#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkw s SER 2 N 0.00 -0.07 -0.92 1.61 1.04 -1.26 -5.08 113.70 109.02 2dkw s SER 2 Ca 0.00 -0.33 -0.24 0.00 0.48 0.00 0.00 55.95 55.86 2dkw s SER 2 Cb 0.00 0.32 -0.05 0.00 0.10 0.00 0.00 66.02 66.39 2dkw s SER 2 CO 0.00 -0.61 1.94 -0.55 0.98 0.00 0.00 173.24 174.99 2dkw s SER 3 N -3.16 5.16 0.20 7.02 0.15 -1.26 -4.86 113.70 116.95 2dkw s SER 3 Ca 0.17 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 56.06 2dkw s SER 3 Cb 0.01 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 2dkw s SER 3 CO 0.00 -2.75 0.00 0.61 1.20 0.00 0.00 173.24 172.31 2dkw n GLY 4 N 6.78 1.55 3.62 9.45 0.00 -1.26 -4.85 105.19 120.48 2dkw n GLY 4 Ca 0.40 -0.32 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 2dkw n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dkw s SER 5 N -4.00 -0.28 -0.76 1.61 0.15 -1.26 -5.06 113.70 104.10 2dkw s SER 5 Ca 0.00 0.42 -0.00 0.00 0.70 0.00 0.00 55.95 57.07 2dkw s SER 5 Cb 0.00 0.39 0.36 0.00 -1.71 0.00 0.00 66.02 65.06 2dkw s SER 5 CO 0.00 -0.17 1.82 -1.20 1.20 0.00 0.00 173.24 174.89 2dkw n SER 6 N 1.30 6.92 0.00 5.45 7.64 -1.26 -4.70 113.62 128.96 2dkw n SER 6 Ca -0.09 -3.81 0.00 0.00 1.01 0.00 0.00 58.87 55.98 2dkw n SER 6 Cb 0.57 -0.94 0.00 0.00 -1.01 0.00 0.00 64.21 62.83 2dkw n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dkw n GLY 7 N -0.52 -0.04 0.29 0.23 0.00 -1.26 -4.60 105.19 99.28 2dkw n GLY 7 Ca 0.51 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.61 2dkw n GLY 7 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2dkw n ASN 8 N -1.72 -0.21 -0.24 1.61 2.85 -1.26 0.70 115.26 116.99 2dkw n ASN 8 Ca 0.00 1.39 -0.02 0.00 -0.11 0.00 0.00 54.58 55.84 2dkw n ASN 8 Cb 0.00 -0.46 0.05 0.00 1.24 0.00 0.00 39.78 40.61 2dkw n ASN 8 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 2dkw h THR 9 N 0.00 0.19 -0.03 -0.44 2.02 -1.86 -0.90 112.91 111.88 2dkw h THR 9 Ca 0.44 0.00 -0.22 0.00 0.77 0.00 0.00 66.41 67.39 2dkw h THR 9 Cb 0.78 0.19 0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2dkw h THR 9 CO -0.81 0.00 -0.85 -0.07 0.37 0.00 0.00 175.52 174.16 2dkw h LEU 10 N -0.08 0.80 -0.91 2.58 3.38 0.02 -3.25 115.31 117.86 2dkw h LEU 10 Ca 0.30 -0.72 0.25 0.00 0.09 0.00 0.00 57.88 57.80 2dkw h LEU 10 Cb 0.55 -0.24 -0.15 0.00 0.09 0.00 0.00 40.66 40.91 2dkw h LEU 10 CO -0.75 1.41 0.22 -0.09 0.09 0.00 0.00 178.44 179.32 2dkw h ARG 11 N 0.26 0.15 -0.52 1.13 2.43 0.49 0.46 114.38 118.77 2dkw h ARG 11 Ca -0.10 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 58.97 2dkw h ARG 11 Cb 1.52 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 31.02 2dkw h ARG 11 CO 0.17 0.10 -0.03 0.93 -1.51 0.00 0.00 179.97 179.63 2dkw h GLU 12 N 0.16 0.95 -0.96 0.20 5.08 -1.29 -2.93 114.58 115.78 2dkw h GLU 12 Ca 0.58 -0.32 0.09 0.00 -1.00 0.00 0.00 59.36 58.71 2dkw h GLU 12 Cb 1.21 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 30.31 2dkw h GLU 12 CO -0.71 0.98 0.60 1.25 -1.00 0.00 0.00 179.01 180.13 2dkw h LEU 13 N 0.82 0.92 0.79 1.33 5.85 -0.16 0.13 115.31 124.99 2dkw h LEU 13 Ca 0.14 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 2dkw h LEU 13 Cb 0.57 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.45 2dkw h LEU 13 CO 0.03 0.54 -0.38 0.03 -0.34 0.00 0.00 178.44 178.33 2dkw h ARG 14 N 1.03 -1.02 -0.99 1.25 3.08 -1.12 -0.60 114.38 116.01 2dkw h ARG 14 Ca 0.45 0.07 0.11 0.00 0.07 0.00 0.00 59.98 60.67 2dkw h ARG 14 Cb 0.32 0.23 -0.08 0.00 0.08 0.00 0.00 29.97 30.53 2dkw h ARG 14 CO -0.22 -0.68 0.63 -0.07 -1.07 0.00 0.00 179.97 178.56 2dkw h LEU 15 N -1.10 0.92 0.42 3.04 3.38 -1.39 0.25 115.31 120.84 2dkw h LEU 15 Ca -0.11 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2dkw h LEU 15 Cb 0.81 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2dkw h LEU 15 CO 0.18 0.51 -0.23 0.15 0.09 0.00 0.00 178.44 179.14 2dkw h PHE 16 N 1.00 -0.60 0.70 1.13 3.57 -0.62 -1.15 116.94 120.97 2dkw h PHE 16 Ca 0.47 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.93 2dkw h PHE 16 Cb 0.43 0.21 0.01 0.00 2.79 0.00 0.00 35.95 39.39 2dkw h PHE 16 CO -0.00 -0.36 -0.34 -0.07 -2.23 0.00 0.00 178.31 175.31 2dkw h LEU 17 N -0.61 -0.80 -0.93 0.59 3.38 -0.60 -3.10 115.31 113.25 2dkw h LEU 17 Ca -0.05 0.02 0.18 0.00 0.09 0.00 0.00 57.88 58.12 2dkw h LEU 17 Cb 0.49 0.21 -0.17 0.00 0.09 0.00 0.00 40.66 41.27 2dkw h LEU 17 CO 0.07 -0.42 -0.26 -0.09 0.09 0.00 0.00 178.44 177.83 2dkw h ARG 