#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmd n MET 29 N 0.00 0.00 -0.05 -1.40 2.00 -1.26 -2.52 117.12 113.89 2kmd n MET 29 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 57.70 57.59 2kmd n MET 29 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.18 2kmd n MET 29 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 2kmd n GLU 30 N 0.00 0.25 -4.11 0.03 4.07 -1.26 -5.11 120.64 114.51 2kmd n GLU 30 Ca 0.00 0.11 -0.15 0.00 -0.06 0.00 0.00 57.16 57.06 2kmd n GLU 30 Cb 0.00 -0.92 -0.05 0.00 -0.06 0.00 0.00 31.44 30.41 2kmd n GLU 30 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2kmd h ALA 32 N 2.15 1.02 -3.38 0.00 0.00 -2.00 -1.67 119.26 115.37 2kmd h ALA 32 Ca -0.28 0.05 -0.55 0.00 0.00 0.00 0.00 54.91 54.13 2kmd h ALA 32 Cb 1.24 -0.06 -0.39 0.00 0.00 0.00 0.00 17.79 18.58 2kmd h ALA 32 CO 0.39 -0.03 -0.77 0.34 0.00 0.00 0.00 179.25 179.18 2kmd s ASP 33 N -5.51 3.12 -0.14 0.00 2.15 -1.26 -4.51 116.67 110.52 2kmd s ASP 33 Ca -0.13 -0.87 -0.24 0.00 0.43 0.00 0.00 52.55 51.74 2kmd s ASP 33 Cb 0.18 -0.80 -0.02 0.00 -0.30 0.00 0.00 42.92 41.98 2kmd s ASP 33 CO 0.77 -0.26 0.77 0.68 -0.17 0.00 0.00 175.17 176.95 2kmd s VAL 34 N 1.70 4.95 0.14 1.11 -7.23 -1.26 -5.04 120.40 114.77 2kmd s VAL 34 Ca -0.02 1.53 -0.30 0.00 -1.81 0.00 0.00 61.98 61.38 2kmd s VAL 34 Cb -0.17 -4.09 -0.07 0.00 0.56 0.00 0.00 36.38 32.62 2kmd s VAL 34 CO -0.07 0.11 1.00 -2.16 -0.31 0.00 0.00 175.10 173.67 2kmd s PRO 35 N 1.68 4.69 -0.16 4.82 0.04 -1.26 -4.99 135.00 139.81 2kmd s PRO 35 Ca 0.37 1.54 -0.26 0.00 0.04 0.00 0.00 61.00 62.69 2kmd s PRO 35 Cb -0.17 -3.34 -0.24 0.00 0.04 0.00 0.00 34.50 30.80 2kmd s PRO 35 CO 0.14 0.21 0.56 -0.07 0.04 0.00 0.00 177.00 177.88 2kmd h LEU 36 N 5.29 0.01 -9.34 -3.56 4.07 -2.08 -3.51 115.31 106.18 2kmd h LEU 36 Ca -0.43 -0.81 -0.56 0.00 0.08 0.00 0.00 57.88 56.15 2kmd h LEU 36 Cb 1.21 -0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.90 2kmd h LEU 36 CO 0.72 1.20 0.18 -0.76 -1.08 0.00 0.00 178.44 178.70 2kmd s LEU 37 N -8.07 4.31 0.05 1.67 1.43 -1.26 -5.19 118.68 111.62 2kmd s LEU 37 Ca -0.23 1.28 -0.08 0.00 -1.03 0.00 0.00 54.13 54.07 2kmd s LEU 37 Cb 0.00 -3.20 -0.00 0.00 0.03 0.00 0.00 46.19 43.03 2kmd s LEU 37 CO 0.66 -0.18 0.16 -2.16 0.23 0.00 0.00 176.35 175.05 2kmd s PRO 39 N 1.03 0.71 0.85 1.29 0.04 -1.26 -5.28 135.00 132.38 2kmd s PRO 39 Ca 0.40 -0.79 -0.12 0.00 0.04 0.00 0.00 61.00 60.54 2kmd s PRO 39 Cb -0.18 0.29 0.10 0.00 0.04 0.00 0.00 34.50 34.75 2kmd s PRO 39 CO 0.19 -0.20 1.12 -1.54 0.04 0.00 0.00 177.00 176.61 2kmd s SER 40 N -2.37 4.01 0.00 6.66 1.04 -1.26 -5.04 113.70 116.73 2kmd s SER 40 Ca -0.01 1.10 0.00 0.00 0.48 0.00 0.00 55.95 57.52 2kmd s SER 40 Cb 0.01 -1.75 0.00 0.00 0.10 0.00 0.00 66.02 64.39 2kmd s SER 40 CO -0.07 -2.25 0.00 2.29 0.98 0.00 0.00 173.24 174.19 2kmd n LYS 42 N -3.59 0.00 -0.02 4.02 2.85 -1.26 -2.99 118.16 117.17 2kmd n LYS 42 Ca 0.07 0.00 -0.18 0.00 -1.05 0.00 0.00 58.31 57.15 2kmd n LYS 42 Cb 0.58 -0.23 -0.08 0.00 -0.65 0.00 0.00 35.03 34.65 2kmd n LYS 42 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2kmd h GLU 43 N 0.00 0.75 -0.15 -1.58 4.39 -1.86 -2.66 114.58 113.47 2kmd h GLU 43 Ca 0.00 -0.64 -0.20 0.00 0.34 0.00 0.00 59.36 58.87 2kmd h GLU 43 Cb 0.00 0.14 0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2kmd h GLU 43 CO 0.00 1.24 -0.68 0.52 -1.16 0.00 0.00 179.01 178.93 2kmd h MET 44 N 0.46 0.72 -0.91 2.33 2.86 -1.89 -2.29 114.93 116.21 2kmd h MET 44 Ca -0.06 -0.58 -0.01 0.00 -2.06 0.00 0.00 59.70 56.99 2kmd h MET 44 Cb 1.41 0.12 -0.04 0.00 0.06 0.00 0.00 31.60 33.14 2kmd h MET 44 CO 0.16 1.19 