#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rjz h LEU 68 N 0.00 0.79 -0.82 1.04 5.85 -2.05 -2.07 115.31 118.05 2rjz h LEU 68 Ca 0.00 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 2rjz h LEU 68 Cb 0.00 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 2rjz h LEU 68 CO 0.00 0.54 0.23 0.50 -0.34 0.00 0.00 178.44 179.37 2rjz h LYS 69 N 0.93 1.11 -0.81 1.25 3.64 -2.03 -0.76 116.57 119.90 2rjz h LYS 69 Ca 0.30 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 2rjz h LYS 69 Cb 0.02 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.63 2rjz h LYS 69 CO -0.11 0.94 0.48 1.96 -2.27 0.00 0.00 179.45 180.45 2rjz h GLN 70 N 1.07 1.10 -0.16 1.90 4.20 -1.94 0.44 115.11 121.73 2rjz h GLN 70 Ca 0.24 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 2rjz h GLN 70 Cb 0.29 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2rjz h GLN 70 CO -0.01 0.78 0.01 1.96 -0.67 0.00 0.00 178.83 180.90 2rjz h GLN 71 N 1.12 0.28 -0.70 1.46 4.20 -0.66 0.21 115.11 121.02 2rjz h GLN 71 Ca 0.29 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.87 2rjz h GLN 71 Cb -0.03 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.69 2rjz h GLN 71 CO -0.05 0.48 0.24 0.74 -0.67 0.00 0.00 178.83 179.57 2rjz h PHE 72 N 0.04 1.08 0.30 2.96 0.04 -1.02 -2.45 116.94 117.89 2rjz h PHE 72 Ca 0.05 -0.09 -0.00 0.00 2.80 0.00 0.00 57.97 60.72 2rjz h PHE 72 Cb 0.35 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 2rjz h PHE 72 CO 0.03 0.85 -0.24 0.77 -0.60 0.00 0.00 178.31 179.11 2rjz h SER 73 N 1.03 -0.63 -1.00 2.17 0.02 -0.73 -1.88 113.55 112.52 2rjz h SER 73 Ca 0.23 0.05 0.23 0.00 -0.84 0.00 0.00 61.79 61.46 2rjz h SER 73 Cb 0.25 0.21 -0.10 0.00 0.14 0.00 0.00 62.40 62.90 2rjz h SER 73 CO -0.01 -0.37 0.63 0.74 -1.14 0.00 0.00 176.83 176.68 2rjz h THR 74 N -0.55 0.62 -0.14 -2.27 2.02 -0.52 -2.24 112.91 109.82 2rjz h THR 74 Ca -0.02 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2rjz h THR 74 Cb 0.49 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 2rjz h THR 74 CO -0.02 0.10 0.00 0.29 0.37 0.00 0.00 175.52 176.26 2rjz n LYS 75 N -4.68 2.01 -0.27 6.66 5.02 -0.93 -4.41 118.16 121.57 2rjz n LYS 75 Ca 0.24 -1.50 0.02 0.00 -2.02 0.00 0.00 58.31 55.05 2rjz n LYS 75 Cb 0.73 -1.46 0.24 0.00 -0.02 0.00 0.00 35.03 34.52 2rjz n LYS 75 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rjz h ALA 76 N 4.38 1.49 0.00 7.82 0.00 -0.72 -1.41 119.26 130.82 2rjz h ALA 76 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2rjz h ALA 76 Cb 0.71 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2rjz h ALA 76 CO 0.00 0.42 0.04 0.27 0.00 0.00 0.00 179.25 179.99 2rjz h PHE 77 N 1.03 0.00 -0.00 0.00 -5.15 -1.81 -1.60 116.94 109.42 2rjz h PHE 77 Ca 0.34 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.11 2rjz h PHE 77 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.22 2rjz h PHE 77 CO -0.00 0.00 -0.46 1.04 -2.00 0.00 0.00 178.31 176.89 2rjz n GLN 78 N -2.77 0.03 -2.11 6.09 6.02 -0.53 -4.93 117.38 119.18 2rjz n GLN 78 Ca -0.02 -0.01 -0.41 0.00 -0.01 0.00 0.00 57.00 56.54 2rjz n GLN 78 Cb 0.10 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.83 2rjz n GLN 78 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2rjz s ALA 79 N -2.98 3.55 0.32 -1.58 0.00 -0.60 -4.91 121.76 115.55 2rjz s ALA 79 Ca 0.12 1.24 -0.00 0.00 0.00 0.00 0.00 51.96 53.31 2rjz s ALA 79 Cb 0.18 -3.50 0.52 0.00 0.00 0.00 0.00 23.12 20.31 2rjz s ALA 79 CO 0.68 -0.64 1.98 0.00 0.00 0.00 0.00 175.76 177.78 2rjz h ALA 80 N 4.46 1.47 -3.16 0.00 0.00 -1.91 -3.37 119.26 116.75 2rjz h ALA 80 Ca -0.47 -0.05 -0.55 0.00 0.00 0.00 0.00 54.91 53.84 2rjz h ALA 80 Cb 1.22 -0.30 -0.40 0.00 0.00 0.00 0.00 17.79 18.31 2rjz h ALA 80 CO 0.73 0.48 -0.76 1.21 0.00 0.00 0.00 179.25 180.90 2rjz s ASN 81 N -6.33 3.52 0.11 0.00 3.84 -1.26 -5.04 114.94 109.78 2rjz s ASN 81 Ca -0.11 -1.26 -0.25 0.00 0.21 0.00 0.00 52.86 51.45 2rjz s ASN 81 Cb 0.18 -0.70 -0.09 0.00 -0.55 0.00 0.00 41.25 40.09 2rjz s ASN 81 CO 0.78 -0.37 1.67 0.25 -2.79 0.00 0.00 177.10 176.64 2rjz h LEU 82 N 8.19 -0.46 -0.60 3.21 5.85 -1.88 -1.56 115.31 128.06 2rjz h LEU 82 Ca -0.16 0.06 0.12 0.00 0.84 0.00 0.00 57.88 58.74 2rjz h LEU 82 Cb 1.06 0.18 -0.11 0.00 0.37 0.00 0.00 40.66 42.15 2rjz h LEU 82 CO 0.41 -0.24 -0.12 -0.08 -0.34 0.00 0.00 178.44 178.08 2rjz h GLU 83 N -0.32 0.02 -0.51 1.25 4.81 -1.96 0.21 114.58 118.08 2rjz h GLU 83 Ca 0.03 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 2rjz h GLU 83 Cb 0.34 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 2rjz h GLU 83 CO -0.10 0.01 0.10 0.00 -0.73 0.00 0.00 179.01 178.30 2rjz h ALA 84 N 1.59 1.21 -0.11 2.92 0.00 -1.93 -2.59 119.26 120.36 2rjz h ALA 84 Ca 0.30 