18 N -1.24 -0.01 -0.95 1.13 2.43 -0.57 1.14 114.38 116.31 2dkw h ARG 18 Ca -0.10 0.00 0.20 0.00 -0.81 0.00 0.00 59.98 59.28 2dkw h ARG 18 Cb 0.73 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.20 2dkw h ARG 18 CO 0.16 -0.01 0.61 0.22 -1.51 0.00 0.00 179.97 179.44 2dkw h ASP 19 N -0.01 0.55 0.45 -3.80 1.82 -1.22 0.26 116.42 114.48 2dkw h ASP 19 Ca 0.42 0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 57.10 2dkw h ASP 19 Cb 0.66 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.64 2dkw h ASP 19 CO -0.95 0.21 -0.22 0.58 -1.61 0.00 0.00 179.24 177.25 2dkw h VAL 20 N 0.54 0.20 -0.80 2.25 2.07 0.14 -2.77 116.25 117.88 2dkw h VAL 20 Ca 0.51 -0.57 0.15 0.00 0.82 0.00 0.00 66.70 67.61 2dkw h VAL 20 Cb 1.09 0.31 -0.10 0.00 -1.52 0.00 0.00 31.29 31.06 2dkw h VAL 20 CO -0.25 0.04 0.35 0.74 0.02 0.00 0.00 177.57 178.47 2dkw h THR 21 N -1.09 0.65 0.08 2.57 2.02 -0.81 -2.78 112.91 113.55 2dkw h THR 21 Ca -0.06 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.95 2dkw h THR 21 Cb 0.54 0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 2dkw h THR 21 CO 0.10 0.09 -0.06 0.50 0.37 0.00 0.00 175.52 176.52 2dkw h LYS 22 N 0.49 -0.13 -0.73 6.66 3.64 -1.01 -1.55 116.57 123.93 2dkw h LYS 22 Ca 0.45 0.01 0.25 0.00 -1.27 0.00 0.00 60.65 60.09 2dkw h LYS 22 Cb 0.69 0.03 -0.13 0.00 -0.41 0.00 0.00 32.23 32.40 2dkw h LYS 22 CO -0.41 -0.09 0.19 -2.13 -2.27 0.00 0.00 179.45 174.75 2dkw n ARG 23 N -2.60 -0.05 0.01 1.90 0.63 -1.04 0.17 116.66 115.67 2dkw n ARG 23 Ca -0.02 1.06 -0.12 0.00 -0.92 0.00 0.00 57.85 57.85 2dkw n ARG 23 Cb 0.06 -1.78 -0.08 0.00 0.45 0.00 0.00 32.46 31.11 2dkw n ARG 23 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2dkw h LEU 24 N 0.00 0.03 0.35 6.15 3.38 -1.21 -2.04 115.31 121.96 2dkw h LEU 24 Ca 0.53 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 2dkw h LEU 24 Cb 1.25 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2dkw h LEU 24 CO -0.63 0.24 -0.20 0.00 0.09 0.00 0.00 178.44 177.94 2dkw h ALA 25 N 0.79 -0.50 -0.97 1.53 0.00 0.28 -2.60 119.26 117.78 2dkw h ALA 25 Ca 0.01 -0.10 0.18 0.00 0.00 0.00 0.00 54.91 55.00 2dkw h ALA 25 Cb 0.22 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 18.15 2dkw h ALA 25 CO -0.00 -0.79 0.61 1.79 0.00 0.00 0.00 179.25 180.86 2dkw h THR 26 N -0.51 0.73 -3.64 0.00 1.35 -0.94 -3.40 112.91 106.51 2dkw h THR 26 Ca -0.04 -0.24 -0.53 0.00 -0.55 0.00 0.00 66.41 65.05 2dkw h THR 26 Cb 0.41 -0.02 0.09 0.00 -1.73 0.00 0.00 68.15 66.90 2dkw h THR 26 CO 0.05 0.13 0.80 -0.62 -0.25 0.00 0.00 175.52 175.63 2dkw s ASP 27 N -5.53 6.44 0.24 5.36 2.15 -0.77 -4.91 116.67 119.65 2dkw s ASP 27 Ca -0.10 2.93 0.03 0.00 0.43 0.00 0.00 52.55 55.83 2dkw s ASP 27 Cb 0.24 -2.65 0.27 0.00 -0.30 0.00 0.00 42.92 40.49 2dkw s ASP 27 CO 0.80 -0.83 1.59 0.50 -0.17 0.00 0.00 175.17 177.06 2dkw h LYS 28 N 3.98 0.36 -0.43 4.34 3.64 -1.84 -2.72 116.57 123.91 2dkw h LYS 28 Ca -0.49 -0.21 0.02 0.00 -1.27 0.00 0.00 60.65 58.71 2dkw h LYS 28 Cb 1.23 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 2dkw h LYS 28 CO 0.72 0.78 0.28 0.00 -2.27 0.00 0.00 179.45 178.96 2dkw h ARG 29 N 0.28 0.47 -1.05 1.90 3.08 -1.91 -2.58 114.38 114.58 2dkw h ARG 29 Ca 0.01 -0.03 -0.58 0.00 0.07 0.00 0.00 59.98 59.46 2dkw h ARG 29 Cb 0.99 -0.11 -0.41 0.00 0.08 0.00 0.00 29.97 30.52 2dkw h ARG 29 CO 0.08 0.31 -0.63 1.19 -1.07 0.00 0.00 179.97 179.86 2dkw n PHE 30 N -4.48 3.00 -0.11 3.04 3.72 -1.13 -4.69 117.46 116.82 2dkw n PHE 30 Ca 0.04 -2.56 -0.19 0.00 -0.05 0.00 0.00 57.45 54.69 2dkw n PHE 30 Cb 0.13 -0.35 -0.12 0.00 -0.94 0.00 0.00 39.48 38.20 2dkw n PHE 30 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2dkw n ASN 31 N -0.64 2.00 -0.32 4.37 6.94 -0.97 -4.27 115.26 122.37 2dkw n ASN 31 Ca 0.44 -0.05 0.30 0.00 -0.02 0.00 0.00 54.58 55.25 2dkw n ASN 31 Cb 0.83 -0.51 0.65 0.00 -2.36 0.00 0.00 39.78 38.39 2dkw n ASN 31 CO 0.00 0.00 0.00 0.16 -1.03 0.00 0.00 177.26 176.39 2dkw h ILE 32 N -0.06 0.45 -0.16 1.53 3.07 -1.84 0.53 117.51 121.03 2dkw h ILE 32 Ca -0.56 -0.05 -0.17 0.00 1.55 0.00 0.00 64.86 65.62 2dkw h ILE 32 Cb 1.90 0.28 -0.00 0.00 -0.27 0.00 0.00 36.82 38.72 2dkw h ILE 32 CO -0.09 0.03 -0.61 -0.26 -1.05 0.00 0.00 178.15 176.17 2dkw h PHE 33 N 0.16 0.69 -0.97 0.16 0.04 -1.92 -3.12 116.94 111.97 2dkw h PHE 33 Ca 0.57 -0.26 0.22 0.00 2.80 0.00 0.00 57.97 61.30 2dkw h PHE 33 Cb 1.94 -0.12 -0.08 0.00 2.20 0.00 0.00 35.95 39.88 2dkw h PHE 