0.54 1.98 1.06 0.00 0.00 176.91 181.84 2kmd h MET 45 N 0.42 1.25 -0.09 1.72 1.85 -1.85 -2.26 114.93 115.98 2kmd h MET 45 Ca -0.04 -0.12 -0.14 0.00 -0.61 0.00 0.00 59.70 58.78 2kmd h MET 45 Cb 1.31 -0.26 -0.01 0.00 0.43 0.00 0.00 31.60 33.07 2kmd h MET 45 CO 0.14 0.89 -0.58 0.66 -0.40 0.00 0.00 176.91 177.62 2kmd h SER 46 N 1.27 0.32 -0.83 1.39 4.64 -1.48 -3.17 113.55 115.69 2kmd h SER 46 Ca 0.33 -0.18 0.19 0.00 -0.47 0.00 0.00 61.79 61.66 2kmd h SER 46 Cb -0.03 -0.09 -0.12 0.00 -0.31 0.00 0.00 62.40 61.85 2kmd h SER 46 CO -0.06 0.83 0.29 -0.61 -0.87 0.00 0.00 176.83 176.41 2kmd h GLN 47 N 0.22 0.33 -0.75 4.77 4.15 -0.80 0.89 115.11 123.91 2kmd h GLN 47 Ca -0.00 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.41 2kmd h GLN 47 Cb 1.08 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.65 2kmd h GLN 47 CO 0.09 0.22 0.50 0.00 -1.93 0.00 0.00 178.83 177.71 2kmd h ALA 48 N 1.67 0.95 -0.93 3.38 0.00 -1.53 -1.43 119.26 121.37 2kmd h ALA 48 Ca 0.49 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.39 2kmd h ALA 48 Cb 0.90 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 2kmd h ALA 48 CO -0.53 0.37 0.61 -0.07 0.00 0.00 0.00 179.25 179.64 2kmd h LEU 49 N 1.02 1.02 -0.68 0.00 3.38 -0.95 -2.03 115.31 117.06 2kmd h LEU 49 Ca 0.28 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 2kmd h LEU 49 Cb -0.12 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.38 2kmd h LEU 49 CO -0.06 0.70 -0.34 0.50 0.09 0.00 0.00 178.44 179.34 2kmd h LYS 50 N 1.18 0.64 -1.00 1.13 1.63 -0.74 -3.14 116.57 116.28 2kmd h LYS 50 Ca 0.37 -0.30 0.22 0.00 -0.85 0.00 0.00 60.65 60.09 2kmd h LYS 50 Cb -0.00 -0.01 -0.10 0.00 -0.60 0.00 0.00 32.23 31.52 2kmd h LYS 50 CO -0.11 0.89 0.62 0.00 -3.45 0.00 0.00 179.45 177.40 2kmd h ALA 51 N 1.09 1.92 -0.12 5.00 0.00 -0.52 0.14 119.26 126.76 2kmd h ALA 51 Ca 0.06 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.08 2kmd h ALA 51 Cb 0.84 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2kmd h ALA 51 CO 0.07 -0.31 0.10 1.79 0.00 0.00 0.00 179.25 180.90 2kmd h THR 52 N 0.58 0.82 -2.44 0.00 1.35 -1.54 -3.06 112.91 108.62 2kmd h THR 52 Ca 0.58 0.00 -0.81 0.00 -0.55 0.00 0.00 66.41 65.64 2kmd h THR 52 Cb 1.17 0.93 -0.27 0.00 -1.73 0.00 0.00 68.15 68.25 2kmd h THR 52 CO -0.35 0.00 1.02 0.49 -0.25 0.00 0.00 175.52 176.43 2kmd n PHE 53 N -4.32 2.55 0.22 4.73 3.72 0.48 -4.75 117.46 120.08 2kmd n PHE 53 Ca -0.00 -2.58 0.08 0.00 -0.05 0.00 0.00 57.45 54.90 2kmd n PHE 53 Cb 0.22 -1.26 0.50 0.00 -0.94 0.00 0.00 39.48 37.99 2kmd n PHE 53 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2kmd h SER 54 N 4.74 0.00 0.57 4.37 4.64 -1.70 -2.41 113.55 123.76 2kmd h SER 54 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 2kmd h SER 54 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2kmd h SER 54 CO 1.27 0.26 0.00 0.61 -0.87 0.00 0.00 176.83 178.10 2kmd n GLY 55 N -0.34 -1.14 0.13 -0.77 0.00 -1.26 -3.28 105.19 98.52 2kmd n GLY 55 Ca -0.01 -0.10 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 2kmd n GLY 55 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2kmd n PHE 56 N -1.37 0.52 -0.33 1.61 7.35 -0.91 -4.01 117.46 120.31 2kmd n PHE 56 Ca 0.09 0.17 0.05 0.00 -0.76 0.00 0.00 57.45 57.00 2kmd n PHE 56 Cb 0.22 -1.06 0.23 0.00 0.35 0.00 0.00 39.48 39.22 2kmd n PHE 56 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 2kmd h THR 57 N -0.56 1.02 -0.54 -2.13 2.02 -1.58 0.16 112.91 111.30 2kmd h THR 57 Ca -0.53 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 66.27 2kmd h THR 57 Cb 1.68 -0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 2kmd h THR 57 CO -0.19 0.19 0.24 0.07 0.37 0.00 0.00 175.52 176.19 2kmd h LYS 58 N 1.04 0.76 -0.06 6.66 2.10 -1.75 -2.29 116.57 123.03 2kmd h LYS 58 Ca 0.43 -0.10 -0.22 0.00 -2.00 0.00 0.00 60.65 58.76 2kmd h LYS 58 Cb 0.29 -0.14 0.01 0.00 -0.90 0.00 0.00 32.23 31.50 2kmd h LYS 58 CO -0.18 0.61 -0.83 1.49 -2.00 0.00 0.00 179.45 178.54 2kmd h GLU 59 N 0.76 0.67 -0.13 0.07 4.57 -1.23 -2.98 114.58 116.31 2kmd h GLU 59 Ca 0.19 -0.64 0.04 0.00 -1.18 0.00 0.00 59.36 57.77 2kmd h GLU 59 Cb 0.12 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 2kmd h GLU 59 CO -0.02 1.24 0.13 1.96 -1.18 0.00 0.00 179.01 181.14 2kmd h GLN 60 N 0.33 0.00 0.03 1.92 4.20 -0.40 -0.84 115.11 120.35 2kmd h GLN 60 Ca -0.09 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.37 2kmd h GLN 60 Cb 1.48 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.23 2kmd h GLN 60 CO 0.17 0.00 -1.29 1.96 -0.67 0.00 0.00 178.83 179.00 2kmd h GLN 61 N 0.00 0.06 -0.18 1.46 4.20 -1.38 0.20 115.11 119.47 2kmd h GLN 61 Ca 0.06 -0.11 -0.13 0.00 0.06 0.00 0.00 58.65 58.53 2kmd h GLN 61 Cb 0.32 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.14 2kmd h GLN 61 CO -0.00 0.91 -0.41 0.00 -0.67 0.00 0.00 178.83 178.66 2kmd h ARG 62 N 0.02 0.59 0.00 1.46 3.08 -1.05 -3.33 114.38 115.16 2kmd h ARG 62 Ca -0.13 -0.40 -0.19 0.00 0.07 0.00 0.00 59.98 59.33 2kmd h ARG 62 Cb 1.89 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.96 2kmd h ARG 62 CO 0.13 1.01 -1.79 1.28 -1.07 0.00 0.00 179.97 179.53 2kmd n LEU 63 N -4.25 0.46 0.00 3.04 4.77 -0.53 -4.99 117.00 115.50 2kmd n LEU 63 Ca -0.06 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2kmd n LEU 63 Cb 0.54 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 2kmd n LEU 63 CO 0.45 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 2kmd n GLY 64 N 1.47 0.66 3.64 -0.72 0.00 0.64 -5.03 105.19 105.85 2kmd n GLY 64 Ca -0.15 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.35 2kmd n GLY 64 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2kmd n ILE 65 N -2.04 0.13 -0.47 -0.61 5.41 -0.79 -4.94 119.36 116.06 2kmd n ILE 65 Ca 0.00 -0.02 -0.28 0.00 1.00 0.00 0.00 62.75 63.45 2kmd n ILE 65 Cb 0.00 -1.13 0.27 0.00 -0.71 0.00 0.00 39.64 38.07 2kmd n ILE 65 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2kmd s PRO 66 N 1.69 -1.25 -0.63 0.38 0.02 -1.26 -4.72 135.00 129.22 2kmd s PRO 66 Ca 0.88 0.81 -0.01 0.00 0.02 0.00 0.00 61.00 62.70 2kmd s PRO 66 Cb -0.92 -1.52 0.47 0.00 0.02 0.00 0.00 34.50 32.56 2kmd s PRO 66 CO 0.51 -3.94 1.99 1.17 -0.33 0.00 0.00 177.00 176.40 2kmd n LYS 67 N -5.07 2.68 -3.57 5.54 4.81 -1.26 -4.87 118.16 116.42 2kmd n LYS 67 Ca 0.02 -3.30 -0.01 0.00 -0.87 0.00 0.00 58.31 54.15 2kmd n LYS 67 Cb 0.54 -2.27 -0.05 0.00 0.02 0.00 0.00 35.03 33.27 2kmd n LYS 67 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2kmd s ASP 68 N -1.86 -0.88 0.17 3.14 2.15 -1.26 -4.01 116.67 114.11 2kmd s ASP 68 Ca 0.63 1.26 -0.14 0.00 0.43 0.00 0.00 52.55 54.73 2kmd s ASP 68 Cb 0.50 1.88 0.06 0.00 -0.30 0.00 0.00 42.92 45.06 2kmd s ASP 68 CO 0.00 -0.18 1.83 -0.65 -0.17 0.00 0.00 175.17 176.00 2kmd h PRO 69 N 7.52 0.70 -0.79 4.34 0.11 -1.86 -2.36 132.00 139.67 2kmd h PRO 69 Ca -0.20 -0.05 0.16 0.00 0.11 0.00 0.00 66.00 66.03 2kmd h PRO 69 Cb 1.13 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.03 2kmd h PRO 69 CO 0.11 0.48 0.53 0.00 -0.21 0.00 0.00 178.00 178.91 2kmd h ARG 70 N 0.72 0.39 -1.27 1.05 3.08 -1.93 -0.45 114.38 115.96 2kmd h ARG 70 Ca 0.19 -0.02 -0.66 0.00 0.07 0.00 0.00 59.98 59.56 2kmd h ARG 70 Cb -0.06 -0.09 -0.27 0.00 0.08 0.00 0.00 29.97 29.63 2kmd h ARG 70 CO -0.04 0.26 0.87 