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2rjz h ALA 84 Cb 0.46 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2rjz h ALA 84 CO -0.60 0.54 -0.06 -0.92 0.00 0.00 0.00 179.25 178.21 2rjz h TYR 85 N 0.76 0.26 -0.91 0.00 3.20 -0.18 -1.31 116.97 118.79 2rjz h TYR 85 Ca 0.17 -0.07 0.09 0.00 3.14 0.00 0.00 58.73 62.06 2rjz h TYR 85 Cb 0.32 -0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.46 2rjz h TYR 85 CO 0.02 0.59 0.59 0.87 -1.64 0.00 0.00 178.16 178.58 2rjz h LYS 86 N -0.14 0.91 -0.41 1.82 1.57 -1.03 0.12 116.57 119.41 2rjz h LYS 86 Ca 0.02 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 2rjz h LYS 86 Cb 0.52 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2rjz h LYS 86 CO 0.02 0.60 -0.24 0.00 -0.57 0.00 0.00 179.45 179.26 2rjz h ALA 87 N 1.54 0.81 -0.25 3.86 0.00 -1.16 -0.97 119.26 123.08 2rjz h ALA 87 Ca 0.42 -0.38 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 2rjz h ALA 87 Cb 0.37 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2rjz h ALA 87 CO -0.18 0.65 -0.48 1.96 0.00 0.00 0.00 179.25 181.19 2rjz h GLN 88 N 0.72 0.68 -0.38 0.00 1.08 -0.56 -1.76 115.11 114.89 2rjz h GLN 88 Ca 0.09 -0.39 0.05 0.00 -1.45 0.00 0.00 58.65 56.94 2rjz h GLN 88 Cb 0.77 0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 28.19 2rjz h GLN 88 CO 0.06 1.01 0.13 0.52 -0.95 0.00 0.00 178.83 179.60 2rjz h MET 89 N 0.54 0.28 -0.44 1.46 2.86 -0.74 -0.68 114.93 118.21 2rjz h MET 89 Ca 0.03 -0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 2rjz h MET 89 Cb 1.04 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.61 2rjz h MET 89 CO 0.10 0.18 0.02 -0.22 1.06 0.00 0.00 176.91 178.05 2rjz h LYS 90 N 0.29 0.70 -0.17 1.72 3.64 -1.08 -1.29 116.57 120.37 2rjz h LYS 90 Ca 0.17 -0.17 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 2rjz h LYS 90 Cb 0.15 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2rjz h LYS 90 CO -0.18 0.70 -0.60 0.93 -2.27 0.00 0.00 179.45 178.03 2rjz h GLU 91 N 0.66 0.59 -0.02 1.90 5.08 -0.96 0.13 114.58 121.96 2rjz h GLU 91 Ca 0.14 -0.40 0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2rjz h GLU 91 Cb 0.38 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2rjz h GLU 91 CO 0.01 1.02 -0.03 1.98 -1.00 0.00 0.00 179.01 180.99 2rjz h MET 92 N 0.44 -0.04 -0.36 2.33 4.05 -0.96 -0.78 114.93 119.61 2rjz h MET 92 Ca -0.00 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2rjz h MET 92 Cb 1.17 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.96 2rjz h MET 92 CO 0.12 -0.03 0.22 0.93 0.23 0.00 0.00 176.91 178.38 2rjz h GLU 93 N -0.04 0.49 -0.49 0.39 5.08 -1.19 -0.11 114.58 118.72 2rjz h GLU 93 Ca 0.02 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2rjz h GLU 93 Cb 0.07 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2rjz h GLU 93 CO -0.05 0.36 0.28 1.49 -1.00 0.00 0.00 179.01 180.09 2rjz h GLU 94 N 0.48 0.67 -0.95 2.33 4.81 -0.90 -0.79 114.58 120.22 2rjz h GLU 94 Ca 0.13 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2rjz h GLU 94 Cb -0.01 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.19 2rjz h GLU 94 CO -0.03 0.51 0.61 0.77 -0.73 0.00 0.00 179.01 180.15 2rjz h SER 95 N 0.65 1.11 -0.32 1.04 0.02 -0.96 0.15 113.55 115.24 2rjz h SER 95 Ca 0.17 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2rjz h SER 95 Cb 0.03 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 2rjz h SER 95 CO -0.03 0.82 0.16 0.15 -1.14 0.00 0.00 176.83 176.79 2rjz h PHE 96 N 1.30 0.45 -0.72 3.45 3.57 -0.39 -1.31 116.94 123.29 2rjz h PHE 96 Ca 0.35 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.80 2rjz h PHE 96 Cb -0.12 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.45 2rjz h PHE 96 CO -0.00 0.40 0.34 0.78 -2.23 0.00 0.00 178.31 177.60 2rjz h GLY 97 N 0.38 1.12 1.05 2.40 0.00 -0.85 -2.00 103.07 105.17 2rjz h GLY 97 Ca 0.11 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 2rjz h GLY 97 CO -0.01 0.54 0.55 0.00 0.00 0.00 0.00 176.54 177.61 2rjz h ALA 98 N 1.17 1.23 -0.32 3.60 0.00 -0.43 -1.57 119.26 122.94 2rjz h ALA 98 Ca 0.25 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2rjz h ALA 98 Cb 0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2rjz h ALA 98 CO -0.03 0.65 0.16 -0.07 0.00 0.00 0.00 179.25 179.96 2rjz h LEU 99 N 1.27 0.42 -1.45 0.00 3.38 -0.98 -2.33 115.31 115.62 2rjz h LEU 99 Ca 0.33 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2rjz h LEU 99 Cb -0.04 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2rjz h LEU 99 CO -0.06 0.42 0.26 -0.07 0.09 0.00 0.00 178.44 179.08 2rjz h LEU 100 N 0.39 0.56 -0.58 1.67 3.38 -1.03 -2.73 115.31 116.97 2rjz h LEU 100 Ca 0.11 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.94 2rjz h LEU 100 Cb 0.11 