#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j02 n LEU 2 N 0.00 -4.93 -0.07 3.17 4.77 -1.26 -4.99 117.00 113.69 2j02 n LEU 2 Ca 0.00 1.72 -0.13 0.00 -0.03 0.00 0.00 56.01 57.57 2j02 n LEU 2 Cb 0.00 -2.54 -0.10 0.00 -2.33 0.00 0.00 43.42 38.44 2j02 n LEU 2 CO 0.00 -2.46 0.12 0.71 -1.33 0.00 0.00 177.39 174.43 2j02 h THR 3 N 2.82 1.26 -3.53 -5.08 1.35 -2.06 -3.42 112.91 104.25 2j02 h THR 3 Ca -0.24 -2.04 -0.68 0.00 -0.55 0.00 0.00 66.41 62.90 2j02 h THR 3 Cb 0.55 2.48 -0.37 0.00 -1.73 0.00 0.00 68.15 69.07 2j02 h THR 3 CO 0.00 0.43 -0.56 -0.62 -0.25 0.00 0.00 175.52 174.52 2j02 s ASP 4 N -6.21 4.94 0.26 5.36 2.15 -1.26 -4.98 116.67 116.93 2j02 s ASP 4 Ca -0.18 -2.46 -0.02 0.00 0.43 0.00 0.00 52.55 50.33 2j02 s ASP 4 Cb -0.01 -1.75 0.48 0.00 -0.30 0.00 0.00 42.92 41.35 2j02 s ASP 4 CO 0.54 -0.40 1.80 -0.65 -0.17 0.00 0.00 175.17 176.28 2j02 h PRO 5 N 7.39 0.74 0.57 4.34 0.11 -1.97 -2.87 132.00 140.32 2j02 h PRO 5 Ca -0.07 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.97 2j02 h PRO 5 Cb 0.99 -0.17 0.01 0.00 0.11 0.00 0.00 31.00 31.94 2j02 h PRO 5 CO 0.66 0.49 -0.27 0.82 -0.21 0.00 0.00 178.00 179.48 2j02 h ILE 6 N 0.76 0.44 -1.08 4.15 5.03 -2.00 -1.48 117.51 123.33 2j02 h ILE 6 Ca 0.44 -0.03 0.30 0.00 -0.12 0.00 0.00 64.86 65.45 2j02 h ILE 6 Cb 0.51 0.45 -0.06 0.00 -3.03 0.00 0.00 36.82 34.69 2j02 h ILE 6 CO -0.30 0.01 0.76 0.00 -0.68 0.00 0.00 178.15 177.94 2j02 h ALA 7 N -0.36 2.82 0.67 1.87 0.00 -1.93 -0.29 119.26 122.04 2j02 h ALA 7 Ca -0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2j02 h ALA 7 Cb 0.60 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.46 2j02 h ALA 7 CO 0.13 -1.16 -0.32 0.22 0.00 0.00 0.00 179.25 178.12 2j02 h ASP 8 N 0.11 -0.76 -0.94 0.00 3.58 -1.15 -1.70 116.42 115.55 2j02 h ASP 8 Ca 0.54 0.03 0.21 0.00 0.42 0.00 0.00 57.03 58.22 2j02 h ASP 8 Cb 1.93 0.20 -0.18 0.00 1.72 0.00 0.00 39.33 43.00 2j02 h ASP 8 CO -0.08 -0.42 -0.16 0.80 -2.88 0.00 0.00 179.24 176.49 2j02 n MET 9 N -5.09 -0.08 0.19 0.28 1.56 -0.17 0.13 117.12 113.94 2j02 n MET 9 Ca -0.11 1.45 -0.15 0.00 -0.27 0.00 0.00 57.70 58.62 2j02 n MET 9 Cb 0.35 -2.20 -0.08 0.00 2.15 0.00 0.00 33.22 33.44 2j02 n MET 9 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 2j02 h LEU 10 N 0.00 -0.36 -0.50 -0.89 3.38 -1.36 -0.28 115.31 115.30 2j02 h LEU 10 Ca 0.48 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.52 2j02 h LEU 10 Cb 0.82 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.62 2j02 h LEU 10 CO -0.94 -0.25 0.23 0.74 0.09 0.00 0.00 178.44 178.30 2j02 h THR 11 N -0.41 0.91 -0.70 0.22 2.02 0.20 2.10 112.91 117.24 2j02 h THR 11 Ca -0.04 -0.15 0.10 0.00 0.77 0.00 0.00 66.41 67.09 2j02 h THR 11 Cb 0.32 0.43 -0.08 0.00 -1.74 0.00 0.00 68.15 67.08 2j02 h THR 11 CO 0.06 0.08 0.33 0.03 0.37 0.00 0.00 175.52 176.39 2j02 h ARG 12 N 0.44 0.53 0.09 6.66 3.08 0.63 0.39 114.38 126.20 2j02 h ARG 12 Ca 0.23 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 2j02 h ARG 12 Cb 0.18 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2j02 h ARG 12 CO -0.19 0.35 -0.04 0.82 -1.07 0.00 0.00 179.97 179.84 2j02 h ILE 13 N 0.55 1.10 0.00 2.04 2.04 0.70 -0.80 117.51 123.14 2j02 h ILE 13 Ca 0.36 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.48 2j02 h ILE 13 Cb 0.42 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 2j02 h ILE 13 CO -0.30 0.18 0.09 -0.09 0.00 0.00 0.00 178.15 178.04 2j02 h ARG 14 N -0.46 0.00 0.00 2.37 2.43 0.48 -1.14 114.38 118.06 2j02 h ARG 14 Ca -0.01 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.88 2j02 h ARG 14 Cb 0.39 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.89 2j02 h ARG 14 CO 0.02 0.00 -1.63 0.09 -1.51 0.00 0.00 179.97 176.94 2j02 n ASN 15 N -2.92 1.90 -0.35 -3.80 3.02 0.12 -3.43 115.26 109.79 2j02 n ASN 15 Ca -0.03 0.41 0.12 0.00 -0.03 0.00 0.00 54.58 55.06 2j02 n ASN 15 Cb 0.15 -0.89 0.31 0.00 -0.61 0.00 0.00 39.78 38.74 2j02 n ASN 15 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j02 h ALA 16 N -0.76 1.62 0.16 5.41 0.00 -0.90 -1.22 119.26 123.58 2j02 h ALA 16 Ca -0.42 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2j02 h ALA 16 Cb 1.