#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 3.79 0.49 1.61 0.02 -1.26 -5.01 135.00 134.64 2ksp s PRO 36 Ca 0.00 1.21 -0.07 0.00 0.02 0.00 0.00 61.00 62.15 2ksp s PRO 36 Cb 0.00 -3.95 -0.04 0.00 0.02 0.00 0.00 34.50 30.53 2ksp s PRO 36 CO 0.00 -1.29 0.82 -0.48 -0.33 0.00 0.00 177.00 175.72 2ksp s LEU 37 N 4.84 3.60 -0.14 -5.54 0.05 -1.26 -5.08 118.68 115.15 2ksp s LEU 37 Ca 0.60 1.04 -0.04 0.00 0.05 0.00 0.00 54.13 55.78 2ksp s LEU 37 Cb -0.17 -4.00 -0.03 0.00 -2.05 0.00 0.00 46.19 39.94 2ksp s LEU 37 CO 0.27 -0.59 0.00 -0.83 -0.55 0.00 0.00 176.35 174.65 2ksp s GLY 38 N -3.95 1.82 -0.01 -3.48 0.00 -1.26 -5.10 107.32 95.34 2ksp s GLY 38 Ca 0.49 -0.79 -0.18 0.00 0.00 0.00 0.00 44.72 44.24 2ksp s GLY 38 CO 0.44 -0.22 0.50 -1.35 0.00 0.00 0.00 173.10 172.47 2ksp s SER 39 N -0.10 6.87 -0.94 1.64 1.04 -1.26 -5.01 113.70 115.95 2ksp s SER 39 Ca 0.04 1.04 -0.24 0.00 0.48 0.00 0.00 55.95 57.27 2ksp s SER 39 Cb -0.13 -2.31 0.05 0.00 0.10 0.00 0.00 66.02 63.74 2ksp s SER 39 CO 0.02 0.20 1.37 -0.62 0.98 0.00 0.00 173.24 175.19 2ksp s ASP 40 N -0.53 6.42 -0.59 7.02 -1.08 -1.26 -4.85 116.67 121.80 2ksp s ASP 40 Ca 0.27 -1.24 0.06 0.00 -0.52 0.00 0.00 52.55 51.12 2ksp s ASP 40 Cb -0.17 -2.55 0.26 0.00 -1.46 0.00 0.00 42.92 38.99 2ksp s ASP 40 CO 0.15 -1.56 0.72 0.47 0.52 0.00 0.00 175.17 175.47 2ksp n ASP 41 N 8.81 3.20 -4.09 -0.34 8.00 -1.26 -5.06 116.55 125.81 2ksp n ASP 41 Ca 0.24 -3.33 -0.29 0.00 0.71 0.00 0.00 54.79 52.11 2ksp n ASP 41 Cb 0.50 -0.66 -0.17 0.00 -0.02 0.00 0.00 41.12 40.78 2ksp n ASP 41 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2ksp s VAL 42 N -2.38 1.62 -0.13 2.53 0.11 -1.26 -4.95 120.40 115.93 2ksp s VAL 42 Ca 0.40 -0.72 0.02 0.00 -2.93 0.00 0.00 61.98 58.75 2ksp s VAL 42 Cb 0.16 -1.46 0.01 0.00 -1.53 0.00 0.00 36.38 33.57 2ksp s VAL 42 CO -0.03 0.46 -0.19 -1.83 -3.33 0.00 0.00 175.10 170.18 2ksp s GLU 43 N 0.88 2.63 -0.99 1.54 -1.05 -1.26 -5.07 118.70 115.38 2ksp s GLU 43 Ca -0.08 -0.71 -0.23 0.00 -0.15 0.00 0.00 54.97 53.79 2ksp s GLU 43 Cb -0.15 -2.18 0.04 0.00 -0.44 0.00 0.00 34.13 31.39 2ksp s GLU 43 CO -0.00 -0.05 1.51 -0.46 0.95 0.00 0.00 175.26 177.21 2ksp s TRP 44 N 0.93 2.42 0.43 4.83 -0.00 -1.26 -4.82 118.94 121.46 2ksp s TRP 44 Ca -0.06 -0.61 0.12 0.00 -0.00 0.00 0.00 56.10 55.55 2ksp s TRP 44 Cb -0.15 -4.61 0.98 0.00 -0.00 0.00 0.00 33.47 29.69 2ksp s TRP 44 CO -0.02 -1.92 2.01 -0.39 -0.00 0.00 0.00 176.95 176.63 2ksp h VAL 45 N 6.84 0.97 0.00 5.86 -1.51 -1.98 0.14 116.25 126.57 2ksp h VAL 45 Ca 0.17 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.49 2ksp h VAL 45 Cb 1.01 0.49 0.00 0.00 -2.13 0.00 0.00 31.29 30.66 2ksp h VAL 45 CO 1.39 0.08 0.00 1.62 -1.23 0.00 0.00 177.57 179.44 2ksp h VAL 46 N 0.45 0.00 0.00 7.19 3.04 -1.90 -2.04 116.25 122.99 2ksp h VAL 46 Ca 0.22 -0.30 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 2ksp h VAL 46 Cb 0.31 1.10 0.00 0.00 -2.01 0.00 0.00 31.29 30.69 2ksp h VAL 46 CO -0.06 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.11 2ksp n GLY 47 N -0.01 -0.96 0.09 3.17 0.00 0.49 -1.93 105.19 106.04 2ksp n GLY 47 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2ksp n GLY 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ksp n LYS 48 N -1.32 0.63 -0.04 1.61 5.02 -0.77 -4.02 118.16 119.28 2ksp n LYS 48 Ca 0.08 0.16 0.12 0.00 -2.02 0.00 0.00 58.31 56.66 2ksp n LYS 48 Cb 0.16 -1.76 0.40 0.00 -0.02 0.00 0.00 35.03 33.81 2ksp n LYS 48 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2ksp n ASP 49 N -2.81 1.90 -0.09 4.39 8.00 -0.81 -4.54 116.55 122.58 2ksp n