#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kdc n ASN 2 N 0.00 0.00 -2.70 0.00 5.15 -1.26 -3.27 115.26 113.18 2kdc n ASN 2 Ca 0.00 0.25 -0.07 0.00 -0.60 0.00 0.00 54.58 54.16 2kdc n ASN 2 Cb 0.00 -0.31 0.09 0.00 -0.53 0.00 0.00 39.78 39.03 2kdc n ASN 2 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 2kdc n ASN 3 N -1.31 -1.88 -4.53 1.20 0.23 -1.26 -5.07 115.26 102.64 2kdc n ASN 3 Ca 0.02 -2.77 -0.13 0.00 -0.53 0.00 0.00 54.58 51.17 2kdc n ASN 3 Cb 0.04 1.41 -0.10 0.00 -2.08 0.00 0.00 39.78 39.06 2kdc n ASN 3 CO 0.00 0.00 0.00 0.41 -0.93 0.00 0.00 177.26 176.74 2kdc n THR 4 N -0.02 0.00 0.00 5.53 -1.04 -1.20 -3.35 114.28 114.20 2kdc n THR 4 Ca -0.03 -0.32 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 2kdc n THR 4 Cb 0.75 -1.70 0.00 0.00 -1.82 0.00 0.00 70.33 67.56 2kdc n THR 4 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2kdc n THR 5 N 8.37 0.00 0.67 12.58 -1.04 -1.26 -4.90 114.28 128.70 2kdc n THR 5 Ca 0.43 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.56 2kdc n THR 5 Cb 0.42 0.00 0.46 0.00 -1.82 0.00 0.00 70.33 69.39 2kdc n THR 5 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kdc n GLY 6 N -0.98 -1.33 0.27 3.41 0.00 -1.21 -3.02 105.19 102.32 2kdc n GLY 6 Ca 0.00 -0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.08 2kdc n GLY 6 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2kdc h PHE 7 N 0.00 0.00 -0.94 1.61 -1.00 -1.90 -1.39 116.94 113.32 2kdc h PHE 7 Ca 0.00 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.79 2kdc h PHE 7 Cb 0.43 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.94 2kdc h PHE 7 CO 0.00 0.00 0.62 0.00 -1.61 0.00 0.00 178.31 177.32 2kdc h THR 8 N 0.00 1.22 -0.40 -1.55 1.03 -1.95 -1.40 112.91 109.86 2kdc h THR 8 Ca -0.00 -0.43 -0.14 0.00 -0.01 0.00 0.00 66.41 65.83 2kdc h THR 8 Cb 0.00 -0.14 -0.01 0.00 -1.07 0.00 0.00 68.15 66.94 2kdc h THR 8 CO 0.00 0.23 -0.31 -0.09 -0.01 0.00 0.00 175.52 175.34 2kdc h ARG 9 N 1.25 0.92 0.01 0.00 9.65 -1.49 0.28 114.38 125.01 2kdc h ARG 9 Ca 0.35 -0.45 -0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2kdc h ARG 9 Cb -0.12 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.46 2kdc h ARG 9 CO -0.08 1.11 -0.01 0.82 2.80 0.00 0.00 179.97 184.61 2kdc h ILE 10 N 0.74 1.04 -0.22 1.20 1.08 -1.29 1.33 117.51 121.39 2kdc h ILE 10 Ca 0.07 -0.16 -0.18 0.00 -0.39 0.00 0.00 64.86 64.20 2kdc h ILE 10 Cb 0.90 1.15 0.00 0.00 -3.07 0.00 0.00 36.82 35.80 2kdc h ILE 10 CO 0.08 0.04 -0.56 0.16 -0.69 0.00 0.00 178.15 177.18 2kdc h ILE 11 N -0.09 1.29 -0.37 -0.67 3.07 -1.29 -2.82 117.51 116.64 2kdc h ILE 11 Ca -0.00 -1.77 -0.08 0.00 1.55 0.00 0.00 64.86 64.56 2kdc h ILE 11 Cb 0.08 1.82 -0.02 0.00 -0.27 0.00 0.00 36.82 38.43 2kdc h ILE 11 CO 0.00 0.56 -0.12 0.50 -1.05 0.00 0.00 178.15 178.04 2kdc h LYS 12 N 0.50 0.64 -0.18 0.16 3.64 -0.32 -2.45 116.57 118.57 2kdc h LYS 12 Ca -0.01 -0.20 -0.04 0.00 -1.27 0.00 0.00 60.65 59.13 2kdc h LYS 12 Cb 1.18 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 2kdc h LYS 12 CO 0.12 0.75 -0.05 0.00 -2.27 0.00 0.00 179.45 178.00 2kdc h ALA 13 N 1.28 1.58 0.00 5.00 0.00 0.18 -1.32 119.26 125.98 2kdc h ALA 13 Ca 0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2kdc h ALA 13 Cb 0.55 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2kdc h ALA 13 CO 0.03 0.31 -0.04 0.00 0.00 0.00 0.00 179.25 179.56 2kdc h ALA 14 N 1.69 1.23 0.00 0.00 0.00 -1.18 -3.45 119.26 117.56 2kdc h ALA 14 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2kdc h ALA 14 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2kdc h ALA 14 CO 0.01 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.72 2kdc n GLY 15 N -0.93 0.00 1.92 0.00 0.00 -0.50 -3.08 105.19 102.61 2kdc n GLY 15 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2kdc n GLY 15 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2kdc n TYR 16 N -2.01 -1.58 -0.33 1.61 4.02 -1.26 -4.71 117.16 112.90 2kdc n TYR 16 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.86 2kdc n TYR 16 Cb 0.49 -0.94 0.09 0.00 -0.02 0.00 0.00 39.34 38.96 2kdc n TYR 16 