#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksp s PRO 36 N 0.00 4.37 0.11 1.61 0.02 -1.26 -5.04 135.00 134.81 2ksp s PRO 36 Ca 0.00 1.71 -0.05 0.00 0.02 0.00 0.00 61.00 62.68 2ksp s PRO 36 Cb 0.00 -3.51 -0.05 0.00 0.02 0.00 0.00 34.50 30.96 2ksp s PRO 36 CO 0.00 -0.40 0.34 -0.51 -0.33 0.00 0.00 177.00 176.10 2ksp s LEU 37 N 1.92 4.30 -0.17 -5.54 1.02 -1.26 -5.09 118.68 113.87 2ksp s LEU 37 Ca 0.57 0.57 -0.06 0.00 0.02 0.00 0.00 54.13 55.22 2ksp s LEU 37 Cb -0.26 -3.15 -0.04 0.00 0.02 0.00 0.00 46.19 42.76 2ksp s LEU 37 CO 0.24 0.11 0.04 -0.83 0.02 0.00 0.00 176.35 175.93 2ksp s GLY 38 N -2.27 1.88 -0.32 -3.19 0.00 -1.26 -5.05 107.32 97.10 2ksp s GLY 38 Ca 0.38 -0.75 -0.29 0.00 0.00 0.00 0.00 44.72 44.05 2ksp s GLY 38 CO 0.23 -0.02 1.59 -0.56 0.00 0.00 0.00 173.10 174.34 2ksp s SER 39 N 0.24 6.23 -0.82 1.64 0.01 -1.26 -4.95 113.70 114.80 2ksp s SER 39 Ca 0.03 1.24 -0.17 0.00 1.31 0.00 0.00 55.95 58.36 2ksp s SER 39 Cb -0.13 -2.53 0.16 0.00 0.21 0.00 0.00 66.02 63.73 2ksp s SER 39 CO 0.01 -1.44 0.90 -1.81 0.41 0.00 0.00 173.24 171.30 2ksp s ASP 40 N 4.62 6.58 -0.10 2.44 1.01 -1.26 -4.96 116.67 125.00 2ksp s ASP 40 Ca 0.70 -2.15 -0.04 0.00 0.71 0.00 0.00 52.55 51.77 2ksp s ASP 40 Cb -0.20 -2.31 0.05 0.00 1.01 0.00 0.00 42.92 41.48 2ksp s ASP 40 CO 0.31 -0.89 0.19 1.51 0.21 0.00 0.00 175.17 176.51 2ksp s ASP 41 N 3.08 0.57 0.19 0.27 -4.77 -1.26 -5.10 116.67 109.64 2ksp s ASP 41 Ca 0.22 0.42 0.09 0.00 -3.30 0.00 0.00 52.55 49.98 2ksp s ASP 41 Cb -0.11 0.41 -0.04 0.00 -1.09 0.00 0.00 42.92 42.08 2ksp s ASP 41 CO -0.06 -0.24 -0.18 0.54 0.70 0.00 0.00 175.17 175.93 2ksp s VAL 42 N 2.27 1.95 -0.53 2.11 0.11 -1.26 -5.08 120.40 119.96 2ksp s VAL 42 Ca 0.02 -2.05 -0.28 0.00 -2.93 0.00 0.00 61.98 56.74 2ksp s VAL 42 Cb -0.12 -1.97 0.01 0.00 -1.53 0.00 0.00 36.38 32.76 2ksp s VAL 42 CO -0.07 -0.36 1.51 -1.83 -3.33 0.00 0.00 175.10 171.02 2ksp s GLU 43 N -3.04 3.24 -0.74 1.54 1.03 -1.26 -4.95 118.70 114.52 2ksp s GLU 43 Ca 0.19 0.60 -0.25 0.00 0.03 0.00 0.00 54.97 55.54 2ksp s GLU 43 Cb -0.05 -4.16 0.04 0.00 -0.80 0.00 0.00 34.13 29.17 2ksp s GLU 43 CO 0.08 -2.00 1.20 -0.46 -1.33 0.00 0.00 175.26 172.75 2ksp s TRP 44 N 6.48 2.41 0.25 4.83 -0.00 -1.26 -4.64 118.94 127.01 2ksp s TRP 44 Ca 0.57 -0.25 -0.04 0.00 -0.00 0.00 0.00 56.10 56.39 2ksp s TRP 44 Cb -0.12 -4.54 0.37 0.00 -0.00 0.00 0.00 33.47 29.17 2ksp s TRP 44 CO 0.26 -1.95 1.88 0.28 -0.00 0.00 0.00 176.95 177.42 2ksp h VAL 45 N 6.05 1.09 0.00 5.86 2.07 -1.92 -2.22 116.25 127.18 2ksp h VAL 45 Ca -0.25 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2ksp h VAL 45 Cb 1.05 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2ksp h VAL 45 CO 1.26 0.20 0.00 1.33 0.02 0.00 0.00 177.57 180.38 2ksp n VAL 46 N -4.53 0.98 0.36 2.57 0.24 -1.26 -1.57 118.33 115.12 2ksp n VAL 46 Ca 0.14 0.25 0.13 0.00 -2.04 0.00 0.00 64.34 62.82 2ksp n VAL 46 Cb 0.16 -1.03 0.55 0.00 -1.47 0.00 0.00 33.84 32.05 2ksp n VAL 46 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2ksp h GLY 47 N 2.43 0.00 2.00 7.63 0.00 -1.82 -2.10 103.07 111.21 2ksp h GLY 47 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 2ksp h GLY 47 CO 0.00 0.00 -0.75 1.70 0.00 0.00 0.00 176.54 177.49 2ksp h LYS 48 N 0.00 0.00 0.00 4.80 1.63 -1.49 -3.28 116.57 118.23 2ksp h LYS 48 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2ksp h LYS 48 Cb 0.38 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.00 2ksp h LYS 48 CO 0.00 0.75 -0.20 -3.47 -3.45 0.00 0.00 179.45 173.08 2ksp n ASP 49 N -3.39 2.03 -0.31 4.20 2.03 -1.05 -4.76 116.55 115.30 2ksp n ASP 49 