ASP 49 Ca -0.11 -1.67 -0.06 0.00 0.71 0.00 0.00 54.79 53.66 2ksp n ASP 49 Cb 0.84 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.88 2ksp n ASP 49 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2ksp h LYS 50 N 2.77 0.03 -1.00 -1.24 1.79 -1.67 -2.00 116.57 115.26 2ksp h LYS 50 Ca 0.00 -0.00 0.16 0.00 -2.18 0.00 0.00 60.65 58.63 2ksp h LYS 50 Cb 0.60 -0.01 -0.10 0.00 -1.58 0.00 0.00 32.23 31.14 2ksp h LYS 50 CO 0.00 0.02 0.62 -1.00 -1.08 0.00 0.00 179.45 178.01 2ksp h PRO 51 N 0.03 0.82 0.04 3.15 0.13 -1.89 0.28 132.00 134.57 2ksp h PRO 51 Ca 0.16 -0.05 -0.25 0.00 -0.87 0.00 0.00 66.00 64.99 2ksp h PRO 51 Cb 0.23 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 31.15 2ksp h PRO 51 CO -0.31 0.54 -1.27 1.15 -0.23 0.00 0.00 178.00 177.89 2ksp h THR 52 N 0.85 1.42 0.00 1.56 2.02 -1.82 -1.96 112.91 114.98 2ksp h THR 52 Ca 0.54 -3.12 -0.03 0.00 0.77 0.00 0.00 66.41 64.57 2ksp h THR 52 Cb 0.74 2.77 -0.00 0.00 -1.74 0.00 0.00 68.15 69.92 2ksp h THR 52 CO -0.32 0.85 -0.13 1.88 0.37 0.00 0.00 175.52 178.16 2ksp h TYR 53 N 0.03 0.00 -0.22 3.16 0.05 -0.58 -1.71 116.97 117.69 2ksp h TYR 53 Ca -0.12 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.52 2ksp h TYR 53 Cb 1.89 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.63 2ksp h TYR 53 CO 0.02 0.13 -0.41 0.22 -1.05 0.00 0.00 178.16 177.08 2ksp h ASP 54 N 0.00 0.74 -0.52 3.88 3.58 -0.32 0.67 116.42 124.46 2ksp h ASP 54 Ca -0.00 -0.54 0.04 0.00 0.42 0.00 0.00 57.03 56.95 2ksp h ASP 54 Cb 0.66 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 41.46 2ksp h ASP 54 CO 0.02 1.14 0.35 -0.33 -2.88 0.00 0.00 179.24 177.53 2ksp h GLU 55 N 0.37 0.54 0.02 0.28 5.08 -0.55 -0.62 114.58 119.70 2ksp h GLU 55 Ca 0.01 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2ksp h GLU 55 Cb 1.00 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2ksp h GLU 55 CO 0.09 0.35 -0.01 0.82 -1.00 0.00 0.00 179.01 179.27 2ksp h ILE 56 N 0.55 1.32 -0.94 3.13 2.04 -1.25 -3.29 117.51 119.07 2ksp h ILE 56 Ca 0.22 -1.88 0.20 0.00 1.00 0.00 0.00 64.86 64.40 2ksp h ILE 56 Cb 0.17 2.44 -0.11 0.00 -0.74 0.00 0.00 36.82 38.58 2ksp h ILE 56 CO -0.06 0.43 0.51 0.15 0.00 0.00 0.00 178.15 179.18 2ksp h PHE 57 N -0.95 0.87 0.00 1.37 3.57 -0.55 0.01 116.94 121.26 2ksp h PHE 57 Ca -0.00 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 2ksp h PHE 57 Cb 0.72 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 2ksp h PHE 57 CO 0.19 0.11 -0.19 1.88 -2.23 0.00 0.00 178.31 178.07 2ksp h TYR 58 N 0.59 0.00 0.00 0.41 -1.99 -1.26 -3.01 116.97 111.71 2ksp h TYR 58 Ca 0.56 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 61.27 2ksp h TYR 58 Cb 0.95 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.68 2ksp h TYR 58 CO -0.06 0.19 -0.08 1.79 -0.00 0.00 0.00 178.16 180.00 2ksp h THR 59 N 0.00 0.14 -0.00 -2.88 1.35 -1.06 -2.86 112.91 107.60 2ksp h THR 59 Ca -0.00 -1.17 0.00 0.00 -0.55 0.00 0.00 66.41 64.69 2ksp h THR 59 Cb 0.88 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 69.34 2ksp h THR 59 CO 0.02 0.08 -0.13 0.18 -0.25 0.00 0.00 175.52 175.42 2ksp n LEU 60 N -3.12 0.50 -2.22 3.87 4.77 -1.12 -4.99 117.00 114.69 2ksp n LEU 60 Ca 0.03 -0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.01 2ksp n LEU 60 Cb 0.55 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 2ksp n LEU 60 CO 0.35 0.09 -0.32 -0.24 -1.33 0.00 0.00 177.39 175.94 2ksp n SER 61 N -0.96 -4.68 -4.74 -1.43 2.88 -1.08 -4.95 113.62 98.66 2ksp n SER 61 Ca 0.14 0.86 -0.41 0.00 -1.33 0.00 0.00 58.87 58.12 2ksp n SER 61 Cb 0.29 -3.62 -0.03 0.00 -0.75 0.00 0.00 