#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jpo s PRO 2 N 0.00 3.24 0.26 4.33 0.04 -1.26 -4.39 135.00 137.22 2jpo s PRO 2 Ca 0.00 -0.86 0.00 0.00 0.04 0.00 0.00 61.00 60.18 2jpo s PRO 2 Cb 0.00 -5.26 0.00 0.00 0.04 0.00 0.00 34.50 29.28 2jpo s PRO 2 CO 0.00 -2.62 0.00 -1.91 0.04 0.00 0.00 177.00 172.51 2jpo n GLU 3 N 8.86 0.00 -2.93 4.56 2.13 -1.26 -5.00 120.64 127.00 2jpo n GLU 3 Ca 0.36 0.00 -0.18 0.00 0.66 0.00 0.00 57.16 57.99 2jpo n GLU 3 Cb 0.49 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.19 2jpo n GLU 3 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2jpo n ILE 4 N -3.17 1.03 -4.38 6.31 -5.35 -1.26 -5.05 119.36 107.48 2jpo n ILE 4 Ca 0.00 -4.43 -0.19 0.00 -0.27 0.00 0.00 62.75 57.86 2jpo n ILE 4 Cb 0.00 -0.35 -0.10 0.00 -1.74 0.00 0.00 39.64 37.44 2jpo n ILE 4 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2jpo s MET 5 N -2.93 1.51 -0.80 6.28 -1.94 -1.26 -4.97 119.30 115.19 2jpo s MET 5 Ca 0.39 -1.82 -0.23 0.00 -1.71 0.00 0.00 55.69 52.33 2jpo s MET 5 Cb 0.37 -0.61 0.03 0.00 2.01 0.00 0.00 34.83 36.63 2jpo s MET 5 CO -0.07 -0.21 0.45 1.63 -0.01 0.00 0.00 175.02 176.81 2jpo n LYS 6 N -0.56 -0.51 -3.61 2.03 5.02 -1.26 -4.90 118.16 114.37 2jpo n LYS 6 Ca -0.02 -0.10 -0.29 0.00 -2.02 0.00 0.00 58.31 55.88 2jpo n LYS 6 Cb 0.66 -1.33 -0.15 0.00 -0.02 0.00 0.00 35.03 34.19 2jpo n LYS 6 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2jpo s ASN 7 N -3.93 3.52 -1.40 4.39 2.20 -1.26 -4.80 114.94 113.66 2jpo s ASN 7 Ca 0.32 -1.29 -0.18 0.00 -0.94 0.00 0.00 52.86 50.77 2jpo s ASN 7 Cb -0.18 -0.50 0.18 0.00 -2.00 0.00 0.00 41.25 38.75 2jpo s ASN 7 CO 0.66 -0.42 0.44 -0.11 -2.94 0.00 0.00 177.10 174.73 2jpo n LEU 8 N 5.13 -0.61 -0.05 3.54 -0.00 -1.26 -4.78 117.00 118.96 2jpo n LEU 8 Ca -0.05 -0.85 -0.07 0.00 -0.00 0.00 0.00 56.01 55.03 2jpo n LEU 8 Cb 0.43 -1.32 -0.02 0.00 -0.00 0.00 0.00 43.42 42.50 2jpo n LEU 8 CO 0.07 0.07 -0.52 -1.54 -0.00 0.00 0.00 177.39 175.47 2jpo n SER 9 N -1.95 1.65 0.22 1.96 3.41 -1.26 -4.42 113.62 113.23 2jpo n SER 9 Ca 0.09 0.27 -0.09 0.00 -0.26 0.00 0.00 58.87 58.88 2jpo n SER 9 Cb 0.40 -0.61 -0.04 0.00 -0.26 0.00 0.00 64.21 63.70 2jpo n SER 9 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2jpo h ASN 10 N -0.68 -0.50 -0.76 4.04 2.35 -1.92 -1.78 115.58 116.33 2jpo h ASN 10 Ca -0.04 0.02 0.16 0.00 -0.55 0.00 0.00 56.30 55.89 2jpo h ASN 10 Cb 0.74 0.13 -0.14 0.00 0.05 0.00 0.00 38.32 39.11 2jpo h ASN 10 CO -0.03 -0.34 -0.10 -0.55 -1.65 0.00 0.00 177.43 174.76 2jpo h ASN 11 N -0.56 -0.55 0.37 5.81 7.08 -1.85 0.16 115.58 126.04 2jpo h ASN 11 Ca -0.06 0.22 -0.02 0.00 -3.08 0.00 0.00 56.30 53.36 2jpo h ASN 11 Cb 0.43 0.42 0.00 0.00 -2.08 0.00 0.00 38.32 37.10 2jpo h ASN 11 CO 0.08 -0.23 -0.18 0.15 -2.08 0.00 0.00 177.43 175.18 2jpo h PHE 12 N 0.04 -0.46 -0.49 4.14 3.04 -1.63 -0.74 116.94 120.83 2jpo h PHE 12 Ca 0.39 -0.01 -0.07 0.00 3.98 0.00 0.00 57.97 62.26 2jpo h PHE 12 Cb 0.65 0.15 -0.02 0.00 2.56 0.00 0.00 35.95 39.29 2jpo h PHE 12 CO -0.52 -0.28 0.04 0.78 -2.02 0.00 0.00 178.31 176.30 2jpo h GLY 13 N -0.50 0.85 0.93 2.40 0.00 -0.86 -2.84 103.07 103.05 2jpo h GLY 13 Ca -0.05 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 2jpo h GLY 13 CO 0.08 0.50 0.02 1.70 0.00 0.00 0.00 176.54 178.84 2jpo h LYS 14 N 0.75 0.04 -0.20 4.80 3.64 -0.61 -1.16 116.57 123.82 2jpo h LYS 14 Ca 0.15 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 2jpo h LYS 14 Cb 0.40 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 2jpo h LYS 14 CO 0.01 0.10 0.01 0.00 -2.27 0.00 0.00 179.45 177.31 2jpo h ALA 15 N 0.94 1.65 -0.13 5.00 0.00 -1.05 -0.77 119.26 124.91 2jpo h ALA 15 Ca 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2jpo h ALA 15 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2jpo h ALA 15 CO -0.00 0.27 0.05 1.98 0.00 0.00 0.00 179.25 181.54 2jpo h MET 16 N 0.29 0.20 -0.72 0.00 1.85 -1.19 -2.30 114.93 113.05 2jpo h MET 16 Ca 0.07 -0.04 -0.02 0.00 -0.61 0.00 0.00 59.70 59.10 2jpo h MET 16 Cb 0.18 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.15 2jpo h MET 16 CO 0.00 0.32 0.38 0.22 -0.40 0.00 0.00 176.91 177.43 2jpo h ASP 17 N 0.04 0.92 -0.81 1.39 3.58 -0.48 0.38 116.42 121.43 2jpo h ASP 17 Ca 0.04 -0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.41 2jpo h ASP 17 Cb 0.20 -0.23 -0.05 0.00 1.72 0.00 0.00 39.33 40.97 2jpo h ASP 17 CO -0.00 0.76 0.52 1.56 -2.88 0.00 0.00 179.24 179.20 2jpo h GLN 18 N 1.00 1.00 -0.12 0.28 4.20 -1.13 -0.67 115.11 119.68 2jpo h GLN 18 Ca 0.25 -0.06 -0.22 0.00 0.06 0.00 0.00 58.65 58.68 2jpo h GLN 18 Cb 0.06 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 27.63 2jpo h GLN 18 CO -0.04 0.66 -0.80 0.00 -0.67 0.00 0.00 