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2j02 h ALA 16 CO -0.25 -0.06 -0.08 1.79 0.00 0.00 0.00 179.25 180.65 2j02 h THR 17 N 0.75 0.94 0.00 0.00 1.35 -1.40 -2.32 112.91 112.23 2j02 h THR 17 Ca 0.57 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.91 2j02 h THR 17 Cb 0.87 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.55 2j02 h THR 17 CO -0.38 0.12 0.22 0.54 -0.25 0.00 0.00 175.52 175.77 2j02 n ARG 18 N -5.07 0.00 0.00 4.72 3.00 -0.47 0.15 116.66 118.99 2j02 n ARG 18 Ca -0.09 0.24 0.00 0.00 -0.01 0.00 0.00 57.85 57.99 2j02 n ARG 18 Cb 0.20 -1.72 0.00 0.00 0.00 0.00 0.00 32.46 30.94 2j02 n ARG 18 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 2j02 n VAL 19 N -1.22 0.00 -2.02 1.55 0.24 -1.09 -5.08 118.33 110.71 2j02 n VAL 19 Ca 0.00 -0.48 -0.00 0.00 -2.04 0.00 0.00 64.34 61.81 2j02 n VAL 19 Cb 0.22 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.60 2j02 n VAL 19 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2j02 n TYR 20 N -0.91 -1.67 -4.32 6.34 4.01 0.12 -5.08 117.16 115.66 2j02 n TYR 20 Ca 0.00 0.73 -0.21 0.00 -0.16 0.00 0.00 57.90 58.26 2j02 n TYR 20 Cb 0.00 -2.57 -0.11 0.00 -0.31 0.00 0.00 39.34 36.34 2j02 n TYR 20 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2j02 s LYS 21 N -0.83 1.23 0.00 -0.72 2.20 -1.16 -5.03 119.74 115.43 2j02 s LYS 21 Ca 0.02 -1.37 0.00 0.00 -0.36 0.00 0.00 55.97 54.26 2j02 s LYS 21 Cb -0.00 -1.27 0.00 0.00 -1.51 0.00 0.00 37.83 35.04 2j02 s LYS 21 CO 0.33 0.26 0.89 -1.91 -0.36 0.00 0.00 175.35 174.56 2j02 n GLU 22 N 0.37 0.00 -4.16 4.03 4.07 -1.26 -4.49 120.64 119.21 2j02 n GLU 22 Ca -0.14 0.46 -0.10 0.00 -0.06 0.00 0.00 57.16 57.32 2j02 n GLU 22 Cb 0.57 -1.42 -0.10 0.00 -0.06 0.00 0.00 31.44 30.42 2j02 n GLU 22 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 2j02 s SER 23 N -2.06 0.61 0.08 4.31 1.04 -1.26 -1.52 113.70 114.89 2j02 s SER 23 Ca 0.00 -1.13 0.05 0.00 0.48 0.00 0.00 55.95 55.34 2j02 s SER 23 Cb 0.00 0.22 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 2j02 s SER 23 CO 0.00 -0.64 -0.13 -0.89 0.98 0.00 0.00 173.24 172.55 2j02 s THR 24 N -3.90 1.08 -0.41 2.02 2.01 -0.65 -4.89 115.64 110.90 2j02 s THR 24 Ca 0.19 -1.36 -0.01 0.00 0.31 0.00 0.00 61.69 60.82 2j02 s THR 24 Cb 0.07 -1.11 0.11 0.00 0.01 0.00 0.00 72.50 71.58 2j02 s THR 24 CO -0.01 -0.29 0.18 -1.81 -0.69 0.00 0.00 174.62 172.00 2j02 s ASP 25 N -1.87 5.10 0.00 3.53 1.11 -1.26 0.16 116.67 123.44 2j02 s ASP 25 Ca -0.01 -2.15 -0.17 0.00 0.18 0.00 0.00 52.55 50.40 2j02 s ASP 25 Cb -0.09 -1.77 -0.06 0.00 1.07 0.00 0.00 42.92 42.07 2j02 s ASP 25 CO 0.02 -0.48 0.48 0.54 1.18 0.00 0.00 175.17 176.91 2j02 s VAL 26 N 0.96 4.95 0.24 -1.27 0.11 -0.93 -4.69 120.40 119.76 2j02 s VAL 26 Ca 0.10 1.00 -0.31 0.00 -2.93 0.00 0.00 61.98 59.84 2j02 s VAL 26 Cb -0.22 -3.80 -0.14 0.00 -1.53 0.00 0.00 36.38 30.69 2j02 s VAL 26 CO -0.05 0.52 1.27 -2.65 -3.33 0.00 0.00 175.10 170.86 2j02 n PRO 27 N 2.14 1.70 -1.54 1.54 -0.02 -1.26 0.10 135.00 137.66 2j02 n PRO 27 Ca -0.11 0.60 -0.50 0.00 -2.02 0.00 0.00 63.50 61.47 2j02 n PRO 27 Cb 0.52 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2j02 n PRO 27 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j02 n ALA 28 N 1.39 -1.53 -3.15 3.55 0.00 -0.05 -4.76 120.51 115.96 2j02 n ALA 28 Ca 0.12 0.48 0.05 0.00 0.00 0.00 0.00 53.44 54.09 2j02 n ALA 28 Cb 0.30 -1.92 -0.01 0.00 0.00 0.00 0.00 19.45 17.82 2j02 n ALA 28 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2j02 s SER 29 N -0.17 -0.61 0.11 0.00 0.15 -1.26 -5.02 113.70 106.90 2j02 s SER 29 Ca 0.74 0.25 -0.22 0.00 0.70 0.00 0.00 55.95 57.42 2j02 s SER 29 Cb -0.92 1.46 -0.05 0.00 -1.71 0.00 0.00 66.02 64.80 2j02 s SER 29 CO 0.54 -0.11 1.34 -1.14 1.20 0.00 0.00 173.24 175.06 2j02 n ARG 30 N 5.35 -0.31 -0.06 5.44 0.63 -1.26 0.20 116.66 126.65 2j02 n ARG 30 Ca -0.00 1.32 0.21 0.00 -0.92 0.00 0.00 57.85 58.46 2j02 n ARG 30 Cb 0.55 -1.95 0.67 0.00 0.45 0.00 0.00 32.46 32.18 2j02 n ARG 30 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 2j02 h PHE 31 N 0.00 0.07 0.25 -0.14 3.57 -2.01 -1.36 116.94 117.33 2j02 h PHE 31 Ca 0.11 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 2j02 h PHE 31 Cb 0.29 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.00 2j02 h PHE 31 CO -0.97 0.03 -0.12 0.87 -2.23 0.00 0.00 178.31 175.89 2j02 h LYS 32 N 0.06 -0.33 -1.06 1.11 1.57 0.18 -2.90 116.57 115.20 2j02 h LYS 32 Ca 0.31 0.02 0.29 0.00 -1.87 0.00 0.00 60.65 59.40 2j02 h LYS 32 Cb 1.13 0.07 -0.11 0.00 0.08 0.00 0.00 32.23 33.40 2j02 h LYS 32 CO -0.02 -0.00 0.66 0.93 -0.57 0.00 0.00 179.45 180.45 2j02 h GLU 33 N -0.69 0.37 0.08 3.15 5.08 0.06 0.27 114.58 122.90 2j02 h GLU 33 Ca -0.03 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2j02 h GLU 33 Cb 0.48 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 2j02 h GLU 33 CO 0.06 0.25 -0.50 0.93 -1.00 0.00 0.00 179.01 178.74 2j02 h GLU 34 N 0.38 -0.66 -0.37 2.33 4.39 -1.24 2.02 114.58 121.44 2j02 h GLU 34 Ca 0.66 0.05 0.11 0.00 0.34 0.00 0.00 59.36 60.51 2j02 h GLU 34 Cb 1.61 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 30.40 