64.21 60.10 2ksp n SER 61 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 2ksp s PRO 62 N -0.95 4.30 -0.35 -1.46 0.02 -1.26 -4.87 135.00 130.43 2ksp s PRO 62 Ca -0.04 2.22 -0.05 0.00 0.02 0.00 0.00 61.00 63.15 2ksp s PRO 62 Cb 0.00 -3.15 0.06 0.00 0.02 0.00 0.00 34.50 31.44 2ksp s PRO 62 CO 0.48 -0.39 0.12 0.08 -0.33 0.00 0.00 177.00 176.96 2ksp s VAL 63 N 0.20 3.60 -1.06 3.83 1.01 0.15 -4.62 120.40 123.51 2ksp s VAL 63 Ca 0.60 -1.38 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 2ksp s VAL 63 Cb -0.40 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 32.84 2ksp s VAL 63 CO 0.40 -0.30 0.92 0.59 0.00 0.00 0.00 175.10 176.71 2ksp n ASN 64 N 4.75 -5.00 0.00 3.32 5.03 -1.26 -3.09 115.26 119.01 2ksp n ASN 64 Ca -0.11 -0.44 0.00 0.00 0.87 0.00 0.00 54.58 54.91 2ksp n ASN 64 Cb 0.44 -4.12 0.00 0.00 -1.02 0.00 0.00 39.78 35.08 2ksp n ASN 64 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2ksp n GLY 65 N -1.62 0.78 3.85 7.41 0.00 -1.26 -5.01 105.19 109.34 2ksp n GLY 65 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.92 2ksp n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ksp s LYS 66 N -0.67 1.79 0.24 1.61 0.00 -1.18 -4.34 119.74 117.20 2ksp s LYS 66 Ca 0.00 -1.00 0.06 0.00 0.00 0.00 0.00 55.97 55.03 2ksp s LYS 66 Cb 0.00 0.60 -0.04 0.00 0.00 0.00 0.00 37.83 38.40 2ksp s LYS 66 CO 0.00 -0.82 0.21 0.96 0.00 0.00 0.00 175.35 175.70 2ksp s ILE 67 N -3.80 4.58 0.64 3.79 -4.36 -0.62 0.32 121.20 121.75 2ksp s ILE 67 Ca 0.11 -1.30 -0.03 0.00 -0.26 0.00 0.00 60.65 59.17 2ksp s ILE 67 Cb -0.06 -3.46 0.06 0.00 1.25 0.00 0.00 42.46 40.25 2ksp s ILE 67 CO 0.07 -0.32 0.91 0.42 0.24 0.00 0.00 174.94 176.26 2ksp s THR 68 N -2.07 2.43 0.44 8.37 -4.23 -1.26 -1.58 115.64 117.75 2ksp s THR 68 Ca 0.33 -0.46 0.20 0.00 -1.18 0.00 0.00 61.69 60.57 2ksp s THR 68 Cb -0.08 -2.97 0.23 0.00 1.34 0.00 0.00 72.50 71.01 2ksp s THR 68 CO 0.25 0.00 2.03 1.23 -0.54 0.00 0.00 174.62 177.59 2ksp h GLY 69 N -0.31 0.00 0.81 3.99 0.00 -1.92 -2.64 103.07 103.00 2ksp h GLY 69 Ca -0.43 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 2ksp h GLY 69 CO 0.55 0.00 -0.20 0.00 0.00 0.00 0.00 176.54 176.89 2ksp h ALA 70 N 1.84 0.27 -0.29 3.60 0.00 -1.93 0.66 119.26 123.40 2ksp h ALA 70 Ca -0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2ksp h ALA 70 Cb 0.32 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2ksp h ALA 70 CO 0.02 0.20 0.10 -0.91 0.00 0.00 0.00 179.25 178.66 2ksp h ASN 71 N 0.11 0.42 1.27 0.00 -0.26 -1.88 -1.81 115.58 113.43 2ksp h ASN 71 Ca 0.03 -0.19 -0.06 0.00 -0.56 0.00 0.00 56.30 55.51 2ksp h ASN 71 Cb 0.74 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.89 2ksp h ASN 71 CO 0.05 0.49 -0.31 0.00 -1.06 0.00 0.00 177.43 176.61 2ksp h ALA 72 N 0.94 0.88 0.06 -0.83 0.00 -1.53 -2.22 119.26 116.55 2ksp h ALA 72 Ca 0.10 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2ksp h ALA 72 Cb 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2ksp h ALA 72 CO -0.00 0.38 -0.03 -0.22 0.00 0.00 0.00 179.25 179.38 2ksp h LYS 73 N 0.00 -0.08 0.00 0.00 3.64 -0.29 0.14 116.57 119.98 2ksp h LYS 73 Ca -0.00 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 2ksp h LYS 73 Cb 1.02 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 2ksp h LYS 73 CO 0.04 0.01 -0.39 1.57 -2.27 0.00 0.00 179.45 178.41 2ksp h LYS 74 N -0.15 0.00 -0.46 1.90 2.10 -1.26 -1.74 116.57 116.96 2ksp h LYS 74 Ca -0.01 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.51 2ksp h LYS 74 Cb 0.12 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.44 2ksp h LYS 74 CO 0.01 