178.83 177.98 2jpo n LYS 20 N -3.90 0.10 -0.07 0.00 4.81 0.13 -0.15 118.16 119.08 2jpo n LYS 20 Ca -0.07 0.53 -0.07 0.00 -0.87 0.00 0.00 58.31 57.83 2jpo n LYS 20 Cb 0.76 -1.79 -0.02 0.00 0.02 0.00 0.00 35.03 33.99 2jpo n LYS 20 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2jpo n ASP 21 N -2.00 1.54 0.24 3.14 -0.08 -0.31 -2.32 116.55 116.77 2jpo n ASP 21 Ca -0.00 0.29 0.10 0.00 -1.51 0.00 0.00 54.79 53.67 2jpo n ASP 21 Cb 0.07 -0.70 0.61 0.00 2.34 0.00 0.00 41.12 43.44 2jpo n ASP 21 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2jpo h GLU 22 N -0.80 0.00 0.00 -0.67 5.08 -0.92 -0.59 114.58 116.68 2jpo h GLU 22 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jpo h GLU 22 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2jpo h GLU 22 CO 0.00 0.18 -1.56 1.28 -1.00 0.00 0.00 179.01 177.91 2jpo n LEU 23 N -3.77 0.33 -3.50 1.33 4.77 0.79 -5.02 117.00 111.93 2jpo n LEU 23 Ca -0.02 -0.18 -0.20 0.00 -0.03 0.00 0.00 56.01 55.59 2jpo n LEU 23 Cb 0.29 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.44 2jpo n LEU 23 CO 0.33 0.08 0.01 -1.20 -1.33 0.00 0.00 177.39 175.27 2jpo n SER 24 N -1.93 -3.40 -4.72 -1.43 7.64 -0.23 -4.93 113.62 104.62 2jpo n SER 24 Ca -0.01 -0.76 -0.42 0.00 1.01 0.00 0.00 58.87 58.69 2jpo n SER 24 Cb 0.44 -4.57 -0.03 0.00 -1.01 0.00 0.00 64.21 59.04 2jpo n SER 24 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jpo s LEU 25 N -6.22 4.39 0.54 -3.43 1.43 -0.98 -4.97 118.68 109.44 2jpo s LEU 25 Ca 0.19 2.09 -0.21 0.00 -1.03 0.00 0.00 54.13 55.17 2jpo s LEU 25 Cb -0.04 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.55 2jpo s LEU 25 CO 0.78 -0.46 1.23 -2.16 0.23 0.00 0.00 176.35 175.97 2jpo s PRO 26 N 0.78 3.25 0.58 1.29 0.04 -1.26 -4.74 135.00 134.95 2jpo s PRO 26 Ca 0.58 1.91 0.29 0.00 0.04 0.00 0.00 61.00 63.81 2jpo s PRO 26 Cb -0.31 -2.15 1.50 0.00 0.04 0.00 0.00 34.50 33.58 2jpo s PRO 26 CO 0.31 -1.00 1.94 0.22 0.04 0.00 0.00 177.00 178.51 2jpo h ASP 27 N 1.38 0.00 0.44 6.66 3.58 -1.97 0.13 116.42 126.63 2jpo h ASP 27 Ca -0.50 0.00 -0.31 0.00 0.42 0.00 0.00 57.03 56.64 2jpo h ASP 27 Cb 1.28 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.31 2jpo h ASP 27 CO 0.57 0.00 -1.62 0.77 -2.88 0.00 0.00 179.24 176.08 2jpo h SER 28 N 0.00 0.29 -0.08 2.28 4.64 -1.98 -0.39 113.55 118.31 2jpo h SER 28 Ca 0.20 -0.46 -0.15 0.00 -0.47 0.00 0.00 61.79 60.91 2jpo h SER 28 Cb 1.06 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 2jpo h SER 28 CO -0.00 1.40 -0.47 0.58 -0.87 0.00 0.00 176.83 177.46 2jpo h VAL 29 N 0.05 1.30 0.68 0.95 2.07 -1.46 -1.41 116.25 118.43 2jpo h VAL 29 Ca -0.27 -1.67 -0.03 0.00 0.82 0.00 0.00 66.70 65.54 2jpo h VAL 29 Cb 2.00 1.62 0.01 0.00 -1.52 0.00 0.00 31.29 33.40 2jpo h VAL 29 CO 0.13 0.53 -0.32 0.58 0.02 0.00 0.00 177.57 178.51 2jpo h VAL 30 N 0.51 0.32 -0.91 2.57 2.07 -0.85 0.11 116.25 120.06 2jpo h VAL 30 Ca 0.03 -0.07 0.11 0.00 0.82 0.00 0.00 66.70 67.59 2jpo h VAL 30 Cb 1.01 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 31.04 2jpo h VAL 30 CO 0.09 0.01 0.55 0.00 0.02 0.00 0.00 177.57 178.24 2jpo h ALA 31 N -0.65 1.34 -0.28 1.67 0.00 -1.09 -1.81 119.26 118.44 2jpo h ALA 31 Ca -0.09 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2jpo h ALA 31 Cb 0.71 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2jpo h ALA 31 CO 0.15 0.16 0.10 -0.44 0.00 0.00 0.00 179.25 179.23 2jpo h ASP 32 N 0.89 0.40 0.30 0.00 5.19 -1.07 -0.91 116.42 121.21 2jpo h ASP 32 Ca 0.45 -0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 2jpo h ASP 32 Cb 0.42 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.83 2jpo h ASP 32 CO -0.26 0.48 0.00 0.25 -3.12 0.00 0.00 179.24 176.59 2jpo h LEU 33 N 0.30 0.00 0.15 1.55 7.12 -0.02 0.56 115.31 124.98 2jpo h LEU 33 Ca 0.09 0.00 -0.29 0.00 0.13 0.00 0.00 57.88 57.81 2jpo h LEU 33 Cb 0.21 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.35 2jpo h LEU 33 CO -0.01 0.00 -1.44 1.88 -0.13 0.00 0.00 178.44 178.74 2jpo h TYR 34 N 0.00 0.59 -0.53 1.25 -1.99 -0.92 -3.37 116.97 112.00 2jpo h TYR 34 Ca 0.00 -0.43 0.12 0.00 2.00 0.00 0.00 58.73 60.42 2jpo h TYR 34 Cb 0.15 -0.02 -0.03 0.00 2.00 0.00 0.00 36.73 38.83 2jpo h TYR 34 CO 0.00 1.56 0.37 -0.91 -0.00 0.00 0.00 178.16 179.18 2jpo h ASN 35 N -0.15 0.19 -0.02 3.88 2.35 0.44 -2.96 115.58 119.31 2jpo h ASN 35 Ca -0.29 0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.49 2jpo h ASN 35 Cb 1.88 -0.03 -0.06 0.00 0.05 0.00 0.00 38.32 40.16 2jpo h ASN 35 CO 0.13 0.11 -0.50 0.15 -1.65 0.00 0.00 177.43 175.67 2jpo h PHE 36 N 0.21 -1.45 0.00 1.19 3.57 -1.24 -1.41 116.94 117.81 2jpo h PHE 36 Ca 0.25 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.80 2jpo h PHE 36 Cb 0.71 0.64 