 0.32 -2.01 2.49 -0.02 0.00 -1.26 -5.22 105.19 99.49 2ju4 n GLY 51 Ca -0.05 0.74 -0.02 0.00 0.00 0.00 0.00 46.02 46.69 2ju4 n GLY 51 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ju4 n ASP 52 N 0.00 -4.84 -1.28 1.61 2.03 -1.26 -4.81 116.55 107.99 2ju4 n ASP 52 Ca 0.00 1.51 0.14 0.00 0.52 0.00 0.00 54.79 56.97 2ju4 n ASP 52 Cb 0.00 -4.58 -0.07 0.00 -0.72 0.00 0.00 41.12 35.75 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2ju4 n ASP 53 N 1.89 -6.59 -3.68 1.67 2.03 -1.26 -4.76 116.55 105.85 2ju4 n ASP 53 Ca -0.17 1.10 -0.27 0.00 0.52 0.00 0.00 54.79 55.97 2ju4 n ASP 53 Cb 0.27 -4.31 -0.11 0.00 -0.72 0.00 0.00 41.12 36.25 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2ju4 n ILE 54 N -4.05 0.60 0.42 5.18 2.08 -1.26 -4.90 119.36 117.42 2ju4 n ILE 54 Ca -0.07 -4.35 0.12 0.00 0.56 0.00 0.00 62.75 59.01 2ju4 n ILE 54 Cb 0.59 -1.99 0.18 0.00 -0.75 0.00 0.00 39.64 37.67 2ju4 n ILE 54 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 2ju4 h PRO 55 N 5.37 0.00 0.00 0.38 0.13 -1.94 -3.43 132.00 132.50 2ju4 h PRO 55 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2ju4 h PRO 55 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2ju4 h PRO 55 CO 0.59 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.77 2ju4 n GLY 56 N 1.25 -1.82 4.07 1.56 0.00 -1.26 -5.08 105.19 103.91 2ju4 n GLY 56 Ca 0.03 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.85 2ju4 n GLY 56 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2ju4 n MET 57 N 0.00 0.00 -2.67 1.61 0.00 -1.26 -3.91 117.12 110.89 2ju4 n MET 57 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 57.70 57.65 2ju4 n MET 57 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 33.22 33.25 2ju4 n MET 57 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 2ju4 n GLU 58 N 0.00 0.48 0.00 3.17 0.00 -1.19 -4.93 120.64 118.17 2ju4 n GLU 58 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 57.16 56.13 2ju4 n GLU 58 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 31.44 31.41 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ju4 n GLY 59 N -0.51 -0.20 0.00 8.31 0.00 -1.25 -4.20 105.19 107.34 2ju4 n GLY 59 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2ju4 n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ju4 n GLY 61 N 2.78 0.98 2.57 -0.02 0.00 -1.07 -4.96 105.19 105.47 2ju4 n GLY 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ju4 n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ju4 n THR 62 N 0.00 0.00 0.58 2.61 -2.24 -1.26 -4.55 114.28 109.42 2ju4 n THR 62 Ca 0.00 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.85 2ju4 n THR 62 Cb 0.26 -0.43 0.32 0.00 -2.10 0.00 0.00 70.33 68.38 2ju4 n THR 62 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2ju4 n ASP 63 N 0.88 0.00 -3.11 3.42 5.75 -1.26 -3.25 116.55 118.98 2ju4 n ASP 63 Ca 0.00 0.25 -0.26 0.00 -0.01 0.00 0.00 54.79 54.77 2ju4 n ASP 63 Cb 0.19 -0.37 -0.05 0.00 -1.03 0.00 0.00 41.12 39.86 2ju4 n ASP 63 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ju4 n ILE 64 N -1.37 2.26 -0.39 2.12 3.06 -1.26 -4.83 119.36 118.95 2ju4 n ILE 64 Ca 0.05 -5.27 0.31 0.00 -2.50 0.00 0.00 62.75 55.34 2ju4 n ILE 64 Cb 0.13 -1.46 0.59 0.00 0.54 0.00 0.00 39.64 39.43 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.71 -2.50 0.00 0.00 176.55 174.76 2ju4 h THR 65 N 2.71 0.27 0.00 9.51 1.35 -1.95 -3.39 112.91 121.41 2ju4 h THR 65 Ca 0.14 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.93 2ju4 h THR 65 Cb 0.62 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.09 2ju4 h THR 65 CO 0.76 0.04 0.00 0.52 -0.25 0.00 0.00 175.52 176.59 2ju4 n VAL 66 N -4.70 0.00 -3.64 6.82 0.31 -1.26 -5.17 118.33 110.69 2ju4 n VAL 66 Ca 0.33 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.66 2ju4 n VAL 66 Cb 1.21 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 34.14 2ju4 n VAL 66 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2ju4 n ILE 67 N -2.68 0.00 -0.08 2.52 5.41 -1.26 -5.18 119.36 118.09 2ju4 n ILE 67 Ca 0.00 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.69 2ju4 n ILE 67 Cb 0.00 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 