33 CO -0.00 1.01 0.63 0.77 -0.60 0.00 0.00 178.31 180.12 2dkw h SER 34 N 0.40 0.49 -2.43 2.17 0.02 -0.12 -3.41 113.55 110.67 2dkw h SER 34 Ca -0.01 0.07 -0.49 0.00 -0.84 0.00 0.00 61.79 60.52 2dkw h SER 34 Cb 1.17 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 2dkw h SER 34 CO 0.11 0.16 -0.39 -0.54 -1.14 0.00 0.00 176.83 175.04 2dkw s LYS 35 N -5.53 3.46 -1.19 3.45 3.01 -1.18 -4.52 119.74 117.25 2dkw s LYS 35 Ca -0.09 -0.61 -0.23 0.00 -1.01 0.00 0.00 55.97 54.03 2dkw s LYS 35 Cb 0.24 -2.86 -0.09 0.00 -1.01 0.00 0.00 37.83 34.11 2dkw s LYS 35 CO 0.79 0.40 1.94 -1.25 0.51 0.00 0.00 175.35 177.73 2dkw s PRO 36 N -3.83 2.49 0.59 -1.68 0.04 -1.26 -4.75 135.00 126.59 2dkw s PRO 36 Ca 0.36 -1.17 0.29 0.00 0.04 0.00 0.00 61.00 60.52 2dkw s PRO 36 Cb -0.10 -5.24 1.41 0.00 0.04 0.00 0.00 34.50 30.61 2dkw s PRO 36 CO 0.30 -4.00 1.81 -0.39 0.04 0.00 0.00 177.00 174.77 2dkw h VAL 37 N 6.17 0.32 -3.33 -0.36 -1.51 -1.86 -3.41 116.25 112.26 2dkw h VAL 37 Ca 0.22 0.00 -0.43 0.00 -1.23 0.00 0.00 66.70 65.26 2dkw h VAL 37 Cb 0.94 0.52 0.20 0.00 -2.13 0.00 0.00 31.29 30.82 2dkw h VAL 37 CO 1.22 0.00 0.03 -0.44 -1.23 0.00 0.00 177.57 177.15 2dkw s SER 38 N -4.98 0.80 -0.03 4.19 0.01 -1.26 -5.01 113.70 107.42 2dkw s SER 38 Ca -0.04 1.21 -0.00 0.00 1.31 0.00 0.00 55.95 58.43 2dkw s SER 38 Cb 0.16 -1.86 -0.00 0.00 0.21 0.00 0.00 66.02 64.53 2dkw s SER 38 CO 0.56 -4.27 0.03 0.44 0.41 0.00 0.00 173.24 170.41 2dkw h ASP 39 N -2.67 -0.01 -5.09 2.44 5.19 -1.96 -3.48 116.42 110.84 2dkw h ASP 39 Ca -0.56 0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 55.58 2dkw h ASP 39 Cb 1.33 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.84 2dkw h ASP 39 CO 0.47 0.13 -0.08 0.00 -3.12 0.00 0.00 179.24 176.63 2dkw n TYR 40 N -2.77 -1.94 -0.06 4.55 9.36 -1.26 -5.08 117.16 119.96 2dkw n TYR 40 Ca -0.00 -1.16 -0.10 0.00 3.32 0.00 0.00 57.90 59.96 2dkw n TYR 40 Cb 0.00 -0.27 -0.05 0.00 -0.63 0.00 0.00 39.34 38.39 2dkw n TYR 40 CO 0.00 0.00 0.00 1.47 0.22 0.00 0.00 176.86 178.55 2dkw n LEU 41 N 0.00 2.49 0.28 2.98 -0.00 -1.26 -4.56 117.00 116.93 2dkw n LEU 41 Ca 0.04 -0.01 0.16 0.00 -0.00 0.00 0.00 56.01 56.20 2dkw n LEU 41 Cb 0.32 -0.41 0.77 0.00 -0.00 0.00 0.00 43.42 44.11 2dkw n LEU 41 CO 0.20 0.60 1.00 -0.33 -0.00 0.00 0.00 177.39 178.85 2dkw h GLU 42 N -0.11 0.00 0.00 1.47 5.08 -2.03 -1.91 114.58 117.08 2dkw h GLU 42 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2dkw h GLU 42 Cb 1.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 2dkw h GLU 42 CO -0.08 0.07 0.00 1.55 -1.00 0.00 0.00 179.01 179.56 2dkw n VAL 43 N -3.33 0.00 -4.86 3.13 3.14 -1.26 -4.66 118.33 110.49 2dkw n VAL 43 Ca -0.01 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.04 2dkw n VAL 43 Cb 0.25 -0.55 -0.14 0.00 -1.06 0.00 0.00 33.84 32.34 2dkw n VAL 43 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2dkw s ILE 44 N -2.00 2.92 -0.16 1.55 1.01 -0.72 -5.03 121.20 118.76 2dkw s ILE 44 Ca 0.25 -0.72 -0.20 0.00 0.00 0.00 0.00 60.65 59.98 2dkw s ILE 44 Cb 0.11 -2.20 -0.17 0.00 0.01 0.00 0.00 42.46 40.22 2dkw s ILE 44 CO 0.19 0.54 0.31 0.11 0.00 0.00 0.00 174.94 176.09 2dkw h LYS 45 N 6.46 0.00 -3.14 2.79 1.79 -1.86 -3.42 116.57 119.20 2dkw h LYS 45 Ca -0.29 0.00 -0.69 0.00 -2.18 0.00 0.00 60.65 57.50 2dkw h LYS 45 Cb 1.20 0.00 -0.37 0.00 -1.58 0.00 0.00 32.23 31.49 2dkw h LYS 45 CO 0.54 0.74 -0.16 0.39 -1.08 0.00 0.00 179.45 179.88 2dkw n GLU 46 N -4.55 2.63 -2.20 3.15 4.71 -1.26 -5.06 120.64 118.05 2dkw n GLU 46 Ca -0.18 -4.51 -0.42 0.00 -0.01 0.00 0.00 57.16 52.04 2dkw n GLU 46 Cb 0.48 -2.38 -0.03 0.00 -1.01 0.00 0.00 31.44 28.50 2dkw n GLU 46 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2dkw s PRO 47 N -1.61 4.32 -0.04 3.49 0.04 -1.26 -5.01 135.00 134.92 2dkw s PRO 47 Ca 0.29 2.03 -0.27 0.00 0.04 0.00 0.00 61.00 63.08 2dkw s PRO 47 Cb -0.04 -3.35 0.06 0.00 0.04 0.00 0.00 34.50 31.22 2dkw s PRO 47 CO -0.11 -0.46 0.60 1.41 0.04 0.00 0.00 177.00 178.48 2dkw s MET 48 N 1.46 0.98 -0.12 4.56 1.75 -1.26 -5.09 119.30 121.58 2dkw s MET 48 Ca 0.64 0.15 -0.32 0.00 -1.25 0.00 0.00 55.69 54.92 2dkw s MET 48 Cb -0.35 0.46 0.13 0.00 2.84 0.00 0.00 34.83 37.90 2dkw s MET 48 CO 0.29 -0.30 1.06 0.16 -0.65 0.00 0.00 175.02 175.59 2dkw s ASP 49 N -1.24 -0.25 0.26 1.11 -4.77 -1.26 -4.84 116.67 105.67 2dkw s ASP 49 Ca -0.11 0.06 0.07 0.00 -3.30 0.00 0.00 52.55 49.26 2dkw s ASP 49 Cb -0.01 0.25 0.76 0.00 -1.09 0.00 