#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 -6.11 0.00 3.17 5.03 -1.26 -4.82 115.26 111.27 2ju4 n ASN 2 Ca 0.00 0.79 0.00 0.00 0.87 0.00 0.00 54.58 56.24 2ju4 n ASN 2 Cb 0.00 -3.83 0.00 0.00 -1.02 0.00 0.00 39.78 34.93 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2ju4 n LEU 3 N -3.70 0.00 -4.71 3.41 0.00 -1.26 -4.39 117.00 106.36 2ju4 n LEU 3 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 56.01 55.60 2ju4 n LEU 3 Cb 0.61 0.00 -0.07 0.00 0.00 0.00 0.00 43.42 43.97 2ju4 n LEU 3 CO 0.02 -0.14 0.10 -0.70 0.00 0.00 0.00 177.39 176.67 2ju4 s GLU 4 N 0.00 4.27 -0.85 1.96 -6.30 -1.26 -4.96 118.70 111.56 2ju4 s GLU 4 Ca 0.00 0.28 -0.34 0.00 -2.50 0.00 0.00 54.97 52.40 2ju4 s GLU 4 Cb 0.00 -3.46 -0.21 0.00 0.00 0.00 0.00 34.13 30.46 2ju4 s GLU 4 CO 0.00 0.13 2.53 -2.30 0.02 0.00 0.00 175.26 175.64 2ju4 n PRO 5 N 3.85 0.00 -2.77 4.30 -0.02 -1.26 -4.88 135.00 134.22 2ju4 n PRO 5 Ca -0.09 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 60.98 2ju4 n PRO 5 Cb 0.52 -1.49 -0.05 0.00 -0.02 0.00 0.00 33.50 32.46 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 8.11 4.66 0.00 0.52 0.04 -1.26 -4.91 135.00 142.16 2ju4 s PRO 6 Ca 1.31 1.38 0.00 0.00 0.04 0.00 0.00 61.00 63.73 2ju4 s PRO 6 Cb -1.32 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 29.85 2ju4 s PRO 6 CO 0.53 0.23 0.00 0.36 0.04 0.00 0.00 177.00 178.16 2ju4 n LYS 7 N 2.78 3.87 -0.23 4.56 2.85 -1.26 -5.00 118.16 125.73 2ju4 n LYS 7 Ca 0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.27 2ju4 n LYS 7 Cb 0.49 -0.62 0.00 0.00 -0.65 0.00 0.00 35.03 34.25 2ju4 n LYS 7 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ju4 n ALA 8 N -0.48 0.00 0.05 0.58 0.00 -1.26 -5.20 120.51 114.20 2ju4 n ALA 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ju4 n ALA 8 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.04 0.00 -1.07 0.00 0.28 -1.26 -5.25 120.64 113.30 2ju4 n GLU 9 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.98 2ju4 n GLU 9 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 2ju4 n GLU 9 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2ju4 n ARG 11 N -2.69 0.00 -2.98 3.44 0.63 -1.26 -5.18 116.66 108.62 2ju4 n ARG 11 Ca 0.00 -1.20 -0.40 0.00 -0.92 0.00 0.00 57.85 55.33 2ju4 n ARG 11 Cb 0.00 0.22 -0.05 0.00 0.45 0.00 0.00 32.46 33.08 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2ju4 s SER 12 N -1.20 7.12 0.00 6.15 0.15 -1.26 -5.03 113.70 119.63 2ju4 s SER 12 Ca 0.11 1.35 0.00 0.00 0.70 0.00 0.00 55.95 58.10 2ju4 s SER 12 Cb 0.12 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 2ju4 s SER 12 CO -0.05 -0.09 0.00 0.00 1.20 0.00 0.00 173.24 174.30 2ju4 n ALA 13 N 3.44 0.00 0.00 5.45 0.00 -1.26 -5.09 120.51 123.05 2ju4 n ALA 13 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2ju4 n ALA 13 