0.00 0.00 2.79 0.00 0.00 35.95 40.09 2jpo h PHE 36 CO -0.00 -0.55 0.00 0.91 -2.23 0.00 0.00 178.31 176.44 2jpo n TRP 37 N -5.46 0.00 -0.07 0.41 7.02 -1.13 -4.25 117.44 113.97 2jpo n TRP 37 Ca -0.07 0.00 -0.07 0.00 -1.02 0.00 0.00 57.50 56.34 2jpo n TRP 37 Cb 0.39 -0.37 -0.05 0.00 -2.42 0.00 0.00 31.31 28.86 2jpo n TRP 37 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 2jpo h LYS 38 N 0.00 0.00 0.00 -0.99 3.64 -1.17 -3.47 116.57 114.58 2jpo h LYS 38 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jpo h LYS 38 Cb 0.31 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2jpo h LYS 38 CO 0.00 0.36 0.00 -0.25 -2.27 0.00 0.00 179.45 177.29 2jpo n ASP 39 N -4.66 0.00 -2.74 4.20 8.00 -1.18 -5.10 116.55 115.07 2jpo n ASP 39 Ca -0.08 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.37 2jpo n ASP 39 Cb 0.25 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.39 2jpo n ASP 39 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2jpo n ASP 40 N -0.69 -2.85 -4.07 -2.24 2.03 -1.26 -5.05 116.55 102.42 2jpo n ASP 40 Ca 0.00 -2.79 -0.11 0.00 0.52 0.00 0.00 54.79 52.41 2jpo n ASP 40 Cb 0.00 1.60 -0.11 0.00 -0.72 0.00 0.00 41.12 41.89 2jpo n ASP 40 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 2jpo s TYR 41 N 0.74 0.59 -0.14 -0.67 6.14 -1.26 -5.01 117.35 117.75 2jpo s TYR 41 Ca 0.30 -0.66 0.00 0.00 0.64 0.00 0.00 57.07 57.35 2jpo s TYR 41 Cb 0.13 -0.37 0.02 0.00 0.42 0.00 0.00 41.96 42.16 2jpo s TYR 41 CO -0.14 -0.16 -0.12 0.08 0.64 0.00 0.00 175.55 175.85 2jpo s VAL 42 N -2.17 1.40 0.35 3.14 1.01 -1.26 -4.69 120.40 118.19 2jpo s VAL 42 Ca -0.05 -0.55 -0.28 0.00 0.00 0.00 0.00 61.98 61.10 2jpo s VAL 42 Cb -0.05 -1.36 -0.10 0.00 0.00 0.00 0.00 36.38 34.88 2jpo s VAL 42 CO -0.02 0.41 1.29 -0.04 0.00 0.00 0.00 175.10 176.74 2jpo s MET 43 N 1.55 4.24 0.00 2.72 -1.94 -1.26 -4.91 119.30 119.71 2jpo s MET 43 Ca 0.05 2.17 0.00 0.00 -1.71 0.00 0.00 55.69 56.19 2jpo s MET 43 Cb -0.13 -2.97 0.00 0.00 2.01 0.00 0.00 34.83 33.74 2jpo s MET 43 CO -0.10 -0.26 0.00 -2.37 -0.01 0.00 0.00 175.02 172.28 2jpo n THR 44 N 0.59 0.00 -1.83 2.05 5.66 -1.26 -5.01 114.28 114.47 2jpo n THR 44 Ca 0.01 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.58 2jpo n THR 44 Cb 0.43 -0.35 -0.03 0.00 -1.55 0.00 0.00 70.33 68.83 2jpo n THR 44 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2jpo s ASP 45 N -3.36 6.04 0.47 1.09 1.11 -1.26 -4.90 116.67 115.86 2jpo s ASP 45 Ca 0.00 1.93 0.20 0.00 0.18 0.00 0.00 52.55 54.86 2jpo s ASP 45 Cb 0.00 -2.52 1.20 0.00 1.07 0.00 0.00 42.92 42.67 2jpo s ASP 45 CO 0.00 -1.49 1.93 0.08 1.18 0.00 0.00 175.17 176.87 2jpo h ARG 46 N 12.34 0.24 0.00 8.23 0.11 -1.96 -1.51 114.38 131.84 2jpo h ARG 46 Ca -0.40 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 59.66 2jpo h ARG 46 Cb 1.20 -0.06 -0.00 0.00 1.11 0.00 0.00 29.97 32.23 2jpo h ARG 46 CO 0.98 0.16 -0.04 -0.07 0.10 0.00 0.00 179.97 181.10 2jpo h LEU 47 N 0.25 0.00 -0.70 0.08 3.38 -1.91 -2.07 115.31 114.34 2jpo h LEU 47 Ca 0.36 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.29 2jpo h LEU 47 Cb 1.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 2jpo h LEU 47 CO -0.08 0.04 0.30 0.00 0.09 0.00 0.00 178.44 178.79 2jpo h ALA 48 N 1.96 0.91 -0.04 1.53 0.00 -1.60 -0.01 119.26 122.01 2jpo h ALA 48 Ca -0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 2jpo h ALA 48 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2jpo h ALA 48 CO 0.01 0.51 -0.34 0.78 0.00 0.00 0.00 179.25 180.20 2jpo h GLY 49 N 0.99 0.08 0.96 0.00 0.00 -1.54 -2.25 103.07 101.31 2jpo h GLY 49 Ca 0.24 -0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.48 2jpo h GLY 49 CO -0.02 0.06 0.19 0.00 0.00 0.00 0.00 176.54 176.77 2jpo h ALA 51 N 1.03 0.41 0.63 0.00 0.00 -0.48 -1.13 119.26 119.72 2jpo h ALA 51 Ca 0.15 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2jpo h ALA 51 Cb 0.17 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2jpo h ALA 51 CO -0.01 -0.37 -0.42 0.82 0.00 0.00 0.00 179.25 179.27 2jpo h ILE 52 N 0.14 0.16 0.00 0.00 2.04 -1.25 -1.77 117.51 116.83 2jpo h ILE 52 Ca 0.20 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.06 2jpo h ILE 52 Cb 0.28 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2jpo h ILE 52 CO -0.31 0.00 -0.03 -0.55 0.00 0.00 0.00 178.15 177.26 2jpo h ASN 53 N -1.00 0.00 0.15 1.72 7.08 -0.86 -1.38 115.58 121.28 2jpo h ASN 53 Ca -0.08 0.00 -0.27 0.00 -3.08 0.00 0.00 56.30 52.88 2jpo h ASN 53 Cb 0.82 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 37.08 2jpo h ASN 53 CO 0.06 0.03 -1.09 0.00 -2.08 0.00 0.00 177.43 174.35 2jpo h LEU 55 N 0.31 0.42 -0.48 0.00 3.38 -0.36 -0.73 115.31 117.86 2jpo h LEU 55 Ca -0.13 