Ca 0.00 -3.29 0.07 0.00 0.52 0.00 0.00 54.79 52.10 2ksp n ASP 49 Cb 0.80 -0.45 0.23 0.00 -0.72 0.00 0.00 41.12 40.98 2ksp n ASP 49 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2ksp h LYS 50 N 0.34 0.67 -0.86 -0.67 1.79 -1.45 -2.11 116.57 114.28 2ksp h LYS 50 Ca -0.00 -0.04 0.20 0.00 -2.18 0.00 0.00 60.65 58.62 2ksp h LYS 50 Cb 1.03 -0.15 -0.12 0.00 -1.58 0.00 0.00 32.23 31.41 2ksp h LYS 50 CO 0.00 0.45 0.35 -1.00 -1.08 0.00 0.00 179.45 178.17 2ksp h PRO 51 N 0.69 0.39 -0.20 3.15 0.13 -1.88 0.62 132.00 134.91 2ksp h PRO 51 Ca 0.47 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 65.49 2ksp h PRO 51 Cb 0.64 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 2ksp h PRO 51 CO -0.34 0.26 -0.23 1.15 -0.23 0.00 0.00 178.00 178.60 2ksp h THR 52 N 0.40 1.33 0.00 1.56 2.02 -1.78 -1.31 112.91 115.14 2ksp h THR 52 Ca 0.52 -1.42 -0.03 0.00 0.77 0.00 0.00 66.41 66.25 2ksp h THR 52 Cb 0.93 1.80 -0.00 0.00 -1.74 0.00 0.00 68.15 69.13 2ksp h THR 52 CO -0.50 0.43 -0.15 1.88 0.37 0.00 0.00 175.52 177.55 2ksp h TYR 53 N 0.17 0.00 -0.08 3.16 0.05 -1.08 -2.27 116.97 116.93 2ksp h TYR 53 Ca 0.03 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.68 2ksp h TYR 53 Cb 0.79 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.54 2ksp h TYR 53 CO 0.08 0.15 -0.46 0.22 -1.05 0.00 0.00 178.16 177.11 2ksp h ASP 54 N 0.00 0.54 0.03 3.88 1.82 0.39 -1.43 116.42 121.66 2ksp h ASP 54 Ca -0.00 -0.66 0.02 0.00 -0.39 0.00 0.00 57.03 56.01 2ksp h ASP 54 Cb 0.67 -0.16 -0.04 0.00 0.68 0.00 0.00 39.33 40.48 2ksp h ASP 54 CO 0.02 1.12 -0.21 -0.08 -1.61 0.00 0.00 179.24 178.47 2ksp h GLU 55 N 0.01 -0.35 -0.72 0.28 4.81 -0.84 -1.75 114.58 116.02 2ksp h GLU 55 Ca -0.03 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 2ksp h GLU 55 Cb 1.11 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 2ksp h GLU 55 CO 0.09 -0.23 0.18 0.82 -0.73 0.00 0.00 179.01 179.14 2ksp h ILE 56 N -0.36 1.26 -0.84 2.32 2.04 -1.45 -1.27 117.51 119.22 2ksp h ILE 56 Ca 0.05 -0.98 0.03 0.00 1.00 0.00 0.00 64.86 64.96 2ksp h ILE 56 Cb 0.42 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 2ksp h ILE 56 CO -0.17 0.38 0.55 0.15 0.00 0.00 0.00 178.15 179.06 2ksp h PHE 57 N 1.09 1.01 0.00 1.37 3.57 -0.99 -2.07 116.94 120.93 2ksp h PHE 57 Ca 0.23 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.68 2ksp h PHE 57 Cb 0.37 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 2ksp h PHE 57 CO 0.03 0.60 -0.49 1.88 -2.23 0.00 0.00 178.31 178.10 2ksp h TYR 58 N 1.06 0.00 0.00 0.41 -1.99 -0.80 -3.18 116.97 112.47 2ksp h TYR 58 Ca 0.33 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.06 2ksp h TYR 58 Cb -0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2ksp h TYR 58 CO -0.00 0.30 0.00 1.79 -0.00 0.00 0.00 178.16 180.25 2ksp h THR 59 N 0.00 0.00 -0.18 -2.88 1.35 -0.58 -2.69 112.91 107.93 2ksp h THR 59 Ca -0.02 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 2ksp h THR 59 Cb 1.25 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 2ksp h THR 59 CO 0.04 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.49 2ksp n LEU 60 N -2.89 1.89 -2.22 3.87 4.32 -0.91 -4.99 117.00 116.07 2ksp n LEU 60 Ca 0.04 -0.78 -0.01 0.00 -0.02 0.00 0.00 56.01 55.24 2ksp n LEU 60 Cb 0.45 -0.11 -0.00 0.00 -1.62 0.00 0.00 43.42 42.13 2ksp n LEU 60 CO 0.31 0.39 -0.32 -1.20 -1.22 0.00 0.00 177.39 175.36 2ksp n SER 61 N 0.47 -4.96 -4.54 -1.43 7.64 -1.01 -4.88 113.62 104.91 2ksp n SER 61 Ca 0.17 0.86 -0.41 0.00 1.01 0.00 0.00 58.87 60.49 2ksp n SER 61 Cb 0.37 -3.62 -0.03 0.00 -1.01 0.00 0.00 64.21 59.92 2ksp n SER 61 