2j02 h GLU 34 CO -0.40 -0.44 0.38 0.82 -1.16 0.00 0.00 179.01 178.21 2j02 h ILE 35 N -0.69 0.42 0.10 3.13 2.04 -0.95 0.07 117.51 121.64 2j02 h ILE 35 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 2j02 h ILE 35 Cb 0.70 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2j02 h ILE 35 CO -0.29 0.00 -0.05 -0.07 0.00 0.00 0.00 178.15 177.74 2j02 h LEU 36 N 0.00 -0.11 -0.65 1.44 3.38 0.86 -0.11 115.31 120.12 2j02 h LEU 36 Ca 0.17 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.21 2j02 h LEU 36 Cb 0.94 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.64 2j02 h LEU 36 CO -0.00 0.08 -0.38 -1.14 0.09 0.00 0.00 178.44 177.08 2j02 n ARG 37 N -3.25 -0.29 -0.25 1.13 0.63 0.63 0.18 116.66 115.44 2j02 n ARG 37 Ca -0.02 1.12 0.03 0.00 -0.92 0.00 0.00 57.85 58.07 2j02 n ARG 37 Cb 0.05 -1.65 0.16 0.00 0.45 0.00 0.00 32.46 31.47 2j02 n ARG 37 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2j02 h ILE 38 N 0.00 0.77 -0.77 5.15 2.04 -1.12 1.19 117.51 124.76 2j02 h ILE 38 Ca 0.10 -0.19 0.11 0.00 1.00 0.00 0.00 64.86 65.88 2j02 h ILE 38 Cb 0.27 0.18 -0.05 0.00 -0.74 0.00 0.00 36.82 36.47 2j02 h ILE 38 CO -0.61 0.10 0.50 0.25 0.00 0.00 0.00 178.15 178.39 2j02 h LEU 39 N 0.54 0.59 0.06 1.44 5.85 0.39 -2.28 115.31 121.89 2j02 h LEU 39 Ca 0.38 0.02 -0.29 0.00 0.84 0.00 0.00 57.88 58.83 2j02 h LEU 39 Cb 0.49 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 2j02 h LEU 39 CO -0.33 0.34 -1.56 0.00 -0.34 0.00 0.00 178.44 176.56 2j02 h ALA 40 N 1.62 0.32 0.00 1.25 0.00 0.20 -1.13 119.26 121.52 2j02 h ALA 40 Ca 0.36 -1.28 0.00 0.00 0.00 0.00 0.00 54.91 53.99 2j02 h ALA 40 Cb 0.53 0.71 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2j02 h ALA 40 CO -0.13 0.95 0.29 -2.13 0.00 0.00 0.00 179.25 178.22 2j02 n ARG 41 N -4.04 0.04 -0.03 0.00 0.63 0.38 0.41 116.66 114.05 2j02 n ARG 41 Ca -0.32 0.42 0.04 0.00 -0.92 0.00 0.00 57.85 57.07 2j02 n ARG 41 Cb 0.84 -1.93 0.05 0.00 0.45 0.00 0.00 32.46 31.87 2j02 n ARG 41 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2j02 n GLU 42 N -1.66 0.80 -2.70 -0.14 -0.58 -0.87 -5.03 120.64 110.46 2j02 n GLU 42 Ca -0.00 -1.20 -0.08 0.00 -0.42 0.00 0.00 57.16 55.45 2j02 n GLU 42 Cb 0.30 -1.16 0.04 0.00 -0.57 0.00 0.00 31.44 30.05 2j02 n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2j02 n GLY 43 N 0.39 0.04 0.00 0.62 0.00 1.34 -4.98 105.19 102.60 2j02 n GLY 43 Ca 0.06 -0.18 0.07 0.00 0.00 0.00 0.00 46.02 45.97 2j02 n GLY 43 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2j02 n PHE 44 N -2.55 0.00 -3.90 1.61 3.72 -0.43 -5.00 117.46 110.91 2j02 n PHE 44 Ca -0.14 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.15 2j02 n PHE 44 Cb 0.58 -0.23 -0.10 0.00 -0.94 0.00 0.00 39.48 38.79 2j02 n PHE 44 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 2j02 s ILE 45 N -2.78 0.09 0.24 4.37 -4.36 -1.26 -4.19 121.20 113.32 2j02 s ILE 45 Ca -0.02 -0.75 -0.05 0.00 -0.26 0.00 0.00 60.65 59.57 2j02 s ILE 45 Cb 0.09 -0.39 0.21 0.00 1.25 0.00 0.00 42.46 43.62 2j02 s ILE 45 CO 0.57 -0.41 1.73 0.11 0.24 0.00 0.00 174.94 177.19 2j02 h LYS 46 N 4.37 0.43 0.00 0.37 1.57 -1.61 -3.44 116.57 118.25 2j02 h LYS 46 Ca -0.31 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 2j02 h LYS 46 Cb 1.20 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.41 2j02 h LYS 46 CO 0.41 0.28 0.00 0.41 -0.57 0.00 0.00 179.45 179.98 2j02 n GLY 47 N -1.32 -0.13 3.49 3.86 0.00 -1.21 -5.01 105.19 104.87 2j02 n GLY 47 Ca 0.13 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 2j02 n GLY 47 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2j02 n TYR 48 N 9.00 -1.88 -3.62 1.61 0.18 -1.26 0.93 117.16 122.11 2j02 n TYR 48 Ca 0.00 -2.07 -0.06 0.00 1.88 0.00 0.00 57.90 57.65 2j02 n TYR 48 Cb 0.00 0.72 -0.06 0.00 -0.38 0.00 0.00 39.34 39.62 2j02 n TYR 48 CO 0.00 0.00 0.00 -1.83 -2.08 0.00 0.00 176.86 172.95 2j02 s GLU 49 N -2.44 0.31 0.51 -3.48 -1.05 -0.30 -4.97 118.70 107.28 2j02 s GLU 49 Ca 0.22 0.19 -0.21 0.00 -0.15 0.00 0.00 54.97 55.02 2j02 s GLU 49 Cb -0.03 0.15 -0.06 0.00 -0.44 0.00 0.00 34.13 33.75 2j02 s GLU 49 CO 0.16 -0.07 1.17 1.03 0.95 0.00 0.00 175.26 178.50 2j02 s ARG 50 N -0.54 3.49 0.00 -4.83 0.52 -1.26 -0.10 118.95 116.24 2j02 s ARG 50 Ca 0.04 1.76 0.00 0.00 -0.52 0.00 0.00 55.73 57.02 2j02 s ARG 50 Cb -0.03 -2.21 0.00 0.00 0.52 0.00 0.00 34.95 33.23 2j02 s ARG 50 CO -0.07 -0.77 0.00 1.33 0.02 0.00 0.00 175.30 175.81 2j02 n VAL 51 N -0.92 0.00 -3.19 3.52 0.24 -0.97 -4.84 118.33 112.17 2j02 n VAL 51 Ca 0.10 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.44 2j02 n VAL 51 Cb 0.49 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.84 