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2jpo h LEU 55 Cb 1.74 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.42 2jpo h LEU 55 CO 0.20 0.25 0.00 0.00 0.09 0.00 0.00 178.44 178.99 2jpo h ALA 56 N 1.68 1.00 -0.28 1.53 0.00 -1.24 -0.66 119.26 121.29 2jpo h ALA 56 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2jpo h ALA 56 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2jpo h ALA 56 CO -0.09 0.00 0.00 -2.37 0.00 0.00 0.00 179.25 176.79 2jpo n THR 57 N -2.36 0.35 -2.30 0.00 5.66 -0.32 -4.30 114.28 111.01 2jpo n THR 57 Ca 0.03 -0.60 -0.16 0.00 -3.05 0.00 0.00 64.05 60.27 2jpo n THR 57 Cb 0.32 0.89 0.03 0.00 -1.55 0.00 0.00 70.33 70.02 2jpo n THR 57 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2jpo n LYS 58 N 1.16 2.98 0.11 1.09 5.02 -0.27 -4.81 118.16 123.44 2jpo n LYS 58 Ca 0.18 -3.95 0.06 0.00 -2.02 0.00 0.00 58.31 52.58 2jpo n LYS 58 Cb 0.53 -2.05 0.52 0.00 -0.02 0.00 0.00 35.03 34.01 2jpo n LYS 58 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2jpo h LEU 59 N 2.33 0.26 -0.30 -0.35 3.38 -1.71 0.13 115.31 119.05 2jpo h LEU 59 Ca 0.20 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.97 2jpo h LEU 59 Cb 1.45 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2jpo h LEU 59 CO 0.56 0.18 -0.55 -2.24 0.09 0.00 0.00 178.44 176.48 2jpo h ASP 60 N 0.30 0.97 -0.13 -0.43 2.03 -1.87 0.57 116.42 117.86 2jpo h ASP 60 Ca 0.09 -0.53 -0.07 0.00 -0.73 0.00 0.00 57.03 55.79 2jpo h ASP 60 Cb 0.00 -0.28 -0.00 0.00 -0.83 0.00 0.00 39.33 38.22 2jpo h ASP 60 CO -0.02 1.33 -0.20 0.58 -1.03 0.00 0.00 179.24 179.89 2jpo h VAL 61 N 0.67 1.37 0.00 4.15 2.07 -1.77 -2.24 116.25 120.50 2jpo h VAL 61 Ca 0.01 -1.44 -0.12 0.00 0.82 0.00 0.00 66.70 65.97 2jpo h VAL 61 Cb 1.16 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.92 2jpo h VAL 61 CO 0.12 0.42 -0.58 1.62 0.02 0.00 0.00 177.57 179.18 2jpo h VAL 62 N -0.05 1.23 -2.06 2.57 3.04 -0.79 -3.38 116.25 116.82 2jpo h VAL 62 Ca 0.01 -2.12 -0.54 0.00 -1.01 0.00 0.00 66.70 63.05 2jpo h VAL 62 Cb 0.77 2.20 -0.36 0.00 -2.01 0.00 0.00 31.29 31.90 2jpo h VAL 62 CO 0.05 0.57 -0.97 -0.67 -1.01 0.00 0.00 177.57 175.53 2jpo n ASP 63 N -3.58 -0.58 0.00 3.17 2.03 0.19 -3.92 116.55 113.86 2jpo n ASP 63 Ca -0.00 -2.55 0.10 0.00 0.52 0.00 0.00 54.79 52.86 2jpo n ASP 63 Cb 0.64 -0.33 0.45 0.00 -0.72 0.00 0.00 41.12 41.16 2jpo n ASP 63 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2jpo n PRO 64 N 2.34 0.08 -0.17 -0.67 -0.04 -0.84 -1.52 135.00 134.16 2jpo n PRO 64 Ca 0.25 0.14 -0.05 0.00 -0.04 0.00 0.00 63.50 63.81 2jpo n PRO 64 Cb 0.51 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.52 2jpo n PRO 64 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2jpo h ASP 65 N 0.00 0.42 -0.12 3.54 5.19 -1.93 -3.48 116.42 120.05 2jpo h ASP 65 Ca 0.00 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2jpo h ASP 65 Cb 0.30 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.75 2jpo h ASP 65 CO 0.00 0.29 0.00 0.61 -3.12 0.00 0.00 179.24 177.02 2jpo n GLY 66 N -1.25 0.67 0.18 2.75 0.00 -0.58 -5.04 105.19 101.92 2jpo n GLY 66 Ca 0.04 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2jpo n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jpo n ASN 67 N -0.01 2.12 -4.68 1.61 3.02 -1.26 -4.93 115.26 111.14 2jpo n ASN 67 Ca 0.00 0.02 -0.42 0.00 -0.03 0.00 0.00 54.58 54.15 2jpo n ASN 67 Cb 0.04 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 38.75 2jpo n ASN 67 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2jpo s LEU 68 N -6.51 4.37 0.20 3.41 0.20 -1.26 -4.10 118.68 114.98 2jpo s LEU 68 Ca -0.28 2.46 -0.01 0.00 0.69 0.00 0.00 54.13 56.99 2jpo s LEU 68 Cb 0.09 -3.55 -0.04 0.00 -0.43 0.00 0.00 46.19 42.25 2jpo s LEU 68 CO 0.43 -0.93 0.12 -1.00 -0.29 0.00 0.00 176.35 174.69 2jpo s HIS 69 N 3.27 1.15 0.46 5.38 3.76 -0.93 -4.85 115.29 123.54 2jpo s HIS 69 Ca 0.76 -1.35 -0.25 0.00 -0.15 0.00 0.00 55.06 54.07 2jpo s HIS 69 Cb -0.39 -0.57 -0.08 0.00 1.11 0.00 0.00 32.58 32.65 2jpo s HIS 69 CO 0.33 -0.61 1.37 -2.39 -0.85 0.00 0.00 174.74 172.59 2jpo n HIS 70 N -0.26 2.45 -1.14 1.40 1.44 -1.26 -1.01 115.22 116.84 2jpo n HIS 70 Ca 0.01 0.45 -0.09 0.00 -2.01 0.00 0.00 57.72 56.09 2jpo n HIS 70 Cb 0.66 -2.42 -0.04 0.00 0.12 0.00 0.00 29.99 28.31 2jpo n HIS 70 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2jpo n GLY 71 N 0.68 0.85 2.38 -1.39 0.00 0.43 -4.85 105.19 103.29 2jpo n GLY 71 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 2jpo n GLY 71 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2jpo n ASN 72 N -0.25 -0.85 0.00 1.61 5.15 -0.18 -4.85 115.26 115.89 2jpo n ASN 72 Ca -0.09 -2.93 0.09 0.00 -0.60 0.00 0.00 54.58 51.05 2jpo n ASN 72 Cb 0.41 0.22 0.46 0.00 -0.53 