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2ksp s PRO 62 N -0.96 3.33 -0.30 1.43 0.05 -1.25 -4.65 135.00 132.66 2ksp s PRO 62 Ca -0.03 -0.64 -0.23 0.00 0.05 0.00 0.00 61.00 60.15 2ksp s PRO 62 Cb 0.00 -4.59 -0.00 0.00 0.05 0.00 0.00 34.50 29.96 2ksp s PRO 62 CO 0.48 -2.12 0.77 0.14 0.05 0.00 0.00 177.00 176.32 2ksp s VAL 63 N 5.21 4.81 -1.63 -0.36 -7.23 -0.30 -3.51 120.40 117.39 2ksp s VAL 63 Ca 0.37 1.18 0.00 0.00 -1.81 0.00 0.00 61.98 61.72 2ksp s VAL 63 Cb -0.06 -4.13 0.00 0.00 0.56 0.00 0.00 36.38 32.75 2ksp s VAL 63 CO 0.05 -0.22 0.00 0.59 -0.31 0.00 0.00 175.10 175.21 2ksp n ASN 64 N 6.15 -4.97 -0.13 4.85 3.02 -1.26 -2.64 115.26 120.28 2ksp n ASN 64 Ca 0.03 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 2ksp n ASN 64 Cb 0.48 -3.98 0.00 0.00 -0.61 0.00 0.00 39.78 35.67 2ksp n ASN 64 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ksp n GLY 65 N -0.97 0.82 3.59 7.41 0.00 -1.23 -5.07 105.19 109.74 2ksp n GLY 65 Ca -0.18 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 2ksp n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ksp s LYS 66 N -3.52 0.72 -0.00 1.61 2.47 -1.08 -4.72 119.74 115.22 2ksp s LYS 66 Ca 0.00 0.44 -0.01 0.00 -1.56 0.00 0.00 55.97 54.84 2ksp s LYS 66 Cb 0.00 0.34 -0.04 0.00 -1.46 0.00 0.00 37.83 36.67 2ksp s LYS 66 CO 0.00 -0.17 0.12 0.96 0.16 0.00 0.00 175.35 176.42 2ksp s ILE 67 N -0.51 5.00 0.64 5.43 -4.36 -0.60 -1.15 121.20 125.64 2ksp s ILE 67 Ca -0.02 -0.33 -0.07 0.00 -0.26 0.00 0.00 60.65 59.97 2ksp s ILE 67 Cb -0.02 -3.31 0.02 0.00 1.25 0.00 0.00 42.46 40.40 2ksp s ILE 67 CO 0.01 0.33 0.96 0.42 0.24 0.00 0.00 174.94 176.91 2ksp s THR 68 N -1.26 3.31 0.07 8.37 -4.23 -1.26 -1.66 115.64 118.98 2ksp s THR 68 Ca 0.25 0.03 0.32 0.00 -1.18 0.00 0.00 61.69 61.11 2ksp s THR 68 Cb -0.12 -3.36 0.34 0.00 1.34 0.00 0.00 72.50 70.70 2ksp s THR 68 CO 0.16 -0.39 1.97 1.23 -0.54 0.00 0.00 174.62 177.05 2ksp h GLY 69 N -0.36 0.00 0.65 3.99 0.00 -1.97 -2.90 103.07 102.49 2ksp h GLY 69 Ca -0.45 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 2ksp h GLY 69 CO 0.61 0.00 -0.14 0.00 0.00 0.00 0.00 176.54 177.01 2ksp h ALA 70 N 2.06 -0.39 -0.33 3.60 0.00 -1.97 -1.09 119.26 121.15 2ksp h ALA 70 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 2ksp h ALA 70 Cb 0.23 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2ksp h ALA 70 CO 0.00 -0.54 -0.35 -0.91 0.00 0.00 0.00 179.25 177.44 2ksp h ASN 71 N -0.74 0.88 0.44 0.00 4.21 -1.86 -1.91 115.58 116.59 2ksp h ASN 71 Ca -0.04 -0.48 -0.08 0.00 1.21 0.00 0.00 56.30 56.91 2ksp h ASN 71 Cb 0.49 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.43 2ksp h ASN 71 CO 0.06 1.18 -0.38 0.00 -1.29 0.00 0.00 177.43 177.00 2ksp h ALA 72 N 0.73 1.30 -0.65 -0.83 0.00 -1.61 -1.82 119.26 116.38 2ksp h ALA 72 Ca 0.05 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 2ksp h ALA 72 Cb 0.94 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2ksp h ALA 72 CO 0.09 0.48 0.09 -0.22 0.00 0.00 0.00 179.25 179.68 2ksp h LYS 73 N 0.00 1.10 -0.67 0.00 3.64 -0.78 -0.85 116.57 119.00 2ksp h LYS 73 Ca -0.00 -0.30 0.01 0.00 -1.27 0.00 0.00 60.65 59.08 2ksp h LYS 73 Cb 0.70 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 2ksp h LYS 73 CO 0.05 1.02 0.44 0.87 -2.27 0.00 0.00 179.45 179.56 2ksp h LYS 74 N 1.01 0.89 -0.33 1.90 1.57 -0.63 -1.40 116.57 119.59 2ksp h LYS 74 Ca 0.20 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.87 2ksp h LYS 74 Cb 0.46 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2ksp h LYS 74 CO 0.02 0.59 0.03 1.49 -0.57 0.00 0.00 179.45 181.01 2ksp h GLU 75 N 0.91 0.56 -0.47 3.15 4.57 -1.12 -1.77 114.58 120.40 2ksp h GLU 75 Ca 0.25 -0.17 0.05 0.00 -1.18 0.00 0.00 59.36 58.31 2ksp h GLU 75 Cb -0.10 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 28.39 2ksp h GLU 75 CO -0.05 0.67 0.20 0.52 -1.18 0.00 0.00 179.01 179.17 2ksp h MET 76 N 0.37 0.38 0.00 1.92 2.86 -0.85 -1.10 114.93 118.52 2ksp h MET 76 Ca 0.10 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2ksp h MET 76 Cb 0.40 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2ksp h MET 76 CO 0.01 0.25 0.00 -0.39 1.06 0.00 0.00 176.91 177.84 2ksp h VAL 77 N 0.39 0.00 -0.01 -2.22 -1.51 -1.18 -1.81 116.25 109.91 2ksp h VAL 77 Ca 0.22 -0.59 -0.11 0.00 -1.23 0.00 0.00 66.70 64.99 2ksp h VAL 77 Cb 0.18 1.53 -0.02 0.00 -2.13 0.00 0.00 31.29 30.86 2ksp h VAL 77 CO -0.19 0.00 -0.52 0.11 -1.23 0.00 0.00 177.57 175.74 2ksp h LYS 78 N 0.00 0.03 0.00 5.19 1.57 -0.30 -2.78 116.57 120.28 2ksp h LYS 78 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2ksp h LYS 78 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2ksp h LYS 78 CO 0.00 0.54 0.00 0.43 -0.57 0.00 0.00 179.45 179.85 2ksp n SER 79 N -3.92 0.00 -1.89 0.86 7.64 -0.69 -4.87 113.62 110.75 2ksp n SER 79 Ca -0.01 0.38 -0.18 0.00 1.01 0.00 0.00 58.87 60.06 2ksp n SER 79 Cb 0.53 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 63.25 2ksp n SER 79 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2ksp n LYS 80 N -1.45 -1.41 -3.28 1.43 4.76 -1.05 -4.97 118.16 112.19 2ksp n LYS 80 Ca 0.07 0.97 -0.39 0.00 -2.87 0.00 0.00 58.31 56.10 2ksp n LYS 80 Cb 0.26 -5.42 -0.06 0.00 -1.84 0.00 0.00 35.03 27.97 2ksp n LYS 80 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2ksp s LEU 81 N -4.97 4.46 0.49 -0.35 2.96 -1.24 -5.03 118.68 115.01 2ksp s LEU 81 Ca 0.00 1.16 -0.23 0.00 -0.22 0.00 0.00 54.13 54.85 2ksp s LEU 81 Cb 0.00 -2.86 -0.08 0.00 0.50 0.00 0.00 46.19 43.76 2ksp s LEU 81 CO 0.00 0.20 1.12 -2.65 -1.32 0.00 0.00 176.35 173.70 2ksp n PRO 82 N 2.24 1.43 -0.36 0.98 -0.02 -1.26 -4.76 135.00 133.25 2ksp n PRO 82 Ca -0.09 0.52 0.10 0.00 -2.02 0.00 0.00 63.50 62.01 2ksp n PRO 82 Cb 0.51 -2.25 0.29 0.00 -0.02 0.00 0.00 33.50 32.03 2ksp n PRO 82 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2ksp h ASN 83 N 1.37 0.85 -0.61 2.55 4.21 -1.99 0.11 115.58 122.08 2ksp h ASN 83 Ca -0.47 0.07 0.05 0.00 1.21 0.00 0.00 56.30 57.16 2ksp h ASN 83 Cb 1.33 -0.09 -0.04 0.00 -1.12 0.00 0.00 38.32 38.41 2ksp h ASN 83 CO 0.56 0.37 0.40 0.74 -1.29 0.00 0.00 177.43 178.22 2ksp h THR 84 N 0.87 1.02 0.01 2.81 2.02 -1.99 0.29 112.91 117.95 2ksp h THR 84 Ca 0.54 -0.22 -0.25 0.00 0.77 0.00 0.00 66.41 67.26 2ksp h THR 84 Cb 0.72 0.34 0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2ksp h THR 84 CO -0.33 0.12 -0.97 0.58 0.37 0.00 0.00 175.52 175.29 2ksp h VAL 85 N 0.63 1.31 -0.54 3.16 2.07 -1.15 -2.26 116.25 119.47 2ksp h VAL 85 Ca 0.26 -2.23 0.05 0.00 0.82 0.00 0.00 66.70 65.59 2ksp h VAL 85 Cb 0.22 2.46 -0.05 0.00 -1.52 0.00 0.00 31.29 32.40 2ksp h VAL 85 CO -0.07 0.68 0.28 -0.07 0.02 0.00 0.00 177.57 178.41 2ksp h LEU 86 N 0.27 0.41 -0.87 2.57 4.07 -0.75 0.16 115.31 121.17 2ksp h LEU 86 Ca -0.12 0.03 0.08 0.00 0.08 0.00 0.00 57.88 57.94 2ksp h LEU 86 Cb 1.64 -0.05 -0.07 0.00 1.08 0.00 0.00 40.66 43.26 2ksp h LEU 86 CO 0.19 0.28 0.53 1.23 -1.08 0.00 0.00 178.44 179.59 2ksp h GLY 87 N 0.54 1.33 0.70 0.83 0.00 -0.86 -0.08 103.07 105.54 2ksp h GLY 87 Ca 0.24 -0.37 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 2ksp h GLY 87 CO -0.16 0.22 -0.19 0.50 0.00 0.00 0.00 176.54 176.91 2ksp h LYS 88 N 0.93 0.32 -0.14 4.80 1.57 -0.66 -0.31 