2j02 n VAL 51 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2j02 s ASP 52 N 1.08 -0.82 -1.20 -1.34 2.15 -1.26 -3.46 116.67 111.82 2j02 s ASP 52 Ca 0.00 0.59 -0.09 0.00 0.43 0.00 0.00 52.55 53.48 2j02 s ASP 52 Cb 0.00 1.71 0.22 0.00 -0.30 0.00 0.00 42.92 44.55 2j02 s ASP 52 CO 0.00 -0.15 1.61 0.52 -0.17 0.00 0.00 175.17 176.97 2j02 n VAL 53 N 5.41 4.61 -2.48 1.11 0.31 0.28 -4.61 118.33 122.96 2j02 n VAL 53 Ca -0.05 -4.97 -0.02 0.00 -0.01 0.00 0.00 64.34 59.29 2j02 n VAL 53 Cb 0.52 -2.33 0.00 0.00 -0.91 0.00 0.00 33.84 31.12 2j02 n VAL 53 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2j02 n ASP 54 N 3.43 -5.87 0.00 4.52 8.00 -1.26 -3.19 116.55 122.19 2j02 n ASP 54 Ca 0.34 0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.95 2j02 n ASP 54 Cb 0.37 -3.87 0.00 0.00 -0.02 0.00 0.00 41.12 37.60 2j02 n ASP 54 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2j02 n GLY 55 N -1.08 0.31 3.22 0.44 0.00 -1.26 -4.91 105.19 101.91 2j02 n GLY 55 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2j02 n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j02 s LYS 56 N -0.75 2.97 -0.25 1.61 1.02 -1.19 -5.06 119.74 118.10 2j02 s LYS 56 Ca 0.00 -2.30 -0.29 0.00 0.02 0.00 0.00 55.97 53.40 2j02 s LYS 56 Cb 0.00 -4.08 -0.01 0.00 -0.52 0.00 0.00 37.83 33.22 2j02 s LYS 56 CO 0.00 -1.23 1.47 -1.25 -0.92 0.00 0.00 175.35 173.41 2j02 s PRO 57 N 0.41 3.88 0.00 -1.68 0.04 -1.26 0.98 135.00 137.37 2j02 s PRO 57 Ca 0.14 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.68 2j02 s PRO 57 Cb -0.18 -3.95 0.00 0.00 0.04 0.00 0.00 34.50 30.41 2j02 s PRO 57 CO -0.05 -1.18 0.00 0.66 0.04 0.00 0.00 177.00 176.47 2j02 n TYR 58 N 7.97 -0.84 -3.61 0.56 4.02 -1.23 -0.87 117.16 123.18 2j02 n TYR 58 Ca 0.17 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.79 2j02 n TYR 58 Cb 0.46 0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.61 2j02 n TYR 58 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2j02 s LEU 59 N 0.00 0.44 0.17 7.72 1.43 0.12 -2.30 118.68 126.25 2j02 s LEU 59 Ca 0.00 -0.73 -0.32 0.00 -1.03 0.00 0.00 54.13 52.05 2j02 s LEU 59 Cb 0.00 -0.28 -0.10 0.00 0.03 0.00 0.00 46.19 45.84 2j02 s LEU 59 CO 0.00 -0.36 1.58 -0.13 0.23 0.00 0.00 176.35 177.67 2j02 s ARG 60 N 2.11 4.21 -0.28 1.70 1.81 0.86 -2.20 118.95 127.16 2j02 s ARG 60 Ca 0.03 2.37 0.02 0.00 -1.72 0.00 0.00 55.73 56.43 2j02 s ARG 60 Cb -0.16 -3.16 0.08 0.00 -0.45 0.00 0.00 34.95 31.26 2j02 s ARG 60 CO -0.13 -0.62 0.00 0.08 -0.68 0.00 0.00 175.30 173.95 2j02 s VAL 61 N 1.17 1.69 -0.08 3.52 1.01 0.41 -1.14 120.40 126.97 2j02 s VAL 61 Ca 0.70 -1.63 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 2j02 s VAL 61 Cb -0.44 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 2j02 s VAL 61 CO 0.31 -0.35 1.15 -0.31 0.00 0.00 0.00 175.10 175.90 2j02 s TYR 62 N 1.26 3.24 0.13 5.22 2.02 0.26 -1.63 117.35 127.86 2j02 s TYR 62 Ca 0.02 1.30 -0.16 0.00 -0.37 0.00 0.00 57.07 57.85 2j02 s TYR 62 Cb -0.19 -3.37 -0.07 0.00 -0.40 0.00 0.00 41.96 37.93 2j02 s TYR 62 CO -0.10 -1.06 0.57 -0.51 -1.57 0.00 0.00 175.55 172.88 2j02 s LEU 63 N 2.30 4.39 -0.15 -1.29 2.01 -0.58 -1.87 118.68 123.49 2j02 s LEU 63 Ca 0.54 1.15 -0.03 0.00 0.01 0.00 0.00 54.13 55.80 2j02 s LEU 63 Cb -0.23 -3.20 -0.02 0.00 0.01 0.00 0.00 46.19 42.75 2j02 s LEU 63 CO 0.20 0.14 -0.07 -0.75 1.01 0.00 0.00 176.35 176.88 2j02 s LYS 64 N -1.75 3.57 0.50 1.70 2.20 -1.26 -4.56 119.74 120.15 2j02 s LYS 64 Ca 0.36 -0.58 0.01 0.00 -0.36 0.00 0.00 55.97 55.40 2j02 s LYS 64 Cb -0.16 -2.83 -0.01 0.00 -1.51 0.00 0.00 37.83 33.32 2j02 s LYS 64 CO 0.19 0.21 0.04 0.71 -0.36 0.00 0.00 175.35 176.14 2j02 s TYR 65 N 0.42 1.76 0.00 4.03 1.51 -1.26 -3.74 117.35 120.07 2j02 s TYR 65 Ca -0.06 -1.09 0.00 0.00 -1.01 0.00 0.00 57.07 54.91 2j02 s TYR 65 Cb -0.15 -1.48 0.00 0.00 -0.11 0.00 0.00 41.96 40.22 2j02 s TYR 65 CO 0.04 0.06 0.00 0.41 -1.11 0.00 0.00 175.55 174.95 2j02 n GLY 66 N -1.23 1.00 3.84 0.71 0.00 0.66 -4.82 105.19 105.35 2j02 n GLY 66 Ca -0.18 -1.94 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 2j02 n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2j02 s PRO 67 N 0.19 4.10 0.96 1.61 0.04 -1.26 -4.76 135.00 135.88 2j02 s PRO 67 Ca 0.00 0.86 -0.13 0.00 0.04 0.00 0.00 61.00 61.78 2j02 s PRO 67 Cb 0.00 -2.33 0.07 0.00 0.04 0.00 0.00 34.50 32.28 2j02 s PRO 67 CO 0.00 0.08 0.56 -2.13 0.04 0.00 0.00 177.00 175.55 2j02 n ARG 68 N -0.46 -0.49 -4.44 4.56 0.63 -1.26 -4.13 116.66 111.06 2j02 n ARG 68 Ca 0.05 -0.10 -0.24 0.00 -0.92 0.00 0.00 57.85 56.64 2j02 n ARG 68 Cb 0.53 -1.97 -0.10 0.00 0.45 0.00 0.00 32.46 31.38 2j02 n ARG 68 