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2rjz h LEU 100 CO -0.01 0.45 -0.53 -0.09 0.09 0.00 0.00 178.44 178.34 2rjz h ARG 101 N 0.65 0.00 0.00 1.13 2.43 -1.10 -2.49 114.38 115.00 2rjz h ARG 101 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 2rjz h ARG 101 Cb 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2rjz h ARG 101 CO -0.03 0.53 0.00 1.04 -1.51 0.00 0.00 179.97 180.00 2rjz n GLN 102 N -3.49 0.19 -3.78 0.20 6.02 -0.89 -4.79 117.38 110.83 2rjz n GLN 102 Ca 0.00 0.38 -0.21 0.00 -0.01 0.00 0.00 57.00 57.16 2rjz n GLN 102 Cb 0.64 -1.83 -0.03 0.00 1.02 0.00 0.00 30.24 30.03 2rjz n GLN 102 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2rjz s LEU 103 N -4.37 3.68 -0.55 1.08 1.43 -0.94 -5.01 118.68 114.00 2rjz s LEU 103 Ca 0.05 -0.43 -0.05 0.00 -1.03 0.00 0.00 54.13 52.67 2rjz s LEU 103 Cb 0.10 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 2rjz s LEU 103 CO 0.42 -0.34 2.97 -0.81 0.23 0.00 0.00 176.35 178.81 2rjz n PRO 104 N -1.40 2.72 0.25 1.29 -0.04 -1.26 -4.70 135.00 131.86 2rjz n PRO 104 Ca -0.02 -2.13 0.13 0.00 -0.04 0.00 0.00 63.50 61.44 2rjz n PRO 104 Cb 0.59 -2.23 0.61 0.00 -0.04 0.00 0.00 33.50 32.44 2rjz n PRO 104 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2rjz h SER 105 N 3.39 0.00 0.00 3.54 4.64 -1.91 -2.00 113.55 121.21 2rjz h SER 105 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2rjz h SER 105 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2rjz h SER 105 CO 0.86 0.12 0.00 -0.90 -0.87 0.00 0.00 176.83 176.04 2rjz n ASP 106 N -3.32 0.27 0.00 4.97 5.75 -1.26 -2.65 116.55 120.31 2rjz n ASP 106 Ca -0.00 -1.52 0.00 0.00 -0.01 0.00 0.00 54.79 53.26 2rjz n ASP 106 Cb 0.34 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 2rjz n ASP 106 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 2rjz n THR 107 N -0.28 0.01 0.15 2.12 -1.04 -0.75 -4.88 114.28 109.61 2rjz n THR 107 Ca 0.00 -0.16 0.10 0.00 -2.04 0.00 0.00 64.05 61.95 2rjz n THR 107 Cb 0.07 1.66 0.06 0.00 -1.82 0.00 0.00 70.33 70.30 2rjz n THR 107 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2rjz h GLU 108 N 0.00 0.00 -0.34 -2.82 4.39 -1.52 -3.38 114.58 110.91 2rjz h GLU 108 Ca 0.00 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.77 2rjz h GLU 108 Cb 0.36 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.95 2rjz h GLU 108 CO 0.00 0.08 -0.07 0.28 -1.16 0.00 0.00 179.01 178.15 2rjz h VAL 109 N 0.00 0.68 -0.47 3.13 2.07 -1.90 0.46 116.25 120.23 2rjz h VAL 109 Ca -0.02 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.41 2rjz h VAL 109 Cb 1.10 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2rjz h VAL 109 CO 0.01 0.00 -0.07 -0.65 0.02 0.00 0.00 177.57 176.88 2rjz h PRO 110 N 0.02 0.83 -0.51 1.57 0.11 -1.99 0.25 132.00 132.28 2rjz h PRO 110 Ca 0.16 -0.26 -0.08 0.00 0.11 0.00 0.00 66.00 65.93 2rjz h PRO 110 Cb 0.24 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 2rjz h PRO 110 CO -0.33 0.88 0.02 0.78 -0.21 0.00 0.00 178.00 179.14 2rjz h GLY 111 N 0.98 0.95 0.69 -0.55 0.00 -1.71 -1.14 103.07 102.28 2rjz h GLY 111 Ca 0.13 -0.68 0.02 0.00 0.00 0.00 0.00 47.33 46.80 2rjz h GLY 111 CO 0.03 0.63 -0.09 -2.00 0.00 0.00 0.00 176.54 175.11 2rjz h LEU 112 N 0.75 -0.27 -1.02 3.11 5.85 0.39 -0.90 115.31 123.22 2rjz h LEU 112 Ca 0.15 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.96 2rjz h LEU 112 Cb 0.49 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 2rjz h LEU 112 CO 0.02 -0.13 0.65 -0.07 -0.34 0.00 0.00 178.44 178.58 2rjz h LEU 113 N -0.13 1.08 -0.40 2.25 3.38 -0.86 0.16 115.31 120.79 2rjz h LEU 113 Ca 0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2rjz h LEU 113 Cb 0.21 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2rjz h LEU 113 CO -0.14 0.72 0.27 -0.08 0.09 0.00 0.00 178.44 179.30 2rjz h GLU 114 N 1.24 0.53 -0.33 1.13 4.81 -0.87 -1.14 114.58 119.94 2rjz h GLU 114 Ca 0.41 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.49 2rjz h GLU 114 Cb 0.06 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2rjz h GLU 114 CO -0.14 0.35 -0.25 -0.44 -0.73 0.00 0.00 179.01 177.80 2rjz h ASP 115 N 0.54 0.79 -0.62 1.04 3.32 -0.18 -1.84 116.42 119.47 2rjz h ASP 115 Ca 0.15 -0.44 0.07 0.00 0.02 0.00 0.00 57.03 56.83 2rjz h ASP 115 Cb -0.06 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 39.21 2rjz h ASP 115 CO -0.03 1.06 0.30 0.40 -1.72 0.00 0.00 179.24 179.25 2rjz h ILE 116 N 0.52 0.89 -0.33 0.35 2.04 -0.68 -0.09 117.51 120.20 2rjz h ILE 116 Ca 0.06 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 2rjz h ILE 116 Cb 0.81 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2rjz h ILE 116 CO 0.07 0.10 -0.07 0.74 0.00 0.00 0.00 178.15 178.98 2rjz h THR 117 N 0.55 1.28 -0.69 -0.27 