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 2ju4 n ALA 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ju4 n THR 14 N 0.00 0.00 0.00 0.00 -1.04 -1.26 -5.03 114.28 106.95 2ju4 n THR 14 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2ju4 n THR 14 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2ju4 n THR 14 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2ju4 n ARG 15 N -1.95 0.00 -2.99 -2.82 1.85 -1.26 -5.08 116.66 104.42 2ju4 n ARG 15 Ca 0.00 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.44 2ju4 n ARG 15 Cb 0.00 -0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.35 2ju4 n ARG 15 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2ju4 s VAL 16 N -1.01 4.87 -0.03 8.89 0.11 -1.26 -4.66 120.40 127.31 2ju4 s VAL 16 Ca 0.00 1.25 -0.03 0.00 -2.93 0.00 0.00 61.98 60.28 2ju4 s VAL 16 Cb 0.00 -4.07 0.01 0.00 -1.53 0.00 0.00 36.38 30.79 2ju4 s VAL 16 CO 0.00 -0.12 0.05 0.80 -3.33 0.00 0.00 175.10 172.51 2ju4 n MET 17 N 5.99 -4.23 -2.47 1.54 1.56 -1.26 -5.00 117.12 113.25 2ju4 n MET 17 Ca 0.03 3.10 -0.06 0.00 -0.27 0.00 0.00 57.70 60.51 2ju4 n MET 17 Cb 0.48 -4.07 -0.01 0.00 2.15 0.00 0.00 33.22 31.77 2ju4 n MET 17 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2ju4 n GLY 18 N 1.89 2.42 0.00 -5.12 0.00 -1.26 -4.65 105.19 98.46 2ju4 n GLY 18 Ca -0.09 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.24 0.74 0.00 -0.02 0.00 -1.26 -5.15 105.19 99.26 2ju4 n GLY 19 Ca -0.01 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.45 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 1.05 3.56 0.00 1.61 -0.02 -1.26 -5.11 135.00 134.83 2ju4 n PRO 20 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2ju4 n PRO 20 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2ju4 n PRO 20 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2ju4 n THR 22 N 0.00 0.00 -1.53 3.45 -2.24 -1.26 -5.26 114.28 107.44 2ju4 n THR 22 Ca 0.00 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.34 2ju4 n THR 22 Cb 0.00 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 2ju4 n THR 22 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2ju4 n PRO 23 N 0.00 1.37 0.00 -0.78 -0.02 -1.26 -4.25 135.00 130.07 2ju4 n PRO 23 Ca 0.00 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2ju4 n PRO 23 Cb 0.00 -2.92 0.00 0.00 -0.02 0.00 0.00 33.50 30.56 2ju4 n PRO 23 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2ju4 n ARG 24 N 8.60 0.00 -2.60 -0.52 1.74 -1.26 -5.14 116.66 117.49 2ju4 n ARG 24 Ca 0.37 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 57.12 2ju4 n ARG 24 Cb 0.37 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.76 2ju4 n ARG 24 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2ju4 s LYS 25 N 0.00 3.93 -0.20 5.56 0.00 -1.26 -4.56 119.74 123.21 2ju4 s LYS 25 Ca 0.00 1.23 -0.05 0.00 0.00 0.00 0.00 