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2j02 s ARG 69 N -3.87 1.77 -0.06 -0.14 0.52 -1.24 -4.89 118.95 111.04 2j02 s ARG 69 Ca 0.59 -1.71 -0.17 0.00 -0.52 0.00 0.00 55.73 53.93 2j02 s ARG 69 Cb -0.21 -1.83 -0.05 0.00 0.52 0.00 0.00 34.95 33.38 2j02 s ARG 69 CO 0.65 0.34 0.45 -0.65 0.02 0.00 0.00 175.30 176.11 2j02 s GLN 70 N -3.51 4.19 0.01 3.54 -1.52 -1.26 -4.62 119.66 116.49 2j02 s GLN 70 Ca 0.30 0.44 0.00 0.00 -1.95 0.00 0.00 55.36 54.15 2j02 s GLN 70 Cb -0.05 -3.35 0.00 0.00 -0.22 0.00 0.00 33.01 29.39 2j02 s GLN 70 CO 0.16 0.38 0.00 0.41 -0.25 0.00 0.00 175.29 175.98 2j02 n GLY 71 N 2.66 -2.87 3.64 3.09 0.00 -1.26 -4.90 105.19 105.56 2j02 n GLY 71 Ca -0.10 -2.07 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 2j02 n GLY 71 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2j02 n PRO 72 N -0.01 0.85 -3.46 1.61 -0.02 -1.26 -2.94 135.00 129.77 2j02 n PRO 72 Ca 0.00 0.34 -0.19 0.00 -2.02 0.00 0.00 63.50 61.63 2j02 n PRO 72 Cb 0.00 -2.28 0.06 0.00 -0.02 0.00 0.00 33.50 31.27 2j02 n PRO 72 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2j02 n ASP 73 N -1.30 -3.82 -1.33 2.55 4.64 -1.26 -4.75 116.55 111.27 2j02 n ASP 73 Ca 0.14 -0.74 0.00 0.00 -1.38 0.00 0.00 54.79 52.81 2j02 n ASP 73 Cb 0.48 -4.72 0.00 0.00 -1.04 0.00 0.00 41.12 35.84 2j02 n ASP 73 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2j02 n PRO 74 N -3.86 0.40 -2.82 -0.67 -0.04 -1.15 -4.76 135.00 122.11 2j02 n PRO 74 Ca -0.19 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.85 2j02 n PRO 74 Cb 0.65 -1.30 -0.03 0.00 -0.04 0.00 0.00 33.50 32.77 2j02 n PRO 74 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2j02 s ARG 75 N 0.84 4.29 0.21 0.54 0.52 -1.26 -3.60 118.95 120.49 2j02 s ARG 75 Ca 0.00 1.12 -0.32 0.00 -0.52 0.00 0.00 55.73 56.01 2j02 s ARG 75 Cb 0.00 -3.60 -0.13 0.00 0.52 0.00 0.00 34.95 31.75 2j02 s ARG 75 CO 0.00 -0.42 1.61 -0.35 0.02 0.00 0.00 175.30 176.16 2j02 n PRO 76 N 5.56 2.47 -0.62 3.54 -0.04 -1.26 -4.68 135.00 139.97 2j02 n PRO 76 Ca 0.07 0.89 -0.30 0.00 -0.04 0.00 0.00 63.50 64.11 2j02 n PRO 76 Cb 0.48 -2.67 0.19 0.00 -0.04 0.00 0.00 33.50 31.46 2j02 n PRO 76 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2j02 n GLU 77 N 3.17 -1.09 -4.26 0.54 2.13 -1.26 -4.63 120.64 115.25 2j02 n GLU 77 Ca 0.14 -0.26 -0.24 0.00 0.66 0.00 0.00 57.16 57.46 2j02 n GLU 77 Cb 0.33 -2.26 -0.07 0.00 0.27 0.00 0.00 31.44 29.70 2j02 n GLU 77 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2j02 s GLN 78 N -4.47 2.37 0.10 5.31 -0.21 -1.26 -0.24 119.66 121.26 2j02 s GLN 78 Ca 0.66 -1.32 -0.13 0.00 0.02 0.00 0.00 55.36 54.59 2j02 s GLN 78 Cb -0.23 -2.24 -0.13 0.00 1.00 0.00 0.00 33.01 31.41 2j02 s GLN 78 CO 0.61 0.39 1.34 0.28 -2.12 0.00 0.00 175.29 175.78 2j02 h VAL 79 N 1.98 1.29 -3.53 1.09 2.07 -1.88 -3.40 116.25 113.87 2j02 h VAL 79 Ca -0.45 -1.82 -0.70 0.00 0.82 0.00 0.00 66.70 64.54 2j02 h VAL 79 Cb 1.24 1.86 -0.31 0.00 -1.52 0.00 0.00 31.29 32.56 2j02 h VAL 79 CO 0.60 0.58 -0.54 -0.63 0.02 0.00 0.00 177.57 177.60 2j02 s ILE 80 N -3.92 3.71 -1.15 4.57 1.01 -1.26 -4.89 121.20 119.27 2j02 s ILE 80 Ca -0.11 -1.58 0.25 0.00 0.00 0.00 0.00 60.65 59.20 2j02 s ILE 80 Cb 0.09 -3.31 0.01 0.00 0.01 0.00 0.00 42.46 39.25 2j02 s ILE 80 CO 0.88 -0.48 1.35 1.41 0.00 0.00 0.00 174.94 178.11 2j02 n HIS 81 N 4.76 0.00 -3.54 3.97 8.25 -1.14 -4.88 115.22 122.63 2j02 n HIS 81 Ca -0.08 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.38 2j02 n HIS 81 Cb 0.43 -0.19 -0.04 0.00 1.12 0.00 0.00 29.99 31.31 2j02 n HIS 81 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2j02 s HIS 82 N -2.91 -1.05 -0.01 4.41 5.65 -0.46 -5.06 115.29 115.87 2j02 s HIS 82 Ca 0.13 1.83 0.02 0.00 0.25 0.00 0.00 55.06 57.28 2j02 s HIS 82 Cb 0.18 0.63 -0.00 0.00 -1.18 0.00 0.00 32.58 32.21 2j02 s HIS 82 CO 0.69 -0.52 -0.05 -1.50 -0.65 0.00 0.00 174.74 172.71 2j02 s ILE 83 N 2.67 0.41 -0.27 0.89 2.07 -1.26 -1.94 121.20 123.78 2j02 s ILE 83 Ca -0.05 -0.20 -0.14 0.00 -1.41 0.00 0.00 60.65 58.85 2j02 s ILE 83 Cb -0.09 -0.37 0.09 0.00 0.13 0.00 0.00 42.46 42.22 2j02 s ILE 83 CO -0.18 0.13 0.64 -0.60 -1.91 0.00 0.00 174.94 173.02 2j02 s ARG 84 N 0.02 0.64 0.44 3.50 3.52 -1.11 -5.00 118.95 120.96 2j02 s ARG 84 Ca 0.00 1.21 -0.23 0.00 -0.13 0.00 0.00 55.73 56.58 2j02 s ARG 84 Cb -0.04 0.24 -0.08 0.00 -1.56 0.00 0.00 34.95 33.52 2j02 s ARG 84 CO -0.00 -0.16 1.12 0.50 -0.81 0.00 0.00 175.30 175.94 2j02 s ARG 85 N 1.84 3.91 0.00 5.12 3.52 -1.26 -3.00 118.95 129.07 2j02 s ARG 85 Ca -0.09 1.66 0.00 0.00 -0.13 0.00 0.00 55.73 57.17 2j02 s ARG 85 Cb -0.07 -2.44 0.00 0.00 -1.56 0.00 0.00 34.95 30.88 2j02 s