#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 4.71 0.08 1.61 0.04 -1.26 -5.07 135.00 135.11 2ksp s PRO 36 Ca 0.00 1.37 0.07 0.00 0.04 0.00 0.00 61.00 62.48 2ksp s PRO 36 Cb 0.00 -3.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 2ksp s PRO 36 CO 0.00 0.44 -0.15 -0.51 0.04 0.00 0.00 177.00 176.81 2ksp s LEU 37 N -1.52 2.79 -0.02 -3.56 1.02 -1.26 -5.13 118.68 111.00 2ksp s LEU 37 Ca 0.44 -0.44 0.03 0.00 0.02 0.00 0.00 54.13 54.18 2ksp s LEU 37 Cb -0.23 -1.63 -0.00 0.00 0.02 0.00 0.00 46.19 44.36 2ksp s LEU 37 CO 0.28 0.21 -0.10 -0.83 0.02 0.00 0.00 176.35 175.93 2ksp s GLY 38 N -1.86 0.58 0.13 -3.19 0.00 -1.26 -5.13 107.32 96.58 2ksp s GLY 38 Ca 0.18 -0.41 -0.30 0.00 0.00 0.00 0.00 44.72 44.18 2ksp s GLY 38 CO 0.09 -0.20 1.03 -0.56 0.00 0.00 0.00 173.10 173.46 2ksp s SER 39 N 0.05 7.38 0.13 1.64 0.01 -1.26 -5.00 113.70 116.64 2ksp s SER 39 Ca -0.01 1.91 -0.30 0.00 1.31 0.00 0.00 55.95 58.86 2ksp s SER 39 Cb -0.08 -2.59 -0.07 0.00 0.21 0.00 0.00 66.02 63.50 2ksp s SER 39 CO 0.00 -0.16 1.06 -1.81 0.41 0.00 0.00 173.24 172.74 2ksp s ASP 40 N 0.08 7.32 -0.28 2.44 1.01 -1.26 -5.02 116.67 120.96 2ksp s ASP 40 Ca 0.49 1.97 0.03 0.00 0.71 0.00 0.00 52.55 55.75 2ksp s ASP 40 Cb -0.26 -2.59 0.07 0.00 1.01 0.00 0.00 42.92 41.15 2ksp s ASP 40 CO 0.32 -0.20 -0.07 -0.62 0.21 0.00 0.00 175.17 174.81 2ksp s ASP 41 N 0.11 4.54 -0.29 0.27 -1.08 -1.26 -5.09 116.67 113.88 2ksp s ASP 41 Ca 0.50 -1.58 -0.11 0.00 -0.52 0.00 0.00 52.55 50.84 2ksp s ASP 41 Cb -0.27 -1.58 -0.04 0.00 -1.46 0.00 0.00 42.92 39.58 2ksp s ASP 41 CO 0.32 -0.24 0.18 -0.69 0.52 0.00 0.00 175.17 175.26 2ksp s VAL 42 N 1.06 5.09 -0.17 1.11 1.01 -1.26 -5.07 120.40 122.17 2ksp s VAL 42 Ca -0.04 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.75 2ksp s VAL 42 Cb -0.20 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 2ksp s VAL 42 CO -0.06 0.21 0.58 -1.83 0.00 0.00 0.00 175.10 174.00 2ksp s GLU 43 N 1.72 4.26 -0.56 2.72 -1.05 -1.26 -5.01 118.70 119.52 2ksp s GLU 43 Ca 0.07 0.57 -0.28 0.00 -0.15 0.00 0.00 54.97 55.18 2ksp s GLU 43 Cb -0.16 -3.53 0.01 0.00 -0.44 0.00 0.00 34.13 30.01 2ksp s GLU 43 CO 0.09 -0.10 1.50 -0.46 0.95 0.00 0.00 175.26 177.24 2ksp s TRP 44 N 1.44 2.17 0.47 4.83 -0.00 -1.26 -4.86 118.94 121.74 2ksp s TRP 44 Ca 0.28 0.50 0.20 0.00 -0.00 0.00 0.00 56.10 57.08 2ksp s TRP 44 Cb -0.16 -4.34 1.20 0.00 -0.00 0.00 0.00 33.47 30.17 2ksp s TRP 44 CO 0.11 -2.10 1.96 0.28 -0.00 0.00 0.00 176.95 177.21 2ksp h VAL 45 N 6.46 