2.02 -1.01 -0.78 112.91 114.01 2rjz h THR 117 Ca 0.29 -1.12 -0.07 0.00 0.77 0.00 0.00 66.41 66.29 2rjz h THR 117 Cb 0.26 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 2rjz h THR 117 CO -0.23 0.36 0.16 -0.09 0.37 0.00 0.00 175.52 176.10 2rjz h ARG 118 N 0.41 1.10 -0.54 6.66 2.43 -1.19 0.58 114.38 123.81 2rjz h ARG 118 Ca 0.08 -0.26 -0.06 0.00 -0.81 0.00 0.00 59.98 58.93 2rjz h ARG 118 Cb 0.57 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 2rjz h ARG 118 CO 0.03 0.97 0.09 1.15 -1.51 0.00 0.00 179.97 180.70 2rjz h THR 119 N 1.04 1.25 0.42 0.20 2.02 -0.67 0.29 112.91 117.46 2rjz h THR 119 Ca 0.22 -0.95 -0.02 0.00 0.77 0.00 0.00 66.41 66.42 2rjz h THR 119 Cb 0.37 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 2rjz h THR 119 CO 0.00 0.34 -0.20 1.23 0.37 0.00 0.00 175.52 177.26 2rjz h GLY 120 N 0.79 -0.59 0.28 2.16 0.00 -0.86 -1.21 103.07 103.64 2rjz h GLY 120 Ca 0.17 0.22 0.12 0.00 0.00 0.00 0.00 47.33 47.84 2rjz h GLY 120 CO 0.01 -0.22 0.33 1.41 0.00 0.00 0.00 176.54 178.08 2rjz h LEU 121 N -0.66 0.37 -2.02 3.11 3.38 -0.82 -1.09 115.31 117.57 2rjz h LEU 121 Ca -0.06 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2rjz h LEU 121 Cb 0.49 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 2rjz h LEU 121 CO 0.10 0.17 -0.04 1.23 0.09 0.00 0.00 178.44 179.99 2rjz h GLY 122 N 0.52 0.00 -0.79 0.83 0.00 -0.21 -1.10 103.07 102.31 2rjz h GLY 122 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 2rjz h GLY 122 CO -0.35 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.63 2rjz n SER 123 N -4.34 1.67 -0.12 0.19 7.64 -0.47 -4.91 113.62 113.28 2rjz n SER 123 Ca -0.03 -1.69 -0.01 0.00 1.01 0.00 0.00 58.87 58.15 2rjz n SER 123 Cb 0.12 -0.09 -0.00 0.00 -1.01 0.00 0.00 64.21 63.23 2rjz n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rjz n GLY 124 N 1.14 0.33 3.80 0.23 0.00 -0.42 -4.70 105.19 105.57 2rjz n GLY 124 Ca 0.17 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 2rjz n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rjz s LEU 125 N -0.30 3.90 -0.12 0.99 1.43 -0.68 -4.72 118.68 119.18 2rjz s LEU 125 Ca 0.00 0.02 -0.06 0.00 -1.03 0.00 0.00 54.13 53.06 2rjz s LEU 125 Cb 0.00 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 2rjz s LEU 125 CO 0.00 0.15 0.11 -1.83 0.23 0.00 0.00 176.35 175.02 2rjz s GLU 126 N -2.53 3.38 0.00 1.70 -1.05 -0.33 -4.10 118.70 115.77 2rjz s GLU 126 Ca 0.30 -0.18 -0.23 0.00 -0.15 0.00 0.00 54.97 54.71 2rjz s GLU 126 Cb -0.12 -3.13 -0.05 0.00 -0.44 0.00 0.00 34.13 30.39 2rjz s GLU 126 CO 0.23 0.75 0.69 -0.06 0.95 0.00 0.00 175.26 177.83 2rjz s PHE 127 N -0.96 3.68 -0.21 4.83 0.08 -1.26 -1.30 117.98 122.84 2rjz s PHE 127 Ca 0.14 1.33 0.06 0.00 0.12 0.00 0.00 56.93 58.58 2rjz s PHE 127 Cb -0.12 -2.75 -0.17 0.00 -0.57 0.00 0.00 43.02 39.42 2rjz s PHE 127 CO 0.04 0.26 -0.12 0.39 -0.10 0.00 0.00 175.22 175.68 2rjz n GLU 128 N 3.00 0.73 -3.62 0.44 1.02 -0.19 -4.99 120.64 117.03 2rjz n GLU 128 Ca -0.04 0.09 -0.13 0.00 -0.02 0.00 0.00 57.16 57.07 2rjz n GLU 128 Cb 0.51 -1.45 -0.07 0.00 -0.02 0.00 0.00 31.44 30.41 2rjz n GLU 128 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2rjz s GLU 129 N -2.44 0.74 -0.15 3.49 2.12 -1.16 -5.02 118.70 116.28 2rjz s GLU 129 Ca -0.24 0.79 0.00 0.00 0.36 0.00 0.00 54.97 55.89 2rjz s GLU 129 Cb 0.07 0.36 0.03 0.00 0.26 0.00 0.00 34.13 34.85 2rjz s GLU 129 CO 0.57 -0.11 -0.13 0.42 -0.54 0.00 0.00 175.26 175.48 2rjz s ILE 130 N 0.17 1.52 -0.22 -3.70 1.01 -1.26 -1.47 121.20 117.24 2rjz s ILE 130 Ca 0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 60.65 60.00 2rjz s ILE 130 Cb -0.04 -1.46 0.03 0.00 0.01 0.00 0.00 42.46 40.99 2rjz s ILE 130 CO -0.01 0.40 -0.11 -0.75 0.00 0.00 0.00 174.94 174.48 2rjz s LYS 131 N 1.50 2.85 -0.16 2.79 2.20 0.10 -4.99 119.74 124.04 2rjz s LYS 131 Ca 0.04 -0.95 -0.20 0.00 -0.36 0.00 0.00 55.97 54.51 2rjz s LYS 131 Cb -0.13 -2.84 -0.03 0.00 -1.51 0.00 0.00 37.83 33.32 2rjz s LYS 131 CO -0.10 -0.34 0.57 -0.51 -0.36 0.00 0.00 175.35 174.60 2rjz s LEU 132 N 1.30 4.20 0.33 5.43 1.02 -1.26 -0.20 118.68 129.50 2rjz s LEU 132 Ca 0.01 0.83 0.07 0.00 0.02 0.00 0.00 54.13 55.06 2rjz s LEU 132 Cb -0.16 -2.81 -0.02 0.00 0.02 0.00 0.00 46.19 43.23 2rjz s LEU 132 CO -0.07 -0.15 0.39 -0.76 0.02 0.00 0.00 176.35 175.77 2rjz s LEU 133 N 1.35 3.83 0.20 1.79 1.43 -0.18 -5.00 118.68 122.10 2rjz s LEU 133 Ca 0.28 -0.31 -0.32 0.00 -1.03 0.00 0.00 54.13 52.74 2rjz s LEU 133 Cb -0.16 -2.53 -0.14 0.00 0.03 0.00 0.00 46.19 43.39 2rjz s LEU 133 CO 0.11 -0.39 1.36 -2.65 0.23 0.00 0.00 176.35 175.02 2rjz n PRO 134 N -1.52 1.76 -1.71 1.29 -0.02 -1.26 -4.45 135.00 129.09 2rjz n PRO 134 Ca -0.01 0.63 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 2rjz n PRO 134 Cb 0.59 -2.26 0.01 0.00 -0.02 0.00 0.00 33.50 31.82 2rjz n PRO 134 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2rjz n GLU 135 N 2.20 1.96 -4.05 -0.52 1.02 -1.26 -4.56 120.64 115.43 2rjz n GLU 135 Ca 0.14 0.70 -0.32 0.00 -0.02 0.00 0.00 57.16 57.66 2rjz n GLU 135 Cb 0.28 -2.40 -0.16 0.00 -0.02 0.00 0.00 31.44 29.15 2rjz n GLU 135 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2rjz s VAL 136 N -1.20 1.87 0.03 2.62 1.01 -0.43 -4.98 120.40 119.33 2rjz s VAL 136 Ca 0.61 -1.