0.00 42.92 42.83 2dkw s ASP 49 CO 0.08 -0.39 1.23 0.18 0.70 0.00 0.00 175.17 176.98 2dkw n LEU 50 N -0.01 0.03 0.00 2.11 4.77 -1.26 -1.25 117.00 121.40 2dkw n LEU 50 Ca -0.05 1.32 0.00 0.00 -0.03 0.00 0.00 56.01 57.26 2dkw n LEU 50 Cb 0.60 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2dkw n LEU 50 CO 0.10 -1.39 0.40 -1.20 -1.33 0.00 0.00 177.39 173.98 2dkw n SER 51 N -4.99 0.00 -0.33 -1.43 7.64 -1.26 -2.52 113.62 110.74 2dkw n SER 51 Ca 0.22 0.81 0.21 0.00 1.01 0.00 0.00 58.87 61.12 2dkw n SER 51 Cb 0.74 -0.31 0.40 0.00 -1.01 0.00 0.00 64.21 64.04 2dkw n SER 51 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2dkw h THR 52 N 0.00 0.09 -0.77 0.44 2.02 -1.55 0.54 112.91 113.69 2dkw h THR 52 Ca 0.00 -0.02 0.17 0.00 0.77 0.00 0.00 66.41 67.33 2dkw h THR 52 Cb 0.00 0.02 -0.11 0.00 -1.74 0.00 0.00 68.15 66.31 2dkw h THR 52 CO 0.00 0.01 0.20 0.58 0.37 0.00 0.00 175.52 176.69 2dkw h VAL 53 N 0.07 0.49 -0.29 3.16 2.07 -1.01 0.30 116.25 121.04 2dkw h VAL 53 Ca 0.68 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 68.07 2dkw h VAL 53 Cb 1.58 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 2dkw h VAL 53 CO -0.80 0.05 -0.00 0.40 0.02 0.00 0.00 177.57 177.24 2dkw h ILE 54 N 0.28 1.18 0.62 4.57 2.04 0.40 -3.07 117.51 123.52 2dkw h ILE 54 Ca 0.44 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 2dkw h ILE 54 Cb 0.78 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2dkw h ILE 54 CO -0.53 0.24 -0.47 0.74 0.00 0.00 0.00 178.15 178.13 2dkw h THR 55 N 0.43 0.07 -0.59 -0.27 2.02 -0.23 -2.50 112.91 111.84 2dkw h THR 55 Ca 0.10 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.40 2dkw h THR 55 Cb 0.29 0.07 -0.11 0.00 -1.74 0.00 0.00 68.15 66.66 2dkw h THR 55 CO 0.01 0.00 -0.10 0.11 0.37 0.00 0.00 175.52 175.90 2dkw h LYS 56 N -1.05 0.03 -0.77 6.66 6.56 -1.43 0.51 116.57 127.08 2dkw h LYS 56 Ca -0.08 -0.00 0.17 0.00 -1.06 0.00 0.00 60.65 59.68 2dkw h LYS 56 Cb 0.88 -0.01 -0.11 0.00 -0.57 0.00 0.00 32.23 32.42 2dkw h LYS 56 CO 0.02 0.02 0.21 0.82 -2.06 0.00 0.00 179.45 178.46 2dkw h ILE 57 N 0.03 0.50 0.00 1.86 2.04 -1.42 0.77 117.51 121.29 2dkw h ILE 57 Ca 0.29 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 66.06 2dkw h ILE 57 Cb 0.46 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2dkw h ILE 57 CO -0.58 0.05 0.00 -0.67 0.00 0.00 0.00 178.15 176.95 2dkw n ASP 58 N -5.15 0.70 -1.64 1.72 -0.08 -0.01 -2.90 116.55 109.19 2dkw n ASP 58 Ca 0.16 0.60 -0.01 0.00 -1.51 0.00 0.00 54.79 54.02 2dkw n ASP 58 Cb 0.49 -0.77 0.26 0.00 2.34 0.00 0.00 41.12 43.44 2dkw n ASP 58 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2dkw n LYS 59 N -2.19 3.37 -4.19 -0.67 4.76 0.26 -4.90 118.16 114.60 2dkw n LYS 59 Ca 0.05 -2.31 -0.33 0.00 -2.87 0.00 0.00 58.31 52.84 2dkw n LYS 59 Cb 0.36 -2.02 -0.04 0.00 -1.84 0.00 0.00 35.03 31.48 2dkw n LYS 59 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2dkw n HIS 60 N 0.14 -1.58 -0.08 2.13 8.25 -1.05 -4.87 115.22 118.17 2dkw n HIS 60 Ca 0.27 0.74 -0.06 0.00 -0.26 0.00 0.00 57.72 58.41 2dkw n HIS 60 Cb 1.07 -3.05 -0.02 0.00 1.12 0.00 0.00 29.99 29.11 2dkw n HIS 60 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2dkw n ASN 61 N -2.77 1.83 -4.74 0.41 2.85 -0.99 -4.93 115.26 106.91 2dkw n ASN 61 Ca -0.10 0.53 -0.41 0.00 -0.11 0.00 0.00 54.58 54.49 2dkw n ASN 61 Cb 0.58 -0.82 -0.02 0.00 1.24 0.00 0.00 39.78 40.75 2dkw n ASN 61 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 2dkw s TYR 62 N -2.44 3.03 0.00 1.20 2.02 -1.26 -4.90 117.35 115.00 2dkw s TYR 62 Ca -0.19 1.00 0.00 0.00 -0.37 0.00 0.00 57.07 57.51 2dkw s TYR 62 Cb 0.03 -3.82 0.00 0.00 -0.40 0.00 0.00 41.96 37.77 2dkw s TYR 62 CO 0.29 -2.69 0.00 1.47 -1.57 0.00 0.00 175.55 173.04 2dkw n LEU 63 N 2.49 0.00 -4.18 -1.29 -0.00 -1.26 -4.92 117.00 107.84 2dkw n LEU 63 Ca 0.07 -0.31 -0.11 0.00 -0.00 0.00 0.00 56.01 55.66 2dkw n LEU 63 Cb 0.40 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.72 2dkw n LEU 63 CO 0.60 0.00 -0.25 0.42 -0.00 0.00 0.00 177.39 178.16 2dkw s THR 64 N -1.02 0.03 0.05 1.47 -4.23 -1.26 -4.42 115.64 106.25 2dkw s THR 64 Ca 0.00 -1.97 -0.04 0.00 -1.18 0.00 0.00 61.69 58.50 2dkw s THR 64 Cb 0.00 -2.36 -0.28 0.00 1.34 0.00 0.00 72.50 71.20 2dkw s THR 64 CO 0.00 -0.14 1.03 0.00 -0.54 0.00 0.00 174.62 174.98 2dkw h ALA 65 N 2.69 0.16 -0.02 3.99 0.00 -1.94 -3.26 119.26 120.88 2dkw h ALA 65 Ca -0.36 -0.97 0.03 0.00 0.00 0.00 0.00 