55.97 57.15 2ju4 s LYS 25 Cb 0.00 -2.12 0.02 0.00 0.00 0.00 0.00 37.83 35.73 2ju4 s LYS 25 CO 0.00 -0.30 0.10 0.41 0.00 0.00 0.00 175.35 175.56 2ju4 n GLY 26 N -0.54 -4.48 3.14 0.59 0.00 -1.26 -4.98 105.19 97.67 2ju4 n GLY 26 Ca 0.08 0.88 -0.28 0.00 0.00 0.00 0.00 46.02 46.71 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 0.98 -4.28 -1.90 1.61 -0.02 -1.26 -4.88 135.00 125.26 2ju4 n PRO 27 Ca -0.18 -1.32 -0.42 0.00 -2.02 0.00 0.00 63.50 59.56 2ju4 n PRO 27 Cb 0.27 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 31.90 2ju4 n PRO 27 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2ju4 s PRO 28 N -4.79 4.20 0.00 0.52 0.02 -1.26 -5.19 135.00 128.50 2ju4 s PRO 28 Ca 0.61 2.40 0.00 0.00 0.02 0.00 0.00 61.00 64.03 2ju4 s PRO 28 Cb -0.11 -3.26 0.00 0.00 0.02 0.00 0.00 34.50 31.16 2ju4 s PRO 28 CO 0.51 -0.66 0.00 1.17 -0.33 0.00 0.00 177.00 177.69 2ju4 n LYS 29 N 4.39 0.00 0.00 5.54 4.81 -1.26 -5.27 118.16 126.36 2ju4 n LYS 29 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 2ju4 n LYS 29 Cb 0.38 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.43 2ju4 n LYS 29 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2ju4 n LYS 31 N 0.00 0.00 -4.33 1.64 2.85 -1.26 -5.12 118.16 111.94 2ju4 n LYS 31 Ca 0.00 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.88 2ju4 n LYS 31 Cb 0.00 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.30 2ju4 n LYS 31 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ju4 n GLN 32 N 0.00 -0.77 -1.32 -1.58 10.64 -1.26 -4.76 117.38 118.33 2ju4 n GLN 32 Ca 0.00 0.12 -0.39 0.00 -1.83 0.00 0.00 57.00 54.91 2ju4 n GLN 32 Cb 0.00 -4.20 0.02 0.00 -0.86 0.00 0.00 30.24 25.20 2ju4 n GLN 32 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2ju4 n ARG 33 N -3.95 0.17 0.00 2.61 1.74 -1.26 -4.90 116.66 111.07 2ju4 n ARG 33 Ca 0.02 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 2ju4 n ARG 33 Cb 0.47 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 2ju4 n ARG 33 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ju4 n GLN 34 N 0.97 0.50 -0.06 5.56 6.02 -1.26 -4.85 117.38 124.26 2ju4 n GLN 34 Ca 0.09 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.99 2ju4 n GLN 34 Cb 0.47 -0.62 -0.03 0.00 1.02 0.00 0.00 30.24 31.08 2ju4 n GLN 34 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2ju4 n THR 35 N -1.28 1.33 0.00 5.09 -1.04 -1.26 -4.78 114.28 112.34 2ju4 n THR 35 Ca 0.00 0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 2ju4 n THR 35 Cb 0.12 -2.03 0.00 0.00 -1.82 0.00 0.00 70.33 66.60 2ju4 n THR 35 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2ju4 n ARG 36 N -4.09 0.00 0.00 -2.82 5.12 -1.26 -5.11 116.66 108.50 2ju4 n ARG 36 Ca -0.16 0.50 0.00 0.00 -1.93 0.00 0.00 57.85 56.26 2ju4 n ARG 36 Cb 0.45 -1.21 0.00 0.00 -1.16 0.00 0.00 32.46 30.53 2ju4 n ARG 36 