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.26 2rjz s VAL 136 Cb -0.50 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2rjz s VAL 136 CO 0.58 0.27 0.74 0.00 0.00 0.00 0.00 175.10 176.69 2rjz s ALA 137 N 1.31 3.38 0.06 5.51 0.00 -1.26 -0.95 121.76 129.80 2rjz s ALA 137 Ca -0.00 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.20 2rjz s ALA 137 Cb -0.16 -2.96 0.01 0.00 0.00 0.00 0.00 23.12 20.01 2rjz s ALA 137 CO -0.09 0.06 0.05 1.04 0.00 0.00 0.00 175.76 176.82 2rjz n GLN 138 N 2.89 1.25 -0.05 0.00 1.13 0.06 -4.99 117.38 117.67 2rjz n GLN 138 Ca -0.03 -0.33 -0.11 0.00 -1.94 0.00 0.00 57.00 54.59 2rjz n GLN 138 Cb 0.50 0.02 -0.05 0.00 0.11 0.00 0.00 30.24 30.82 2rjz n GLN 138 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 2rjz h GLN 139 N 0.00 0.26 -0.01 -1.09 4.15 -1.99 -3.36 115.11 113.07 2rjz h GLN 139 Ca -0.03 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2rjz h GLN 139 Cb 0.12 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.78 2rjz h GLN 139 CO 0.05 0.38 -0.06 1.19 -1.93 0.00 0.00 178.83 178.46 2rjz n PHE 140 N -4.82 0.00 -3.61 3.99 3.72 -1.26 -4.74 117.46 110.74 2rjz n PHE 140 Ca -0.05 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.23 2rjz n PHE 140 Cb 0.15 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.64 2rjz n PHE 140 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 176.76 178.23 2rjz s TYR 141 N -0.91 -0.31 -0.08 1.38 -0.85 -1.26 -1.95 117.35 113.38 2rjz s TYR 141 Ca 0.09 0.17 0.05 0.00 -0.52 0.00 0.00 57.07 56.86 2rjz s TYR 141 Cb 0.07 0.29 -0.00 0.00 0.38 0.00 0.00 41.96 42.70 2rjz s TYR 141 CO 0.15 -0.66 -0.23 0.42 -1.52 0.00 0.00 175.55 173.71 2rjz s ILE 142 N -3.05 1.93 0.02 -3.49 1.01 0.11 -0.76 121.20 116.98 2rjz s ILE 142 Ca -0.02 -0.97 -0.07 0.00 0.00 0.00 0.00 60.65 59.59 2rjz s ILE 142 Cb 0.00 -1.66 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 2rjz s ILE 142 CO -0.07 0.54 0.29 -1.83 0.00 0.00 0.00 174.94 173.87 2rjz s GLU 143 N 0.17 3.61 -0.32 2.79 -1.05 -0.13 -1.11 118.70 122.67 2rjz s GLU 143 Ca -0.12 -0.04 0.02 0.00 -0.15 0.00 0.00 54.97 54.67 2rjz s GLU 143 Cb -0.16 -3.06 0.10 0.00 -0.44 0.00 0.00 34.13 30.57 2rjz s GLU 143 CO 0.06 0.63 0.06 -0.51 0.95 0.00 0.00 175.26 176.45 2rjz s LEU 144 N -1.82 3.50 0.02 1.83 1.02 0.20 -1.31 118.68 122.11 2rjz s LEU 144 Ca 0.29 -1.86 -0.30 0.00 0.02 0.00 0.00 54.13 52.27 2rjz s LEU 144 Cb -0.13 -1.26 -0.04 0.00 0.02 0.00 0.00 46.19 44.78 2rjz s LEU 144 CO 0.17 -0.39 1.00 -2.84 0.02 0.00 0.00 176.35 174.31 2rjz s PRO 145 N 1.25 4.56 -0.18 1.29 0.02 -1.26 -1.57 135.00 139.11 2rjz s PRO 145 Ca 0.09 1.46 0.01 0.00 0.02 0.00 0.00 61.00 62.58 2rjz s PRO 145 Cb -0.18 -3.44 0.04 0.00 0.02 0.00 0.00 34.50 30.94 2rjz s PRO 145 CO -0.16 -0.04 -0.10 0.42 -0.33 0.00 0.00 177.00 176.79 2rjz s ILE 146 N 0.90 1.54 -0.25 2.83 1.01 0.29 -1.01 121.20 126.50 2rjz s ILE 146 Ca 0.52 -0.85 -0.17 0.00 0.00 0.00 0.00 60.65 60.14 2rjz s ILE 146 Cb -0.22 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.63 2rjz s ILE 146 CO 0.28 0.24 0.49 -1.58 0.00 0.00 0.00 174.94 174.37 2rjz s GLN 147 N 1.46 4.08 -0.18 2.79 0.74 0.72 -0.34 119.66 128.93 2rjz s GLN 147 Ca 0.01 0.29 -0.05 0.00 0.05 0.00 0.00 55.36 55.66 2rjz s GLN 147 Cb -0.15 -3.64 -0.03 0.00 1.10 0.00 0.00 33.01 30.29 2rjz s GLN 147 CO -0.09 -0.31 -0.01 0.42 -0.55 0.00 0.00 175.29 174.75 2rjz s ILE 148 N 2.18 4.02 -0.21 -2.34 -1.09 0.07 -0.72 121.20 123.10 2rjz s ILE 148 Ca 0.20 -0.30 -0.04 0.00 -2.23 0.00 0.00 60.65 58.28 2rjz s ILE 148 Cb -0.16 -2.79 -0.01 0.00 -1.58 0.00 0.00 42.46 37.92 2rjz s ILE 148 CO 0.09 0.46 -0.03 -0.44 -1.23 0.00 0.00 174.94 173.80 2rjz s SER 149 N 0.62 4.48 0.22 3.58 0.01 -0.54 -0.42 113.70 121.65 2rjz s SER 149 Ca -0.01 -0.33 0.04 0.00 1.31 0.00 0.00 55.95 56.96 2rjz s SER 149 Cb -0.14 -1.77 -0.05 0.00 0.21 0.00 0.00 66.02 64.27 2rjz s SER 149 CO 0.02 0.01 -0.02 0.68 0.41 0.00 0.00 173.24 174.34 2rjz s VAL 150 N 1.31 1.06 -0.02 3.43 -7.23 -0.43 -1.02 120.40 117.50 2rjz s VAL 150 Ca 0.04 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 2rjz s VAL 150 Cb -0.14 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.55 2rjz s VAL 150 CO -0.01 -0.39 