54.91 53.62 2dkw h ALA 65 Cb 1.23 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 2dkw h ALA 65 CO 0.55 1.03 -0.21 0.87 0.00 0.00 0.00 179.25 181.49 2dkw h LYS 66 N 0.07 -0.31 0.04 0.00 1.79 -1.98 -2.26 116.57 113.92 2dkw h LYS 66 Ca -0.18 0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.34 2dkw h LYS 66 Cb 1.99 0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 32.68 2dkw h LYS 66 CO 0.19 -0.21 -0.16 -0.44 -1.08 0.00 0.00 179.45 177.75 2dkw h ASP 67 N -0.32 -0.46 -0.70 0.86 5.19 -2.00 -2.17 116.42 116.81 2dkw h ASP 67 Ca 0.07 0.06 0.11 0.00 -0.62 0.00 0.00 57.03 56.65 2dkw h ASP 67 Cb 0.41 0.19 -0.13 0.00 0.18 0.00 0.00 39.33 39.98 2dkw h ASP 67 CO -0.21 -0.23 -0.37 0.15 -3.12 0.00 0.00 179.24 175.46 2dkw h PHE 68 N -0.29 -1.04 -0.05 4.55 3.04 -1.53 -0.36 116.94 121.27 2dkw h PHE 68 Ca 0.04 0.08 0.03 0.00 3.98 0.00 0.00 57.97 62.11 2dkw h PHE 68 Cb 0.33 0.56 -0.04 0.00 2.56 0.00 0.00 35.95 39.37 2dkw h PHE 68 CO -0.20 -0.39 -0.16 -0.07 -2.02 0.00 0.00 178.31 175.47 2dkw h LEU 69 N -0.13 -0.46 -0.92 0.59 3.38 -1.14 -2.00 115.31 114.62 2dkw h LEU 69 Ca 0.25 0.07 0.27 0.00 0.09 0.00 0.00 57.88 58.57 2dkw h LEU 69 Cb 0.56 0.20 -0.15 0.00 0.09 0.00 0.00 40.66 41.36 2dkw h LEU 69 CO -0.77 -0.21 0.25 0.11 0.09 0.00 0.00 178.44 177.91 2dkw h LYS 70 N -0.23 0.15 -0.06 1.13 1.57 -0.44 1.24 116.57 119.93 2dkw h LYS 70 Ca 0.07 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.76 2dkw h LYS 70 Cb 0.33 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2dkw h LYS 70 CO -0.18 0.10 -0.32 -0.44 -0.57 0.00 0.00 179.45 178.03 2dkw h ASP 71 N 0.16 0.11 -0.03 0.86 5.19 -0.65 -2.72 116.42 119.34 2dkw h ASP 71 Ca 0.61 -0.04 -0.09 0.00 -0.62 0.00 0.00 57.03 56.89 2dkw h ASP 71 Cb 1.30 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.77 2dkw h ASP 71 CO -0.72 0.44 -0.25 0.40 -3.12 0.00 0.00 179.24 175.99 2dkw h ILE 72 N 0.10 1.26 0.00 0.35 1.08 0.20 -2.59 117.51 117.91 2dkw h ILE 72 Ca 0.01 -1.24 -0.01 0.00 -0.39 0.00 0.00 64.86 63.24 2dkw h ILE 72 Cb 0.63 1.36 -0.00 0.00 -3.07 0.00 0.00 36.82 35.73 2dkw h ILE 72 CO 0.05 0.39 -0.03 -0.78 -0.69 0.00 0.00 178.15 177.09 2dkw h ASP 73 N 0.39 0.00 -0.40 1.72 1.82 -0.98 -1.70 116.42 117.27 2dkw h ASP 73 Ca 0.06 0.00 -0.06 0.00 -0.39 0.00 0.00 57.03 56.64 2dkw h ASP 73 Cb 0.65 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.63 2dkw h ASP 73 CO 0.05 0.03 0.05 0.25 -1.61 0.00 0.00 179.24 178.01 2dkw h LEU 74 N 0.00 0.70 -1.58 2.28 5.85 -1.52 -2.44 115.31 118.61 2dkw h LEU 74 Ca -0.00 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.61 2dkw h LEU 74 Cb 0.05 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 2dkw h LEU 74 CO 0.00 0.74 0.33 0.40 -0.34 0.00 0.00 178.44 179.57 2dkw h ILE 75 N 0.71 1.04 0.33 4.05 2.04 -1.40 0.27 117.51 124.56 2dkw h ILE 75 Ca 0.15 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 2dkw h ILE 75 Cb 0.36 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 2dkw h ILE 75 CO 0.01 0.10 -0.16 0.00 0.00 0.00 0.00 178.15 178.10 2dkw h SER 77 N -0.99 0.70 0.19 0.00 4.64 -1.33 -2.18 113.55 114.56 2dkw h SER 77 Ca -0.05 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.28 2dkw h SER 77 Cb 0.50 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.39 2dkw h SER 77 CO 0.08 0.50 -0.33 0.78 -0.87 0.00 0.00 176.83 176.99 2dkw h ASN 78 N 0.83 -0.93 0.17 4.97 4.21 -0.55 1.71 115.58 125.98 2dkw h ASN 78 Ca 0.24 0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.85 2dkw h ASN 78 Cb -0.06 0.34 0.00 0.00 -1.12 0.00 0.00 38.32 37.48 2dkw h ASN 78 CO -0.07 -0.43 0.00 0.00 -1.29 0.00 0.00 177.43 175.64 2dkw n ALA 79 N -2.69 1.21 0.29 -0.83 0.00 -0.95 -0.89 120.51 116.66 2dkw n ALA 79 Ca -0.08 0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.42 2dkw n ALA 79 Cb 0.34 -1.13 0.02 0.00 0.00 0.00 0.00 19.45 18.67 2dkw n ALA 79 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dkw n LEU 80 N -1.68 1.33 -0.11 0.00 4.77 0.14 -3.90 117.00 117.55 2dkw n LEU 80 Ca 0.01 -0.90 -0.22 0.00 -0.03 0.00 0.00 56.01 54.86 2dkw n LEU 80 Cb 0.06 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.03 2dkw n LEU 80 CO 0.06 0.27 -1.20 1.21 -1.33 0.00 0.00 177.39 176.40 2dkw n GLU 81 N 0.09 0.64 -0.00 3.23 4.07 0.56 -4.14 120.64 125.10 2dkw n GLU 81 Ca 0.03 0.25 -0.15 0.00 -0.06 0.00 0.00 57.16 57.23 2dkw n GLU 81 Cb 0.16 -1.57 -0.14 0.00 -0.06 0.00 0.00 31.44 29.83 2dkw n GLU 81 CO 0.00 0.00 0.00 1.88 -0.06 0.00 0.00 177.13 178.95 2dkw h TYR 82 N -0.38 0.25 -2.90 4.31 0.05 -1.62 -3.42 116.97 113.26 2dkw h TYR 82 Ca -0.57 -0.18 -0.61 0.00 0.05 0.00 0.00 58.73 57.42 2dkw h TYR 82 Cb 1.78 -0.01 -0.41 0.00 1.01 0.00 0.00 36.73 39.10 2dkw h TYR 82 CO 0.01 1.37 -0.69 0.54 -1.05 0.00 0.00 178.16 178.34 2dkw s ASN 83 N -6.59 3.86 0.48 3.88 4.22 -1.25 -5.02 114.94 114.52 2dkw s ASN 83 Ca -0.12 -3.57 0.00 0.00 -2.14 0.00 0.00 52.86 47.02 2dkw s ASN 83 Cb 0.07 -1.29 0.00 0.00 1.28 0.00 0.00 41.25 41.31 2dkw s ASN 83 CO 0.81 -0.12 0.00 -0.81 -2.04 0.00 0.00 177.10 174.94 2dkw n PRO 84 N 2.30 0.03 -0.56 3.55 -0.04 -1.26 -4.30 135.00 134.73 2dkw n PRO 84 Ca 0.21 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.63 2dkw n PRO 84 Cb 0.38 0.00 0.15 0.00 -0.04 0.00 0.00 33.50 33.99 2dkw n PRO 84 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2dkw n ASP 85 N -1.43 3.43 0.52 3.54 5.75 -1.26 -4.46 116.55 122.64 2dkw n ASP 85 Ca 0.00 -2.66 -0.20 0.00 -0.01 0.00 0.00 54.79 51.91 2dkw n ASP 85 Cb 0.00 -0.64 -0.10 0.00 -1.03 0.00 0.00 41.12 39.35 2dkw n ASP 85 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2dkw h LYS 86 N 1.28 -1.26 -7.17 0.11 3.64 -1.91 -3.41 116.57 107.85 2dkw h LYS 86 Ca 0.17 0.09 -0.53 0.00 -1.27 0.00 0.00 60.65 59.11 2dkw h LYS 86 Cb 1.63 0.29 0.14 0.00 -0.41 0.00 0.00 32.23 33.88 2dkw h LYS 86 CO 0.42 -0.84 0.40 -0.51 -2.27 0.00 0.00 179.45 176.65 2dkw s ASP 87 N -4.05 4.49 0.00 4.20 1.01 -1.26 -4.89 116.67 116.17 2dkw s ASP 87 Ca -0.19 2.29 0.15 0.00 0.71 0.00 0.00 52.55 55.50 2dkw s ASP 87 Cb 0.02 -2.58 0.71 0.00 1.01 0.00 0.00 42.92 42.08 2dkw s ASP 87 CO 0.59 -2.06 1.42 -0.81 0.21 0.00 0.00 175.17 174.52 2dkw n PRO 88 N -2.53 0.16 -0.03 8.23 -0.04 -1.26 -2.68 135.00 136.85 2dkw n PRO 88 Ca 0.13 0.17 -0.00 0.00 -0.04 0.00 0.00 63.50 63.76 2dkw n PRO 88 Cb 0.50 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 2dkw n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dkw n GLY 89 N -0.03 -0.59 0.18 0.55 0.00 -1.26 -4.43 105.19 99.60 2dkw n GLY 89 Ca 0.06 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.97 2dkw n GLY 89 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dkw h ASP 90 N 0.00 0.00 -0.94 1.61 3.32 -1.79 -3.13 116.42 115.49 2dkw h ASP 90 Ca -0.17 0.00 0.07 0.00 0.02 0.00 0.00 57.03 56.95 2dkw h ASP 90 Cb 1.20 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.68 2dkw h ASP 90 CO 0.01 0.00 0.59 0.11 -1.72 0.00 0.00 179.24 178.23 2dkw h LYS 91 N 0.00 1.02 -0.39 3.56 1.57 -1.77 -1.29 116.57 119.27 2dkw h LYS 91 Ca 0.00 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 2dkw h LYS 91 Cb 0.53 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 2dkw h LYS 91 CO 0.00 0.67 -0.02 0.82 -0.57 0.00 0.00 179.45 180.35 2dkw h ILE 92 N 1.05 1.22 -0.51 1.86 5.03 -1.84 -3.01 117.51 121.30 2dkw h ILE 92 Ca 0.42 -0.92 0.10 0.00 -0.12 0.00 0.00 64.86 64.34 2dkw h ILE 92 Cb 0.22 0.96 -0.10 0.00 -3.03 0.00 0.00 36.82 34.87 2dkw h ILE 92 CO -0.19 0.32 -0.12 0.40 -0.68 0.00 0.00 178.15 177.88 2dkw h ILE 93 N 0.59 0.50 -1.15 -0.67 1.08 -1.39 -0.06 117.51 116.40 2dkw h ILE 93 Ca 0.12 -0.00 0.42 0.00 -0.39 0.00 0.00 64.86 65.01 2dkw h ILE 93 Cb 0.41 0.49 -0.14 0.00 -3.07 0.00 0.00 36.82 34.51 2dkw h ILE 93 CO 0.02 0.00 0.71 0.54 -0.69 0.00 0.00 178.15 178.73 2dkw n ARG 94 N -5.36 -0.04 0.09 2.37 1.74 -1.14 -0.14 116.66 114.19 2dkw n ARG 94 Ca 0.05 1.18 -0.08 0.00 -0.77 0.00 0.00 57.85 58.23 2dkw n ARG 94 Cb 0.27 -2.26 -0.05 0.00 -1.02 0.00 0.00 32.46 29.41 2dkw n ARG 94 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2dkw h HIS 95 N 0.00 -0.30 -0.35 -1.55 2.76 -1.18 -2.59 115.15 111.93 2dkw h HIS 95 Ca 0.80 -0.01 0.08 0.00 -2.20 0.00 0.00 60.37 59.03 2dkw h HIS 95 Cb 2.43 0.10 -0.08 0.00 1.55 0.00 0.00 27.41 31.40 2dkw h HIS 95 CO -0.01 -0.04 -0.27 0.00 -1.30 0.00 0.00 177.93 176.31 2dkw h ARG 96 N -1.03 -0.22 0.16 5.26 3.08 -0.42 -1.72 114.38 119.50 2dkw h ARG 96 Ca -0.03 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2dkw h ARG 96 Cb 0.39 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2dkw h ARG 96 CO 0.05 -0.15 -0.15 0.00 -1.07 0.00 0.00 179.97 178.66 2dkw h ALA 97 N 0.86 -0.88 -0.96 0.04 0.00 -0.93 -2.23 119.26 115.16 2dkw h ALA 97 Ca 0.17 -0.06 0.38 0.00 0.00 0.00 0.00 54.91 55.41 2dkw h ALA 97 Cb 0.50 0.38 -0.15 0.00 0.00 0.00 0.00 17.79 18.52 2dkw h ALA 97 CO -0.48 -0.89 0.55 0.00 0.00 0.00 0.00 179.25 178.43 