ARG 85 CO -0.19 -0.40 0.00 -0.89 -0.81 0.00 0.00 175.30 173.01 2j02 n ILE 86 N -0.36 0.00 -1.54 4.11 2.08 -0.95 -4.88 119.36 117.82 2j02 n ILE 86 Ca 0.07 0.00 -0.42 0.00 0.56 0.00 0.00 62.75 62.95 2j02 n ILE 86 Cb 0.49 -0.53 -0.05 0.00 -0.75 0.00 0.00 39.64 38.80 2j02 n ILE 86 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 2j02 n SER 87 N -0.19 2.41 -4.96 4.38 2.88 -0.73 -4.86 113.62 112.55 2j02 n SER 87 Ca 0.00 -0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 2j02 n SER 87 Cb 0.00 -1.44 -0.02 0.00 -0.75 0.00 0.00 64.21 61.99 2j02 n SER 87 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2j02 s LYS 88 N 7.23 3.41 0.50 -1.46 1.02 -1.15 -4.79 119.74 124.50 2j02 s LYS 88 Ca 1.05 -0.76 0.21 0.00 0.02 0.00 0.00 55.97 56.50 2j02 s LYS 88 Cb -0.48 -2.88 1.31 0.00 -0.52 0.00 0.00 37.83 35.26 2j02 s LYS 88 CO 0.36 0.44 2.08 -1.00 -0.92 0.00 0.00 175.35 176.31 2j02 h PRO 89 N 1.31 0.00 -0.00 -1.68 0.13 -1.96 0.06 132.00 129.86 2j02 h PRO 89 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2j02 h PRO 89 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2j02 h PRO 89 CO 0.62 0.12 -0.02 0.41 -0.23 0.00 0.00 178.00 178.89 2j02 n GLY 90 N -1.00 -0.94 2.77 1.56 0.00 -1.26 -4.49 105.19 101.83 2j02 n GLY 90 Ca -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.75 2j02 n GLY 90 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j02 s ARG 91 N -2.22 0.46 0.25 1.61 3.52 -0.04 -5.14 118.95 117.40 2j02 s ARG 91 Ca 0.39 -0.37 -0.31 0.00 -0.13 0.00 0.00 55.73 55.31 2j02 s ARG 91 Cb 0.21 0.00 -0.13 0.00 -1.56 0.00 0.00 34.95 33.47 2j02 s ARG 91 CO 0.41 -0.60 1.51 0.54 -0.81 0.00 0.00 175.30 176.35 2j02 n ARG 92 N 3.12 2.33 -3.86 5.12 5.12 -0.92 -2.95 116.66 124.63 2j02 n ARG 92 Ca 0.12 0.83 -0.35 0.00 -1.93 0.00 0.00 57.85 56.52 2j02 n ARG 92 Cb 0.62 -2.56 -0.13 0.00 -1.16 0.00 0.00 32.46 29.23 2j02 n ARG 92 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2j02 s VAL 93 N 0.14 3.06 0.11 1.55 1.01 -1.26 -4.92 120.40 120.08 2j02 s VAL 93 Ca 0.68 -1.78 0.04 0.00 0.00 0.00 0.00 61.98 60.92 2j02 s VAL 93 Cb -0.59 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 2j02 s VAL 93 CO 0.47 -0.42 0.06 -0.31 0.00 0.00 0.00 175.10 174.90 2j02 s TYR 94 N 1.17 3.09 0.02 5.22 2.02 -1.26 -0.27 117.35 127.33 2j02 s TYR 94 Ca 0.03 0.00 0.00 0.00 -0.37 0.00 0.00 57.07 56.73 2j02 s TYR 94 Cb -0.21 -1.55 -0.02 0.00 -0.40 0.00 0.00 41.96 39.79 2j02 s TYR 94 CO -0.03 0.51 -0.03 0.14 -1.57 0.00 0.00 175.55 174.57 2j02 s VAL 95 N -1.48 0.14 0.70 0.71 -7.23 -1.13 -4.88 120.40 107.24 2j02 s VAL 95 Ca 0.28 -0.72 -0.07 0.00 -1.81 0.00 0.00 61.98 59.66 2j02 s VAL 95 Cb -0.11 -0.25 0.06 0.00 0.56 0.00 0.00 36.38 36.64 2j02 s VAL 95 CO 0.21 -0.37 1.02 -0.83 -0.31 0.00 0.00 175.10 174.82 2j02 s GLY 96 N -1.13 1.67 0.48 2.32 0.00 -1.26 -2.54 107.32 106.86 2j02 s GLY 96 Ca -0.12 -0.88 0.17 0.00 0.00 0.00 0.00 44.72 43.90 2j02 s GLY 96 CO -0.01 -0.47 2.02 -0.24 0.00 0.00 0.00 173.10 174.40 2j02 h VAL 97 N -0.61 0.88 0.00 1.40 3.04 -1.79 0.19 116.25 119.36 2j02 h VAL 97 Ca -0.45 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.17 2j02 h VAL 97 Cb 1.31 0.64 0.00 0.00 -2.01 0.00 0.00 31.29 31.23 2j02 h VAL 97 CO 0.61 0.04 -0.30 0.29 -1.01 0.00 0.00 177.57 177.20 2j02 n LYS 98 N -4.46 0.07 0.00 4.17 5.02 -1.26 -3.77 118.16 117.93 2j02 n LYS 98 Ca 0.07 0.03 0.11 0.00 -2.02 0.00 0.00 58.31 56.51 2j02 n LYS 98 Cb 0.37 -1.55 0.14 0.00 -0.02 0.00 0.00 35.03 33.97 2j02 n LYS 98 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2j02 n GLU 99 N -1.66 0.03 -1.66 1.97 1.02 0.64 -4.96 120.64 116.03 2j02 n GLU 99 Ca 0.06 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.75 2j02 n GLU 99 Cb 0.36 -1.51 -0.02 0.00 -0.02 0.00 0.00 31.44 30.24 2j02 n GLU 99 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2j02 n ILE 100 N -1.56 1.12 -1.16 -3.67 5.41 -1.04 -4.83 119.36 113.63 2j02 n ILE 100 Ca 0.05 -0.28 -0.32 0.00 1.00 0.00 0.00 62.75 63.20 2j02 n ILE 100 Cb 0.35 -1.40 0.11 0.00 -0.71 0.00 0.00 39.64 37.99 2j02 n ILE 100 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2j02 s PRO 101 N -0.63 1.85 -0.74 0.38 0.02 -1.26 -5.01 135.00 129.61 2j02 s PRO 101 Ca 0.67 1.48 0.03 0.00 0.02 0.00 0.00 61.00 63.19 2j02 s PRO 101 Cb -0.66 -1.83 0.18 0.00 0.02 0.00 0.00 34.50 32.21 2j02 s PRO 101 CO 0.52 -2.00 0.55 1.03 -0.33 0.00 0.00 177.00 176.77 2j02 s ARG 102 N -4.47 2.64 0.12 5.54 3.00 -1.26 -4.85 118.95 119.66 2j02 s ARG 102 Ca 0.67 -3.27 -0.32 0.00 0.00 0.00 0.00 55.73 52.81 2j02 s ARG 102 Cb -0.22 -3.56 -0.12 0.00 0.00 0.00 0.00 34.95 31.05 2j02 s ARG 102 CO 0.52 -1.27 1.78 0.28 0.00 