0.39 -0.22 1.49 -2.00 0.00 0.00 179.45 179.12 2ksp h GLU 75 N 0.00 0.96 -0.73 0.07 4.57 -1.17 -1.80 114.58 116.49 2ksp h GLU 75 Ca -0.00 -0.42 0.01 0.00 -1.18 0.00 0.00 59.36 57.76 2ksp h GLU 75 Cb 0.81 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.33 2ksp h GLU 75 CO 0.05 1.09 0.48 0.52 -1.18 0.00 0.00 179.01 179.97 2ksp h MET 76 N 0.81 0.95 0.00 1.92 2.86 -0.00 -1.24 114.93 120.22 2ksp h MET 76 Ca 0.10 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.63 2ksp h MET 76 Cb 0.80 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 2ksp h MET 76 CO 0.07 0.63 -0.24 -0.39 1.06 0.00 0.00 176.91 178.03 2ksp h VAL 77 N 0.98 0.58 0.00 -2.22 -1.51 -1.26 -1.81 116.25 111.00 2ksp h VAL 77 Ca 0.27 -1.19 -0.01 0.00 -1.23 0.00 0.00 66.70 64.54 2ksp h VAL 77 Cb -0.10 1.81 -0.00 0.00 -2.13 0.00 0.00 31.29 30.87 2ksp h VAL 77 CO -0.07 0.24 -0.05 0.11 -1.23 0.00 0.00 177.57 176.57 2ksp h LYS 78 N 0.00 0.00 -0.03 5.19 1.57 -0.36 -2.19 116.57 120.75 2ksp h LYS 78 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ksp h LYS 78 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 2ksp h LYS 78 CO 0.03 0.05 0.00 0.43 -0.57 0.00 0.00 179.45 179.39 2ksp n SER 79 N -3.16 0.76 -1.82 0.86 7.64 -0.65 -4.92 113.62 112.34 2ksp n SER 79 Ca 0.01 -1.35 -0.19 0.00 1.01 0.00 0.00 58.87 58.35 2ksp n SER 79 Cb 0.36 -0.02 -0.04 0.00 -1.01 0.00 0.00 64.21 63.50 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 -0.37 -1.42 -3.81 1.43 4.01 -0.82 -4.98 118.16 112.20 2ksp n LYS 80 Ca 0.19 1.04 -0.37 0.00 -0.51 0.00 0.00 58.31 58.66 2ksp n LYS 80 Cb 0.22 -5.47 -0.06 0.00 -0.51 0.00 0.00 35.03 29.21 2ksp n LYS 80 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2ksp s LEU 81 N -4.89 4.40 0.83 -0.35 1.43 -1.24 -5.08 118.68 113.77 2ksp s LEU 81 Ca 0.00 0.55 -0.11 0.00 -1.03 0.00 0.00 54.13 53.54 2ksp s LEU 81 Cb 0.00 -2.22 0.10 0.00 0.03 0.00 0.00 46.19 44.10 2ksp s LEU 81 CO 0.00 0.38 1.13 -2.84 0.23 0.00 0.00 176.35 175.24 2ksp s PRO 82 N -1.13 1.68 0.21 1.29 0.02 -1.26 -4.74 135.00 131.07 2ksp s PRO 82 Ca 0.18 1.39 -0.09 0.00 0.02 0.00 0.00 61.00 62.50 2ksp s PRO 82 Cb -0.13 -1.81 0.26 0.00 0.02 0.00 0.00 34.50 32.83 2ksp s PRO 82 CO 0.07 -2.11 1.81 -0.91 -0.33 0.00 0.00 177.00 175.53 2ksp h ASN 83 N -1.40 0.59 -0.52 2.53 4.21 -1.98 -0.83 115.58 118.18 2ksp h ASN 83 Ca -0.44 0.03 0.06 0.00 1.21 0.00 0.00 56.30 57.16 2ksp h ASN 83 Cb 1.25 -0.09 -0.05 0.00 -1.12 0.00 0.00 38.32 38.31 2ksp h ASN 83 CO 0.47 0.38 0.24 0.74 -1.29 0.00 0.00 177.43 177.96 2ksp h THR 84 N 0.72 0.90 -0.35 2.81 2.02 -1.98 0.37 112.91 117.40 2ksp h THR 84 Ca 0.31 -0.16 -0.03 0.00 0.77 0.00 0.00 66.41 67.30 2ksp h THR 84 Cb 0.19 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 2ksp h THR 84 CO -0.18 0.08 0.10 0.58 0.37 0.00 0.00 175.52 176.47 2ksp h VAL 85 N 0.46 1.22 -0.72 3.16 2.07 -1.67 -1.93 116.25 118.84 2ksp h VAL 85 Ca 0.24 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 2ksp h VAL 85 Cb 0.19 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2ksp h VAL 85 CO -0.20 0.24 0.31 -0.07 0.02 0.00 0.00 177.57 177.88 2ksp h LEU 86 N 0.42 0.95 -1.26 2.57 3.38 -0.78 -0.13 115.31 120.45 2ksp h LEU 86 Ca 0.11 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.04 2ksp h LEU 86 Cb 0.27 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 2ksp h LEU 86 CO -0.00 0.83 0.54 1.23 0.09 0.00 0.00 178.44 181.13 2ksp h GLY 87 N 1.09 1.16 0.38 0.83 0.00 0.17 0.52 103.07 107.22 2ksp h GLY 87 Ca 0.24 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.16 2ksp h GLY 87 CO -0.03 0.22 -0.29 0.50 0.00 