2dkw h THR 99 N 0.00 0.34 -0.84 0.00 2.02 -0.75 -2.91 112.91 110.77 2dkw h THR 99 Ca 0.76 -0.20 0.33 0.00 0.77 0.00 0.00 66.41 68.06 2dkw h THR 99 Cb 2.11 0.41 -0.15 0.00 -1.74 0.00 0.00 68.15 68.79 2dkw h THR 99 CO -0.62 0.03 0.36 -0.11 0.37 0.00 0.00 175.52 175.55 2dkw n LEU 100 N -5.39 0.21 0.23 2.58 7.94 0.15 0.46 117.00 123.18 2dkw n LEU 100 Ca -0.12 1.41 -0.14 0.00 -1.11 0.00 0.00 56.01 56.04 2dkw n LEU 100 Cb 0.35 -0.65 -0.08 0.00 0.53 0.00 0.00 43.42 43.57 2dkw n LEU 100 CO 0.34 -1.54 0.52 0.50 -1.11 0.00 0.00 177.39 176.10 2dkw h LYS 101 N 0.00 -0.58 0.10 1.96 3.64 -1.42 -2.21 116.57 118.06 2dkw h LYS 101 Ca 0.67 0.04 0.02 0.00 -1.27 0.00 0.00 60.65 60.11 2dkw h LYS 101 Cb 1.71 0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 33.63 2dkw h LYS 101 CO -0.68 -0.28 -0.25 -0.44 -2.27 0.00 0.00 179.45 175.53 2dkw h ASP 102 N -0.89 -0.72 -0.18 4.20 3.32 0.18 -0.90 116.42 121.42 2dkw h ASP 102 Ca -0.06 0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.11 2dkw h ASP 102 Cb 0.57 0.28 -0.07 0.00 0.22 0.00 0.00 39.33 40.33 2dkw h ASP 102 CO 0.10 -0.34 -0.54 0.74 -1.72 0.00 0.00 179.24 177.48 2dkw h THR 103 N -0.45 0.01 0.05 0.35 2.02 -0.77 0.17 112.91 114.30 2dkw h THR 103 Ca 0.03 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 2dkw h THR 103 Cb 0.48 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 2dkw h THR 103 CO -0.16 0.00 -0.09 0.00 0.37 0.00 0.00 175.52 175.64 2dkw h ALA 104 N -0.21 -0.72 -0.97 6.16 0.00 -1.24 0.12 119.26 122.39 2dkw h ALA 104 Ca 0.04 -0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.20 2dkw h ALA 104 Cb 0.67 0.44 -0.18 0.00 0.00 0.00 0.00 17.79 18.71 2dkw h ALA 104 CO -0.46 -0.74 0.06 0.45 0.00 0.00 0.00 179.25 178.56 2dkw h HIS 105 N -0.15 0.01 0.04 0.00 -0.00 -1.04 0.41 115.15 114.40 2dkw h HIS 105 Ca -0.01 0.07 -0.00 0.00 -0.00 0.00 0.00 60.37 60.43 2dkw h HIS 105 Cb 0.14 0.16 0.00 0.00 -0.00 0.00 0.00 27.41 27.71 2dkw h HIS 105 CO -0.21 -0.42 -0.02 0.00 -0.00 0.00 0.00 177.93 177.28 2dkw h ALA 106 N 1.96 -0.05 -0.79 2.45 0.00 -0.21 0.15 119.26 122.77 2dkw h ALA 106 Ca 0.60 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.52 2dkw h ALA 106 Cb 1.25 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.01 2dkw h ALA 106 CO -0.89 -0.49 0.52 0.82 0.00 0.00 0.00 179.25 179.21 2dkw h ILE 107 N -0.13 1.06 0.02 0.00 2.04 0.24 0.37 117.51 121.12 2dkw h ILE 107 Ca -0.00 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 2dkw h ILE 107 Cb 0.11 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 2dkw h ILE 107 CO 0.01 0.16 -0.01 0.40 0.00 0.00 0.00 178.15 178.71 2dkw h ILE 108 N 0.89 1.40 -0.86 -0.67 1.08 -0.51 -0.41 117.51 118.42 2dkw h ILE 108 Ca 0.34 -1.39 0.06 0.00 -0.39 0.00 0.00 64.86 63.48 2dkw h ILE 108 Cb 0.19 2.31 -0.06 0.00 -3.07 0.00 0.00 36.82 36.20 2dkw h ILE 108 CO -0.11 0.35 0.56 0.00 -0.69 0.00 0.00 178.15 178.26 2dkw h ALA 109 N 0.29 1.55 0.31 1.87 0.00 -0.41 0.76 119.26 123.63 2dkw h ALA 109 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2dkw h ALA 109 Cb 0.60 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2dkw h ALA 109 CO 0.01 0.32 -0.15 0.00 0.00 0.00 0.00 179.25 179.43 2dkw h ALA 110 N 1.53 -0.41 0.84 0.00 0.00 -0.96 -3.38 119.26 116.87 2dkw h ALA 110 Ca 0.37 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2dkw h ALA 110 Cb 0.20 0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.16 2dkw h ALA 110 CO -0.13 -0.38 -0.40 0.93 0.00 0.00 0.00 179.25 179.26 2dkw h GLU 111 N -1.11 -1.08 -6.32 0.00 5.08 -0.99 -3.44 114.58 106.73 2dkw h GLU 111 Ca -0.04 0.07 -0.60 0.00 -1.00 0.00 0.00 59.36 57.79 2dkw h GLU 111 Cb 0.33 0.25 0.15 0.00 0.50 0.00 0.00 28.75 29.97 2dkw h GLU 111 CO 0.07 -0.72 -0.46 -0.11 -1.00 0.00 0.00 179.01 176.79 2dkw n LEU 112 N -5.28 -0.23 -4.46 1.33 7.94 0.26 -4.99 117.00 111.58 2dkw n LEU 112 Ca -0.14 0.87 -0.30 0.00 -1.11 0.00 0.00 56.01 55.33 2dkw n LEU 112 Cb 0.44 -1.10 -0.12 0.00 0.53 0.00 0.00 43.42 43.17 2dkw n LEU 112 CO 0.34 -3.05 -0.50 -1.81 -1.11 0.00 0.00 177.39 171.25 2dkw s ASP 113 N -0.98 3.76 0.00 1.96 1.01 -1.26 -4.80 116.67 116.35 2dkw s ASP 113 Ca 0.63 -0.52 0.15 0.00 0.71 0.00 0.00 52.55 53.52 2dkw s ASP 113 Cb -0.58 -0.53 0.73 0.00 1.01 0.00 0.00 42.92 43.55 2dkw s ASP 113 CO 0.58 0.21 1.41 -0.81 0.21 0.00 0.00 175.17 176.78 2dkw n PRO 114 N 1.17 0.18 -0.09 8.23 -0.04 -1.26 -1.74 135.00 141.44 2dkw n PRO 114 Ca -0.16 0.16 