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 2kdc h SER 17 N 0.00 1.05 -0.99 7.72 0.02 -1.95 -1.99 113.55 117.41 2kdc h SER 17 Ca 0.00 -0.05 0.22 0.00 -0.84 0.00 0.00 61.79 61.12 2kdc h SER 17 Cb 0.64 -0.26 -0.09 0.00 0.14 0.00 0.00 62.40 62.83 2kdc h SER 17 CO 0.00 0.78 0.63 -0.25 -1.14 0.00 0.00 176.83 176.85 2kdc h TRP 18 N 1.21 0.80 -0.39 3.45 7.01 -1.84 0.32 115.95 126.52 2kdc h TRP 18 Ca 0.32 0.03 -0.10 0.00 2.11 0.00 0.00 58.89 61.25 2kdc h TRP 18 Cb -0.09 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 26.71 2kdc h TRP 18 CO -0.00 0.15 -0.16 -0.22 -2.79 0.00 0.00 178.44 175.41 2kdc h LYS 19 N 0.55 0.72 -0.34 2.65 3.64 -1.73 -2.58 116.57 119.48 2kdc h LYS 19 Ca 0.56 -0.26 0.10 0.00 -1.27 0.00 0.00 60.65 59.78 2kdc h LYS 19 Cb 1.17 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 2kdc h LYS 19 CO -0.30 0.85 0.27 0.78 -2.27 0.00 0.00 179.45 178.77 2kdc h GLY 20 N 0.98 0.00 1.29 5.01 0.00 -0.28 0.10 103.07 110.16 2kdc h GLY 20 Ca 0.10 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.37 2kdc h GLY 20 CO 0.04 0.00 0.08 1.41 0.00 0.00 0.00 176.54 178.08 2kdc h LEU 21 N 0.00 0.83 -0.51 3.11 3.38 -1.31 0.13 115.31 120.94 2kdc h LEU 21 Ca 0.16 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2kdc h LEU 21 Cb 0.70 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2kdc h LEU 21 CO -0.00 0.85 -0.21 0.03 0.09 0.00 0.00 178.44 179.19 2kdc h ARG 22 N 0.83 0.99 -0.13 1.13 2.47 -1.08 -1.63 114.38 116.97 2kdc h ARG 22 Ca 0.17 -0.42 -0.17 0.00 -1.26 0.00 0.00 59.98 58.31 2kdc h ARG 22 Cb 0.38 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 2kdc h ARG 22 CO 0.01 1.09 -0.62 0.00 0.56 0.00 0.00 179.97 181.01 2kdc h ALA 23 N 0.89 0.69 -0.02 0.04 0.00 -1.23 -3.07 119.26 116.56 2kdc h ALA 23 Ca 0.11 -0.55 -0.11 0.00 0.00 0.00 0.00 54.91 54.36 2kdc h ALA 23 Cb 0.79 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2kdc h ALA 23 CO 0.07 0.72 -0.50 0.00 0.00 0.00 0.00 179.25 179.53 2kdc h ALA 24 N 1.00 1.14 -0.03 0.00 0.00 -0.62 -2.77 119.26 117.99 2kdc h ALA 24 Ca -0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2kdc h ALA 24 Cb 1.16 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 2kdc h ALA 24 CO 0.11 0.63 0.00 2.35 0.00 0.00 0.00 179.25 182.34 2kdc h TRP 25 N 0.03 0.06 0.00 0.00 7.01 -1.21 -2.61 115.95 119.23 2kdc h TRP 25 Ca -0.00 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 2kdc h TRP 25 Cb 0.89 -0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 27.94 2kdc h TRP 25 CO 0.00 0.34 -0.05 -0.84 -2.79 0.00 0.00 178.44 175.10 2kdc h ILE 26 N -0.24 0.20 -1.13 2.65 3.07 -1.53 0.37 117.51 120.90 2kdc h ILE 26 Ca 0.01 -0.39 -0.64 0.00 1.55 0.00 0.00 64.86 65.38 2kdc h ILE 26 Cb 0.32 1.32 -0.35 0.00 -0.27 0.00 0.00 36.82 37.84 2kdc h ILE 26 CO 0.00 0.05 0.19 -3.20 -1.05 0.00 0.00 178.15 174.14 2kdc n ASN 27 N -3.28 6.48 0.00 2.16 4.05 -1.01 -4.49 115.26 119.17 2kdc n ASN 27 Ca -0.01 -3.78 0.00 0.00 0.45 0.00 0.00 54.58 51.24 2kdc n ASN 27 Cb 0.22 -0.73 0.00 0.00 1.23 0.00 0.00 39.78 40.50 2kdc n ASN 27 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 2kdc n GLU 28 N -0.75 0.00 0.00 1.20 2.13 -0.97 -4.92 120.64 117.34 2kdc n GLU 28 Ca 0.53 0.00 0.05 0.00 0.66 0.00 0.00 57.16 58.40 2kdc n GLU 28 Cb 0.69 0.00 0.31 0.00 0.27 0.00 0.00 31.44 32.72 2kdc n GLU 28 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2kdc n ALA 29 N -3.00 2.16 -0.54 4.31 0.00 -0.95 -3.93 120.51 118.55 2kdc n ALA 29 Ca 0.00 -0.07 0.44 0.00 0.00 0.00 0.00 53.44 53.81 2kdc n ALA 29 Cb 0.00 -1.17 0.73 0.00 0.00 0.00 0.00 19.45 19.01 2kdc n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kdc h ALA 30 N 2.74 3.22 0.00 0.00 0.00 -0.49 1.52 119.26 126.26 2kdc h ALA 30 Ca 0.00 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 2kdc h ALA 30 Cb 0.00 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2kdc h ALA 30 CO 0.00 -1.82 -0.96 0.35 0.00 0.00 0.00 179.25 176.82 2kdc h PHE 31 N 0.03 0.01 0.00 0.00 3.04 -1.86 -3.35 116.94 114.81 2kdc h PHE 31 Ca 0.86 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.79 2kdc h PHE 31 Cb 3.06 -0.00 -0.00 0.00 2.56 0.00 0.00 35.95 41.57 2kdc h PHE 31 CO -0.00 1.38 -0.08 0.00 -2.02 0.00 0.00 178.31 177.59 2kdc h ARG 32 N -0.98 0.00 0.72 1.11 -0.00 -1.09 -2.67 114.38 111.46 2kdc h ARG 32 Ca -0.26 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.18 2kdc h ARG 32 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.22 2kdc h ARG 32 CO -0.15 0.08 -0.37 0.37 0.00 0.00 0.00 179.97 179.89 2kdc h GLN 33 N 0.00 -0.96 -1.03 0.04 5.75 0.19 0.21 115.11 119.31 2kdc h GLN 33 Ca -0.00 0.07 0.30 0.00 -0.15 0.00 0.00 58.65 58.86 2kdc h GLN 33 Cb 0.22 0.22 -0.04 0.00 1.07 0.00 0.00 27.48 28.95 2kdc h GLN 33 CO 0.01 -0.64 1.14 0.93 -2.65 0.00 0.00 178.83 177.62 2kdc h GLU 34 N -1.00 0.00 0.02 1.69 4.39 -1.60 0.48 114.58 118.55 2kdc h GLU 34 Ca -0.10 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.32 2kdc h GLU 34 Cb 0.78 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.39 2kdc h GLU 34 CO 0.14 0.00 -1.56 0.41 -1.16 0.00 0.00 179.01 176.84 2kdc n GLY 35 N -1.71 -0.74 0.38 -3.84 0.00 -0.49 -3.99 105.19 94.78 2kdc n GLY 35 Ca 0.23 0.03 0.15 0.00 0.00 0.00 0.00 46.02 46.43 2kdc n GLY 35 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2kdc h VAL 36 N -0.85 0.81 0.00 1.61 2.07 0.30 -2.97 116.25 117.22 2kdc h VAL 36 Ca -0.42 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2kdc h VAL 36 Cb 1.45 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2kdc h VAL 36 CO -0.21 0.07 0.00 0.00 0.02 0.00 0.00 177.57 177.46 2kdc n ALA 37 N -2.52 -0.33 0.24 1.67 0.00 0.03 -1.06 120.51 118.54 2kdc n ALA 37 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2kdc n ALA 37 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 2kdc n ALA 37 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2kdc n VAL 38 N -1.69 0.00 -0.07 0.00 3.14 -1.16 0.27 118.33 118.82 2kdc n VAL 38 Ca 0.00 0.85 -0.22 0.00 -2.96 0.00 0.00 64.34 62.01 2kdc n VAL 38 Cb 0.00 -1.83 -0.12 0.00 -1.06 0.00 0.00 33.84 30.83 2kdc n VAL 38 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 2kdc n LEU 39 N -2.06 2.09 0.02 6.55 7.94 -1.08 -2.99 117.00 127.47 2kdc n LEU 39 Ca 0.00 0.36 -0.05 0.00 -1.11 0.00 0.00 56.01 55.20 2kdc n LEU 39 Cb 0.85 -1.01 0.15 0.00 0.53 0.00 0.00 43.42 43.94 2kdc n LEU 39 CO 0.00 0.46 0.63 -0.07 -1.11 0.00 0.00 177.39 177.30 2kdc h LEU 40 N -0.69 0.48 0.36 -1.96 3.38 0.54 -2.55 115.31 114.88 2kdc h LEU 40 Ca -0.38 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.36 2kdc h LEU 40 Cb 1.53 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.15 2kdc h LEU 40 CO -0.13 0.82 -0.17 0.00 0.09 0.00 0.00 178.44 179.05 2kdc h ALA 41 N 1.20 -0.54 -1.04 1.53 0.00 -0.04 -3.21 119.26 117.17 2kdc h ALA 41 Ca 0.04 -0.11 0.28 0.00 0.00 0.00 0.00 54.91 55.12 2kdc h ALA 41 Cb 0.84 0.19 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 2kdc h ALA 41 CO 0.07 -0.50 0.64 -0.39 0.00 0.00 0.00 179.25 179.07 2kdc h VAL 42 N -0.99 0.47 -0.74 0.00 -1.51 -1.61 0.60 116.25 112.46 2kdc h VAL 42 Ca -0.05 -0.15 0.09 0.00 -1.23 0.00 0.00 66.70 65.36 2kdc h VAL 42 Cb 0.37 -0.00 -0.07 0.00 -2.13 0.00 0.00 31.29 29.46 2kdc h VAL 42 CO 0.08 0.08 0.40 0.58 -1.23 0.00 0.00 177.57 177.48 2kdc h VAL 43 N 0.43 0.89 -0.02 7.19 2.07 -1.51 0.59 116.25 125.90 2kdc h VAL 43 Ca 0.65 -0.23 -0.06 0.00 0.82 0.00 0.00 66.70 67.87 2kdc h VAL 43 Cb 1.50 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2kdc h VAL 43 CO -0.41 0.12 -0.22 0.40 0.02 0.00 0.00 177.57 177.48 2kdc h ILE 44 N 0.68 1.52 -0.97 4.57 2.04 0.05 -3.01 117.51 122.38 2kdc h ILE 44 Ca 0.35 -1.83 0.13 0.00 1.00 0.00 0.00 64.86 64.51 2kdc h ILE 44 Cb 0.33 2.64 -0.08 0.00 -0.74 0.00 0.00 36.82 38.97 2kdc h ILE 44 CO -0.24 0.50 0.61 0.00 0.00 0.00 0.00 178.15 179.02 2kdc h ALA 45 N 0.31 1.61 -0.15 1.87 0.00 -0.30 -0.94 119.26 121.66 2kdc h ALA 45 Ca -0.02 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2kdc h ALA 45 Cb 0.94 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2kdc h ALA 45 CO 0.04 0.14 0.09 0.00 0.00 0.00 0.00 179.25 179.52 2kdc h TRP 47 N 0.17 0.00 0.00 0.00 2.91 -1.03 -3.33 115.95 114.67 2kdc h TRP 47 Ca 0.05 