0.00 0.00 176.54 176.95 2ksp h LYS 88 N 0.84 0.15 -0.15 4.80 1.57 -0.56 -1.93 116.57 121.30 2ksp h LYS 88 Ca 0.38 -0.19 0.02 0.00 -1.87 0.00 0.00 60.65 58.99 2ksp h LYS 88 Cb 0.36 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 2ksp h LYS 88 CO -0.15 1.00 0.00 0.82 -0.57 0.00 0.00 179.45 180.55 2ksp h ILE 89 N -0.61 0.90 -0.53 1.86 2.04 -0.80 -1.59 117.51 118.78 2ksp h ILE 89 Ca -0.04 -0.02 -0.09 0.00 1.00 0.00 0.00 64.86 65.71 2ksp h ILE 89 Cb 1.12 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 2ksp h ILE 89 CO 0.05 0.01 -0.03 -0.25 0.00 0.00 0.00 178.15 177.93 2ksp h TRP 90 N 0.05 1.01 -0.54 1.37 2.91 -1.01 0.11 115.95 119.84 2ksp h TRP 90 Ca 0.07 -0.17 0.08 0.00 1.13 0.00 0.00 58.89 60.00 2ksp h TRP 90 Cb 0.08 -0.26 -0.03 0.00 -0.51 0.00 0.00 29.16 28.43 2ksp h TRP 90 CO -0.15 0.92 0.36 -0.22 -1.03 0.00 0.00 178.44 178.33 2ksp h LYS 91 N 0.85 0.37 0.08 2.65 3.64 -0.80 -2.38 116.57 120.99 2ksp h LYS 91 Ca 0.15 -0.02 -0.33 0.00 -1.27 0.00 0.00 60.65 59.18 2ksp h LYS 91 Cb 0.55 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 2ksp h LYS 91 CO 0.03 0.25 -1.82 1.28 -2.27 0.00 0.00 179.45 176.92 2ksp n LEU 92 N -4.47 2.41 -0.21 5.20 7.99 -0.65 -4.55 117.00 122.73 2ksp n LEU 92 Ca 0.08 0.26 -0.08 0.00 -0.01 0.00 0.00 56.01 56.27 2ksp n LEU 92 Cb 0.33 -1.06 0.03 0.00 -0.11 0.00 0.00 43.42 42.60 2ksp n LEU 92 CO 0.34 0.69 0.96 0.00 -1.51 0.00 0.00 177.39 177.87 2ksp h ALA 93 N -0.12 0.77 -1.74 -1.18 0.00 -0.55 -3.35 119.26 113.08 2ksp h ALA 93 Ca -0.42 -0.18 -0.65 0.00 0.00 0.00 0.00 54.91 53.66 2ksp h ALA 93 Cb 1.81 -0.23 -0.16 0.00 0.00 0.00 0.00 17.79 19.21 2ksp h ALA 93 CO -0.02 0.41 0.42 0.34 0.00 0.00 0.00 179.25 180.40 2ksp s ASP 94 N -6.14 6.19 0.07 0.00 2.15 -0.92 -4.59 116.67 113.43 2ksp s ASP 94 Ca -0.13 -1.16 0.08 0.00 0.43 0.00 0.00 52.55 51.77 2ksp s ASP 94 Cb 0.13 -2.38 -0.22 0.00 -0.30 0.00 0.00 42.92 40.15 2ksp s ASP 94 CO 0.80 -1.33 1.10 -0.37 -0.17 0.00 0.00 175.17 175.20 2ksp h VAL 95 N 5.95 1.47 -0.00 1.11 -1.51 -1.88 -3.32 116.25 118.06 2ksp h VAL 95 Ca -0.28 -3.21 0.00 0.00 -1.23 0.00 0.00 66.70 61.98 2ksp h VAL 95 Cb 1.07 2.74 0.00 0.00 -2.13 0.00 0.00 31.29 32.97 2ksp h VAL 95 CO 1.16 0.84 -0.82 -0.90 -1.23 0.00 0.00 177.57 176.61 2ksp n ASP 96 N -3.28 1.02 -2.52 4.19 5.68 -1.26 -5.04 116.55 115.35 2ksp n ASP 96 Ca -0.05 -1.01 -0.02 0.00 -0.50 0.00 0.00 54.79 53.20 2ksp n ASP 96 Cb 0.97 0.93 0.00 0.00 -1.14 0.00 0.00 41.12 41.89 2ksp n ASP 96 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2ksp n LYS 97 N -1.25 -1.25 -0.02 0.11 4.76 -1.25 -4.97 118.16 114.28 2ksp n LYS 97 Ca 0.04 1.39 -0.07 0.00 -2.87 0.00 0.00 58.31 56.80 2ksp n LYS 97 Cb 0.31 -4.43 -0.13 0.00 -1.84 0.00 0.00 35.03 28.93 2ksp n LYS 97 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2ksp n ASP 98 N -1.01 0.73 0.00 4.39 8.00 -1.26 -4.94 116.55 122.46 2ksp n ASP 98 Ca 0.04 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.88 2ksp n ASP 98 Cb 0.42 0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 2ksp n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ksp n GLY 99 N 1.55 0.77 3.39 0.44 0.00 -1.26 -5.03 105.19 105.05 2ksp n GLY 99 Ca -0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 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 1.81 -0.12 0.99 1.43 -1.26 -3.22 118.68 118.32 2ksp s LEU 100 Ca 0.00 -1.61 -0.01 0.00 -1.03 0.00 0.00 54.13 51.48 2ksp s LEU 100 Cb 0.00 0.10 0.03 0.00 0.03 0.00 0.00 46.19 46.36 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 -3.46 1.07 0.00 1.79 1.43 -0.62 -4.94 118.68 113.96 2ksp