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.67 2rjz s VAL 151 N -3.40 0.34 -1.60 1.32 1.01 -0.42 -1.03 120.40 116.62 2rjz s VAL 151 Ca 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2rjz s VAL 151 Cb 0.05 -0.36 0.00 0.00 0.00 0.00 0.00 36.38 36.07 2rjz s VAL 151 CO 0.07 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2rjz n GLY 152 N 3.64 -0.70 3.89 4.51 0.00 -0.05 -1.19 105.19 115.29 2rjz n GLY 152 Ca -0.21 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 2rjz n GLY 152 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2rjz s GLY 153 N 0.00 1.62 0.26 -0.02 0.00 -1.13 0.40 107.32 108.45 2rjz s GLY 153 Ca 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 44.72 44.29 2rjz s GLY 153 CO 0.00 -0.08 1.80 0.10 0.00 0.00 0.00 173.10 174.93 2rjz h TYR 154 N -0.47 0.94 -0.41 1.90 -0.00 -1.83 -1.77 116.97 115.33 2rjz h TYR 154 Ca -0.45 -0.09 -0.13 0.00 0.00 0.00 0.00 58.73 58.06 2rjz h TYR 154 Cb 1.25 -0.27 -0.01 0.00 0.00 0.00 0.00 36.73 37.69 2rjz h TYR 154 CO 0.51 0.77 -0.24 1.25 -0.00 0.00 0.00 178.16 180.46 2rjz h HIS 155 N 0.87 1.03 -0.37 0.10 2.76 -1.96 -3.19 115.15 114.39 2rjz h HIS 155 Ca 0.19 -0.27 -0.06 0.00 -2.20 0.00 0.00 60.37 58.03 2rjz h HIS 155 Cb 0.30 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 2rjz h HIS 155 CO 0.02 1.06 0.00 -0.44 -1.30 0.00 0.00 177.93 177.27 2rjz h ASP 156 N 0.70 0.64 -0.78 3.26 3.32 -1.70 -1.79 116.42 120.07 2rjz h ASP 156 Ca 0.09 -0.31 0.16 0.00 0.02 0.00 0.00 57.03 56.99 2rjz h ASP 156 Cb 0.81 -0.17 -0.11 0.00 0.22 0.00 0.00 39.33 40.08 2rjz h ASP 156 CO 0.07 0.79 0.27 -0.07 -1.72 0.00 0.00 179.24 178.58 2rjz h LEU 157 N 0.47 0.19 -0.16 1.55 3.38 -1.41 -0.27 115.31 119.06 2rjz h LEU 157 Ca 0.10 0.13 -0.23 0.00 0.09 0.00 0.00 57.88 57.98 2rjz h LEU 157 Cb 0.46 0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.36 2rjz h LEU 157 CO 0.02 0.03 -0.85 0.00 0.09 0.00 0.00 178.44 177.73 2rjz h ALA 158 N 1.60 0.32 -0.63 1.53 0.00 -1.40 -1.90 119.26 118.78 2rjz h ALA 158 Ca 0.44 -0.63 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 2rjz h ALA 158 Cb 0.73 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2rjz h ALA 158 CO -0.47 0.71 0.05 1.79 0.00 0.00 0.00 179.25 181.33 2rjz h THR 159 N 0.44 1.26 -0.21 0.00 1.35 -1.13 -0.53 112.91 114.09 2rjz h THR 159 Ca -0.07 -1.10 0.05 0.00 -0.55 0.00 0.00 66.41 64.74 2rjz h THR 159 Cb 1.48 0.74 -0.05 0.00 -1.73 0.00 0.00 68.15 68.59 2rjz h THR 159 CO 0.17 0.40 -0.09 0.15 -0.25 0.00 0.00 175.52 175.90 2rjz h PHE 160 N 0.99 -0.21 -0.78 4.73 3.57 -0.99 0.32 116.94 124.56 2rjz h PHE 160 Ca 0.18 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.72 2rjz h PHE 160 Cb 0.51 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.33 2rjz h PHE 160 CO 0.04 -0.15 0.51 0.28 -2.23 0.00 0.00 178.31 176.77 2rjz h VAL 161 N -0.06 1.19 -0.43 1.41 2.07 -1.05 -1.21 116.25 118.17 2rjz h VAL 161 Ca 0.11 -0.36 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 2rjz h VAL 161 Cb 0.23 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 2rjz h VAL 161 CO -0.25 0.19 -0.13 -1.28 0.02 0.00 0.00 177.57 176.11 2rjz h SER 162 N 1.05 0.79 -0.17 0.57 0.87 -0.71 -2.43 113.55 113.52 2rjz h SER 162 Ca 0.29 -0.25 -0.18 0.00 -1.23 0.00 0.00 61.79 60.41 2rjz h SER 162 Cb -0.11 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 61.63 2rjz h SER 162 CO -0.07 0.94 -0.57 1.23 -0.53 0.00 0.00 176.83 177.83 2rjz h GLY 163 N 0.97 0.85 1.16 5.77 0.00 0.18 -2.61 103.07 109.39 2rjz h GLY 163 Ca 0.12 -1.01 -0.05 0.00 0.00 0.00 0.00 47.33 46.39 2rjz h GLY 163 CO 0.04 0.90 0.25 -2.08 0.00 0.00 0.00 176.54 175.65 2rjz h VAL 164 N 0.58 1.25 0.00 4.60 2.07 -1.20 -2.58 116.25 120.97 2rjz h VAL 164 Ca 0.01 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2rjz h VAL 164 Cb 1.17 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 2rjz h VAL 164 CO 0.12 0.33 0.00 0.77 0.02 0.00 0.00 177.57 178.81 2rjz h SER 165 N 1.03 0.00 -0.39 0.57 4.64 -1.30 -2.56 113.55 115.55 2rjz h SER 165 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2rjz h SER 165 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 2rjz h SER 165 CO -0.01 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.75 2rjz n SER 166 N -3.07 2.10 -4.80 4.97 7.64 -0.99 -4.98 113.62 114.49 2rjz n SER 166 Ca 0.03 -1.99 -0.34 0.00 1.01 0.00 0.00 58.87 57.58 2rjz n SER 166 Cb 0.45 -0.26 -0.01 0.00 -1.01 0.00 0.00 64.21 63.37 2rjz n SER 166 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2rjz s LEU 167 N -1.03 3.72 -1.12 -3.43 1.43 -0.97 -4.93 118.68 112.35 2rjz s LEU 167 Ca 0.27 1.92 -0.08 0.00 -1.03 0.00 0.00 54.13 55.20 2rjz s LEU 167 Cb 0.14 -4.55 -0.12 0.00 0.03 0.00 0.00 46.19 41.69 2rjz s LEU 167 CO 