0.00 0.00 175.30 176.62 2j02 n VAL 103 N 2.16 0.28 -3.97 3.52 0.31 -1.26 -3.52 118.33 115.85 2j02 n VAL 103 Ca 0.19 -0.05 -0.38 0.00 -0.01 0.00 0.00 64.34 64.09 2j02 n VAL 103 Cb 0.35 -1.98 0.01 0.00 -0.91 0.00 0.00 33.84 31.32 2j02 n VAL 103 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2j02 n ARG 104 N 5.14 -0.73 -3.32 5.55 3.00 -1.26 -0.30 116.66 124.74 2j02 n ARG 104 Ca 0.18 0.31 -0.21 0.00 -0.00 0.00 0.00 57.85 58.13 2j02 n ARG 104 Cb 0.35 -2.27 -0.04 0.00 0.00 0.00 0.00 32.46 30.50 2j02 n ARG 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2j02 n ARG 105 N -4.05 -1.62 0.00 -0.14 5.12 -1.23 0.59 116.66 115.34 2j02 n ARG 105 Ca -0.19 0.07 0.00 0.00 -1.93 0.00 0.00 57.85 55.80 2j02 n ARG 105 Cb 0.60 -4.02 0.00 0.00 -1.16 0.00 0.00 32.46 27.88 2j02 n ARG 105 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2j02 n GLY 106 N -0.75 3.00 0.18 -0.13 0.00 0.59 -4.86 105.19 103.22 2j02 n GLY 106 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2j02 n GLY 106 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2j02 h LEU 107 N 0.00 0.08-10.65 0.99 3.38 0.17 -3.45 115.31 105.82 2j02 h LEU 107 Ca 0.00 -0.03 -0.46 0.00 0.09 0.00 0.00 57.88 57.48 2j02 h LEU 107 Cb 0.00 -0.02 0.09 0.00 0.09 0.00 0.00 40.66 40.82 2j02 h LEU 107 CO 0.00 0.50 0.19 -0.83 0.09 0.00 0.00 178.44 178.39 2j02 s GLY 108 N -4.31 1.75 0.32 0.83 0.00 -0.25 -4.97 107.32 100.69 2j02 s GLY 108 Ca -0.03 -1.28 0.06 0.00 0.00 0.00 0.00 44.72 43.47 2j02 s GLY 108 CO 0.75 -0.77 -0.02 -1.50 0.00 0.00 0.00 173.10 171.55 2j02 s ILE 109 N -3.27 1.68 -0.45 0.90 2.07 -0.61 -4.56 121.20 116.96 2j02 s ILE 109 Ca 0.64 -2.08 0.07 0.00 -1.41 0.00 0.00 60.65 57.86 2j02 s ILE 109 Cb -0.08 -2.65 0.24 0.00 0.13 0.00 0.00 42.46 40.10 2j02 s ILE 109 CO 0.45 -0.17 0.72 0.00 -1.91 0.00 0.00 174.94 174.04 2j02 n ALA 110 N -0.70 0.07 -1.44 1.50 0.00 -1.26 -2.21 120.51 116.47 2j02 n ALA 110 Ca -0.05 -2.14 -0.43 0.00 0.00 0.00 0.00 53.44 50.83 2j02 n ALA 110 Cb 0.65 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.96 2j02 n ALA 110 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2j02 n ILE 111 N 1.72 1.68 -3.54 0.00 5.41 -1.23 -3.41 119.36 119.99 2j02 n ILE 111 Ca 0.15 -0.50 -0.16 0.00 1.00 0.00 0.00 62.75 63.24 2j02 n ILE 111 Cb 0.58 -0.47 -0.06 0.00 -0.71 0.00 0.00 39.64 38.99 2j02 n ILE 111 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 2j02 s LEU 112 N 2.06 -0.56 0.00 1.39 0.05 -0.70 -2.14 118.68 118.77 2j02 s LEU 112 Ca 0.62 0.62 -0.19 0.00 0.05 0.00 0.00 54.13 55.24 2j02 s LEU 112 Cb -0.65 2.32 -0.06 0.00 -2.05 0.00 0.00 46.19 45.75 2j02 s LEU 112 CO 0.59 -0.52 0.53 -0.55 -0.55 0.00 0.00 176.35 175.85 2j02 s SER 113 N -1.16 6.92 0.19 1.48 0.15 -0.67 -2.25 113.70 118.37 2j02 s SER 113 Ca -0.08 1.09 0.04 0.00 0.70 0.00 0.00 55.95 57.71 2j02 s SER 113 Cb -0.00 -2.33 -0.05 0.00 -1.71 0.00 0.00 66.02 61.93 2j02 s SER 113 CO 0.07 0.18 -0.06 0.42 1.20 0.00 0.00 173.24 175.05 2j02 s THR 114 N -0.49 1.18 0.38 6.45 -4.23 0.21 -1.56 115.64 117.57 2j02 s THR 114 Ca 0.28 -2.06 0.08 0.00 -1.18 0.00 0.00 61.69 58.81 2j02 s THR 114 Cb -0.18 -2.11 0.31 0.00 1.34 0.00 0.00 72.50 71.86 2j02 s THR 114 CO 0.16 -0.53 1.95 0.77 -0.54 0.00 0.00 174.62 176.43 2j02 h SER 115 N 2.60 0.59 -2.14 3.99 4.64 -1.99 -2.70 113.55 118.55 2j02 h SER 115 Ca -0.38 0.01 -0.73 0.00 -0.47 0.00 0.00 61.79 60.23 2j02 h SER 115 Cb 1.21 -0.11 -0.32 0.00 -0.31 0.00 0.00 62.40 62.86 2j02 h SER 115 CO 0.64 0.36 0.46 0.29 -0.87 0.00 0.00 176.83 177.71 2j02 n LYS 116 N -4.49 4.20 0.00 4.77 5.02 -1.26 -5.04 118.16 121.36 2j02 n LYS 116 Ca 0.11 -4.48 0.00 0.00 -2.02 0.00 0.00 58.31 51.92 2j02 n LYS 116 Cb 0.29 -2.35 0.00 0.00 -0.02 0.00 0.00 35.03 32.95 2j02 n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2j02 n GLY 117 N -0.24 -3.30 3.37 0.72 0.00 -1.02 -4.90 105.19 99.82 2j02 n GLY 117 Ca 0.44 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.06 2j02 n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j02 s VAL 118 N -0.69 4.55 0.51 1.61 1.01 -1.26 -0.62 120.40 125.50 2j02 s VAL 118 Ca 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.09 2j02 s VAL 118 Cb 0.00 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 32.83 2j02 s VAL 118 CO 0.00 -0.26 0.10 0.18 0.00 0.00 0.00 175.10 175.12 2j02 n LEU 119 N 4.99 0.00 -4.59 3.92 4.77 -0.95 -4.95 117.00 120.18 2j02 n LEU 119 Ca -0.12 -3.04 -0.27 0.00 -0.03 0.00 0.00 56.01 52.55 2j02 n LEU 119 Cb 0.46 0.25 -0.11 0.00 -2.33 0.00 0.00 43.42 41.69 2j02 n LEU 119 CO 0.37 -0.47 -0.32 0.42 -1.33 0.00 0.00 177.39 176.05 2j02 s THR 120 N -2.76 2.05 0.36 -5.08 -4.23 -1.26 -1.72 