s LEU 101 Ca 0.32 -0.35 -0.09 0.00 -1.03 0.00 0.00 54.13 52.98 2ksp s LEU 101 Cb 0.04 -0.70 0.13 0.00 0.03 0.00 0.00 46.19 45.69 2ksp s LEU 101 CO 0.18 -0.17 0.77 -0.90 0.23 0.00 0.00 176.35 176.46 2ksp n ASP 102 N 5.01 0.12 -0.08 2.29 5.75 -1.26 -1.58 116.55 126.80 2ksp n ASP 102 Ca -0.10 -1.32 0.01 0.00 -0.01 0.00 0.00 54.79 53.37 2ksp n ASP 102 Cb 0.49 -0.59 0.32 0.00 -1.03 0.00 0.00 41.12 40.31 2ksp n ASP 102 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 2ksp h ASP 103 N -0.98 0.62 0.32 -1.12 3.58 -1.99 0.87 116.42 117.73 2ksp h ASP 103 Ca -0.25 -0.05 -0.02 0.00 0.42 0.00 0.00 57.03 57.13 2ksp h ASP 103 Cb 0.71 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.60 2ksp h ASP 103 CO 0.18 0.53 -0.16 -0.33 -2.88 0.00 0.00 179.24 176.58 2ksp h GLU 104 N 0.70 -0.42 -0.05 0.28 5.08 -1.97 -2.34 114.58 115.86 2ksp h GLU 104 Ca 0.18 0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 58.42 2ksp h GLU 104 Cb 0.06 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2ksp h GLU 104 CO -0.03 -0.09 -0.62 0.93 -1.00 0.00 0.00 179.01 178.20 2ksp h GLU 105 N -0.85 0.19 -0.38 2.33 5.08 -1.78 -1.52 114.58 117.65 2ksp h GLU 105 Ca -0.04 -0.14 -0.15 0.00 -1.00 0.00 0.00 59.36 58.03 2ksp h GLU 105 Cb 0.52 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2ksp h GLU 105 CO 0.07 0.75 -0.35 0.35 -1.00 0.00 0.00 179.01 178.84 2ksp h PHE 106 N 0.14 1.03 -0.82 4.33 3.57 -0.91 0.14 116.94 124.42 2ksp h PHE 106 Ca -0.01 -0.29 -0.04 0.00 3.53 0.00 0.00 57.97 61.17 2ksp h PHE 106 Cb 1.12 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 39.60 2ksp h PHE 106 CO 0.02 1.09 0.37 0.00 -2.23 0.00 0.00 178.31 177.56 2ksp h ALA 107 N 0.88 1.06 -0.43 2.41 0.00 -1.19 -0.14 119.26 121.85 2ksp h ALA 107 Ca 0.07 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2ksp h ALA 107 Cb 0.92 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2ksp h ALA 107 CO 0.08 0.64 -0.05 -0.07 0.00 0.00 0.00 179.25 179.86 2ksp h LEU 108 N 1.17 0.70 0.13 0.00 3.38 -0.95 0.17 115.31 119.91 2ksp h LEU 108 Ca 0.28 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2ksp h LEU 108 Cb 0.15 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2ksp h LEU 108 CO -0.03 0.80 -0.12 0.00 0.09 0.00 0.00 178.44 179.18 2ksp h ALA 109 N 1.27 -0.24 -0.50 1.53 0.00 -0.02 0.51 119.26 121.81 2ksp h ALA 109 Ca 0.13 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2ksp h ALA 109 Cb 0.49 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2ksp h ALA 109 CO 0.03 -0.65 0.11 -0.91 0.00 0.00 0.00 179.25 177.83 2ksp h ASN 110 N -0.27 0.72 -0.29 0.00 -0.26 -0.78 -1.51 115.58 113.17 2ksp h ASN 110 Ca 0.00 -0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 55.60 2ksp h ASN 110 Cb 0.26 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.32 2ksp h ASN 110 CO -0.03 0.71 0.10 -0.74 -1.06 0.00 0.00 177.43 176.41 2ksp h HIS 111 N 0.74 0.46 -0.70 1.19 2.76 -0.32 0.79 115.15 120.08 2ksp h HIS 111 Ca 0.16 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.24 2ksp h HIS 111 Cb 0.29 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 29.08 2ksp h HIS 111 CO 0.02 0.47 0.25 -0.07 -1.30 0.00 0.00 177.93 177.30 2ksp h LEU 112 N 0.32 0.99 -0.60 0.26 3.38 -0.59 0.11 115.31 119.18 2ksp h LEU 112 Ca 0.10 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.88 2ksp h LEU 112 Cb 0.22 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 2ksp h LEU 112 CO -0.00 0.92 0.39 0.40 0.09 0.00 0.00 178.44 180.23 2ksp h ILE 113 N 1.01 1.14 -0.77 1.22 2.04 -1.11 -1.72 117.51 119.32 2ksp h ILE 113 Ca 0.23 