1.04 -1.07 0.00 0.00 179.97 181.02 2kmd n GLN 71 N -4.48 2.62 -4.70 0.04 6.02 -0.89 -2.89 117.38 113.09 2kmd n GLN 71 Ca 0.16 -3.16 -0.31 0.00 -0.01 0.00 0.00 57.00 53.67 2kmd n GLN 71 Cb 0.58 -2.22 -0.09 0.00 1.02 0.00 0.00 30.24 29.53 2kmd n GLN 71 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2kmd s TRP 72 N -3.65 2.04 0.22 1.08 0.52 -0.18 -4.80 118.94 114.17 2kmd s TRP 72 Ca 0.59 -0.90 0.04 0.00 0.02 0.00 0.00 56.10 55.86 2kmd s TRP 72 Cb 0.47 -1.62 -0.02 0.00 -1.15 0.00 0.00 33.47 31.15 2kmd s TRP 72 CO -0.10 0.26 0.15 0.25 0.02 0.00 0.00 176.95 177.53 2kmd n THR 73 N -1.15 0.00 -0.31 2.01 -2.24 -1.26 -1.74 114.28 109.58 2kmd n THR 73 Ca -0.14 -1.51 0.15 0.00 -2.27 0.00 0.00 64.05 60.28 2kmd n THR 73 Cb 0.67 0.70 0.40 0.00 -2.10 0.00 0.00 70.33 70.00 2kmd n THR 73 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2kmd h GLU 74 N 0.00 0.61 0.38 -0.78 5.08 -1.85 0.18 114.58 118.19 2kmd h GLU 74 Ca -0.16 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 2kmd h GLU 74 Cb 0.75 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2kmd h GLU 74 CO 0.24 0.40 -0.18 1.15 -1.00 0.00 0.00 179.01 179.62 2kmd h THR 75 N 0.63 0.52 -0.74 1.13 2.02 -1.96 -1.99 112.91 112.52 2kmd h THR 75 Ca 0.53 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 67.13 2kmd h THR 75 Cb 1.00 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 2kmd h THR 75 CO -0.28 0.09 0.49 0.45 0.37 0.00 0.00 175.52 176.64 2kmd h HIS 76 N -0.89 0.92 -0.30 3.16 3.86 -1.81 0.48 115.15 120.57 2kmd h HIS 76 Ca -0.05 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2kmd h HIS 76 Cb 0.54 -0.31 -0.03 0.00 1.06 0.00 0.00 27.41 28.68 2kmd h HIS 76 CO 0.02 0.57 0.14 0.28 0.86 0.00 0.00 177.93 179.80 2kmd h VAL 77 N 0.99 0.97 -0.13 2.45 2.07 -0.73 -0.53 116.25 121.34 2kmd h VAL 77 Ca 0.28 -0.10 -0.17 0.00 0.82 0.00 0.00 66.70 67.53 2kmd h VAL 77 Cb -0.09 0.66 0.01 0.00 -1.52 0.00 0.00 31.29 30.34 2kmd h VAL 77 CO -0.07 0.05 -0.58 -0.09 0.02 0.00 0.00 177.57 176.91 2kmd h ARG 78 N 0.29 0.62 -0.74 1.57 1.12 -1.02 -1.86 114.38 114.36 2kmd h ARG 78 Ca 0.13 -0.49 0.04 0.00 -1.11 0.00 0.00 59.98 58.54 2kmd h ARG 78 Cb 0.06 0.10 -0.04 0.00 -0.01 0.00 0.00 29.97 30.07 2kmd h ARG 78 CO -0.10 1.11 0.48 -0.44 -3.11 0.00 0.00 179.97 177.92 2kmd h ASP 79 N 0.27 0.75 0.32 -3.80 3.32 0.09 0.16 116.42 117.53 2kmd h ASP 79 Ca -0.04 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 2kmd h ASP 79 Cb 1.21 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2kmd h ASP 79 CO 0.12 0.51 -0.16 -0.25 -1.72 0.00 0.00 179.24 177.74 2kmd h TRP 80 N 0.86 -0.40 -0.91 4.55 7.01 -1.06 -2.36 115.95 123.64 2kmd h TRP 80 Ca 0.30 -0.01 0.17 0.00 2.11 0.00 0.00 58.89 61.45 2kmd h TRP 80 Cb 0.10 0.13 -0.16 0.00 -2.10 0.00 0.00 29.16 27.13 2kmd h TRP 80 CO -0.00 -0.25 -0.30 0.28 -2.79 0.00 0.00 178.44 175.38 2kmd h VAL 81 N -0.89 0.06 -0.36 2.65 2.07 -1.21 0.24 116.25 118.80 2kmd h VAL 81 Ca -0.04 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.54 2kmd h VAL 81 Cb 0.33 0.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.11 2kmd h VAL 81 CO 0.07 0.00 -0.01 -0.03 0.02 0.00 0.00 177.57 177.62 2kmd h MET 82 N -0.02 0.09 -0.89 1.57 1.85 -0.76 -0.15 114.93 116.62 2kmd h MET 82 Ca 0.39 -0.01 0.07 0.00 -0.61 0.00 0.00 59.70 59.54 2kmd h MET 82 Cb 0.63 -0.02 -0.06 0.00 0.43 0.00 0.00 31.60 32.59 2kmd h MET 82 CO -0.93 0.06 0.58 2.35 -0.40 0.00 0.00 176.91 178.56 2kmd h TRP 83 N 0.09 1.02 0.00 1.39 7.01 -0.06 -0.40 115.95 124.99 2kmd h TRP 83 Ca 0.18 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.20 2kmd h TRP 83 Cb 0.25 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 