116.57 123.09 2ksp h LYS 88 Ca 0.40 -0.20 0.04 0.00 -1.87 0.00 0.00 60.65 59.01 2ksp h LYS 88 Cb 0.25 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 2ksp h LYS 88 CO -0.20 0.79 -0.09 0.82 -0.57 0.00 0.00 179.45 180.19 2ksp h ILE 89 N -0.11 0.73 -0.55 1.86 1.08 -0.55 -0.98 117.51 118.99 2ksp h ILE 89 Ca 0.01 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.41 2ksp h ILE 89 Cb 0.77 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 35.22 2ksp h ILE 89 CO 0.04 0.00 0.10 -0.25 -0.69 0.00 0.00 178.15 177.35 2ksp h TRP 90 N -0.09 0.96 -0.18 1.37 2.91 -1.01 0.12 115.95 120.03 2ksp h TRP 90 Ca 0.08 -0.13 -0.06 0.00 1.13 0.00 0.00 58.89 59.91 2ksp h TRP 90 Cb 0.22 -0.26 -0.01 0.00 -0.51 0.00 0.00 29.16 28.59 2ksp h TRP 90 CO -0.22 0.85 -0.16 -0.22 -1.03 0.00 0.00 178.44 177.66 2ksp h LYS 91 N 0.80 0.30 0.14 2.65 3.64 -0.67 -0.62 116.57 122.80 2ksp h LYS 91 Ca 0.17 -0.08 -0.32 0.00 -1.27 0.00 0.00 60.65 59.15 2ksp h LYS 91 Cb 0.40 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2ksp h LYS 91 CO 0.01 0.46 -1.63 -0.07 -2.27 0.00 0.00 179.45 175.95 2ksp h LEU 92 N 0.28 0.46 -0.47 5.20 4.07 -1.01 -3.38 115.31 120.44 2ksp h LEU 92 Ca 0.05 -0.89 -0.05 0.00 0.08 0.00 0.00 57.88 57.07 2ksp h LEU 92 Cb 0.46 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.03 2ksp h LEU 92 CO 0.03 1.72 0.10 0.00 -1.08 0.00 0.00 178.44 179.20 2ksp h ALA 93 N 0.01 0.63 -1.48 1.53 0.00 -0.63 -3.34 119.26 115.97 2ksp h ALA 93 Ca -0.34 -0.22 -0.65 0.00 0.00 0.00 0.00 54.91 53.70 2ksp h ALA 93 Cb 1.91 -0.18 -0.14 0.00 0.00 0.00 0.00 17.79 19.39 2ksp h ALA 93 CO 0.10 0.34 1.26 0.34 0.00 0.00 0.00 179.25 181.28 2ksp s ASP 94 N -6.15 6.62 0.00 0.00 2.15 -0.25 -4.44 116.67 114.61 2ksp s ASP 94 Ca -0.13 -1.88 -0.09 0.00 0.43 0.00 0.00 52.55 50.88 2ksp s ASP 94 Cb 0.11 -2.49 -0.31 0.00 -0.30 0.00 0.00 42.92 39.94 2ksp s ASP 94 CO 0.79 -1.24 0.86 0.58 -0.17 0.00 0.00 175.17 175.99 2ksp h VAL 95 N 6.15 1.15 0.00 1.11 2.07 -1.83 -3.33 116.25 121.57 2ksp h VAL 95 Ca 0.21 -2.71 0.00 0.00 0.82 0.00 0.00 66.70 65.02 2ksp h VAL 95 Cb 1.00 2.85 0.00 0.00 -1.52 0.00 0.00 31.29 33.62 2ksp h VAL 95 CO 1.28 0.84 0.00 -2.24 0.02 0.00 0.00 177.57 177.47 2ksp h ASP 96 N 0.10 0.00 -5.07 0.57 2.03 -1.95 -3.47 116.42 108.63 2ksp h ASP 96 Ca -0.27 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 55.76 2ksp h ASP 96 Cb 2.08 0.00 0.15 0.00 -0.83 0.00 0.00 39.33 40.72 2ksp h ASP 96 CO 0.20 0.00 -0.65 0.29 -1.03 0.00 0.00 179.24 178.05 2ksp n LYS 97 N -2.66 -5.26 0.05 4.15 4.76 -1.25 -4.93 118.16 113.01 2ksp n LYS 97 Ca 0.04 0.72 0.11 0.00 -2.87 0.00 0.00 58.31 56.31 2ksp n LYS 97 Cb 0.41 -5.32 0.02 0.00 -1.84 0.00 0.00 35.03 28.30 2ksp n LYS 97 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2ksp n ASP 98 N -2.81 0.62 0.00 4.39 5.75 -1.26 -4.96 116.55 118.28 2ksp n ASP 98 Ca -0.23 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.54 2ksp n ASP 98 Cb 0.64 0.74 0.00 0.00 -1.03 0.00 0.00 41.12 41.47 2ksp n ASP 98 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ksp n GLY 99 N 1.31 0.66 3.56 6.12 0.00 -1.26 -5.04 105.19 110.54 2ksp n GLY 99 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 2ksp n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ksp s LEU 100 N 0.00 2.06 -0.26 0.99 1.43 -1.26 -4.50 118.68 117.14 2ksp s LEU 100 Ca 0.00 -1.66 -0.02 0.00 -1.03 0.00 0.00 54.13 51.42 2ksp s LEU 100 Cb 0.00 -0.23 0.03 0.00 0.03 0.00 0.00 46.19 46.02 2ksp s LEU 100 CO 0.00 -0.90 -0.04 -0.76 0.23 0.00 0.00 176.35 174.88 2ksp s LEU 101 N -3.65 3.42 0.00 1.79 1.43 -0.67 -4.85 118.68 116.15 2ksp