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 2dkw n PRO 114 Cb 0.52 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.36 2dkw n PRO 114 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2dkw n GLU 115 N -1.32 0.94 0.10 0.54 1.02 -1.26 -4.30 120.64 116.36 2dkw n GLU 115 Ca 0.06 0.04 -0.22 0.00 -0.02 0.00 0.00 57.16 57.03 2dkw n GLU 115 Cb 0.12 -1.44 -0.13 0.00 -0.02 0.00 0.00 31.44 29.97 2dkw n GLU 115 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2dkw h PHE 116 N 0.00 0.97 -0.55 -0.32 3.57 -1.92 -3.31 116.94 115.38 2dkw h PHE 116 Ca -0.48 -0.62 0.07 0.00 3.53 0.00 0.00 57.97 60.47 2dkw h PHE 116 Cb 1.95 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 40.56 2dkw h PHE 116 CO 0.01 1.46 0.24 -0.97 -2.23 0.00 0.00 178.31 176.82 2dkw h ASN 117 N 0.26 0.30 -0.09 0.41 -1.24 -1.58 0.75 115.58 114.38 2dkw h ASN 117 Ca -0.19 0.05 0.03 0.00 0.71 0.00 0.00 56.30 56.90 2dkw h ASN 117 Cb 1.93 0.01 -0.00 0.00 0.73 0.00 0.00 38.32 40.98 2dkw h ASN 117 CO 0.24 0.20 0.14 0.11 -1.29 0.00 0.00 177.43 176.83 2dkw h LYS 118 N 0.45 0.00 0.00 6.67 1.57 -1.75 -2.20 116.57 121.32 2dkw h LYS 118 Ca 0.26 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 2dkw h LYS 118 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 2dkw h LYS 118 CO -0.22 0.00 -0.24 -0.07 -0.57 0.00 0.00 179.45 178.35 2dkw h LEU 119 N 0.00 0.00 -1.73 2.94 3.38 -1.00 -2.51 115.31 116.39 2dkw h LEU 119 Ca 0.04 -0.09 0.38 0.00 0.09 0.00 0.00 57.88 58.31 2dkw h LEU 119 Cb 0.33 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.00 2dkw h LEU 119 CO -0.00 0.67 0.91 0.00 0.09 0.00 0.00 178.44 180.11 2dkw h GLU 121 N 0.11 0.00 -0.89 0.00 4.11 -1.54 -3.34 114.58 113.04 2dkw h GLU 121 Ca 0.69 0.00 0.22 0.00 0.07 0.00 0.00 59.36 60.34 2dkw h GLU 121 Cb 2.41 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 31.61 2dkw h GLU 121 CO -0.16 0.50 0.60 1.49 0.07 0.00 0.00 179.01 181.52 2dkw h GLU 122 N 0.00 0.23 -0.03 1.06 4.81 0.16 0.26 114.58 121.07 2dkw h GLU 122 Ca -0.15 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 58.88 2dkw h GLU 122 Cb 1.72 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 31.03 2dkw h GLU 122 CO 0.07 0.16 -0.77 0.82 -0.73 0.00 0.00 179.01 178.55 2dkw h ILE 123 N 0.24 1.44 -0.81 2.32 2.04 -1.61 -2.28 117.51 118.84 2dkw h ILE 123 Ca 0.45 -2.34 0.20 0.00 1.00 0.00 0.00 64.86 64.17 2dkw h ILE 123 Cb 1.37 2.26 -0.14 0.00 -0.74 0.00 0.00 36.82 39.57 2dkw h ILE 123 CO -0.11 0.69 0.09 0.50 0.00 0.00 0.00 178.15 179.31 2dkw h LYS 124 N 0.17 0.14 0.01 2.37 3.64 -0.64 -2.62 116.57 119.63 2dkw h LYS 124 Ca -0.03 -0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 59.17 2dkw h LYS 124 Cb 1.36 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 2dkw h LYS 124 CO 0.12 0.09 -0.90 0.93 -2.27 0.00 0.00 179.45 177.42 2dkw h GLU 125 N 0.14 0.01 -3.65 1.90 5.08 -1.59 -3.45 114.58 113.01 2dkw h GLU 125 Ca 0.47 -0.02 -0.54 0.00 -1.00 0.00 0.00 59.36 58.28 2dkw h GLU 125 Cb 0.88 0.01 -0.40 0.00 0.50 0.00 0.00 28.75 29.74 2dkw h GLU 125 CO -0.67 1.01 -0.77 0.45 -1.00 0.00 0.00 179.01 178.03 2dkw s SER 126 N -6.68 3.19 0.00 1.42 0.15 -0.86 -5.03 113.70 105.90 2dkw s SER 126 Ca -0.26 -0.98 0.00 0.00 0.70 0.00 0.00 55.95 55.42 2dkw s SER 126 Cb 0.03 -0.71 0.00 0.00 -1.71 0.00 0.00 66.02 63.63 2dkw s SER 126 CO 0.63 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.37 2dkw n GLY 127 N 4.97 -1.80 3.62 9.45 0.00 -1.07 -3.72 105.19 116.65 2dkw n GLY 127 Ca -0.09 0.95 -0.43 0.00 0.00 0.00 0.00 46.02 46.45 2dkw n GLY 127 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dkw s PRO 128 N 0.00 3.71 -0.89 1.61 0.04 -1.26 -4.89 135.00 133.32 2dkw s PRO 128 Ca 0.00 1.58 -0.25 0.00 0.04 0.00 0.00 61.00 62.37 2dkw s PRO 128 Cb 0.00 -4.06 0.04 0.00 0.04 0.00 0.00 34.50 30.52 2dkw s PRO 128 CO 0.00 -1.40 1.36 0.45 0.04 0.00 0.00 177.00 177.45 2dkw s SER 129 N 4.51 6.35 0.32 6.66 0.15 -1.26 -4.77 113.70 125.66 2dkw s SER 129 Ca 0.72 -1.00 -0.28 0.00 0.70 0.00 0.00 55.95 56.08 2dkw s SER 129 Cb -0.24 -2.56 -0.10 0.00 -1.71 0.00 0.00 66.02 61.41 2dkw s SER 129 CO 0.30 -1.65 1.20 -0.55 1.20 0.00 0.00 173.24 173.74 2dkw s SER 130 N 4.39 6.93 0.00 5.45 0.15 -1.26 -5.17 113.70 124.19 2dkw s SER 130 Ca 0.41 2.46 0.00 0.00 0.70 0.00 0.00 55.95 59.51 2dkw s SER 130 Cb -0.04 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2dkw s SER 130 CO 0.01 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.66