26.98 2kmd h TRP 83 CO -0.26 0.53 0.00 0.00 -2.79 0.00 0.00 178.44 175.92 2kmd h ALA 84 N 1.52 1.00 0.01 2.65 0.00 0.16 -1.57 119.26 123.03 2kmd h ALA 84 Ca 0.39 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 55.03 2kmd h ALA 84 Cb 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2kmd h ALA 84 CO -0.15 0.00 -1.43 0.28 0.00 0.00 0.00 179.25 177.96 2kmd h VAL 85 N 0.00 1.20 0.17 0.00 2.07 0.50 -2.75 116.25 117.44 2kmd h VAL 85 Ca 0.00 -2.98 -0.35 0.00 0.82 0.00 0.00 66.70 64.18 2kmd h VAL 85 Cb 0.76 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 33.13 2kmd h VAL 85 CO 0.00 0.70 -1.81 0.78 0.02 0.00 0.00 177.57 177.26 2kmd h ASN 86 N 0.01 0.55 0.33 0.57 4.21 -1.17 0.42 115.58 120.49 2kmd h ASN 86 Ca -0.18 -0.91 -0.20 0.00 1.21 0.00 0.00 56.30 56.22 2kmd h ASN 86 Cb 1.92 -0.18 -0.00 0.00 -1.12 0.00 0.00 38.32 38.94 2kmd h ASN 86 CO 0.10 1.79 -0.83 -0.33 -1.29 0.00 0.00 177.43 176.87 2kmd h GLU 87 N 0.10 0.37 -0.32 0.81 3.07 -1.45 -3.19 114.58 113.97 2kmd h GLU 87 Ca -0.36 -0.35 0.00 0.00 -0.50 0.00 0.00 59.36 58.15 2kmd h GLU 87 Cb 2.08 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 30.08 2kmd h GLU 87 CO 0.15 1.01 0.00 1.19 -1.40 0.00 0.00 179.01 179.97 2kmd n PHE 88 N -3.78 0.40 -3.90 4.33 3.01 -1.04 -4.99 117.46 111.50 2kmd n PHE 88 Ca -0.05 -0.21 -0.33 0.00 1.01 0.00 0.00 57.45 57.87 2kmd n PHE 88 Cb 0.77 -0.00 0.01 0.00 -0.01 0.00 0.00 39.48 40.24 2kmd n PHE 88 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2kmd n SER 89 N 1.43 -2.98 -4.93 4.37 7.64 -0.69 -4.96 113.62 113.50 2kmd n SER 89 Ca 0.18 -1.09 -0.26 0.00 1.01 0.00 0.00 58.87 58.71 2kmd n SER 89 Cb 0.59 -2.79 0.05 0.00 -1.01 0.00 0.00 64.21 61.05 2kmd n SER 89 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2kmd s LEU 90 N -6.91 3.06 0.04 -3.43 1.43 0.05 -5.01 118.68 107.92 2kmd s LEU 90 Ca 0.29 0.56 -0.15 0.00 -1.03 0.00 0.00 54.13 53.80 2kmd s LEU 90 Cb -0.12 -3.31 0.02 0.00 0.03 0.00 0.00 46.19 42.81 2kmd s LEU 90 CO 0.90 -1.30 0.33 -1.59 0.23 0.00 0.00 176.35 174.92 2kmd s LYS 91 N -5.09 0.83 0.00 1.70 0.00 -1.26 -4.89 119.74 111.03 2kmd s LYS 91 Ca 0.57 -0.48 0.00 0.00 0.00 0.00 0.00 55.97 56.06 2kmd s LYS 91 Cb -0.11 0.36 0.00 0.00 0.00 0.00 0.00 37.83 38.09 2kmd s LYS 91 CO 0.45 -0.27 0.00 0.41 0.00 0.00 0.00 175.35 175.93 2kmd n GLY 92 N 0.56 2.17 3.72 0.59 0.00 -1.26 -4.85 105.19 106.12 2kmd n GLY 92 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2kmd n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kmd s VAL 93 N -2.96 4.10 -0.19 1.61 0.11 -1.26 -4.50 120.40 117.32 2kmd s VAL 93 Ca 0.00 1.53 -0.08 0.00 -2.93 0.00 0.00 61.98 60.50 2kmd s VAL 93 Cb 0.00 -3.98 -0.04 0.00 -1.53 0.00 0.00 36.38 30.83 2kmd s VAL 93 CO 0.00 0.13 0.10 -1.81 -3.33 0.00 0.00 175.10 170.19 2kmd s ASP 94 N 0.95 5.93 0.30 3.54 1.11 -1.26 -4.98 116.67 122.26 2kmd s ASP 94 Ca 0.57 0.17 0.22 0.00 0.18 0.00 0.00 52.55 53.69 2kmd s ASP 94 Cb -0.29 -2.02 0.14 0.00 1.07 0.00 0.00 42.92 41.82 2kmd s ASP 94 CO 0.30 0.19 1.30 -0.26 1.18 0.00 0.00 175.17 177.88 2kmd h PHE 95 N 6.56 0.00 -0.23 4.23 -1.00 -1.95 -3.25 116.94 121.30 2kmd h PHE 95 Ca -0.40 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.31 2kmd h PHE 95 Cb 1.16 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.71 2kmd h PHE 95 CO 0.58 0.08 -0.15 1.96 -1.61 0.00 0.00 178.31 179.17 2kmd h GLN 96 N 0.00 0.39 -0.34 1.51 7.50 -1.97 -2.31 115.11 119.89 2kmd h GLN 96 Ca -0.01 -0.11 -0.09 0.00 0.50 0.00 0.00 58.65 58.94 2kmd h GLN 96 Cb 1.08 -0.04 -0.02 0.00 0.05 0.00 0.00 27.48 28.55 2kmd h GLN 96 CO 0.01 0.54 -0.15 0.87 -1.50 0.00 0.00 178.83 178.59 2kmd h LYS 97 N 0.36 0.62 -0.99 1.46 1.79 -1.86 -2.82 116.57 115.13 2kmd h LYS 97 Ca 0.07 -0.21 -0.51 0.00 -2.18 0.00 0.00 60.65 57.83 2kmd h LYS 97 Cb 0.48 -0.05 -0.30 0.00 -1.58 0.00 0.00 32.23 30.78 2kmd h LYS 97 CO 0.03 0.75 0.64 1.19 -1.08 0.00 0.00 179.45 180.98 2kmd n PHE 98 N -4.16 3.04 -1.80 -1.35 3.72 -0.92 -4.80 117.46 111.20 2kmd n PHE 98 Ca 0.01 -1.82 -0.42 0.00 -0.05 0.00 0.00 57.45 55.17 2kmd n PHE 98 Cb 0.37 -0.94 -0.00 0.00 -0.94 0.00 0.00 39.48 37.97 2kmd n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2kmd s MET 100 N 2.25 1.83 0.69 0.00 0.23 -1.26 -5.01 119.30 118.03 2kmd s MET 100 Ca 0.49 -1.06 -0.12 0.00 -1.03 0.00 0.00 55.69 53.97 2kmd s MET 100 Cb 0.14 0.59 0.01 0.00 -1.53 0.00 0.00 34.83 34.04 2kmd s MET 100 CO -0.07 -0.84 1.07 -1.54 -2.03 0.00 0.00 175.02 171.61 2kmd s SER 101 N -2.97 5.23 0.30 -1.18 1.04 -1.26 -2.94 113.70 111.93 2kmd s SER 101 Ca 0.12 1.73 -0.01 0.00 0.48 0.00 0.00 55.95 58.27 2kmd s SER 101 Cb -0.05 -2.51 0.47 0.00 0.10 0.00 0.00 66.02 64.02 2kmd s SER 101 CO 0.08 -1.54 1.95 1.23 0.98 0.00 0.00 173.24 175.93 2kmd h GLY 102 N -0.54 1.06 0.65 7.32 0.00 -1.47 -1.84 103.07 108.24 2kmd h GLY 102 Ca -0.44 -0.44 0.09 0.00 0.00 0.00 0.00 47.33 46.54 2kmd h GLY 102 CO 0.55 0.42 0.62 0.00 0.00 0.00 0.00 176.54 178.14 2kmd h ALA 103 N 1.47 1.51 -0.14 3.60 0.00 -1.52 -0.69 119.26 123.49 2kmd h ALA 103 Ca 0.26 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 2kmd h ALA 103 Cb -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2kmd h ALA 103 CO -0.05 0.30 -0.47 0.00 0.00 0.00 0.00 179.25 179.03 2kmd h ALA 104 N 1.51 0.25 -0.72 0.00 0.00 -1.74 -2.65 119.26 115.91 2kmd h ALA 104 Ca 0.45 -0.49 0.08 0.00 0.00 0.00 0.00 54.91 54.95 2kmd h ALA 104 Cb 0.34 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 2kmd h ALA 104 CO -0.20 0.41 0.38 1.25 0.00 0.00 0.00 179.25 181.08 2kmd h LEU 105 N 0.20 0.52 -0.41 0.00 5.85 -0.61 -0.69 115.31 120.16 2kmd h LEU 105 Ca -0.02 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.66 2kmd h LEU 105 Cb 1.10 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 2kmd h LEU 105 CO 0.10 0.31 -0.09 0.00 -0.34 0.00 0.00 178.44 178.42 2kmd h ALA 107 N 0.85 1.42 -0.09 0.00 0.00 -0.98 -2.26 119.26 118.20 2kmd h ALA 107 Ca 0.11 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 2kmd h ALA 107 Cb 0.62 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2kmd h ALA 107 CO 0.04 0.07 -0.39 -0.07 0.00 0.00 0.00 179.25 178.89 2kmd h LEU 108 N 0.00 0.20 0.00 0.00 3.38 -0.86 -3.50 115.31 114.54 2kmd h LEU 108 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2kmd h LEU 108 Cb 0.15 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2kmd h LEU 108 CO 0.01 0.58 0.00 0.61 0.09 0.00 0.00 178.44 179.73 2kmd n GLY 109 N -0.26 -1.52 0.26 0.83 0.00 -0.85 -3.50 105.19 100.15 2kmd n GLY 109 Ca -0.01 -1.54 -0.08 0.00 0.00 0.00 0.00 46.02 44.39 2kmd n GLY 109 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2kmd h LYS 110 N 0.00 0.89 0.26 1.61 3.64 -1.91 -1.48 116.57 119.58 2kmd h LYS 110 Ca 0.00 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2kmd h LYS 110 Cb 0.00 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 2kmd h LYS 110 CO 0.00 0.78 -0.35 1.49 -2.27 0.00 0.00 179.45 179.10 2kmd h GLU 111 N 0.81 -0.60 -0.94 1.90 4.57 -1.99 0.51 114.58 118.84 2kmd h GLU 111 Ca 0.19 0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.44 2kmd h GLU 111 Cb 0.24 0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.91 2kmd h GLU 111 CO -0.01 -0.40 0.62 0.00 -1.18 0.00 0.00 179.01 178.03 2kmd h PHE 113 