s LEU 101 Ca 0.21 -0.96 -0.08 0.00 -1.03 0.00 0.00 54.13 52.27 2ksp s LEU 101 Cb 0.03 -1.69 0.16 0.00 0.03 0.00 0.00 46.19 44.71 2ksp s LEU 101 CO 0.13 -0.17 0.96 -0.67 0.23 0.00 0.00 176.35 176.83 2ksp n ASP 102 N 4.67 0.47 -0.04 2.29 2.03 -1.26 -1.56 116.55 123.15 2ksp n ASP 102 Ca -0.15 -1.59 -0.04 0.00 0.52 0.00 0.00 54.79 53.52 2ksp n ASP 102 Cb 0.46 -0.70 0.17 0.00 -0.72 0.00 0.00 41.12 40.33 2ksp n ASP 102 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2ksp h ASP 103 N -1.04 0.62 -0.19 1.67 3.58 -1.99 0.20 116.42 119.28 2ksp h ASP 103 Ca -0.31 -0.19 -0.15 0.00 0.42 0.00 0.00 57.03 56.80 2ksp h ASP 103 Cb 0.96 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.84 2ksp h ASP 103 CO 0.26 0.80 -0.46 -0.33 -2.88 0.00 0.00 179.24 176.63 2ksp h GLU 104 N 0.57 0.64 -0.24 0.28 3.07 -1.97 -2.13 114.58 114.79 2ksp h GLU 104 Ca 0.09 -0.44 -0.06 0.00 -0.50 0.00 0.00 59.36 58.45 2ksp h GLU 104 Cb 0.60 0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 2ksp h GLU 104 CO 0.04 1.06 -0.10 0.93 -1.40 0.00 0.00 179.01 179.54 2ksp h GLU 105 N 0.32 0.49 -0.29 2.33 5.08 -1.66 -1.65 114.58 119.19 2ksp h GLU 105 Ca -0.00 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 58.02 2ksp h GLU 105 Cb 1.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2ksp h GLU 105 CO 0.10 0.75 -0.34 0.35 -1.00 0.00 0.00 179.01 178.86 2ksp h PHE 106 N 0.22 0.75 -0.77 4.33 3.57 -0.69 0.79 116.94 125.14 2ksp h PHE 106 Ca 0.06 -0.20 -0.04 0.00 3.53 0.00 0.00 57.97 61.32 2ksp h PHE 106 Cb 0.59 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 2ksp h PHE 106 CO 0.06 0.90 0.34 0.00 -2.23 0.00 0.00 178.31 177.37 2ksp h ALA 107 N 1.08 0.99 -0.36 2.41 0.00 -1.27 0.58 119.26 122.70 2ksp h ALA 107 Ca 0.06 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2ksp h ALA 107 Cb 0.84 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2ksp h ALA 107 CO 0.07 0.58 -0.18 -0.07 0.00 0.00 0.00 179.25 179.65 2ksp h LEU 108 N 1.09 0.66 0.11 0.00 3.38 -0.96 -0.25 115.31 119.35 2ksp h LEU 108 Ca 0.26 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2ksp h LEU 108 Cb 0.16 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2ksp h LEU 108 CO -0.03 0.85 -0.14 0.00 0.09 0.00 0.00 178.44 179.22 2ksp h ALA 109 N 1.21 -0.25 -0.89 1.53 0.00 -0.07 0.70 119.26 121.50 2ksp h ALA 109 Ca 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2ksp h ALA 109 Cb 0.64 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 2ksp h ALA 109 CO 0.05 -0.66 0.50 -0.91 0.00 0.00 0.00 179.25 178.22 2ksp h ASN 110 N -0.29 1.10 -0.23 0.00 -0.26 -0.75 -1.38 115.58 113.77 2ksp h ASN 110 Ca 0.01 -0.09 0.01 0.00 -0.56 0.00 0.00 56.30 55.67 2ksp h ASN 110 Cb 0.29 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 2ksp h ASN 110 CO -0.06 0.87 0.15 -0.74 -1.06 0.00 0.00 177.43 176.59 2ksp h HIS 111 N 1.24 0.27 -0.59 1.19 2.76 -0.66 0.55 115.15 119.91 2ksp h HIS 111 Ca 0.31 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.43 2ksp h HIS 111 Cb 0.01 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 28.86 2ksp h HIS 111 CO 0.01 0.17 0.15 -0.07 -1.30 0.00 0.00 177.93 176.89 2ksp h LEU 112 N 0.30 0.89 -0.90 0.26 3.38 -0.48 0.35 115.31 119.12 2ksp h LEU 112 Ca 0.09 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2ksp h LEU 112 Cb -0.02 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 2ksp h LEU 112 CO -0.03 0.89 0.55 0.40 0.09 0.00 0.00 178.44 180.34 2ksp h ILE 113 N 0.86 1.25 -0.80 1.22 2.04 -1.06 -1.34 117.51 119.67 2ksp h ILE 113 Ca 0.19 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.55 2ksp h ILE 113 