0.00 0.00 39.78 40.35 2jpo n ASN 72 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jpo n ALA 73 N 1.40 1.98 0.07 5.20 0.00 -1.26 -2.18 120.51 125.71 2jpo n ALA 73 Ca 0.17 -0.08 -0.12 0.00 0.00 0.00 0.00 53.44 53.41 2jpo n ALA 73 Cb 0.57 -1.31 -0.08 0.00 0.00 0.00 0.00 19.45 18.63 2jpo n ALA 73 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2jpo h LYS 74 N 0.00 -0.22 -0.83 0.00 1.57 -1.88 0.20 116.57 115.41 2jpo h LYS 74 Ca 0.00 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 2jpo h LYS 74 Cb 0.24 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 2jpo h LYS 74 CO 0.00 0.20 0.54 -0.44 -0.57 0.00 0.00 179.45 179.17 2jpo h ASP 75 N -0.76 0.71 0.04 0.86 5.19 -1.80 -0.13 116.42 120.54 2jpo h ASP 75 Ca -0.02 0.02 -0.21 0.00 -0.62 0.00 0.00 57.03 56.19 2jpo h ASP 75 Cb 0.52 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.90 2jpo h ASP 75 CO 0.04 0.43 -0.78 0.15 -3.12 0.00 0.00 179.24 175.96 2jpo h PHE 76 N 0.79 0.85 -0.64 4.55 3.04 -1.56 -2.04 116.94 121.92 2jpo h PHE 76 Ca 0.38 -0.38 -0.06 0.00 3.98 0.00 0.00 57.97 61.89 2jpo h PHE 76 Cb 0.42 -0.13 -0.03 0.00 2.56 0.00 0.00 35.95 38.77 2jpo h PHE 76 CO -0.00 1.18 0.18 0.00 -2.02 0.00 0.00 178.31 177.65 2jpo h ALA 77 N 0.71 0.84 -0.04 2.41 0.00 0.06 -2.56 119.26 120.67 2jpo h ALA 77 Ca -0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2jpo h ALA 77 Cb 1.38 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 2jpo h ALA 77 CO 0.15 0.53 -0.07 0.52 0.00 0.00 0.00 179.25 180.38 2jpo h MET 78 N 0.93 0.06 -0.01 0.00 2.86 -0.91 -0.75 114.93 117.10 2jpo h MET 78 Ca 0.20 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 2jpo h MET 78 Cb 0.32 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2jpo h MET 78 CO -0.00 0.14 0.00 0.36 1.06 0.00 0.00 176.91 178.46 2jpo n LYS 79 N -4.42 1.07 0.01 1.72 2.85 -0.78 -4.39 118.16 114.21 2jpo n LYS 79 Ca -0.02 -0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.14 2jpo n LYS 79 Cb 0.17 -1.32 0.00 0.00 -0.65 0.00 0.00 35.03 33.23 2jpo n LYS 79 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2jpo n HIS 80 N -0.71 -0.07 0.00 5.58 8.25 -0.57 -5.07 115.22 122.64 2jpo n HIS 80 Ca 0.15 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 2jpo n HIS 80 Cb 0.09 0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.27 2jpo n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jpo n GLY 81 N 3.23 0.00 3.29 -1.41 0.00 -0.39 -5.12 105.19 104.79 2jpo n GLY 81 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2jpo n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jpo s ALA 82 N 0.00 1.60 0.45 4.61 0.00 -0.92 -4.98 121.76 122.51 2jpo s ALA 82 Ca 0.00 -1.79 0.01 0.00 0.00 0.00 0.00 51.96 50.18 2jpo s ALA 82 Cb 0.00 0.94 0.01 0.00 0.00 0.00 0.00 23.12 24.06 2jpo s ALA 82 CO 0.00 -0.43 0.05 -0.25 0.00 0.00 0.00 175.76 175.13 2jpo n ASP 83 N -0.40 3.13 -0.18 0.00 8.00 -1.26 -4.27 116.55 121.58 2jpo n ASP 83 Ca -0.02 -2.89 0.22 0.00 0.71 0.00 0.00 54.79 52.81 2jpo n ASP 83 Cb 0.65 0.26 0.61 0.00 -0.02 0.00 0.00 41.12 42.62 2jpo n ASP 83 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2jpo h GLU 84 N 0.00 0.21 0.37 -1.24 4.81 -1.97 0.89 114.58 117.65 2jpo h GLU 84 Ca -0.36 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.84 2jpo h GLU 84 Cb 1.11 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.44 2jpo h GLU 84 CO 0.59 0.14 -0.18 1.15 -0.73 0.00 0.00 179.01 179.98 2jpo h THR 85 N 0.21 0.00 -0.37 0.32 2.02 -1.98 0.14 112.91 113.26 2jpo h THR 85 Ca 0.41 -0.09 0.07 0.00 0.77 0.00 0.00 66.41 67.58 2jpo h THR 85 Cb 1.28 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.62 2jpo h THR 85 CO -0.09 0.00 -0.06 0.24 0.37 0.00 0.00 175.52 175.98 2jpo h MET 86 N -0.59 0.03 -0.49 6.66 2.86 -1.86 0.12 114.93 121.66 2jpo h MET 86 Ca -0.05 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2jpo h MET 86 Cb 0.39 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 2jpo h MET 86 CO 0.08 0.02 0.31 0.00 1.06 0.00 0.00 176.91 178.39 2jpo h ALA 87 N 1.35 0.62 -0.15 6.32 0.00 -0.89 -0.15 119.26 126.36 2jpo h ALA 87 Ca 0.18 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2jpo h ALA 87 Cb 0.