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2ju4 n GLN 37 N -1.55 0.00 0.00 5.56 6.02 -1.26 -5.15 117.38 121.00 2ju4 n GLN 37 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2ju4 n GLN 37 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2ju4 n GLN 37 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2ju4 n LYS 39 N 0.00 0.00 -3.80 -1.09 3.00 -1.26 -5.10 118.16 109.90 2ju4 n LYS 39 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 2ju4 n LYS 39 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 34.99 2ju4 n LYS 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2ju4 s SER 40 N 0.00 6.43 0.76 3.14 0.01 -1.26 -5.07 113.70 117.70 2ju4 s SER 40 Ca 0.00 0.43 -0.13 0.00 1.31 0.00 0.00 55.95 57.56 2ju4 s SER 40 Cb 0.00 -2.03 0.05 0.00 0.21 0.00 0.00 66.02 64.26 2ju4 s SER 40 CO 0.00 0.12 1.14 -1.59 0.41 0.00 0.00 173.24 173.33 2ju4 s LYS 41 N -2.52 2.13 0.79 12.44 0.00 -1.26 -4.99 119.74 126.33 2ju4 s LYS 41 Ca 0.37 1.47 -0.10 0.00 0.00 0.00 0.00 55.97 57.71 2ju4 s LYS 41 Cb -0.13 -1.86 0.07 0.00 0.00 0.00 0.00 37.83 35.91 2ju4 s LYS 41 CO 0.26 -1.78 1.10 -1.25 0.00 0.00 0.00 175.35 173.67 2ju4 s PRO 42 N -4.35 2.13 0.30 1.78 0.04 -1.26 -5.00 135.00 128.64 2ju4 s PRO 42 Ca 0.68 1.21 -0.28 0.00 0.04 0.00 0.00 61.00 62.64 2ju4 s PRO 42 Cb -0.23 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 2ju4 s PRO 42 CO 0.49 -1.75 1.10 -1.25 0.04 0.00 0.00 177.00 175.63 2ju4 s PRO 43 N -4.88 4.54 0.00 0.56 0.04 -1.26 -4.88 135.00 129.12 2ju4 s PRO 43 Ca 0.62 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2ju4 s PRO 43 Cb -0.18 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.30 2ju4 s PRO 43 CO 0.56 0.13 0.00 1.17 0.04 0.00 0.00 177.00 178.90 2ju4 n LYS 44 N 0.94 0.00 -3.09 4.56 0.00 -1.26 -5.03 118.16 114.28 2ju4 n LYS 44 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 58.31 58.16 2ju4 n LYS 44 Cb 0.45 -0.18 -0.05 0.00 0.00 0.00 0.00 35.03 35.26 2ju4 n LYS 44 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2ju4 s LYS 45 N -1.00 0.97 2.94 1.64 -0.14 -1.26 -4.94 119.74 117.95 2ju4 s LYS 45 Ca 0.00 -1.52 0.00 0.00 -1.36 0.00 0.00 55.97 53.09 2ju4 s LYS 45 Cb 0.00 -0.71 0.00 0.00 -1.68 0.00 0.00 37.83 35.44 2ju4 s LYS 45 CO 0.00 -1.35 0.00 0.41 -0.76 0.00 0.00 175.35 173.65 2ju4 n GLY 46 N 2.99 1.66 3.01 -3.33 0.00 -1.26 -4.91 105.19 103.35 2ju4 n GLY 46 Ca 0.23 0.13 -0.00 0.00 0.00 0.00 0.00 46.02 46.38 2ju4 n GLY 46 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ju4 n VAL 47 N 0.00 -5.40 -2.23 1.61 0.31 -1.26 -4.97 118.33 106.39 2ju4 n VAL 47 Ca 0.00 0.97 0.00 0.00 -0.01 0.00 0.00 64.34 65.30 2ju4 n VAL 47 Cb 0.00 -4.27 0.00 0.00 -0.91 0.00 0.00 33.84 28.66 2ju4 n VAL 47 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ju4 n GLN 48 N 1.32 0.03 -2.07 5.55 3.00 -1.26 -4.99 117.38 