0.78 0.00 5.86 2.07 -1.95 0.24 116.25 129.71 2ksp h VAL 45 Ca -0.27 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2ksp h VAL 45 Cb 1.10 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 2ksp h VAL 45 CO 1.18 0.04 0.00 0.58 0.02 0.00 0.00 177.57 179.39 2ksp h VAL 46 N 0.23 0.00 0.00 2.57 2.07 -1.90 -3.07 116.25 116.15 2ksp h VAL 46 Ca 0.30 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 2ksp h VAL 46 Cb 0.87 1.47 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2ksp h VAL 46 CO -0.06 0.00 -0.11 1.23 0.02 0.00 0.00 177.57 178.65 2ksp h GLY 47 N 4.26 0.00 1.29 2.17 0.00 -0.91 -0.21 103.07 109.67 2ksp h GLY 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ksp h GLY 47 CO 0.00 0.00 -0.57 0.07 0.00 0.00 0.00 176.54 176.04 2ksp h LYS 48 N 0.00 0.00 0.00 4.80 2.10 -1.63 -3.36 116.57 118.48 2ksp h LYS 48 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2ksp h LYS 48 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 2ksp h LYS 48 CO 0.01 0.00 -0.93 -0.25 -2.00 0.00 0.00 179.45 176.28 2ksp n ASP 49 N -2.28 0.84 0.25 7.07 9.92 -0.21 -4.66 116.55 127.47 2ksp n ASP 49 Ca 0.03 -0.73 -0.16 0.00 -0.53 0.00 0.00 54.79 53.41 2ksp n ASP 49 Cb 0.46 1.13 -0.08 0.00 -0.64 0.00 0.00 41.12 42.00 2ksp n ASP 49 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 2ksp h LYS 50 N 0.00 -0.68 -1.03 -1.24 1.79 -1.39 -3.24 116.57 110.78 2ksp h LYS 50 Ca 0.00 0.05 0.26 0.00 -2.18 0.00 0.00 60.65 58.77 2ksp h LYS 50 Cb 0.45 0.16 -0.11 0.00 -1.58 0.00 0.00 32.23 31.14 2ksp h LYS 50 CO 0.00 -0.45 0.64 -1.00 -1.08 0.00 0.00 179.45 177.56 2ksp h PRO 51 N -0.71 0.46 -0.16 3.15 0.13 -1.88 0.36 132.00 133.35 2ksp h PRO 51 Ca -0.04 -0.03 -0.11 0.00 -0.87 0.00 0.00 66.00 64.96 2ksp h PRO 51 Cb 0.60 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.63 2ksp h PRO 51 CO 0.01 0.30 -0.31 1.15 -0.23 0.00 0.00 178.00 178.93 2ksp h THR 52 N 0.47 1.35 0.00 1.56 2.02 -1.91 -1.74 112.91 114.67 2ksp h THR 52 Ca 0.62 -1.55 -0.04 0.00 0.77 0.00 0.00 66.41 66.20 2ksp h THR 52 Cb 1.39 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 69.74 2ksp h THR 52 CO -0.37 0.47 -0.21 1.88 0.37 0.00 0.00 175.52 177.66 2ksp h TYR 53 N 0.13 0.00 -0.20 3.16 0.05 -0.88 -2.55 116.97 116.68 2ksp h TYR 53 Ca 0.01 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.63 2ksp h TYR 53 Cb 0.90 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.64 2ksp h TYR 53 CO 0.10 0.21 -0.49 -0.44 -1.05 0.00 0.00 178.16 176.48 2ksp h ASP 54 N 