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.07 2kdc h TRP 47 Cb 0.02 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.67 2kdc h TRP 47 CO -0.06 0.00 0.00 1.28 -1.03 0.00 0.00 178.44 178.63 2kdc n LEU 48 N -2.37 0.00 -4.56 0.65 4.77 -0.23 -5.09 117.00 110.17 2kdc n LEU 48 Ca -0.01 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.59 2kdc n LEU 48 Cb 0.49 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 2kdc n LEU 48 CO 0.07 0.00 1.43 1.51 -1.33 0.00 0.00 177.39 179.07 2kdc s ASP 49 N 0.00 6.15 -0.36 -1.43 -4.77 0.91 -4.66 116.67 112.50 2kdc s ASP 49 Ca 0.00 -1.17 0.04 0.00 -3.30 0.00 0.00 52.55 48.12 2kdc s ASP 49 Cb 0.00 -2.57 0.16 0.00 -1.09 0.00 0.00 42.92 39.43 2kdc s ASP 49 CO 0.00 -1.83 0.45 -0.69 0.70 0.00 0.00 175.17 173.80 2kdc s VAL 50 N 6.26 -0.57 -0.00 2.11 1.01 -1.26 -5.10 120.40 122.84 2kdc s VAL 50 Ca 0.51 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.88 2kdc s VAL 50 Cb -0.02 -0.56 -0.00 0.00 0.00 0.00 0.00 36.38 35.79 2kdc s VAL 50 CO -0.06 -0.37 0.03 -1.81 0.00 0.00 0.00 175.10 172.90 2kdc s ASP 51 N 1.76 0.06 0.00 3.32 1.11 -1.26 -5.10 116.67 116.56 2kdc s ASP 51 Ca 0.15 -0.15 0.00 0.00 0.18 0.00 0.00 52.55 52.73 2kdc s ASP 51 Cb -0.12 0.12 0.00 0.00 1.07 0.00 0.00 42.92 43.99 2kdc s ASP 51 CO -0.10 -0.17 0.17 0.00 1.18 0.00 0.00 175.17 176.25 2kdc n ALA 52 N 2.31 -0.04 0.00 5.23 0.00 -1.26 -5.01 120.51 121.74 2kdc n ALA 52 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2kdc n ALA 52 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 2kdc n ALA 52 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2kdc n ILE 53 N -1.05 0.00 -0.45 0.00 3.06 -1.26 -4.95 119.36 114.71 2kdc n ILE 53 Ca 0.00 0.00 0.36 0.00 -2.50 0.00 0.00 62.75 60.61 2kdc n ILE 53 Cb 0.00 0.00 0.55 0.00 0.54 0.00 0.00 39.64 40.73 2kdc n ILE 53 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 2kdc n THR 54 N -0.62 0.00 -0.03 9.51 -1.04 -1.26 0.30 114.28 121.13 2kdc n THR 54 Ca 0.00 1.06 -0.16 0.00 -2.04 0.00 0.00 64.05 62.91 2kdc n THR 54 Cb 0.00 -1.79 -0.13 0.00 -1.82 0.00 0.00 70.33 66.59 2kdc n THR 54 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 2kdc h ARG 55 N 0.00 0.10 -0.22 -2.82 1.12 -1.98 -3.32 114.38 107.26 2kdc h ARG 55 Ca 0.63 -0.16 -0.17 0.00 -1.11 0.00 0.00 59.98 59.16 2kdc h ARG 55 Cb 2.66 0.06 -0.00 0.00 -0.01 0.00 0.00 29.97 32.67 2kdc h ARG 55 CO -0.01 1.05 -0.56 0.28 -3.11 0.00 0.00 179.97 177.62 2kdc h VAL 56 N -0.77 1.30 -0.62 0.20 2.07 0.41 -3.21 116.25 115.64 2kdc h VAL 56 Ca -0.04 -1.79 0.12 0.00 0.82 0.00 0.00 66.70 65.81 2kdc h VAL 56 Cb 1.17 1.73 -0.12 0.00 -1.52 0.00 0.00 31.29 32.56 2kdc h VAL 56 CO 0.05 0.57 -0.14 0.25 0.02 0.00 0.00 177.57 178.32 2kdc h LEU 57 N 0.52 -0.54 -0.81 2.57 6.46 0.09 0.53 115.31 124.13 2kdc h LEU 57 Ca 0.01 0.18 0.20 0.00 -0.12 0.00 0.00 57.88 58.15 2kdc h LEU 57 Cb 1.13 0.37 -0.13 0.00 -0.73 0.00 0.00 40.66 41.31 2kdc h LEU 57 CO 0.11 -0.20 0.19 -0.07 -0.62 0.00 0.00 178.44 177.86 2kdc h LEU 58 N 0.01 -0.03 -0.01 2.25 -0.00 -1.64 0.34 115.31 116.23 2kdc h LEU 58 Ca 0.30 0.18 -0.01 0.00 -0.00 0.00 0.00 57.88 58.35 2kdc h LEU 58 Cb 0.46 0.25 0.00 0.00 -0.00 0.00 0.00 40.66 41.37 2kdc h LEU 58 CO -0.62 -0.11 -0.03 0.40 -0.00 0.00 0.00 178.44 178.08 2kdc h ILE 59 N 0.23 1.46 -0.28 1.22 2.04 -0.40 -1.08 117.51 120.70 2kdc h ILE 59 Ca 0.48 -1.40 0.06 0.00 1.00 0.00 0.00 64.86 65.01 2kdc h ILE 59 Cb 0.90 2.38 -0.08 0.00 -0.74 0.00 0.00 36.82 39.28 2kdc h ILE 59 CO -0.60 0.37 -0.34 0.28 0.00 0.00 0.00 178.15 177.86 2kdc h SER 60 N -0.53 -1.11 0.68 1.72 0.02 0.15 0.69 113.55 115.17 2kdc h SER 60 Ca -0.00 0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 2kdc h SER 60 Cb 0.62 0.49 0.01 0.00 0.14 0.00 0.00 62.40 63.66 2kdc h SER 60 CO 0.01 -0.35 -0.33 0.77 -1.14 0.00 0.00 176.83 175.79 2kdc h SER 61 N -0.33 -0.77 -0.91 3.07 4.64 -0.48 -2.76 113.55 116.01 2kdc h SER 61 Ca 0.13 -0.01 0.26 0.00 -0.47 0.00 0.00 61.79 61.71 2kdc h SER 61 Cb 0.55 0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.81 2kdc h SER 61 CO -0.46 -0.44 0.70 0.58 -0.87 0.00 0.00 