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.82 2ksp h ILE 113 Cb 0.26 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 2ksp h ILE 113 CO -0.01 0.14 0.48 0.50 0.00 0.00 0.00 178.15 179.26 2ksp h LYS 114 N 0.79 1.03 -0.43 2.37 3.64 -0.17 0.24 116.57 124.03 2ksp h LYS 114 Ca 0.22 -0.08 0.03 0.00 -1.27 0.00 0.00 60.65 59.55 2ksp h LYS 114 Cb -0.07 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.49 2ksp h LYS 114 CO -0.06 0.71 0.23 0.28 -2.27 0.00 0.00 179.45 178.34 2ksp h VAL 115 N 1.05 0.99 -0.68 2.00 2.07 -0.27 0.32 116.25 121.73 2ksp h VAL 115 Ca 0.28 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.62 2ksp h VAL 115 Cb -0.07 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 2ksp h VAL 115 CO -0.06 0.08 0.34 0.11 0.02 0.00 0.00 177.57 178.07 2ksp h LYS 116 N 0.45 0.97 0.00 1.57 1.57 -0.95 -1.54 116.57 118.64 2ksp h LYS 116 Ca 0.18 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 2ksp h LYS 116 Cb 0.07 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2ksp h LYS 116 CO -0.11 0.75 -0.19 -0.07 -0.57 0.00 0.00 179.45 179.26 2ksp h LEU 117 N 0.94 0.00 0.00 2.94 3.38 -0.10 -0.29 115.31 122.18 2ksp h LEU 117 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2ksp h LEU 117 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2ksp h LEU 117 CO -0.03 0.19 0.00 -0.62 0.09 0.00 0.00 178.44 178.07 2ksp n GLU 118 N -4.09 0.47 -1.01 1.13 -0.58 0.11 -4.83 120.64 111.83 2ksp n GLU 118 Ca -0.02 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.77 2ksp n GLU 118 Cb 0.27 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 2ksp n GLU 118 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ksp n GLY 119 N 0.35 1.17 3.51 0.62 0.00 -0.12 -5.07 105.19 105.64 2ksp n GLY 119 Ca 0.13 -0.40 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 2ksp n GLY 119 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ksp s HIS 120 N -2.12 1.78 0.09 1.61 3.76 -0.63 -5.01 115.29 114.78 2ksp s HIS 120 Ca 0.00 -1.38 0.07 0.00 -0.15 0.00 0.00 55.06 53.60 2ksp s HIS 120 Cb 0.00 -1.11 -0.03 0.00 1.11 0.00 0.00 32.58 32.55 2ksp s HIS 120 CO 0.00 -0.40 -0.19 -1.21 -0.85 0.00 0.00 174.74 172.09 2ksp s GLU 121 N -3.63 1.03 0.33 1.40 0.41 -1.26 -3.75 118.70 113.23 2ksp s GLU 121 Ca 0.23 -1.09 -0.26 0.00 -0.41 0.00 0.00 54.97 53.45 2ksp s GLU 121 Cb 0.01 -1.21 -0.10 0.00 -1.78 0.00 0.00 34.13 31.05 2ksp s GLU 121 CO 0.16 0.28 0.95 -0.48 -0.49 0.00 0.00 175.26 175.68 2ksp s LEU 122 N -1.82 4.33 0.00 1.80 0.05 -1.26 -4.94 118.68 116.84 2ksp s LEU 122 Ca 0.04 1.84 0.11 0.00 0.05 0.00 0.00 54.13 56.17 2ksp s LEU 122 Cb -0.10 -4.03 0.55 0.00 -2.05 0.00 0.00 46.19 40.57 2ksp s LEU 122 CO 0.04 -0.08 1.26 -2.65 -0.55 0.00 0.00 176.35 174.36 2ksp n PRO 123 N 0.52 0.15 -1.42 1.48 -0.02 -1.26 -4.80 135.00 129.65 2ksp n PRO 123 Ca 0.02 0.19 -0.14 0.00 -2.02 0.00 0.00 63.50 61.54 2ksp n PRO 123 Cb 0.50 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.42 2ksp n PRO 123 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ksp n ALA 124 N -1.30 -0.22 -2.41 3.55 0.00 -1.26 -4.96 120.51 113.92 2ksp n ALA 124 Ca 0.05 0.23 -0.12 0.00 0.00 0.00 0.00 53.44 53.60 2ksp n ALA 124 Cb 0.09 -1.76 -0.11 0.00 0.00 0.00 0.00 19.45 17.68 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 -2.63 1.21 -0.63 0.00 1.01 -1.26 -5.06 116.67 109.32 2ksp s ASP 125 Ca 0.00 -0.86 -0.08 0.00 0.71 0.00 0.00 52.55 52.32 2ksp s ASP 125 Cb 0.00 0.05 0.16 0.00 1.01 0.00 0.00 42.92 44.14 2ksp s ASP 125 CO 0.00 -0.34 0.50 -0.76 0.21 0.00 0.00 175.17 174.77 2ksp s LEU 126 N -2.58 5.84 0.65 1.23 1.43 -1.26 -5.07 