0.00 0.78 -0.14 3.88 3.32 -0.38 0.19 116.42 124.07 2ksp h ASP 54 Ca -0.00 -0.57 0.05 0.00 0.02 0.00 0.00 57.03 56.52 2ksp h ASP 54 Cb 1.08 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 40.35 2ksp h ASP 54 CO 0.03 1.21 -0.21 -0.08 -1.72 0.00 0.00 179.24 178.47 2ksp h GLU 55 N 0.38 -0.25 -0.07 3.56 4.57 -1.10 -1.42 114.58 120.25 2ksp h GLU 55 Ca -0.01 0.02 -0.09 0.00 -1.18 0.00 0.00 59.36 58.10 2ksp h GLU 55 Cb 1.11 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 2ksp h GLU 55 CO 0.11 -0.17 -0.36 0.82 -1.18 0.00 0.00 179.01 178.23 2ksp h ILE 56 N -0.26 1.28 -0.75 2.32 2.04 -1.38 -2.43 117.51 118.33 2ksp h ILE 56 Ca 0.10 -1.34 0.01 0.00 1.00 0.00 0.00 64.86 64.63 2ksp h ILE 56 Cb 0.41 1.64 -0.04 0.00 -0.74 0.00 0.00 36.82 38.09 2ksp h ILE 56 CO -0.29 0.40 0.50 0.15 0.00 0.00 0.00 178.15 178.90 2ksp h PHE 57 N 0.12 0.94 0.00 1.37 3.57 0.16 -1.97 116.94 121.12 2ksp h PHE 57 Ca 0.01 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 2ksp h PHE 57 Cb 0.70 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2ksp h PHE 57 CO 0.01 0.59 -0.27 1.88 -2.23 0.00 0.00 178.31 178.28 2ksp h TYR 58 N 1.01 0.00 -0.00 0.41 0.05 -0.78 -2.71 116.97 114.95 2ksp h TYR 58 Ca 0.28 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.06 2ksp h TYR 58 Cb -0.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.63 2ksp h TYR 58 CO -0.00 0.27 -0.18 0.25 -1.05 0.00 0.00 178.16 177.45 2ksp n THR 59 N -3.49 0.00 0.61 -2.88 -2.24 -0.76 -2.74 114.28 102.78 2ksp n THR 59 Ca -0.00 -0.07 0.11 0.00 -2.27 0.00 0.00 64.05 61.82 2ksp n THR 59 Cb 0.43 0.03 0.26 0.00 -2.10 0.00 0.00 70.33 68.96 2ksp n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2ksp n LEU 60 N -0.97 2.85 -2.47 3.22 4.32 -1.02 -5.01 117.00 117.92 2ksp n LEU 60 Ca 0.12 -1.23 -0.02 0.00 -0.02 0.00 0.00 56.01 54.86 2ksp n LEU 60 Cb 0.30 -0.21 0.00 0.00 -1.62 0.00 0.00 43.42 41.90 2ksp n LEU 60 CO 0.26 0.61 -0.22 -1.20 -1.22 0.00 0.00 177.39 175.62 2ksp n SER 61 N 1.09 -6.61 -4.63 -1.43 7.64 -1.11 -4.80 113.62 103.78 2ksp n SER 61 Ca 0.18 0.84 -0.43 0.00 1.01 0.00 0.00 58.87 60.47 2ksp n SER 61 Cb 0.51 -4.35 -0.02 0.00 -1.01 0.00 0.00 64.21 59.33 2ksp n SER 61 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2ksp s PRO 62 N -1.63 3.92 -0.38 1.43 0.02 -1.26 -4.70 135.00 132.40 2ksp s PRO 62 Ca 0.07 1.30 -0.22 0.00 0.02 0.00 0.00 61.00 62.18 2ksp s PRO 62 Cb -0.02 -3.89 0.01 0.00 0.02 0.00 0.00 34.50 30.62 2ksp s PRO 62 CO 0.60 -1.12 0.71 0.08 -0.33 0.00 