176.83 176.34 2kdc h VAL 62 N -1.11 0.45 -0.33 0.95 2.07 -0.93 0.76 116.25 118.12 2kdc h VAL 62 Ca -0.09 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.47 2kdc h VAL 62 Cb 0.73 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2kdc h VAL 62 CO 0.15 0.00 0.22 -0.03 0.02 0.00 0.00 177.57 177.93 2kdc h MET 63 N 0.00 0.26 -0.11 1.57 4.05 0.70 0.42 114.93 121.82 2kdc h MET 63 Ca 0.43 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.80 2kdc h MET 63 Cb 1.83 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 32.57 2kdc h MET 63 CO -0.00 0.17 -0.06 -0.07 0.23 0.00 0.00 176.91 177.18 2kdc h LEU 64 N 0.27 0.24 -0.80 3.39 3.38 0.50 -0.80 115.31 121.48 2kdc h LEU 64 Ca 0.14 -0.42 -0.09 0.00 0.09 0.00 0.00 57.88 57.59 2kdc h LEU 64 Cb 0.22 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2kdc h LEU 64 CO -0.03 0.61 -0.08 0.58 0.09 0.00 0.00 178.44 179.61 2kdc h VAL 65 N -0.14 1.26 -0.19 1.22 2.07 -1.26 -2.63 116.25 116.59 2kdc h VAL 65 Ca 0.02 -1.14 -0.08 0.00 0.82 0.00 0.00 66.70 66.32 2kdc h VAL 65 Cb 0.52 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 2kdc h VAL 65 CO 0.02 0.40 -0.25 0.24 0.02 0.00 0.00 177.57 178.00 2kdc h MET 66 N 0.75 0.34 -1.00 1.57 2.86 -0.16 -2.65 114.93 116.64 2kdc h MET 66 Ca 0.13 -0.12 0.26 0.00 -2.06 0.00 0.00 59.70 57.92 2kdc h MET 66 Cb 0.56 -0.03 -0.13 0.00 0.06 0.00 0.00 31.60 32.07 2kdc h MET 66 CO 0.03 0.57 0.59 0.97 1.06 0.00 0.00 176.91 180.14 2kdc h ILE 67 N 0.31 0.48 0.00 -1.22 6.09 -0.74 1.50 117.51 123.93 2kdc h ILE 67 Ca 0.05 -0.18 -0.03 0.00 -1.37 0.00 0.00 64.86 63.33 2kdc h ILE 67 Cb 0.60 -0.09 -0.00 0.00 0.47 0.00 0.00 36.82 37.80 2kdc h ILE 67 CO 0.04 0.10 -1.06 1.62 -3.07 0.00 0.00 178.15 175.78 2kdc h VAL 68 N 0.52 0.09 0.00 2.19 3.04 -1.61 -3.24 116.25 117.24 2kdc h VAL 68 Ca 0.67 -1.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 2kdc h VAL 68 Cb 1.33 1.60 0.00 0.00 -2.01 0.00 0.00 31.29 32.21 2kdc h VAL 68 CO -0.50 0.05 -0.46 1.21 -1.01 0.00 0.00 177.57 176.85 2kdc n GLU 69 N -2.72 0.36 0.37 4.17 2.13 0.12 -3.73 120.64 121.33 2kdc n GLU 69 Ca -0.02 0.40 -0.16 0.00 0.66 0.00 0.00 57.16 58.05 2kdc n GLU 69 Cb 0.60 -1.42 -0.08 0.00 0.27 0.00 0.00 31.44 30.81 2kdc n GLU 69 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2kdc h ILE 70 N -0.76 0.09 -0.86 6.31 2.04 0.16 -2.59 117.51 121.90 2kdc h ILE 70 Ca 0.00 -0.26 0.21 0.00 1.00 0.00 0.00 64.86 65.81 2kdc h ILE 70 Cb 0.46 0.12 -0.12 0.00 -0.74 0.00 0.00 36.82 36.55 2kdc h ILE 70 CO 0.00 0.01 0.33 0.25 0.00 0.00 0.00 178.15 178.75 2kdc h LEU 71 N -1.20 0.24 -0.08 1.44 5.85 -1.54 2.46 115.31 122.47 2kdc h LEU 71 Ca -0.10 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2kdc h LEU 71 Cb 0.76 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2kdc h LEU 71 CO 0.16 -0.02 0.00 -3.20 -0.34 0.00 0.00 178.44 175.05 2kdc n ASN 72 N -5.08 0.04 -0.09 1.25 5.15 -1.16 -0.17 115.26 115.20 2kdc n ASN 72 Ca 0.20 0.52 -0.17 0.00 -0.60 0.00 0.00 54.58 54.52 2kdc n ASN 72 Cb 0.61 -0.52 -0.09 0.00 -0.53 0.00 0.00 39.78 39.24 2kdc n ASN 72 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 2kdc h SER 73 N 0.00 0.00 0.10 1.20 0.87 0.45 -3.23 113.55 112.95 2kdc h SER 73 Ca 0.00 -0.40 -0.01 0.00 -1.23 0.00 0.00 61.79 60.16 2kdc h SER 73 Cb 0.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 2kdc h SER 73 CO 0.00 1.29 -0.05 0.00 -0.53 0.00 0.00 176.83 177.54 2kdc h ALA 74 N -0.60 -0.14 -1.02 6.23 0.00 -0.49 1.11 119.26 124.35 2kdc h ALA 74 Ca -0.25 -0.05 0.25 0.00 0.00 0.00 0.00 54.91 54.86 2kdc h ALA 74 Cb 1.09 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.82 2kdc h ALA 74 CO -0.15 -0.56 0.63 0.82 0.00 0.00 0.00 179.25 179.99 2kdc h ILE 75 N -0.18 0.54 0.00 0.00 5.03 -0.76 0.71 117.51 122.85 2kdc h ILE 75 Ca -0.01 -0.17 -0.10 0.00 -0.12 0.00 0.00 64.86 64.46 2kdc h ILE 75 Cb 0.14 -0.01 -0.02 0.00 -3.03 0.00 0.00 36.82 33.91 2kdc h ILE 75 CO 0.02 0.09 -0.88 -0.33 -0.68 0.00 0.00 178.15 176.38 2kdc h GLU 76 N 0.50 0.00 0.24 2.37 4.39 -1.33 -3.34 114.58 117.42 2kdc h GLU 76 Ca 0.62 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.31 