Cb 0.34 -0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.35 2ksp h ILE 113 CO 0.00 0.25 0.52 0.50 0.00 0.00 0.00 178.15 179.43 2ksp h LYS 114 N 1.23 1.01 -1.00 2.37 3.64 -0.22 -1.50 116.57 122.11 2ksp h LYS 114 Ca 0.32 -0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.72 2ksp h LYS 114 Cb -0.07 -0.23 -0.07 0.00 -0.41 0.00 0.00 32.23 31.46 2ksp h LYS 114 CO -0.06 0.67 0.64 0.28 -2.27 0.00 0.00 179.45 178.71 2ksp h VAL 115 N 1.04 1.05 -0.44 2.00 2.07 0.13 0.46 116.25 122.57 2ksp h VAL 115 Ca 0.31 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2ksp h VAL 115 Cb -0.06 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 29.52 2ksp h VAL 115 CO -0.09 0.21 0.27 0.11 0.02 0.00 0.00 177.57 178.09 2ksp h LYS 116 N 1.13 0.59 0.00 1.57 1.79 -0.62 -0.68 116.57 120.36 2ksp h LYS 116 Ca 0.44 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.82 2ksp h LYS 116 Cb 0.23 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 2ksp h LYS 116 CO -0.19 0.42 -0.21 -0.07 -1.08 0.00 0.00 179.45 178.33 2ksp h LEU 117 N 0.58 0.00 -1.29 2.94 3.38 -0.01 -1.08 115.31 119.83 2ksp h LEU 117 Ca 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2ksp h LEU 117 Cb -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2ksp h LEU 117 CO -0.03 0.21 -0.09 -0.33 0.09 0.00 0.00 178.44 178.28 2ksp h GLU 118 N 0.00 0.00 0.00 1.13 4.39 0.36 -3.46 114.58 117.00 2ksp h GLU 118 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2ksp h GLU 118 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2ksp h GLU 118 CO 0.03 0.09 0.00 0.41 -1.16 0.00 0.00 179.01 178.38 2ksp n GLY 119 N 0.09 1.36 3.51 -3.84 0.00 -0.41 -5.09 105.19 100.82 2ksp n GLY 119 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2ksp n GLY 119 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ksp n HIS 120 N -0.84 1.02 -4.08 1.61 8.25 -0.31 -5.01 115.22 115.86 2ksp n HIS 120 Ca 0.00 -2.46 -0.07 0.00 -0.26 0.00 0.00 57.72 54.93 2ksp n HIS 120 Cb 0.00 -0.28 -0.10 0.00 1.12 0.00 0.00 29.99 30.73 2ksp n HIS 120 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 2ksp s GLU 121 N -3.75 0.64 -0.21 -0.41 4.04 -1.26 -3.26 118.70 114.48 2ksp s GLU 121 Ca 0.03 -1.21 -0.17 0.00 0.04 0.00 0.00 54.97 53.65 2ksp s GLU 121 Cb 0.00 0.22 -0.03 0.00 0.02 0.00 0.00 34.13 34.34 2ksp s GLU 121 CO 0.02 -0.12 0.48 -0.48 -1.84 0.00 0.00 175.26 173.31 2ksp s LEU 122 N -2.92 4.14 0.00 1.83 2.34 -1.26 -4.95 118.68 117.86 2ksp s LEU 122 Ca 0.07 0.60 0.00 0.00 0.06 0.00 0.00 54.13 54.86 2ksp s LEU 122 Cb 0.08 -2.64 0.00 0.00 -0.56 0.00 0.00 46.19 43.07 2ksp s LEU 122 CO -0.10 -0.16 0.38 -0.81 -1.06 0.00 0.00 176.35 174.60 2ksp n PRO 123 N 4.79 0.52 -1.33 1.48 -0.04 -1.26 -4.69 135.00 134.47 2ksp n PRO 123 Ca -0.06 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.29 2ksp n PRO 123 Cb 0.51 -1.14 -0.05 0.00 -0.04 0.00 0.00 33.50 32.78 2ksp n PRO 123 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ksp n ALA 124 N -0.10 -0.17 -2.41 0.55 0.00 -1.26 -5.00 120.51 112.12 2ksp n ALA 124 Ca 0.00 0.18 -0.30 0.00 0.00 0.00 0.00 53.44 53.33 2ksp n ALA 124 Cb 0.07 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 17.96 2ksp n ALA 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ksp s ASP 125 N -2.71 3.48 -0.59 0.00 1.01 -1.26 -5.03 116.67 111.56 2ksp s ASP 125 Ca 0.00 -0.61 -0.14 0.00 0.71 0.00 0.00 52.55 52.51 2ksp s ASP 125 Cb 0.00 -0.37 0.15 0.00 1.01 0.00 0.00 42.92 43.70 2ksp s ASP 125 CO 0.00 0.21 0.53 -0.76 0.21 0.00 0.00 175.17 175.36 2ksp s LEU 126 N -1.74 6.21 0.54 1.23 1.43 -1.26 -5.08 118.68 120.01 2ksp s LEU 126 Ca 0.14 -2.01 -0.21 0.00 -1.03 0.00 0.00 54.13 51.02 2ksp s LEU 126 Cb -0.10 -2.