0.00 177.00 176.95 2ksp s VAL 63 N 4.40 4.79 -1.58 3.83 1.01 0.51 -3.72 120.40 129.65 2ksp s VAL 63 Ca 0.57 0.63 0.00 0.00 0.00 0.00 0.00 61.98 63.19 2ksp s VAL 63 Cb -0.18 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.03 2ksp s VAL 63 CO 0.23 -0.44 0.00 0.59 0.00 0.00 0.00 175.10 175.48 2ksp n ASN 64 N 6.30 -4.84 0.00 3.32 3.02 -1.26 -1.71 115.26 120.10 2ksp n ASN 64 Ca 0.01 0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 2ksp n ASN 64 Cb 0.48 -3.78 0.00 0.00 -0.61 0.00 0.00 39.78 35.87 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 -1.04 0.54 2.97 7.41 0.00 -1.24 -5.05 105.19 108.77 2ksp n GLY 65 Ca -0.16 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.39 0.13 0.24 1.61 2.20 -0.69 -4.52 119.74 117.32 2ksp s LYS 66 Ca 0.00 0.37 -0.06 0.00 -0.36 0.00 0.00 55.97 55.92 2ksp s LYS 66 Cb 0.00 -0.12 -0.06 0.00 -1.51 0.00 0.00 37.83 36.14 2ksp s LYS 66 CO 0.00 -0.14 0.51 0.96 -0.36 0.00 0.00 175.35 176.32 2ksp s ILE 67 N 1.00 5.03 0.53 5.43 -4.36 -0.14 -0.36 121.20 128.33 2ksp s ILE 67 Ca -0.08 0.14 -0.07 0.00 -0.26 0.00 0.00 60.65 60.39 2ksp s ILE 67 Cb -0.09 -3.68 -0.03 0.00 1.25 0.00 0.00 42.46 39.90 2ksp s ILE 67 CO -0.05 -0.18 0.87 0.42 0.24 0.00 0.00 174.94 176.23 2ksp s THR 68 N -1.92 4.73 0.50 8.37 -4.23 -1.26 -1.32 115.64 120.50 2ksp s THR 68 Ca 0.44 0.38 0.16 0.00 -1.18 0.00 0.00 61.69 61.49 2ksp s THR 68 Cb -0.11 -3.83 0.25 0.00 1.34 0.00 0.00 72.50 70.15 2ksp s THR 68 CO 0.26 -0.90 2.11 1.23 -0.54 0.00 0.00 174.62 176.78 2ksp h GLY 69 N 0.03 0.00 0.69 3.99 0.00 -1.91 -2.58 103.07 103.29 2ksp h GLY 69 Ca -0.46 0.00 0.03 0.00 0.00 0.00 0.00 47.33 46.90 2ksp h GLY 69 CO 0.62 0.00 -0.07 0.00 0.00 0.00 0.00 176.54 177.09 2ksp h ALA 70 N 1.94 0.03 -0.05 3.60 0.00 -1.93 0.18 119.26 123.03 2ksp h ALA 70 Ca -0.00 0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.73 2ksp h ALA 70 Cb 0.10 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2ksp h ALA 70 CO 0.01 -0.52 -0.86 -0.91 0.00 0.00 0.00 179.25 176.96 2ksp h ASN 71 N -0.07 0.66 0.59 0.00 2.35 -1.83 -1.84 115.58 115.44 2ksp h ASN 71 Ca 0.06 -0.48 -0.07 0.00 -0.55 0.00 0.00 56.30 55.26 2ksp h ASN 71 Cb 0.16 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 2ksp h ASN 71 CO -0.15 1.26 -0.35 0.00 -1.65 0.00 0.00 177.43 176.54 2ksp h ALA 72 N 0.71 1.17 -0.01 -0.83 0.00 -1.37 -2.03 119.26 116.90 2ksp h ALA 72 Ca -0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 2ksp h ALA 72 Cb 1.48 