118.96 2ju4 n GLN 48 Ca -0.03 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.95 2ju4 n GLN 48 Cb 0.31 0.00 -0.01 0.00 0.00 0.00 0.00 30.24 30.54 2ju4 n GLN 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ju4 n GLY 49 N 0.04 -3.85 0.00 1.08 0.00 -1.26 -5.19 105.19 96.01 2ju4 n GLY 49 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 0.60 0.29 2.97 -0.02 0.00 -1.26 -5.22 105.19 102.55 2ju4 n GLY 51 Ca -0.11 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.13 -1.37 1.61 2.03 -1.26 -5.02 116.55 111.41 2ju4 n ASP 52 Ca 0.00 -1.18 -0.06 0.00 0.52 0.00 0.00 54.79 54.07 2ju4 n ASP 52 Cb 0.00 -0.82 -0.02 0.00 -0.72 0.00 0.00 41.12 39.55 2ju4 n ASP 52 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2ju4 n ASP 53 N -4.21 -1.08 -3.99 1.67 8.00 -1.26 -4.88 116.55 110.80 2ju4 n ASP 53 Ca 0.13 -2.01 -0.32 0.00 0.71 0.00 0.00 54.79 53.30 2ju4 n ASP 53 Cb 0.48 0.38 -0.12 0.00 -0.02 0.00 0.00 41.12 41.84 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2ju4 s ILE 54 N 0.03 3.05 -0.11 0.53 1.09 -1.26 -4.94 121.20 119.59 2ju4 s ILE 54 Ca 0.02 -3.48 0.01 0.00 -1.10 0.00 0.00 60.65 56.10 2ju4 s ILE 54 Cb 0.10 -3.04 0.13 0.00 -1.06 0.00 0.00 42.46 38.60 2ju4 s ILE 54 CO -0.03 -0.88 1.37 -0.81 -0.10 0.00 0.00 174.94 174.49 2ju4 n PRO 55 N 2.90 1.29 0.00 2.79 -0.04 -1.26 -4.20 135.00 136.47 2ju4 n PRO 55 Ca 0.10 -0.66 0.14 0.00 -0.04 0.00 0.00 63.50 63.04 2ju4 n PRO 55 Cb 0.34 -1.26 0.63 0.00 -0.04 0.00 0.00 33.50 33.17 2ju4 n PRO 55 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ju4 n GLY 56 N 0.32 -1.49 2.70 0.55 0.00 -1.26 -4.28 105.19 101.74 2ju4 n GLY 56 Ca 0.13 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.49 3.26 0.14 1.61 0.00 -1.26 -4.71 117.12 114.67 2ju4 n MET 57 Ca 0.07 -2.85 0.19 0.00 0.00 0.00 0.00 57.70 55.11 2ju4 n MET 57 Cb 0.34 -3.10 0.75 0.00 0.00 0.00 0.00 33.22 31.21 2ju4 n MET 57 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 2ju4 h GLU 58 N 5.74 0.00 -1.64 3.17 5.08 -1.97 -3.34 114.58 121.61 2ju4 h GLU 58 Ca 0.57 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.93 2ju4 h GLU 58 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2ju4 h GLU 58 CO 1.79 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 180.21 2ju4 n GLY 59 N -1.43 0.05 3.37 -3.84 0.00 -1.26 -4.73 105.19 97.34 2ju4 n GLY 59 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 2ju4 n GLY 59 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ju4 s GLY 61 N 0.66 1.66 -0.76 -0.02 0.00 -1.25 -5.11 107.32 102.49 2ju4 s GLY 61 Ca 0.00 -1.11 -0.15 0.00 0.00 0.00 0.00 44.72 43.46 2ju4 s GLY 61 CO 0.00 0.38 0.75 -0.51 0.00 0.00 0.00 173.10 173.72 2ju4 s THR 62 N 1.35 5.35 -0.42 0.90 -4.23 -1.26 -4.86 115.64 112.47 2ju4 s THR 62 Ca 0.04 -2.03 0.24 0.00 -1.18 0.00 0.00 61.69 58.76 2ju4 s THR 62 Cb -0.14 -4.48 