N 1.22 0.82 0.00 0.00 3.57 -1.03 -2.16 116.94 119.35 2kmd h PHE 113 Ca 0.37 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.76 2kmd h PHE 113 Cb -0.04 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 2kmd h PHE 113 CO -0.01 0.66 -0.23 1.25 -2.23 0.00 0.00 178.31 177.75 2kmd h LEU 114 N 0.74 0.00 -0.68 0.59 5.85 0.50 -1.54 115.31 120.77 2kmd h LEU 114 Ca 0.18 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 2kmd h LEU 114 Cb 0.18 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2kmd h LEU 114 CO -0.02 0.23 -0.19 -0.33 -0.34 0.00 0.00 178.44 177.80 2kmd h GLU 115 N 0.00 0.00 0.04 1.25 5.08 -0.68 -3.21 114.58 117.06 2kmd h GLU 115 Ca -0.00 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.09 2kmd h GLU 115 Cb 0.50 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2kmd h GLU 115 CO 0.03 0.19 -1.43 -0.07 -1.00 0.00 0.00 179.01 176.72 2kmd h LEU 116 N 0.00 0.14 -9.38 1.33 3.38 -0.72 -3.47 115.31 106.59 2kmd h LEU 116 Ca -0.00 -0.21 -0.62 0.00 0.09 0.00 0.00 57.88 57.14 2kmd h LEU 116 Cb 0.90 -0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.47 2kmd h LEU 116 CO 0.02 1.18 -0.70 0.00 0.09 0.00 0.00 178.44 179.03 2kmd s ALA 117 N -2.64 3.04 1.01 1.53 0.00 -0.84 -4.44 121.76 119.42 2kmd s ALA 117 Ca -0.05 -1.42 -0.19 0.00 0.00 0.00 0.00 51.96 50.30 2kmd s ALA 117 Cb 0.08 -0.84 -0.09 0.00 0.00 0.00 0.00 23.12 22.28 2kmd s ALA 117 CO 0.83 0.48 -0.64 -2.30 0.00 0.00 0.00 175.76 174.13 2kmd n PRO 118 N 0.03 -0.30 0.31 0.00 -0.02 -1.26 -4.48 135.00 129.28 2kmd n PRO 118 Ca -0.11 -0.08 0.21 0.00 -2.02 0.00 0.00 63.50 61.51 2kmd n PRO 118 Cb 0.55 -1.28 1.06 0.00 -0.02 0.00 0.00 33.50 33.81 2kmd n PRO 118 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2kmd h ASP 119 N -1.28 0.00 0.00 2.55 3.32 -1.97 -1.96 116.42 117.09 2kmd h ASP 119 Ca -0.44 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.39 2kmd h ASP 119 Cb 1.33 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.85 2kmd h ASP 119 CO 0.27 0.00 -1.65 2.22 -1.72 0.00 0.00 179.24 178.36 2kmd n PHE 120 N -3.00 0.00 -0.03 4.55 -1.74 -1.26 -4.63 117.46 111.35 2kmd n PHE 120 Ca -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.87 2kmd n PHE 120 Cb 0.11 -0.51 0.30 0.00 1.52 0.00 0.00 39.48 40.90 2kmd n PHE 120 CO 0.00 0.00 0.00 -0.39 -0.56 0.00 0.00 176.76 175.81 2kmd h VAL 121 N -0.56 1.18 -1.00 1.97 -1.51 -1.89 -2.82 116.25 111.62 2kmd h VAL 121 Ca -0.33 -0.65 0.17 0.00 -1.23 0.00 0.00 66.70 64.66 2kmd h VAL 121 Cb 1.21 0.77 -0.10 0.00 -2.13 0.00 0.00 31.29 31.05 2kmd h VAL 121 CO -0.20 0.24 0.62 1.23 -1.23 0.00 0.00 177.57 178.22 2kmd h GLY 122 N 0.81 1.70 0.81 5.19 0.00 -1.57 -1.06 103.07 108.95 2kmd h GLY 122 Ca 0.14 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 2kmd h GLY 122 CO -0.00 0.02 0.02 -0.55 0.00 0.00 0.00 176.54 176.02 2kmd h ASP 123 N 0.83 0.26 0.35 0.19 3.32 -1.73 -2.19 116.42 117.44 2kmd h ASP 123 Ca 0.55 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 2kmd h ASP 123 Cb 0.77 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 2kmd h ASP 123 CO -0.33 0.47 -0.27 0.40 -1.72 0.00 0.00 179.24 177.79 2kmd h ILE 124 N 0.04 0.44 0.37 0.35 2.04 -1.37 0.36 117.51 119.73 2kmd h ILE 124 Ca 0.05 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.90 2kmd h ILE 124 Cb 0.33 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 2kmd h ILE 124 CO 0.00 0.00 -0.38 -0.07 0.00 0.00 0.00 178.15 177.70 2kmd h LEU 125 N -0.62 -1.04 -2.09 1.44 3.38 -1.27 -2.01 115.31 113.10 2kmd h LEU 125 Ca -0.03 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2kmd h LEU 125 Cb 0.54 0.35 