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2jpo h ALA 87 CO -0.35 0.04 -0.35 0.37 0.00 0.00 0.00 179.25 178.96 2jpo h GLN 88 N 0.63 0.31 -0.23 0.00 5.75 -0.45 -1.67 115.11 119.44 2jpo h GLN 88 Ca 0.19 -0.13 0.01 0.00 -0.15 0.00 0.00 58.65 58.57 2jpo h GLN 88 Cb -0.04 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 2jpo h GLN 88 CO -0.06 0.62 0.11 1.96 -2.65 0.00 0.00 178.83 178.82 2jpo h GLN 89 N 0.27 0.24 -0.40 1.69 4.20 0.33 -1.14 115.11 120.30 2jpo h GLN 89 Ca 0.03 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 2jpo h GLN 89 Cb 0.74 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.45 2jpo h GLN 89 CO 0.06 0.16 0.16 -0.07 -0.67 0.00 0.00 178.83 178.47 2jpo h LEU 90 N 0.24 0.55 -1.43 1.46 3.38 -0.86 -1.50 115.31 117.15 2jpo h LEU 90 Ca 0.10 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.93 2jpo h LEU 90 Cb 0.03 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2jpo h LEU 90 CO -0.07 0.56 0.41 1.62 0.09 0.00 0.00 178.44 181.05 2jpo h VAL 91 N 0.50 1.10 0.00 1.22 3.04 -1.19 -1.35 116.25 119.58 2jpo h VAL 91 Ca 0.13 -0.26 -0.09 0.00 -1.01 0.00 0.00 66.70 65.47 2jpo h VAL 91 Cb 0.18 0.28 -0.01 0.00 -2.01 0.00 0.00 31.29 29.73 2jpo h VAL 91 CO -0.01 0.14 -0.44 -0.78 -1.01 0.00 0.00 177.57 175.47 2jpo h ASP 92 N 0.75 0.00 0.08 3.17 3.58 -0.50 0.16 116.42 123.66 2jpo h ASP 92 Ca 0.24 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.69 2jpo h ASP 92 Cb 0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.09 2jpo h ASP 92 CO -0.06 0.44 -0.04 0.40 -2.88 0.00 0.00 179.24 177.10 2jpo h ILE 93 N 0.00 1.08 -0.14 2.25 2.04 -0.26 -2.58 117.51 119.89 2jpo h ILE 93 Ca -0.00 -0.55 -0.21 0.00 1.00 0.00 0.00 64.86 65.10 2jpo h ILE 93 Cb 0.89 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 2jpo h ILE 93 CO 0.06 0.14 -0.74 -0.29 0.00 0.00 0.00 178.15 177.32 2jpo h ILE 94 N -0.35 1.31 0.00 -0.67 6.09 -1.09 0.21 117.51 123.00 2jpo h ILE 94 Ca -0.01 -1.99 -0.00 0.00 -1.37 0.00 0.00 64.86 61.48 2jpo h ILE 94 Cb 0.30 1.98 -0.00 0.00 0.47 0.00 0.00 36.82 39.57 2jpo h ILE 94 CO 0.02 0.62 -0.02 0.45 -3.07 0.00 0.00 178.15 176.15 2jpo h HIS 95 N 0.47 0.00 0.01 2.19 3.86 -1.07 0.12 115.15 120.73 2jpo h HIS 95 Ca -0.04 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.05 2jpo h HIS 95 Cb 1.34 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.80 2jpo h HIS 95 CO 0.07 0.02 -0.64 0.78 0.86 0.00 0.00 177.93 179.02 2jpo h GLY 96 N 0.17 0.02 1.51 2.45 0.00 -0.86 -3.34 103.07 103.02 2jpo h GLY 96 Ca -0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 2jpo h GLY 96 CO 0.00 0.03 0.15 0.00 0.00 0.00 0.00 176.54 176.72 2jpo h GLU 98 N 0.62 0.00 0.00 0.00 4.39 -0.91 0.25 114.58 118.93 2jpo h GLU 98 Ca 0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2jpo h GLU 98 Cb 0.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2jpo h GLU 98 CO -0.01 0.00 -1.12 1.63 -1.16 0.00 0.00 179.01 178.34 2jpo n LYS 99 N -3.46 1.53 0.15 2.33 4.01 -0.20 -4.31 118.16 118.20 2jpo n LYS 99 Ca -0.03 -0.06 0.03 0.00 -0.51 0.00 0.00 58.31 57.74 2jpo n LYS 99 Cb 0.11 -1.17 0.06 0.00 -0.51 0.00 0.00 35.03 33.52 2jpo n LYS 99 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2jpo h SER 100 N 0.00 0.00 -3.59 4.39 0.87 -0.37 -3.47 113.55 111.38 2jpo h SER 100 Ca 0.00 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.99 2jpo h SER 100 Cb 0.41 0.00 0.14 0.00 -0.44 0.00 0.00 62.40 62.51 2jpo h SER 100 CO 0.00 0.48 0.37 0.00 -0.53 0.00 0.00 176.83 177.15 2jpo n ALA 101 N -2.23 0.88 -1.12 6.23 0.00 0.03 -4.95 120.51 119.35 2jpo n ALA 101 Ca 0.02 0.16 -0.30 0.00 0.00 0.00 0.00 53.44 53.32 2jpo n ALA 101 Cb 0.71 -2.22 0.15 0.00 0.00 0.00 0.00 19.45 18.09 2jpo n ALA 101 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jpo s PRO 102 N -2.49 1.14 -0.83 0.00 0.04 -1.26 -4.88 135.00 126.73 2jpo s PRO 102 Ca 0.68 0.90 -0.25 0.00 0.04 0.00 0.00 61.00 62.37 2jpo s PRO 102 Cb -0.47 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 2jpo s PRO 102 CO 0.53 -2.34 2.18 -1.25 0.04 0.00 0.00 177.00 176.16 2jpo s PRO 103 N -4.88 2.08 0.05 0.56 0.04 -1.26 -4.29 135.00 127.31 2jpo s PRO 103 Ca 0.64 0.16 0.00 0.00 0.04 0.00 0.00 61.00 61.84 2jpo s PRO 103 Cb -0.19 -4.90 0.00 0.00 0.04 0.00 0.00 34.50 29.46 2jpo s PRO 103 CO 0.57 -3.89 0.00 0.27 0.04 0.00 0.00 177.00 174.00 2jpo n ASN 104 N 16.30 0.57 -2.30 6.66 0.23 -1.26 -5.11 115.26 130.35 2jpo n ASN 104 Ca 0.43 0.08 0.00 0.00 -0.53 0.00 0.00 54.58 54.55 2jpo n ASN 104 Cb 0.45 -0.17 0.00 0.00 -2.08 0.00 0.00 39.78 37.99 2jpo n ASN 104 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2jpo n ASP 105 N -3.25 -4.93 -3.62 0.53 8.00 -1.26 -5.01 116.55 107.01 2jpo n ASP 105 Ca 0.00 0.44 -0.15 0.00 0.71 0.00 0.00 54.79 55.79 2jpo n ASP 105 Cb 0.24 -1.10 -0.07 0.00 -0.02 0.00 0.00 41.12 40.17 2jpo n ASP 105 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2jpo s ASP 106 N -0.42 -0.62 0.45 -2.24 2.15 -1.26 -4.96 116.67 109.77 2jpo s ASP 106 Ca 0.00 0.98 0.21 0.00 0.43 0.00 0.00 52.55 54.17 2jpo s ASP 106 Cb 0.00 0.94 1.08 0.00 -0.30 0.00 0.00 42.92 44.64 2jpo s ASP 106 CO 0.00 -0.38 1.94 0.11 -0.17 0.00 0.00 175.17 176.66 2jpo h LYS 107 N 4.23 0.00 0.00 4.34 1.79 -1.98 -0.32 116.57 124.63 2jpo h LYS 107 Ca -0.28 