118.68 118.93 2ksp s LEU 126 Ca 0.06 -2.46 -0.11 0.00 -1.03 0.00 0.00 54.13 50.59 2ksp s LEU 126 Cb -0.00 -2.01 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 2ksp s LEU 126 CO -0.02 -0.55 1.04 -2.16 0.23 0.00 0.00 176.35 174.90 2ksp s PRO 127 N 0.53 3.33 0.57 1.29 0.04 -1.26 -4.78 135.00 134.71 2ksp s PRO 127 Ca 0.13 0.81 0.29 0.00 0.04 0.00 0.00 61.00 62.28 2ksp s PRO 127 Cb -0.20 -2.04 1.46 0.00 0.04 0.00 0.00 34.50 33.76 2ksp s PRO 127 CO -0.04 -0.78 1.88 -1.35 0.04 0.00 0.00 177.00 176.75 2ksp h PRO 128 N -0.48 0.00 -0.29 0.56 0.11 -1.98 0.10 132.00 130.02 2ksp h PRO 128 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2ksp h PRO 128 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2ksp h PRO 128 CO 0.60 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 176.00 2ksp n HIS 129 N -3.91 0.38 0.00 0.65 1.44 -1.26 -3.92 115.22 108.60 2ksp n HIS 129 Ca 0.12 -0.19 0.00 0.00 -2.01 0.00 0.00 57.72 55.64 2ksp n HIS 129 Cb 0.79 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.90 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 0.38 0.51 -4.74 2.39 4.77 0.25 -4.39 117.00 116.16 2ksp n LEU 130 Ca 0.11 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.68 2ksp n LEU 130 Cb 0.27 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.34 2ksp n LEU 130 CO 0.08 0.08 1.25 0.68 -1.33 0.00 0.00 177.39 178.15 2ksp s VAL 131 N -1.59 2.25 0.44 4.08 -7.23 -0.61 -4.95 120.40 112.79 2ksp s VAL 131 Ca 0.00 0.20 -0.25 0.00 -1.81 0.00 0.00 61.98 60.12 2ksp s VAL 131 Cb 0.00 -3.13 -0.09 0.00 0.56 0.00 0.00 36.38 33.72 2ksp s VAL 131 CO 0.00 0.03 1.35 -2.65 -0.31 0.00 0.00 175.10 173.51 2ksp n PRO 132 N 2.92 2.07 0.28 4.82 -0.02 -1.26 -4.86 135.00 138.95 2ksp n PRO 132 Ca 0.11 0.74 0.18 0.00 -2.02 0.00 0.00 63.50 62.51 2ksp n PRO 132 Cb 0.38 -2.50 0.95 0.00 -0.02 0.00 0.00 33.50 32.30 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 2.16 0.00 0.00 0.52 0.11 -1.94 0.76 132.00 133.61 2ksp h PRO 133 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2ksp h PRO 133 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2ksp h PRO 133 CO 0.60 0.00 0.00 1.03 -0.21 0.00 0.00 178.00 179.42 2ksp h SER 134 N 0.00 0.00 0.00 -2.05 0.87 -2.02 -3.29 113.55 107.06 2ksp h SER 134 Ca 0.04 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2ksp h SER 134 Cb 0.37 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2ksp h SER 134 CO -0.00 0.00 -0.18 0.29 -0.53 0.00 0.00 176.83 176.41 2ksp n LYS 135 N -2.60 1.37 -4.17 2.24 4.01 0.26 -5.04 118.16 114.22 2ksp n LYS 135 Ca 0.04 -2.81 -0.29 0.00 -0.51 0.00 0.00 58.31 54.74 2ksp n LYS 135 Cb 0.43 -1.52 -0.08 0.00 -0.51 0.00 0.00 35.03 33.34 2ksp n LYS 135 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 2ksp s ARG 136 N -2.96 2.41 1.23 1.97 1.70 -1.20 -4.90 118.95 117.20 2ksp s ARG 136 Ca 0.34 -0.98 -0.17 0.00 -0.47 0.00 0.00 55.73 54.45 2ksp s ARG 136 Cb 0.31 -2.43 0.30 0.00 -0.57 0.00 0.00 34.95 32.56 2ksp s ARG 136 CO -0.01 0.50 1.02 1.03 -1.08 0.00 0.00 175.30 176.76 2ksp s ARG 137 N -2.55 -1.47 -0.05 3.89 0.52 -1.26 -5.07 118.95 112.96 2ksp s ARG 137 Ca 0.26 0.39 0.01 0.00 -0.52 0.00 0.00 55.73 55.86 2ksp s ARG 137 Cb -0.11 -1.53 0.02 0.00 0.52 0.00 0.00 34.95 33.86 2ksp s ARG 137 CO 0.18 -3.97 -0.05 -3.38 0.02 0.00 0.00 175.30 168.09 2ksp s HIS 138 N -2.58 0.83 0.00 -0.53 -3.43 -1.26 -5.16 115.29 103.16 2ksp s HIS 138 Ca 0.68 -0.25 0.00 0.00 -0.80 0.00 0.00 55.06 54.69 2ksp s HIS 138 Cb -0.18 -0.73 0.00 0.00 -1.43 0.00 0.00 32.58 30.24 2ksp s HIS 138 CO 0.60 -0.22 0.00 0.39 -2.00 0.00 0.00 174.74 173.51