2kdc h GLU 76 Cb 1.35 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.99 2kdc h GLU 76 CO -0.38 0.28 -0.19 0.00 -1.16 0.00 0.00 179.01 177.56 2kdc h ALA 77 N 1.61 -0.42 -0.63 3.43 0.00 0.76 1.44 119.26 125.46 2kdc h ALA 77 Ca -0.06 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 54.93 2kdc h ALA 77 Cb 1.35 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 2kdc h ALA 77 CO 0.04 -0.75 0.44 -0.24 0.00 0.00 0.00 179.25 178.73 2kdc h VAL 78 N -0.44 0.77 0.00 0.00 3.04 -1.51 0.66 116.25 118.78 2kdc h VAL 78 Ca -0.01 -0.07 -0.09 0.00 -1.01 0.00 0.00 66.70 65.51 2kdc h VAL 78 Cb 0.38 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.20 2kdc h VAL 78 CO -0.01 0.04 -0.56 0.58 -1.01 0.00 0.00 177.57 176.60 2kdc h VAL 79 N 0.20 0.64 0.00 1.51 2.07 -1.24 -3.43 116.25 116.01 2kdc h VAL 79 Ca 0.30 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.88 2kdc h VAL 79 Cb 0.91 2.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 2kdc h VAL 79 CO -0.06 0.37 0.00 0.47 0.02 0.00 0.00 177.57 178.37 2kdc n ASP 80 N -3.14 0.00 -0.07 0.57 8.00 0.48 -5.00 116.55 117.39 2kdc n ASP 80 Ca 0.01 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.40 2kdc n ASP 80 Cb 0.71 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.77 2kdc n ASP 80 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2kdc n ARG 81 N 0.00 0.44 0.00 -1.24 1.74 -1.05 -5.04 116.66 111.50 2kdc n ARG 81 Ca 0.00 0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 2kdc n ARG 81 Cb 0.00 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2kdc n ARG 81 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 2kdc n ILE 82 N -4.20 0.00 -4.74 0.55 0.13 -1.20 -4.93 119.36 104.97 2kdc n ILE 82 Ca -0.19 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.46 2kdc n ILE 82 Cb 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.31 2kdc n ILE 82 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2kdc n GLY 83 N 0.00 2.35 3.04 4.50 0.00 -1.26 -4.61 105.19 109.22 2kdc n GLY 83 Ca 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 46.02 45.63 2kdc n GLY 83 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2kdc n SER 84 N -0.34 -2.75 -4.58 1.61 3.41 -1.26 -4.39 113.62 105.33 2kdc n SER 84 Ca 0.00 0.35 -0.53 0.00 -0.26 0.00 0.00 58.87 58.43 2kdc n SER 84 Cb 0.00 -1.17 -0.07 0.00 -0.26 0.00 0.00 64.21 62.71 2kdc n SER 84 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2kdc n GLU 85 N -1.42 1.28 0.08 4.33 1.02 -1.26 -4.81 120.64 119.85 2kdc n GLU 85 Ca 0.00 0.42 0.13 0.00 -0.02 0.00 0.00 57.16 57.69 2kdc n GLU 85 Cb 0.15 -2.34 0.31 0.00 -0.02 0.00 0.00 31.44 29.54 2kdc n GLU 85 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2kdc n TYR 86 N 7.57 0.72 0.21 -0.32 4.19 -1.26 -4.19 117.16 124.08 2kdc n TYR 86 Ca 0.33 0.21 -0.12 0.00 3.31 0.00 0.00 57.90 61.62 2kdc n TYR 86 Cb 0.20 -0.79 -0.07 0.00 0.49 0.00 0.00 39.34 39.17 2kdc n TYR 86 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 2kdc h HIS 87 N 0.00 -0.95 -5.12 2.98 3.86 -1.96 -3.48 115.15 110.48 2kdc h HIS 87 Ca 0.00 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2kdc h HIS 87 Cb 0.72 0.36 -0.03 0.00 1.06 0.00 0.00 27.41 29.53 2kdc h HIS 87 CO 0.00 -0.46 -0.47 -1.91 0.86 0.00 0.00 177.93 175.95 2kdc n GLU 88 N -4.47 -2.19 0.00 2.45 2.13 -1.26 -4.95 120.64 112.36 2kdc n GLU 88 Ca -0.08 1.72 0.00 0.00 0.66 0.00 0.00 57.16 59.46 2kdc n GLU 88 Cb 0.32 -2.16 0.00 0.00 0.27 0.00 0.00 31.44 29.86 2kdc n GLU 88 CO 0.00 0.00 0.00 1.47 -0.41 0.00 0.00 177.13 178.19 2kdc n LEU 89 N 2.13 0.00 -0.93 4.31 -0.00 -1.26 -4.96 117.00 116.29 2kdc n LEU 89 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.92 2kdc n LEU 89 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.55 2kdc n LEU 89 CO 0.08 0.00 0.29 -1.20 -0.00 0.00 0.00 177.39 176.56 2kdc n SER 90 N -0.51 1.69 -1.15 1.45 7.64 -1.26 -4.93 113.62 116.54 2kdc n SER 90 Ca 0.00 -1.25 0.13 0.00 1.01 0.00 0.00 58.87 58.76 2kdc n SER 90 Cb 0.00 -0.31 -0.05 0.00 -1.01 0.00 0.00 64.21 62.84 2kdc n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kdc n GLY 91 N 0.62 -1.82 0.09 0.23 0.00 -1.26 -3.68 105.19 99.37 2kdc n GLY 91 Ca 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.26 2kdc n GLY 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2kdc h ARG 92 N -1.28 0.00 0.02 1.61 2.43 -2.01 -3.25 114.38 111.90 2kdc h ARG 92 Ca -0.07 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2kdc h ARG 92 Cb 1.