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.89 2ksp s LEU 126 CO 0.06 -0.77 1.23 -2.16 0.23 0.00 0.00 176.35 174.94 2ksp s PRO 127 N 1.24 3.26 0.57 1.29 0.04 -1.26 -4.61 135.00 135.53 2ksp s PRO 127 Ca 0.07 1.91 0.30 0.00 0.04 0.00 0.00 61.00 63.32 2ksp s PRO 127 Cb -0.25 -2.16 1.46 0.00 0.04 0.00 0.00 34.50 33.58 2ksp s PRO 127 CO -0.00 -1.00 1.88 -1.35 0.04 0.00 0.00 177.00 176.57 2ksp h PRO 128 N 1.39 0.00 -0.14 0.56 0.11 -1.98 0.31 132.00 132.25 2ksp h PRO 128 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2ksp h PRO 128 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2ksp h PRO 128 CO 0.57 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.97 2ksp n HIS 129 N -3.91 0.19 0.00 0.65 1.44 -1.26 -3.80 115.22 108.52 2ksp n HIS 129 Ca 0.12 -0.10 0.00 0.00 -2.01 0.00 0.00 57.72 55.74 2ksp n HIS 129 Cb 0.80 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.91 2ksp n HIS 129 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2ksp n LEU 130 N -0.06 0.17 -4.67 2.39 4.77 0.88 -3.25 117.00 117.22 2ksp n LEU 130 Ca 0.10 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.66 2ksp n LEU 130 Cb 0.18 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2ksp n LEU 130 CO 0.07 0.03 0.69 0.54 -1.33 0.00 0.00 177.39 177.39 2ksp s VAL 131 N -1.38 4.83 0.18 4.08 0.11 0.02 -4.98 120.40 123.26 2ksp s VAL 131 Ca 0.00 1.77 -0.33 0.00 -2.93 0.00 0.00 61.98 60.48 2ksp s VAL 131 Cb 0.00 -4.19 -0.13 0.00 -1.53 0.00 0.00 36.38 30.52 2ksp s VAL 131 CO 0.00 -0.01 1.63 -2.65 -3.33 0.00 0.00 175.10 170.74 2ksp n PRO 132 N 5.35 2.38 0.23 1.54 -0.02 -1.26 -4.81 135.00 138.41 2ksp n PRO 132 Ca 0.06 0.86 0.14 0.00 -2.02 0.00 0.00 63.50 62.54 2ksp n PRO 132 Cb 0.48 -2.66 0.77 0.00 -0.02 0.00 0.00 33.50 32.08 2ksp n PRO 132 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2ksp h PRO 133 N 6.23 0.00 0.00 0.52 0.11 -1.95 -0.48 132.00 136.44 2ksp h PRO 133 Ca -0.44 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 2ksp h PRO 133 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2ksp h PRO 133 CO 0.91 0.00 -0.25 1.03 -0.21 0.00 0.00 178.00 179.48 2ksp h SER 134 N 0.00 0.00 -0.80 -2.05 0.87 -2.02 -2.95 113.55 106.59 2ksp h SER 134 Ca 0.05 0.00 -0.41 0.00 -1.23 0.00 0.00 61.79 60.20 2ksp h SER 134 Cb 0.23 0.00 -0.24 0.00 -0.44 0.00 0.00 62.40 61.95 2ksp h SER 134 CO -0.00 0.25 0.52 0.29 -0.53 0.00 0.00 176.83 177.36 2ksp n LYS 135 N -3.82 2.09 -3.53 2.24 4.01 -0.19 -4.87 118.16 114.09 2ksp n LYS 135 Ca -0.02 -2.46 -0.41 0.00 -0.51 0.00 0.00 58.31 54.92 2ksp n LYS 135 Cb 0.35 -1.97 -0.11 0.00 -0.51 0.00 0.00 35.03 32.79 2ksp n LYS 135 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2ksp s ARG 136 N -2.68 3.10 0.24 1.97 0.52 -1.12 -4.97 118.95 116.01 2ksp s ARG 136 Ca 0.46 -0.91 0.09 0.00 -0.52 0.00 0.00 55.73 54.85 2ksp s ARG 136 Cb 0.39 -3.83 -0.04 0.00 0.52 0.00 0.00 34.95 31.99 2ksp s ARG 136 CO 0.09 -0.62 0.01 -0.98 0.02 0.00 0.00 175.30 173.81 2ksp s ARG 137 N 1.65 2.36 -0.35 3.54 1.70 -1.26 -5.10 118.95 121.48 2ksp s ARG 137 Ca 0.04 -1.31 -0.13 0.00 -0.47 0.00 0.00 55.73 53.86 2ksp s ARG 137 Cb -0.18 -2.24 -0.01 0.00 -0.57 0.00 0.00 34.95 31.95 2ksp s ARG 137 CO 0.09 0.39 0.25 -1.58 -1.08 0.00 0.00 175.30 173.37 2ksp s HIS 138 N -2.15 3.23 0.00 5.89 5.65 -1.26 -5.27 115.29 121.39 2ksp s HIS 138 Ca 0.30 -0.26 0.00 0.00 0.25 0.00 0.00 55.06 55.35 2ksp s HIS 138 Cb -0.07 -2.49 0.00 0.00 -1.18 0.00 0.00 32.58 28.83 2ksp s HIS 138 CO 0.20 -0.39 0.00 -0.85 -0.65 0.00 0.00 174.74 173.05