0.18 -0.96 3.11 -0.81 0.23 0.00 0.00 176.35 178.10 2rjz n PRO 168 N -1.36 3.26 -4.00 1.29 -0.05 -1.26 -4.79 135.00 128.09 2rjz n PRO 168 Ca 0.09 -1.96 -0.08 0.00 -0.05 0.00 0.00 63.50 61.50 2rjz n PRO 168 Cb 0.52 -2.55 -0.10 0.00 -0.05 0.00 0.00 33.50 31.33 2rjz n PRO 168 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 175.50 176.48 2rjz s ARG 169 N 1.50 0.58 -0.87 0.54 1.81 -1.26 -5.09 118.95 116.16 2rjz s ARG 169 Ca 0.68 -0.96 -0.20 0.00 -1.72 0.00 0.00 55.73 53.53 2rjz s ARG 169 Cb 0.22 0.22 0.11 0.00 -0.45 0.00 0.00 34.95 35.05 2rjz s ARG 169 CO -0.05 -0.13 1.12 0.42 -0.68 0.00 0.00 175.30 175.98 2rjz s ILE 170 N -3.14 4.55 -0.06 1.52 -1.09 -1.26 -4.96 121.20 116.77 2rjz s ILE 170 Ca -0.00 -1.21 -0.02 0.00 -2.23 0.00 0.00 60.65 57.19 2rjz s ILE 170 Cb 0.02 -4.78 0.04 0.00 -1.58 0.00 0.00 42.46 36.16 2rjz s ILE 170 CO -0.07 -1.54 0.12 0.54 -1.23 0.00 0.00 174.94 172.77 2rjz s VAL 171 N 3.24 -0.07 0.12 2.92 0.11 -1.26 -4.29 120.40 121.17 2rjz s VAL 171 Ca 0.31 0.20 0.08 0.00 -2.93 0.00 0.00 61.98 59.65 2rjz s VAL 171 Cb -0.07 -0.21 -0.04 0.00 -1.53 0.00 0.00 36.38 34.52 2rjz s VAL 171 CO -0.05 0.08 -0.14 0.42 -3.33 0.00 0.00 175.10 172.09 2rjz s THR 172 N 1.25 3.11 0.03 5.04 -4.23 -0.51 -4.93 115.64 115.40 2rjz s THR 172 Ca -0.08 -1.44 0.05 0.00 -1.18 0.00 0.00 61.69 59.04 2rjz s THR 172 Cb -0.12 -2.46 -0.03 0.00 1.34 0.00 0.00 72.50 71.23 2rjz s THR 172 CO -0.05 0.07 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.23 2rjz s LEU 173 N -2.28 2.97 0.00 4.79 1.43 -1.26 -0.74 118.68 123.58 2rjz s LEU 173 Ca 0.20 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 2rjz s LEU 173 Cb -0.10 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.39 2rjz s LEU 173 CO 0.12 0.26 0.00 1.41 0.23 0.00 0.00 176.35 178.37 2rjz n HIS 174 N 1.43 0.00 -1.91 0.29 8.25 0.74 -5.00 115.22 119.01 2rjz n HIS 174 Ca -0.15 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 56.93 2rjz n HIS 174 Cb 0.52 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.67 2rjz n HIS 174 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2rjz s ASP 175 N 1.00 5.33 0.04 0.41 1.01 -1.26 -4.68 116.67 118.52 2rjz s ASP 175 Ca 0.00 2.58 -0.03 0.00 0.71 0.00 0.00 52.55 55.81 2rjz s ASP 175 Cb 0.00 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 2rjz s ASP 175 CO 0.00 -1.52 0.04 0.72 0.21 0.00 0.00 175.17 174.63 2rjz s PHE 176 N -1.42 0.30 -0.04 4.23 -0.12 -1.26 -1.30 117.98 118.37 2rjz s PHE 176 Ca 0.73 -0.68 -0.03 0.00 -0.05 0.00 0.00 56.93 56.90 2rjz s PHE 176 Cb -0.36 -0.22 0.02 0.00 -0.63 0.00 0.00 43.02 41.83 2rjz s PHE 176 CO 0.41 -0.35 0.11 -2.00 -0.05 0.00 0.00 175.22 173.33 2rjz s GLU 177 N -2.89 0.10 -0.01 1.99 2.12 -0.11 -5.00 118.70 114.90 2rjz s GLU 177 Ca -0.03 0.20 0.06 0.00 0.36 0.00 0.00 54.97 55.56 2rjz s GLU 177 Cb 0.00 -0.03 -0.03 0.00 0.26 0.00 0.00 34.13 34.34 2rjz s GLU 177 CO -0.06 -0.06 -0.17 0.42 -0.54 0.00 0.00 175.26 174.85 2rjz s ILE 178 N 0.41 2.85 -0.07 -3.70 1.01 -1.26 -0.90 121.20 119.54 2rjz s ILE 178 Ca -0.03 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.61 2rjz s ILE 178 Cb -0.04 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.31 2rjz s ILE 178 CO -0.02 0.48 0.18 -0.75 0.00 0.00 0.00 174.94 174.84 2rjz s LYS 179 N -1.02 0.19 0.41 2.79 2.20 0.13 -4.98 119.74 119.45 2rjz s LYS 179 Ca 0.13 0.31 -0.26 0.00 -0.36 0.00 0.00 55.97 55.79 2rjz s LYS 179 Cb -0.10 0.02 -0.10 0.00 -1.51 0.00 0.00 37.83 36.13 2rjz s LYS 179 CO 0.02 -0.07 1.36 -0.35 -0.36 0.00 0.00 175.35 175.96 2rjz n PRO 180 N 3.39 2.20 -0.04 4.03 -0.04 -1.26 0.84 135.00 144.12 2rjz n PRO 180 Ca -0.17 0.78 -0.16 0.00 -0.04 0.00 0.00 63.50 63.91 2rjz n PRO 180 Cb 0.57 -2.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.45 2rjz n PRO 180 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2rjz h VAL 181 N 2.38 1.32 -3.86 0.52 2.07 -1.72 -3.44 116.25 113.53 2rjz h VAL 181 Ca -0.49 -1.82 -0.27 0.00 0.82 0.00 0.00 66.70 64.94 2rjz h VAL 181 Cb 1.28 2.02 -0.18 0.00 -1.52 0.00 0.00 31.29 32.88 2rjz h VAL 181 CO 0.61 0.56 -0.72 0.00 0.02 0.00 0.00 177.57 178.04 2rjz s ALA 182 N -3.81 0.86 0.31 1.67 0.00 -1.26 -5.10 121.76 114.42 2rjz s ALA 182 Ca -0.12 -1.07 -0.30 0.00 0.00 0.00 0.00 51.96 50.48 2rjz s ALA 182 Cb 0.07 0.07 -0.11 0.00 0.00 0.00 0.00 23.12 23.15 2rjz s ALA 182 CO 0.86 -0.09 1.59 -1.25 0.00 0.00 0.00 175.76 176.87 2rjz s PRO 183 N -2.62 4.11 0.00 0.00 0.04 -1.26 -2.52 135.00 132.75 2rjz s PRO 183 Ca 0.01 2.60 0.00 0.00 0.04 0.00 0.00 61.00 63.65 2rjz s PRO 183 Cb -0.03 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.50 2rjz s PRO 183 CO -0.01 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.80 2rjz n GLY 184 N 1.96 1.91 3.88 0.56 0.00 -1.26 -5.01 105.19 107.22 2rjz n GLY 184 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2rjz n GLY 184 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2rjz s SER 185 N -3.45 6.40 0.00 1.61 1.04 -1.05 -4.95 113.70 113.30 2rjz s SER 185 Ca 0.00 0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.90 2rjz s SER 185 Cb 0.00 -2.07 0.00 0.00 0.10 0.00 0.00 66.02 64.05 2rjz s SER 185 CO 0.00 0.40 0.07 1.07 0.98 0.00 0.00 173.24 175.76 2rjz n THR 186 N 1.91 0.00 0.08 2.02 5.66 -1.26 -4.79 114.28 117.90 2rjz n THR 186 Ca -0.19 -0.10 0.08 0.00 -3.05 0.00 0.00 64.05 60.79 2rjz n THR 186 Cb 0.55 1.61 -0.03 0.00 -1.55 0.00 0.00 70.33 70.92 2rjz n THR 186 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 2rjz h SER 187 N 0.00 0.00 -3.78 1.09 4.64 -1.92 -3.40 113.55 110.18 2rjz h SER 187 Ca 0.00 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 2rjz h SER 187 Cb 0.31 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.02 2rjz h SER 187 CO 0.00 0.20 -0.75 -1.59 -0.87 0.00 0.00 176.83 173.81 2rjz s LYS 188 N -3.21 1.99 0.02 4.77 -2.85 -1.26 -2.82 119.74 116.38 2rjz s LYS 188 Ca -0.01 -1.54 0.04 0.00 -1.00 0.00 0.00 55.97 53.46 2rjz s LYS 188 Cb 0.09 -3.06 -0.03 0.00 -2.06 0.00 0.00 37.83 32.77 2rjz s LYS 188 CO 0.80 -0.72 -0.09 -0.51 0.10 0.00 0.00 175.35 174.93 2rjz s LEU 189 N 1.05 3.08 -0.22 2.77 1.43 0.16 -2.00 118.68 124.95 2rjz s LEU 189 Ca -0.01 -0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 52.77 2rjz s LEU 189 Cb -0.20 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 44.19 2rjz s LEU 189 CO -0.06 0.27 0.18 -0.60 0.23 0.00 0.00 176.35 176.37 2rjz s ARG 190 N -1.51 4.14 -0.10 1.70 3.52 0.25 -0.87 118.95 126.07 2rjz s ARG 190 Ca 0.17 -0.18 0.03 0.00 -0.13 0.00 0.00 55.73 55.62 2rjz s ARG 190 Cb -0.11 -3.49 -0.01 0.00 -1.56 0.00 0.00 34.95 29.79 2rjz s ARG 190 CO 0.08 0.15 -0.21 1.41 -0.81 0.00 0.00 175.30 175.93 2rjz s MET 191 N 0.78 3.09 -0.19 5.12 -2.45 -0.20 0.21 119.30 125.66 2rjz s MET 191 Ca 0.09 -0.82 -0.07 0.00 -1.25 0.00 0.00 55.69 53.65 2rjz s MET 191 Cb -0.13 -2.39 -0.04 0.00 1.25 0.00 0.00 34.83 33.53 2rjz s MET 191 CO 0.02 0.22 0.04 0.45 1.05 0.00 0.00 175.02 176.81 2rjz s SER 192 N 0.27 5.35 -0.01 1.11 0.15 -0.08 -1.31 113.70 119.18 2rjz s SER 192 Ca -0.14 -0.02 0.03 0.00 0.70 0.00 0.00 55.95 56.51 2rjz s SER 192 Cb -0.17 -1.92 -0.00 0.00 -1.71 0.00 0.00 66.02 62.22 2rjz s SER 192 CO 0.07 0.13 -0.08 -0.51 1.20 0.00 0.00 173.24 174.05 2rjz s ILE 193 N 0.60 0.68 -0.21 6.45 2.07 0.44 -0.93 121.20 130.29 2rjz s ILE 193 Ca 0.02 -0.36 -0.17 0.00 -1.41 0.00 0.00 60.65 58.73 2rjz s ILE 193 Cb -0.13 -0.58 -0.03 0.00 0.13 0.00 0.00 42.46 41.84 2rjz s ILE 193 CO 0.02 0.20 0.48 -0.22 -1.91 0.00 0.00 174.94 173.50 2rjz s LEU 194 N -0.12 4.13 0.22 8.50 2.96 -0.42 -0.75 118.68 133.19 2rjz s LEU 194 Ca 0.02 0.59 0.08 0.00 -0.22 0.00 0.00 54.13 54.60 2rjz s LEU 194 Cb -0.04 -2.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.98 2rjz s LEU 194 CO -0.00 -0.17 0.05 0.00 -1.32 0.00 0.00 176.35 174.91 2rjz s ALA 195 N 1.66 3.29 0.01 5.97 0.00 0.54 -0.19 121.76 133.05 2rjz s ALA 195 Ca 0.22 -1.47 0.01 0.00 0.00 0.00 0.00 51.96 50.72 2rjz s ALA 195 Cb -0.15 -1.00 -0.01 0.00 0.00 0.00 0.00 23.12 21.96 2rjz s ALA 195 CO 0.09 0.36 -0.04 0.15 0.00 0.00 0.00 175.76 176.32 2rjz s LYS 196 N -3.39 0.31 0.41 0.00 1.02 0.08 -0.55 119.74 117.62 2rjz s LYS 196 Ca 0.30 -0.33 0.03 0.00 0.02 0.00 0.00 55.97 55.99 2rjz s LYS 196 Cb -0.08 -0.19 -0.04 0.00 -0.52 0.00 0.00 37.83 37.01 2rjz s LYS 196 CO 0.21 0.04 0.07 -0.08 -0.92 0.00 0.00 175.35 174.67 2rjz s THR 197 N -0.59 1.01 0.00 2.17 -1.32 -0.61 -1.42 115.64 114.89 2rjz s THR 197 Ca -0.04 -2.00 -0.06 0.00 -1.21 0.00 0.00 61.69 58.38 2rjz s THR 197 Cb -0.05 -2.49 -0.00 0.00 -1.51 0.00 0.00 72.50 68.45 2rjz s THR 197 CO -0.00 0.00 0.11 -0.31 -2.21 0.00 0.00 174.62 172.21 2rjz s TYR 198 N -3.12 0.06 0.05 9.09 2.02 -1.26 0.61 117.35 124.81 2rjz s TYR 198 Ca 0.24 -0.16 -0.00 0.00 -0.37 0.00 0.00 57.07 56.78 2rjz s TYR 198 Cb 0.05 -0.06 -0.03 0.00 -0.40 0.00 0.00 41.96 41.51 2rjz s TYR 198 CO 0.13 -0.25 -0.04 -0.98 -1.57 0.00 0.00 175.55 172.83 2rjz s ARG 199 N -1.29 0.54 0.19 -0.62 1.70 -0.26 -4.81 118.95 114.40 2rjz s ARG 199 Ca -0.14 -1.01 -0.32 0.00 -0.47 0.00 0.00 55.73 53.79 2rjz s ARG 199 Cb -0.08 0.09 -0.15 0.00 -0.57 0.00 0.00 34.95 34.25 2rjz s ARG 199 CO 0.01 -0.07 1.28 0.98 -1.08 0.00 0.00 175.30 176.43 2rjz n TYR 200 N 0.66 1.69 1.50 5.89 9.36 -1.26 0.07 117.16 135.07 2rjz n TYR 200 Ca -0.18 0.56 0.12 0.00 3.32 0.00 0.00 57.90 61.73 2rjz n TYR 200 Cb 0.59 -2.36 0.71 0.00 -0.63 0.00 0.00 39.34 37.65 2rjz n TYR 200 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37