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 57.92 2jpo h LYS 107 Cb 1.16 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.76 2jpo h LYS 107 CO 0.23 0.23 -2.18 0.00 -1.08 0.00 0.00 179.45 176.66 2jpo h MET 109 N 0.00 -0.07 -0.94 0.00 2.86 -1.63 -3.00 114.93 112.15 2jpo h MET 109 Ca -0.41 0.00 0.15 0.00 -2.06 0.00 0.00 59.70 57.39 2jpo h MET 109 Cb 1.91 0.02 -0.08 0.00 0.06 0.00 0.00 31.60 33.50 2jpo h MET 109 CO 0.02 0.47 0.60 -0.22 1.06 0.00 0.00 176.91 178.84 2jpo h LYS 110 N -0.95 0.72 -0.07 1.72 3.64 -1.38 -0.88 116.57 119.38 2jpo h LYS 110 Ca -0.01 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.20 2jpo h LYS 110 Cb 0.57 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2jpo h LYS 110 CO 0.01 0.48 -0.54 1.15 -2.27 0.00 0.00 179.45 178.28 2jpo h THR 111 N 0.75 1.37 0.29 1.00 2.02 -1.72 -1.25 112.91 115.37 2jpo h THR 111 Ca 0.49 -1.85 -0.01 0.00 0.77 0.00 0.00 66.41 65.80 2jpo h THR 111 Cb 0.75 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2jpo h THR 111 CO -0.25 0.54 -0.14 0.40 0.37 0.00 0.00 175.52 176.44 2jpo h ILE 112 N 0.15 0.74 0.34 3.11 2.04 -1.01 -1.49 117.51 121.39 2jpo h ILE 112 Ca 0.00 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2jpo h ILE 112 Cb 1.01 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 2jpo h ILE 112 CO 0.08 0.09 -0.39 -0.78 0.00 0.00 0.00 178.15 177.15 2jpo h ASP 113 N -0.61 -1.08 -0.93 1.72 3.58 -1.41 -0.74 116.42 116.95 2jpo h ASP 113 Ca -0.04 0.10 0.12 0.00 0.42 0.00 0.00 57.03 57.63 2jpo h ASP 113 Cb 0.44 0.37 -0.08 0.00 1.72 0.00 0.00 39.33 41.78 2jpo h ASP 113 CO 0.07 -0.53 0.55 0.58 -2.88 0.00 0.00 179.24 177.03 2jpo h VAL 114 N -0.77 0.88 -0.16 2.25 2.07 -1.28 0.26 116.25 119.50 2jpo h VAL 114 Ca -0.02 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 2jpo h VAL 114 Cb 0.70 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2jpo h VAL 114 CO -0.10 0.16 -0.01 0.00 0.02 0.00 0.00 177.57 177.64 2jpo h ALA 115 N 1.52 0.22 -0.38 1.67 0.00 -0.87 0.06 119.26 121.48 2jpo h ALA 115 Ca 0.47 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 2jpo h ALA 115 Cb 0.50 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2jpo h ALA 115 CO -0.28 -0.07 -0.37 0.00 0.00 0.00 0.00 179.25 178.53 2jpo h MET 116 N 0.02 0.90 -0.43 0.00 -0.00 -0.26 -2.45 114.93 112.72 2jpo h MET 116 Ca 0.04 -0.46 0.09 0.00 -0.00 0.00 0.00 59.70 59.37 2jpo h MET 116 Cb 0.39 0.01 -0.08 0.00 -0.00 0.00 0.00 31.60 31.92 2jpo h MET 116 CO 0.01 1.12 -0.11 0.00 -0.00 0.00 0.00 176.91 177.92 2jpo h PHE 118 N -0.00 -1.52 -0.74 0.00 3.57 -0.72 0.01 116.94 117.53 2jpo h PHE 118 Ca 0.21 0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.81 2jpo h PHE 118 Cb 0.32 0.67 -0.05 0.00 2.79 0.00 0.00 35.95 39.67 2jpo h PHE 118 CO -0.38 -0.55 0.44 -0.22 -2.23 0.00 0.00 178.31 175.37 2jpo h LYS 119 N -0.63 0.80 -0.95 1.11 3.64 -0.91 -0.90 116.57 118.72 2jpo h LYS 119 Ca 0.03 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.41 2jpo h LYS 119 Cb 0.70 -0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 32.28 2jpo h LYS 119 CO -0.38 0.53 0.62 0.87 -2.27 0.00 0.00 179.45 178.82 2jpo h LYS 120 N 0.83 1.11 -0.00 1.90 6.56 0.09 -1.52 116.57 125.54 2jpo h LYS 120 Ca 0.32 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.85 2jpo h LYS 120 Cb 0.15 -0.25 0.00 0.00 -0.57 0.00 0.00 32.23 31.56 2jpo h LYS 120 CO -0.16 0.73 -0.04 0.39 -2.06 0.00 0.00 179.45 178.31 2jpo n GLU 121 N -4.47 0.02 0.27 3.15 -0.58 -0.11 -2.42 120.64 116.49 2jpo n GLU 121 Ca 0.14 -0.00 0.13 0.00 -0.42 0.00 0.00 57.16 57.00 2jpo n GLU 121 Cb 0.16 -1.50 0.76 0.00 -0.57 0.00 0.00 31.44 30.29 2jpo n GLU 121 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2jpo h ILE 122 N 0.00 0.59 0.00 -3.67 2.04 -0.12 -1.00 117.51 115.36 2jpo h ILE 122 Ca 0.00 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.46 2jpo h ILE 122 Cb 0.49 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 2jpo h ILE 122 CO 0.00 0.09 0.00 1.41 0.00 0.00 0.00 178.15 179.65 2jpo n HIS 123 N -3.74 0.00 0.20 1.37 8.25 -1.02 -2.29 115.22 117.98 2jpo n HIS 123 Ca -0.02 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.46 2jpo n HIS 123 Cb 0.20 -0.12 0.01 0.00 1.12 0.00 0.00 29.99 31.20 2jpo n HIS 123 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2jpo n LYS 124 N -1.12 0.50 0.00 -0.41 -0.00 -0.39 -4.54 118.16 112.21 2jpo n LYS 124 Ca 0.10 -0.67 -0.13 0.00 -0.00 0.00 0.00 58.31 57.61 2jpo n LYS 124 Cb 0.08 -1.03 -0.02 0.00 -0.00 0.00 0.00 35.03 34.06 2jpo n LYS 124 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2jpo h LEU 125 N 0.79 0.75 0.00 -5.58 3.38 -1.41 -3.47 115.31 109.76 2jpo h LEU 125 Ca 0.00 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2jpo