0.25 0.00 1.34 0.00 0.00 72.50 69.46 2ju4 s THR 62 CO -0.01 -1.07 1.71 -0.90 -0.54 0.00 0.00 174.62 173.82 2ju4 n ASP 63 N 4.76 0.67 0.00 3.99 5.68 -1.26 -3.90 116.55 126.49 2ju4 n ASP 63 Ca 0.07 0.69 0.00 0.00 -0.50 0.00 0.00 54.79 55.05 2ju4 n ASP 63 Cb 0.45 -0.82 0.00 0.00 -1.14 0.00 0.00 41.12 39.61 2ju4 n ASP 63 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.20 175.49 2ju4 n ILE 64 N -2.27 0.00 0.00 2.12 2.08 -1.26 -5.01 119.36 115.02 2ju4 n ILE 64 Ca 0.01 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.32 2ju4 n ILE 64 Cb 0.20 -0.58 0.00 0.00 -0.75 0.00 0.00 39.64 38.51 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 2ju4 n THR 65 N -2.35 0.00 -0.02 1.39 -1.04 -1.25 -4.54 114.28 106.46 2ju4 n THR 65 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 2ju4 n THR 65 Cb 0.32 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.82 2ju4 n THR 65 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2ju4 h VAL 66 N 0.00 0.00 -3.84 12.58 2.07 -1.95 -3.45 116.25 121.66 2ju4 h VAL 66 Ca 0.00 -0.40 -0.45 0.00 0.82 0.00 0.00 66.70 66.67 2ju4 h VAL 66 Cb 0.00 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.63 2ju4 h VAL 66 CO 0.00 0.00 -0.54 -0.63 0.02 0.00 0.00 177.57 176.42 2ju4 s ILE 67 N -1.30 0.33 -0.25 4.57 1.01 -1.26 -5.05 121.20 119.25 2ju4 s ILE 67 Ca -0.02 -2.00 -0.16 0.00 0.00 0.00 0.00 60.65 58.47 2ju4 s ILE 67 Cb 0.00 -2.48 -0.14 0.00 0.01 0.00 0.00 42.46 39.86 2ju4 s ILE 67 CO 0.02 0.00 -0.19 -0.81 0.00 0.00 0.00 174.94 173.96 2ju4 n PRO 69 N -0.65 0.58 0.00 2.79 -0.04 -1.26 -4.81 135.00 131.61 2ju4 n PRO 69 Ca 0.01 0.35 0.03 0.00 -0.04 0.00 0.00 63.50 63.85 2ju4 n PRO 69 Cb 0.64 -1.56 0.16 0.00 -0.04 0.00 0.00 33.50 32.70 2ju4 n PRO 69 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2ju4 n TRP 70 N -4.32 0.00 0.41 0.54 2.14 -1.26 -0.83 117.44 114.12 2ju4 n TRP 70 Ca -0.46 0.00 0.08 0.00 2.07 0.00 0.00 57.50 59.18 2ju4 n TRP 70 Cb 0.81 -0.21 -0.10 0.00 -0.81 0.00 0.00 31.31 30.99 2ju4 n TRP 70 CO 0.00 0.00 0.00 -0.85 2.07 0.00 0.00 177.69 178.91 2ju4 n GLU 71 N -1.21 1.25 -1.94 -2.67 -0.00 -1.26 -5.08 120.64 109.72 2ju4 n GLU 71 Ca 0.03 -0.06 -0.42 0.00 -0.00 0.00 0.00 57.16 56.71 2ju4 n GLU 71 Cb 0.04 -1.30 -0.03 0.00 -0.00 0.00 0.00 31.44 30.15 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ju4 s ALA 72 N -2.76 3.63 0.67 -1.84 0.00 -0.01 -5.00 121.76 116.46 2ju4 s ALA 72 Ca 0.01 1.06 -0.14 0.00 0.00 0.00 0.00 51.96 52.89 2ju4 s ALA 72 Cb 0.11 -3.75 0.01 0.00 0.00 0.00 0.00 23.12 19.49 2ju4 s ALA 72 CO 0.65 -1.34 1.09 0.54 0.00 0.00 0.00 175.76 176.70 2ju4 s ASN 74 N 3.26 5.12 0.55 0.00 2.20 -1.26 -5.11 114.94 119.70 2ju4 s ASN 74 Ca 0.76 1.91 0.37 0.00 -0.94 0.00 0.00 52.86 54.95 2ju4 s ASN 74 Cb -0.36 -2.54 1.53 0.00 -2.00 0.00 0.00 41.25 37.87 2ju4 s ASN 74 CO 0.32 -1.62 