115.64 103.01 2j02 s THR 120 Ca 0.07 -2.06 0.02 0.00 -1.18 0.00 0.00 61.69 58.54 2j02 s THR 120 Cb -0.01 -2.89 0.02 0.00 1.34 0.00 0.00 72.50 70.96 2j02 s THR 120 CO 0.05 -0.06 0.85 -2.24 -0.54 0.00 0.00 174.62 172.67 2j02 h ASP 121 N 1.86 0.00 0.00 3.99 2.03 -1.88 0.31 116.42 122.72 2j02 h ASP 121 Ca -0.43 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 55.82 2j02 h ASP 121 Cb 1.24 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.74 2j02 h ASP 121 CO 0.78 0.00 -0.72 0.54 -1.03 0.00 0.00 179.24 178.80 2j02 n ARG 122 N -1.91 0.26 -0.08 4.15 1.74 -1.26 -4.33 116.66 115.24 2j02 n ARG 122 Ca -0.00 0.10 -0.04 0.00 -0.77 0.00 0.00 57.85 57.15 2j02 n ARG 122 Cb 0.75 -0.95 -0.03 0.00 -1.02 0.00 0.00 32.46 31.21 2j02 n ARG 122 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2j02 h GLU 123 N -0.48 -0.07 -0.76 5.56 5.08 -1.49 0.79 114.58 123.22 2j02 h GLU 123 Ca -0.07 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.47 2j02 h GLU 123 Cb 0.63 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.78 2j02 h GLU 123 CO -0.04 -0.04 0.15 0.00 -1.00 0.00 0.00 179.01 178.08 2j02 h ALA 124 N -0.75 0.96 -0.59 3.43 0.00 -1.31 0.42 119.26 121.41 2j02 h ALA 124 Ca 0.03 0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.16 2j02 h ALA 124 Cb 0.16 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2j02 h ALA 124 CO -0.23 -0.37 0.36 -0.09 0.00 0.00 0.00 179.25 178.92 2j02 h ARG 125 N 0.23 0.68 -0.27 0.00 2.43 -1.11 0.91 114.38 117.25 2j02 h ARG 125 Ca 0.43 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 2j02 h ARG 125 Cb 0.77 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 2j02 h ARG 125 CO -0.56 0.45 0.12 -0.22 -1.51 0.00 0.00 179.97 178.25 2j02 h LYS 126 N 0.70 0.40 0.00 0.20 3.64 0.39 0.11 116.57 122.01 2j02 h LYS 126 Ca 0.24 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2j02 h LYS 126 Cb 0.04 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2j02 h LYS 126 CO -0.11 0.41 0.00 -0.07 -2.27 0.00 0.00 179.45 177.41 2j02 h LEU 127 N 0.29 0.00 -2.44 5.20 -0.00 0.49 -3.47 115.31 115.38 2j02 h LEU 127 Ca 0.09 0.00 -0.20 0.00 -0.00 0.00 0.00 57.88 57.77 2j02 h LEU 127 Cb 0.16 0.00 0.16 0.00 -0.00 0.00 0.00 40.66 40.98 2j02 h LEU 127 CO -0.01 0.00 -0.70 0.61 -0.00 0.00 0.00 178.44 178.34 2j02 n GLY 128 N -0.52 -1.17 0.00 0.83 0.00 0.31 -5.03 105.19 99.61 2j02 n GLY 128 Ca -0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 2j02 n GLY 128 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2j02 n VAL 129 N -2.95 0.00 0.00 1.61 0.24 -0.88 -4.98 118.33 111.37 2j02 n VAL 129 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 2j02 n VAL 129 Cb 0.60 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 2j02 n VAL 129 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2j02 n GLY 130 N 2.34 -0.10 0.00 7.63 0.00 -1.26 -2.06 105.19 111.74 2j02 n GLY 130 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 2j02 n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j02 n GLY 131 N -0.19 -1.08 3.54 -0.02 0.00 -1.05 -4.06 105.19 102.33 2j02 n GLY 131 Ca 0.00 -1.41 -0.45 0.00 0.00 0.00 0.00 46.02 44.16 2j02 n GLY 131 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2j02 n GLU 132 N -0.27 1.56 -1.89 1.61 2.13 -0.60 -2.85 120.64 120.32 2j02 n GLU 132 Ca 0.00 0.40 -0.23 0.00 0.66 0.00 0.00 57.16 57.99 2j02 n GLU 132 Cb 0.00 -2.97 -0.08 0.00 0.27 0.00 0.00 31.44 28.66 2j02 n GLU 132 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2j02 s LEU 133 N 8.33 2.81 0.25 4.31 0.20 0.63 -1.67 118.68 133.53 2j02 s LEU 133 Ca 1.04 -1.31 -0.04 0.00 0.69 0.00 0.00 54.13 54.51 2j02 s LEU 133 Cb -0.51 -2.59 0.47 0.00 -0.43 0.00 0.00 46.19 43.13 2j02 s LEU 133 CO 0.39 -3.69 1.69 0.40 -0.29 0.00 0.00 176.35 174.86 2j02 h ILE 134 N 6.48 0.54 0.00 6.68 1.08 -1.83 -1.93 117.51 128.53 2j02 h ILE 134 Ca 0.13 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 2j02 h ILE 134 Cb 0.96 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 34.92 2j02 h ILE 134 CO 1.14 0.06 0.00 0.00 -0.69 0.00 0.00 178.15 178.66 2j02 s GLU 136 N -0.29 0.76 0.30 0.00 -1.05 -1.16 -3.51 118.70 113.74 2j02 s GLU 136 Ca 0.00 1.00 0.06 0.00 -0.15 0.00 0.00 54.97 55.87 2j02 s GLU 136 Cb 0.00 0.32 -0.06 0.00 -0.44 0.00 0.00 34.13 33.95 2j02 s GLU 136 CO 0.00 -0.11 -0.02 0.08 0.95 0.00 0.00 175.26 176.17 2j02 s VAL 137 N 0.69 1.51 0.00 1.83 1.01 -0.94 -2.76 120.40 121.74 2j02 s VAL 137 Ca -0.02 -2.08 0.00 0.00 0.00 0.00 0.00 61.98 59.88 2j02 s VAL 137 Cb -0.05 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.75 2j02 s VAL 137 CO -0.05 -0.20 0.00 -2.67 0.00 0.00 0.00 175.10 172.18