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 2kdc h ARG 92 CO 0.03 0.60 -0.01 0.00 -1.51 0.00 0.00 179.97 179.09 2kdc h ALA 93 N 1.20 -0.03 0.00 2.80 0.00 -2.02 -2.56 119.26 118.66 2kdc h ALA 93 Ca -0.11 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2kdc h ALA 93 Cb 1.71 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 2kdc h ALA 93 CO 0.08 -0.49 -0.31 -0.22 0.00 0.00 0.00 179.25 178.32 2kdc h LYS 94 N -0.08 0.00 -1.00 0.00 3.64 -1.70 -3.12 116.57 114.32 2kdc h LYS 94 Ca -0.00 0.00 0.31 0.00 -1.27 0.00 0.00 60.65 59.69 2kdc h LYS 94 Cb 0.08 0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 31.71 2kdc h LYS 94 CO 0.00 0.31 0.15 0.22 -2.27 0.00 0.00 179.45 177.86 2kdc h ASP 95 N 0.00 -0.30 -0.10 4.20 1.82 -1.48 1.57 116.42 122.12 2kdc h ASP 95 Ca -0.00 0.28 -0.10 0.00 -0.39 0.00 0.00 57.03 56.82 2kdc h ASP 95 Cb 0.57 0.44 0.00 0.00 0.68 0.00 0.00 39.33 41.03 2kdc h ASP 95 CO 0.04 -0.38 -0.32 0.24 -1.61 0.00 0.00 179.24 177.20 2kdc h MET 96 N 0.00 0.40 -0.63 0.28 0.00 -1.65 -3.27 114.93 110.07 2kdc h MET 96 Ca 0.66 -0.30 -0.08 0.00 0.00 0.00 0.00 59.70 59.99 2kdc h MET 96 Cb 1.49 0.05 -0.02 0.00 0.00 0.00 0.00 31.60 33.11 2kdc h MET 96 CO -0.90 0.92 0.07 0.78 0.00 0.00 0.00 176.91 177.78 2kdc h GLY 97 N -0.03 1.15 -0.23 8.32 0.00 -0.18 -2.48 103.07 109.61 2kdc h GLY 97 Ca -0.01 -0.78 0.32 0.00 0.00 0.00 0.00 47.33 46.86 2kdc h GLY 97 CO 0.07 0.72 0.78 0.23 0.00 0.00 0.00 176.54 178.34 2kdc h SER 98 N 0.99 0.09 0.03 0.19 0.87 0.19 1.67 113.55 117.57 2kdc h SER 98 Ca 0.19 0.02 -0.20 0.00 -1.23 0.00 0.00 61.79 60.57 2kdc h SER 98 Cb 0.47 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2kdc h SER 98 CO 0.02 0.02 -1.08 0.00 -0.53 0.00 0.00 176.83 175.26 2kdc h ALA 99 N 1.47 0.21 0.00 6.23 0.00 -1.58 -3.35 119.26 122.24 2kdc h ALA 99 Ca 0.55 -1.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2kdc h ALA 99 Cb 2.03 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 20.37 2kdc h ALA 99 CO -0.07 0.62 -0.03 0.00 0.00 0.00 0.00 179.25 179.77 2kdc h ALA 100 N -0.29 1.07 0.31 0.00 0.00 -0.67 -2.95 119.26 116.73 2kdc h ALA 100 Ca -0.28 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2kdc h ALA 100 Cb 1.36 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2kdc h ALA 100 CO -0.11 0.04 -0.15 0.28 0.00 0.00 0.00 179.25 179.31 2kdc h VAL 101 N 0.00 0.00 -0.65 0.00 2.07 0.23 1.62 116.25 119.52 2kdc h VAL 101 Ca -0.00 -0.08 0.11 0.00 0.82 0.00 0.00 66.70 67.55 2kdc h VAL 101 Cb 0.28 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.97 2kdc h VAL 101 CO 0.00 0.00 0.22 -0.07 0.02 0.00 0.00 177.57 177.75 2kdc h LEU 102 N -0.49 0.18 -1.20 2.57 3.38 -1.70 0.32 115.31 118.38 2kdc h LEU 102 Ca -0.04 0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 2kdc h LEU 102 Cb 0.32 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2kdc h LEU 102 CO 0.07 0.10 -0.23 0.40 0.09 0.00 0.00 178.44 178.86 2kdc h ILE 103 N 0.38 0.60 -0.91 1.22 2.04 -1.53 -3.24 117.51 116.08 2kdc h ILE 103 Ca 0.34 -1.09 0.19 0.00 1.00 0.00 0.00 64.86 65.29 2kdc h ILE 103 Cb 0.47 1.73 -0.17 0.00 -0.74 0.00 0.00 36.82 38.11 2kdc h ILE 103 CO -0.36 0.23 -0.20 0.00 0.00 0.00 0.00 178.15 177.82 2kdc n ALA 104 N -2.24 0.25 -0.16 1.87 0.00 0.55 0.26 120.51 121.04 2kdc n ALA 104 Ca -0.00 0.99 -0.07 0.00 0.00 0.00 0.00 53.44 54.36 2kdc n ALA 104 Cb 0.41 -0.61 0.08 0.00 0.00 0.00 0.00 19.45 19.33 2kdc n ALA 104 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2kdc h ILE 105 N 0.00 1.26 0.18 0.00 2.04 -1.65 -2.75 117.51 116.60 2kdc h ILE 105 Ca 0.45 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 2kdc h ILE 105 Cb 0.71 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2kdc h ILE 105 CO -0.92 0.41 -0.09 0.40 0.00 0.00 0.00 178.15 177.94 2kdc h ILE 106 N 0.86 0.00 0.00 -0.67 2.04 0.34 -3.27 117.51 116.81 2kdc h ILE 106 Ca 0.15 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.39 2kdc h ILE 106 Cb 0.56 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 2kdc h ILE 106 CO 0.03 0.00 0.00 0.55 0.00 0.00 0.00 178.15 178.73 2kdc n VAL 107 N -4.40 0.00 -0.54 1.67 3.14 0.51 -0.33 118.33 118.37 2kdc n VAL 107 Ca -0.03 1.25 0.41 0.00 -2.96 0.00 0.00 64.34 63.00 2kdc n VAL 107 Cb 0.10 -2.00 0.63 0.00 -1.06 0.00 0.00 33.84 31.51 2kdc n VAL 107 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kdc n ALA 108 N -1.61 1.44 -0.70 1.55 0.00 -1.04 0.12 120.51 120.28 2kdc n ALA 108 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2kdc n ALA 108 Cb 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.57 2kdc n ALA 108 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2kdc n VAL 109 N -3.53 0.00 0.14 0.00 0.31 -0.62 -3.98 118.33 110.65 2kdc n VAL 109 Ca 0.34 0.15 0.19 0.00 -0.01 0.00 0.00 64.34 65.01 2kdc n VAL 109 Cb 1.54 -0.62 0.71 0.00 -0.91 0.00 0.00 33.84 34.55 2kdc n VAL 109 CO 0.00 0.00 0.00 0.16 -1.32 0.00 0.00 176.83 175.67 2kdc h ILE 110 N 0.00 0.22 0.20 2.52 -0.00 -0.01 -1.24 117.51 119.20 2kdc h ILE 110 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 64.86 64.86 2kdc h ILE 110 Cb 0.00 0.57 -0.01 0.00 -0.00 0.00 0.00 36.82 37.38 2kdc h ILE 110 CO 0.00 0.00 -0.16 0.74 -0.00 0.00 0.00 178.15 178.73 2kdc h THR 111 N 0.00 0.66 0.00 0.16 2.02 0.79 -1.64 112.91 114.90 2kdc h THR 111 Ca 0.16 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.22 2kdc h THR 111 Cb 1.18 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 2kdc h THR 111 CO -0.00 0.00 -0.57 -0.50 0.37 0.00 0.00 175.52 174.82 2kdc h TRP 112 N -0.37 0.00 0.71 3.16 6.55 -1.37 -2.87 115.95 121.76 2kdc h TRP 112 Ca -0.01 0.00 -0.03 0.00 0.95 0.00 0.00 58.89 59.80 2kdc h TRP 112 Cb 0.33 0.00 0.01 0.00 -0.86 0.00 0.00 29.16 28.63 2kdc h TRP 112 CO -0.11 0.57 -0.34 0.00 -1.05 0.00 0.00 178.44 177.51 2kdc h ILE 114 N -1.19 1.25 -0.39 0.00 1.08 -1.43 -2.26 117.51 114.57 2kdc h ILE 114 Ca -0.10 -0.95 0.09 0.00 -0.39 0.00 0.00 64.86 63.51 2kdc h ILE 114 Cb 0.75 0.84 -0.02 0.00 -3.07 0.00 0.00 36.82 35.32 2kdc h ILE 114 CO 0.16 0.34 0.27 -0.07 -0.69 0.00 0.00 178.15 178.16 2kdc h LEU 115 N 0.77 0.10 -0.74 1.44 -0.00 -1.57 0.11 115.31 115.42 2kdc h LEU 115 Ca 0.16 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.96 2kdc h LEU 115 Cb 0.41 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.02 2kdc h LEU 115 CO 0.01 0.06 -0.01 0.25 -0.00 0.00 0.00 178.44 178.76 2kdc h LEU 116 N 0.11 0.93 -2.48 1.67 5.85 -0.78 -2.03 115.31 118.58 2kdc h LEU 116 Ca 0.18 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2kdc h LEU 116 Cb 0.57 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 2kdc h LEU 116 CO -0.02 0.99 -0.02 -0.50 -0.34 0.00 0.00 178.44 178.54 2kdc h TRP 117 N 0.88 0.00 0.11 1.25 6.55 -0.65 -1.86 115.95 122.23 2kdc h TRP 117 Ca 0.16 0.00 -0.26 0.00 0.95 0.00 0.00 58.89 59.74 2kdc h TRP 117 Cb 0.52 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.82 2kdc h TRP 117 CO 0.03 0.02 -1.21 1.03 -1.05 0.00 0.00 178.44 177.27 2kdc h SER 118 N 0.00 0.36 0.37 -3.49 0.87 -1.19 -3.22 113.55 107.25 2kdc h SER 118 Ca -0.00 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 2kdc h SER 118 Cb 0.11 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 61.95 2kdc h SER 118 CO 0.00 1.30 0.00 1.12 -0.53 0.00 0.00 176.83 178.72 2kdc h HIS 119 N 0.06 0.00 -2.15 2.24 2.07 -1.16 -3.48 115.15 112.73 2kdc h HIS 119 Ca -0.12 0.00 0.23 0.00 -2.85 0.00 0.00 60.37 57.64 2kdc h HIS 119 Cb 1.94 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 31.85 2kdc h HIS 119 CO 0.05 0.00 -0.41 0.34 -3.07 0.00 0.00 177.93 174.84 2kdc n PHE 120 N -2.76 -2.22 -0.40 6.12 7.35 -1.22 -5.14 117.46 119.19 2kdc n PHE 120 Ca -0.01 1.13 0.00 0.00 -0.76 0.00 0.00 57.45 57.81 2kdc n PHE 120 Cb 0.15 -2.02 0.00 0.00 0.35 0.00 0.00 39.48 37.96 2kdc n PHE 120 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41