1.76 -0.74 -2.94 0.00 0.00 177.10 173.88 2ju4 h HIS 75 N -0.18 0.00 -2.24 1.54 -0.00 -2.06 -3.53 115.15 108.69 2ju4 h HIS 75 Ca -0.46 0.00 -0.51 0.00 -0.00 0.00 0.00 60.37 59.41 2ju4 h HIS 75 Cb 1.24 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 28.60 2ju4 h HIS 75 CO 0.56 0.00 -0.52 -1.83 -0.00 0.00 0.00 177.93 176.14 2ju4 s GLU 77 N -4.87 2.98 1.81 5.26 4.04 -1.26 -5.20 118.70 121.46 2ju4 s GLU 77 Ca -0.05 -1.01 0.00 0.00 0.04 0.00 0.00 54.97 53.96 2ju4 s GLU 77 Cb 0.22 -2.61 0.00 0.00 0.02 0.00 0.00 34.13 31.76 2ju4 s GLU 77 CO 0.77 0.41 0.00 1.28 -1.84 0.00 0.00 175.26 175.88 2ju4 n LEU 78 N -1.13 0.00 0.00 1.83 4.32 -1.26 -4.90 117.00 115.86 2ju4 n LEU 78 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.91 2ju4 n LEU 78 Cb 0.57 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.37 2ju4 n LEU 78 CO 0.43 0.00 0.00 1.57 -1.22 0.00 0.00 177.39 178.17 2ju4 n HIS 79 N 14.00 0.00 1.66 -1.77 -0.00 -1.26 -4.96 115.22 122.88 2ju4 n HIS 79 Ca 0.00 0.00 0.12 0.00 0.46 0.00 0.00 57.72 58.30 2ju4 n HIS 79 Cb 0.00 0.00 0.59 0.00 -0.12 0.00 0.00 29.99 30.46 2ju4 n HIS 79 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 2ju4 n GLU 80 N 0.00 1.38 0.08 1.57 0.28 -1.26 -3.38 120.64 119.31 2ju4 n GLU 80 Ca 0.00 -0.56 0.09 0.00 -0.16 0.00 0.00 57.16 56.54 2ju4 n GLU 80 Cb 0.00 -1.42 -0.03 0.00 1.43 0.00 0.00 31.44 31.43 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.47 -0.16 0.00 0.00 177.13 178.44 2ju4 n LEU 81 N -0.28 0.80 0.20 -1.84 -0.00 -1.26 -3.74 117.00 110.88 2ju4 n LEU 81 Ca 0.18 0.32 0.14 0.00 -0.00 0.00 0.00 56.01 56.64 2ju4 n LEU 81 Cb 0.23 -0.03 0.72 0.00 -0.00 0.00 0.00 43.42 44.33 2ju4 n LEU 81 CO 0.15 -0.12 0.91 0.00 -0.00 0.00 0.00 177.39 178.32 2ju4 h ALA 82 N 1.90 1.00 -0.35 1.47 0.00 -1.83 -2.75 119.26 118.70 2ju4 h ALA 82 Ca -0.03 0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2ju4 h ALA 82 Cb 1.11 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2ju4 h ALA 82 CO 0.01 0.00 0.91 0.37 0.00 0.00 0.00 179.25 180.54 2ju4 h GLN 83 N 0.00 0.00 0.00 0.00 4.15 -1.80 -3.35 115.11 114.11 2ju4 h GLN 83 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2ju4 h GLN 83 Cb 0.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2ju4 h GLN 83 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 178.83 177.56 2ju4 n TYR 84 N -2.90 0.00 0.13 3.99 4.02 -1.04 -4.85 117.16 116.51 2ju4 n TYR 84 Ca 0.07 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.80 2ju4 n TYR 84 Cb 1.02 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 40.25 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2ju4 h GLY 85 N 0.00 -1.14 1.00 2.72 0.00 -1.91 -3.53 103.07 100.21 2ju4 h GLY 85 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 47.33 47.96 2ju4 h GLY 85 CO 0.00 -0.28 0.00 0.29 0.00 0.00 0.00 176.54 176.55