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 2kmd h LEU 125 CO -0.01 -0.53 -0.03 -0.25 0.09 0.00 0.00 178.44 177.72 2kmd h TRP 126 N -0.78 0.00 0.75 1.13 7.01 -1.38 0.59 115.95 123.26 2kmd h TRP 126 Ca -0.03 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 60.94 2kmd h TRP 126 Cb 0.70 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 27.77 2kmd h TRP 126 CO -0.22 0.03 -0.36 1.49 -2.79 0.00 0.00 178.44 176.60 2kmd h GLU 127 N 0.00 -0.97 -0.13 2.65 4.81 -0.21 0.45 114.58 121.18 2kmd h GLU 127 Ca -0.00 0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 2kmd h GLU 127 Cb 0.06 0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2kmd h GLU 127 CO 0.00 -0.63 -0.61 1.25 -0.73 0.00 0.00 179.01 178.29 2kmd h HIS 128 N -1.06 0.58 -0.17 0.92 2.76 -1.14 -2.89 115.15 114.15 2kmd h HIS 128 Ca -0.10 -0.22 0.03 0.00 -2.20 0.00 0.00 60.37 57.88 2kmd h HIS 128 Cb 0.78 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.61 2kmd h HIS 128 CO -0.01 0.95 -0.03 1.25 -1.30 0.00 0.00 177.93 178.78 2kmd h LEU 129 N 0.33 -0.14 -1.08 0.26 5.85 0.25 0.30 115.31 121.09 2kmd h LEU 129 Ca -0.01 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2kmd h LEU 129 Cb 1.16 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.26 2kmd h LEU 129 CO 0.11 -0.04 0.15 -0.08 -0.34 0.00 0.00 178.44 178.23 2kmd h GLU 130 N 0.01 0.80 -0.39 1.25 4.81 -0.92 -2.54 114.58 117.61 2kmd h GLU 130 Ca 0.08 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 2kmd h GLU 130 Cb 0.12 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 2kmd h GLU 130 CO -0.17 0.71 0.22 0.82 -0.73 0.00 0.00 179.01 179.86 2kmd h ILE 131 N 0.78 1.15 -0.83 2.32 2.04 -1.15 -2.45 117.51 119.37 2kmd h ILE 131 Ca 0.18 -0.37 0.11 0.00 1.00 0.00 0.00 64.86 65.78 2kmd h ILE 131 Cb 0.25 0.68 -0.06 0.00 -0.74 0.00 0.00 36.82 36.95 2kmd h ILE 131 CO -0.01 0.15 0.54 -0.07 0.00 0.00 0.00 178.15 178.77 2kmd h LEU 132 N 0.51 0.66 -0.60 1.44 3.38 -0.55 -1.37 115.31 118.78 2kmd h LEU 132 Ca 0.14 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 2kmd h LEU 132 Cb 0.05 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2kmd h LEU 132 CO -0.02 0.38 0.26 1.56 0.09 0.00 0.00 178.44 180.70 2kmd h GLN 133 N 0.73 0.88 -0.37 1.13 4.20 -1.17 -2.82 115.11 117.68 2kmd h GLN 133 Ca 0.40 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.91 2kmd h GLN 133 Cb 0.54 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 2kmd h GLN 133 CO -0.16 0.74 0.04 -0.22 -0.67 0.00 0.00 178.83 178.56 2kmd h LYS 134 N 0.82 0.56 -0.55 1.46 3.64 -1.03 -2.97 116.57 118.50 2kmd h LYS 134 Ca 0.20 -0.11 0.11 0.00 -1.27 0.00 0.00 60.65 59.58 2kmd h LYS 134 Cb 0.17 -0.09 -0.10 0.00 -0.41 0.00 0.00 32.23 31.81 2kmd h LYS 134 CO -0.02 0.56 -0.04 0.93 -2.27 0.00 0.00 179.45 178.61 2kmd h GLU 135 N 0.54 0.08 -2.72 1.90 3.07 -1.19 -3.31 114.58 112.95 2kmd h GLU 135 Ca 0.12 -0.00 -0.60 0.00 -0.50 0.00 0.00 59.36 58.37 2kmd h GLU 135 Cb 0.28 -0.02 -0.40 0.00 -0.84 0.00 0.00 28.75 27.78 2kmd h GLU 135 CO 0.00 0.05 -0.81 -0.51 -1.40 0.00 0.00 179.01 176.35 2kmd s ASP 136 N -5.24 2.97 -0.58 1.42 1.11 -1.13 -4.78 116.67 110.43 2kmd s ASP 136 Ca -0.14 -3.05 -0.26 0.00 0.18 0.00 0.00 52.55 49.28 2kmd s ASP 136 Cb 0.17 -0.87 -0.09 0.00 1.07 0.00 0.00 42.92 43.20 2kmd s ASP 136 CO 0.73 -0.19 2.42 0.52 1.18 0.00 0.00 175.17 179.83 2kmd n VAL 137 N 2.94 -0.06 -1.26 -1.27 0.31 -1.16 -4.90 118.33 112.92 2kmd n VAL 137 Ca 0.20 -0.71 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 2kmd n VAL 137 Cb 0.40 -2.55 0.00 0.00 -0.91 0.00 0.00 33.84 30.78 2kmd n VAL 137 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68