h LEU 125 Cb 0.18 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2jpo h LEU 125 CO 0.00 1.23 0.00 0.59 0.09 0.00 0.00 178.44 180.35 2jpo n ASN 126 N -3.91 0.00 -2.13 -0.43 5.03 -1.25 -4.96 115.26 107.62 2jpo n ASN 126 Ca -0.05 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.40 2jpo n ASN 126 Cb 0.70 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.46 2jpo n ASN 126 CO 0.00 0.00 0.00 -2.67 -1.83 0.00 0.00 177.26 172.76 2jpo n TRP 127 N -0.84 -0.91 -3.65 3.10 4.27 -1.26 -5.11 117.44 113.04 2jpo n TRP 127 Ca 0.00 0.00 -0.17 0.00 -3.89 0.00 0.00 57.50 53.44 2jpo n TRP 127 Cb 0.00 0.00 -0.15 0.00 -1.36 0.00 0.00 31.31 29.80 2jpo n TRP 127 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 2jpo s VAL 128 N 0.31 -0.27 0.28 -1.67 0.11 -1.26 -4.93 120.40 112.97 2jpo s VAL 128 Ca 0.00 0.28 -0.28 0.00 -2.93 0.00 0.00 61.98 59.05 2jpo s VAL 128 Cb 0.00 -0.35 -0.09 0.00 -1.53 0.00 0.00 36.38 34.40 2jpo s VAL 128 CO 0.00 0.09 0.98 -2.16 -3.33 0.00 0.00 175.10 170.68 2jpo s PRO 129 N 2.30 4.69 0.69 1.54 0.04 -1.26 -5.05 135.00 137.95 2jpo s PRO 129 Ca 0.03 1.50 -0.17 0.00 0.04 0.00 0.00 61.00 62.41 2jpo s PRO 129 Cb -0.13 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 2jpo s PRO 129 CO -0.07 0.35 0.61 0.09 0.04 0.00 0.00 177.00 178.02 2jpo n ASN 130 N 1.06 -0.83 0.02 6.66 3.02 -1.26 -4.77 115.26 119.17 2jpo n ASN 130 Ca -0.00 0.64 0.22 0.00 -0.03 0.00 0.00 54.58 55.41 2jpo n ASN 130 Cb 0.48 -1.24 0.73 0.00 -0.61 0.00 0.00 39.78 39.13 2jpo n ASN 130 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jpo h MET 131 N -0.18 0.00 0.19 3.52 -0.00 -1.96 -0.15 114.93 116.34 2jpo h MET 131 Ca -0.46 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.23 2jpo h MET 131 Cb 1.36 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.96 2jpo h MET 131 CO 0.44 0.00 -0.09 -0.44 -0.00 0.00 0.00 176.91 176.82 2jpo h ASP 132 N 0.00 -0.22 -0.52 -0.10 3.32 -1.98 -2.84 116.42 114.09 2jpo h ASP 132 Ca 0.25 -0.16 0.06 0.00 0.02 0.00 0.00 57.03 57.20 2jpo h ASP 132 Cb 1.14 0.06 -0.05 0.00 0.22 0.00 0.00 39.33 40.70 2jpo h ASP 132 CO -0.00 0.03 0.23 -0.07 -1.72 0.00 0.00 179.24 177.71 2jpo h LEU 133 N -0.47 0.29 -0.07 1.55 -0.00 -1.38 0.13 115.31 115.36 2jpo h LEU 133 Ca -0.03 0.04 -0.01 0.00 -0.00 0.00 0.00 57.88 57.88 2jpo h LEU 133 Cb 0.36 -0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.02 2jpo h LEU 133 CO 0.04 0.20 -0.01 -0.37 -0.00 0.00 0.00 178.44 178.31 2jpo h VAL 134 N 0.44 1.27 -0.29 1.22 -1.51 -1.41 -0.84 116.25 115.14 2jpo h VAL 134 Ca 0.24 -0.85 -0.09 0.00 -1.23 0.00 0.00 66.70 64.76 2jpo h VAL 134 Cb 0.20 1.70 -0.01 0.00 -2.13 0.00 0.00 31.29 31.06 2jpo h VAL 134 CO -0.20 0.24 -0.18 0.40 -1.23 0.00 0.00 177.57 176.59 2jpo h ILE 135 N -0.18 1.30 -0.76 7.19 2.04 -1.47 -2.57 117.51 123.05 2jpo h ILE 135 Ca 0.02 -1.31 0.13 0.00 1.00 0.00 0.00 64.86 64.70 2jpo h ILE 135 Cb 0.38 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.92 2jpo h ILE 135 CO 0.01 0.42 0.50 1.23 0.00 0.00 0.00 178.15 180.31 2jpo h GLY 136 N 0.38 0.84 0.33 5.37 0.00 -0.65 -1.96 103.07 107.38 2jpo h GLY 136 Ca 0.06 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.10 2jpo h GLY 136 CO 0.05 0.09 -0.29 -2.09 0.00 0.00 0.00 176.54 174.30 2jpo h GLU 137 N 0.52 0.13 -0.61 4.80 4.57 -0.92 -3.04 114.58 120.04 2jpo h GLU 137 Ca 0.37 -0.19 0.08 0.00 -1.18 0.00 0.00 59.36 58.44 2jpo h GLU 137 Cb 0.71 0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 29.30 2jpo h GLU 137 CO -0.13 1.03 0.27 -0.24 -1.18 0.00 0.00 179.01 178.76 2jpo h VAL 138 N -0.67 0.84 -0.61 0.32 3.04 -1.30 -1.27 116.25 116.60 2jpo h VAL 138 Ca -0.05 -0.17 0.13 0.00 -1.01 0.00 0.00 66.70 65.61 2jpo h VAL 138 Cb 1.16 0.32 -0.03 0.00 -2.01 0.00 0.00 31.29 30.72 2jpo h VAL 138 CO 0.06 0.09 0.42 -0.07 -1.01 0.00 0.00 177.57 177.05 2jpo h LEU 139 N 0.48 0.23 -0.08 3.16 4.07 -1.45 -1.76 115.31 119.97 2jpo h LEU 139 Ca 0.29 0.01 -0.11 0.00 0.08 0.00 0.00 57.88 58.15 2jpo h LEU 139 Cb 0.30 -0.04 0.01 0.00 1.08 0.00 0.00 40.66 42.01 2jpo h LEU 139 CO -0.26 0.13 -0.40 0.00 -1.08 0.00 0.00 178.44 176.83 2jpo h ALA 140 N 1.70 0.15 0.00 1.53 0.00 -1.11 -3.34 119.26 118.19 2jpo h ALA 140 Ca 0.29 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2jpo h ALA 140 Cb 0.81 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2jpo h ALA 140 CO -0.06 0.26 -0.72 1.49 0.00 0.00 0.00 179.25 180.22 2jpo h GLU 141 N -0.06 0.00 -0.02 0.00 4.57 -1.38 0.12 114.58 117.81 2jpo h GLU 141 Ca -0.03 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2jpo h GLU 141 Cb 1.05 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 2jpo h GLU 141 CO 0.08 0.00 0.00 0.28 -1.18 0.00 0.00 179.01 178.19