38.91 2ju4 n ILE 67 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2ju4 n PRO 69 N 0.00 0.47 -0.71 0.38 -0.02 -1.26 -4.99 135.00 128.87 2ju4 n PRO 69 Ca 0.00 0.46 -0.19 0.00 -2.02 0.00 0.00 63.50 61.75 2ju4 n PRO 69 Cb 0.00 -1.64 -0.03 0.00 -0.02 0.00 0.00 33.50 31.81 2ju4 n PRO 69 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 2ju4 n TRP 70 N -4.58 1.12 -0.90 6.00 4.27 -1.26 -2.63 117.44 119.46 2ju4 n TRP 70 Ca -0.09 -1.77 0.00 0.00 -3.89 0.00 0.00 57.50 51.75 2ju4 n TRP 70 Cb 0.33 -1.56 0.00 0.00 -1.36 0.00 0.00 31.31 28.71 2ju4 n TRP 70 CO 0.00 0.00 0.00 -0.85 -2.29 0.00 0.00 177.69 174.55 2ju4 n GLU 71 N 3.95 0.00 -1.55 -2.67 -0.00 -1.26 -5.13 120.64 113.99 2ju4 n GLU 71 Ca 0.41 0.00 -0.21 0.00 -0.00 0.00 0.00 57.16 57.35 2ju4 n GLU 71 Cb 0.20 -0.08 -0.08 0.00 -0.00 0.00 0.00 31.44 31.47 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ju4 n ALA 72 N 0.00 0.54 0.00 -1.84 0.00 -1.08 -4.91 120.51 113.22 2ju4 n ALA 72 Ca 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 53.44 52.29 2ju4 n ALA 72 Cb 0.09 -3.10 0.00 0.00 0.00 0.00 0.00 19.45 16.43 2ju4 n ALA 72 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2ju4 n ASN 74 N 15.97 0.00 0.00 0.00 5.03 -1.26 -4.09 115.26 130.91 2ju4 n ASN 74 Ca 0.48 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.93 2ju4 n ASN 74 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.16 2ju4 n ASN 74 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 2ju4 n HIS 75 N 0.00 0.00 -3.87 3.10 -0.00 -1.26 -4.58 115.22 108.60 2ju4 n HIS 75 Ca 0.00 0.00 -0.24 0.00 0.46 0.00 0.00 57.72 57.94 2ju4 n HIS 75 Cb 0.00 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 29.84 2ju4 n HIS 75 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 2ju4 s GLU 77 N 0.00 2.32 0.74 1.57 -1.05 -1.26 -4.87 118.70 116.16 2ju4 s GLU 77 Ca 0.00 -1.85 -0.15 0.00 -0.15 0.00 0.00 54.97 52.82 2ju4 s GLU 77 Cb 0.00 -2.13 0.04 0.00 -0.44 0.00 0.00 34.13 31.60 2ju4 s GLU 77 CO 0.00 -0.37 1.24 -0.51 0.95 0.00 0.00 175.26 176.57 2ju4 s LEU 78 N -4.14 3.32 -0.17 1.83 1.02 -1.26 -4.88 118.68 114.40 2ju4 s LEU 78 Ca 0.39 2.48 0.09 0.00 0.02 0.00 0.00 54.13 57.11 2ju4 s LEU 78 Cb -0.01 -4.60 0.56 0.00 0.02 0.00 0.00 46.19 42.16 2ju4 s LEU 78 CO 0.23 -2.40 1.37 0.00 0.02 0.00 0.00 176.35 175.57 2ju4 n HIS 79 N -2.72 1.47 1.15 0.29 1.44 -1.26 -4.27 115.22 111.31 2ju4 n HIS 79 Ca 0.14 -0.53 0.07 0.00 -2.01 0.00 0.00 57.72 55.39 2ju4 n HIS 79 Cb 0.49 -0.40 0.43 0.00 0.12 0.00 0.00 29.99 30.63 2ju4 n HIS 79 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 2ju4 n GLU 80 N 0.39 0.57 -0.42 -1.40 0.28 -1.26 -2.30 120.64 116.50 2ju4 n GLU 80 Ca 0.20 0.00 0.09 0.00 -0.16 0.00 0.00 57.16 57.29 2ju4 n GLU 80 Cb 0.92 -1.39 0.29 0.00 1.43 0.00 0.00 31.44 32.70 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2ju4 n LEU 81 N -0.89 3.76 -4.77 -1.84 4.77 -1.26 -4.95 117.00 111.81 2ju4 n LEU 81 Ca 0.11 -1.89 -0.39 0.00 -0.03 0.00 0.00 56.01 53.81 2ju4 n LEU 81 Cb 0.05 -0.48 -0.00 0.00 -2.33 0.00 0.00 43.42 40.66 2ju4 n LEU 81 CO 0.08 0.78 0.94 0.00 -1.33 0.00 0.00 177.39 177.86 2ju4 s ALA 82 N -1.46 3.15 -0.36 -1.18 0.00 -0.97 -4.93 121.76 116.00 2ju4 s ALA 82 Ca 0.43 1.18 0.11 0.00 0.00 0.00 0.00 51.96 53.68 2ju4 s ALA 82 Cb 0.25 -3.47 0.39 0.00 0.00 0.00 0.00 23.12 20.28 2ju4 s ALA 82 CO 0.25 -0.85 1.44 0.94 0.00 0.00 0.00 175.76 177.54 2ju4 n GLN 83 N -0.13 1.25 -3.46 0.00 7.27 -1.26 -4.96 117.38 116.09 2ju4 n GLN 83 Ca 0.05 -1.46 -0.24 0.00 0.07 0.00 0.00 57.00 55.42 2ju4 n GLN 83 Cb 0.45 0.20 -0.01 0.00 2.41 0.00 0.00 30.24 33.29 2ju4 n GLN 83 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2ju4 n TYR 84 N -1.08 -1.76 -1.24 3.69 4.01 -1.26 -4.69 117.16 114.83 2ju4 n TYR 84 Ca -0.11 0.49 0.00 0.00 -0.16 0.00 0.00 57.90 58.11 2ju4 n TYR 84 Cb 0.86 -2.79 0.00 0.00 -0.31 0.00 0.00 39.34 37.10 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ju4 n GLY 85 N -1.15 0.14 0.63 2.72 0.00 -1.26 -5.31 105.19 100.96 2ju4 n GLY 85 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 2ju4 n GLY 85 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61