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.22 2ksp h ALA 72 CO 0.16 0.44 -0.03 -0.22 0.00 0.00 0.00 179.25 179.60 2ksp h LYS 73 N 0.00 0.04 -0.70 0.00 3.64 -0.35 -1.42 116.57 117.78 2ksp h LYS 73 Ca -0.00 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2ksp h LYS 73 Cb 0.74 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.53 2ksp h LYS 73 CO 0.05 0.66 0.46 1.57 -2.27 0.00 0.00 179.45 179.92 2ksp h LYS 74 N -0.57 0.90 0.23 1.90 2.10 -1.28 0.20 116.57 120.05 2ksp h LYS 74 Ca -0.00 -0.05 -0.01 0.00 -2.00 0.00 0.00 60.65 58.58 2ksp h LYS 74 Cb 0.66 -0.20 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 2ksp h LYS 74 CO 0.01 0.60 -0.11 1.49 -2.00 0.00 0.00 179.45 179.43 2ksp h GLU 75 N 0.93 -0.30 0.00 0.07 4.57 -1.38 -1.37 114.58 117.10 2ksp h GLU 75 Ca 0.26 0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.40 2ksp h GLU 75 Cb -0.08 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 2ksp h GLU 75 CO -0.06 -0.15 -0.29 1.98 -1.18 0.00 0.00 179.01 179.32 2ksp h MET 76 N -0.39 0.00 0.10 1.92 4.05 -0.46 -1.52 114.93 118.64 2ksp h MET 76 Ca -0.03 0.00 -0.28 0.00 -0.28 0.00 0.00 59.70 59.10 2ksp h MET 76 Cb 0.29 0.00 0.03 0.00 -0.80 0.00 0.00 31.60 31.12 2ksp h MET 76 CO 0.05 0.29 -1.17 0.28 0.23 0.00 0.00 176.91 176.59 2ksp h VAL 77 N 0.00 1.30 0.00 -5.77 2.07 -0.56 -3.05 116.25 110.23 2ksp h VAL 77 Ca -0.00 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.11 2ksp h VAL 77 Cb 0.60 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 2ksp h VAL 77 CO 0.04 0.73 0.00 0.29 0.02 0.00 0.00 177.57 178.65 2ksp n LYS 78 N -3.84 0.07 0.07 1.57 5.02 -0.52 -1.74 118.16 118.79 2ksp n LYS 78 Ca -0.13 0.15 0.11 0.00 -2.02 0.00 0.00 58.31 56.41 2ksp n LYS 78 Cb 0.95 -1.50 0.44 0.00 -0.02 0.00 0.00 35.03 34.90 2ksp n LYS 78 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ksp n SER 79 N -1.44 0.40 -0.69 4.39 2.88 -0.61 -4.90 113.62 113.64 2ksp n SER 79 Ca 0.06 0.58 -0.07 0.00 -1.33 0.00 0.00 58.87 58.11 2ksp n SER 79 Cb 0.21 -0.67 -0.01 0.00 -0.75 0.00 0.00 64.21 62.99 2ksp n SER 79 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2ksp n LYS 80 N -1.92 -0.52 -3.83 -1.46 4.76 -0.71 -5.04 118.16 109.43 2ksp n LYS 80 Ca 0.04 0.47 -0.35 0.00 -2.87 0.00 0.00 58.31 55.60 2ksp n LYS 80 Cb 0.27 -4.32 -0.05 0.00 -1.84 0.00 0.00 35.03 29.09 2ksp n LYS 80 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2ksp s LEU 81 N -1.83 4.38 0.36 -0.35 2.01 -1.26 -5.07 118.68 116.92 2ksp s LEU 81 Ca 0.00 0.47 -0.28 0.00 0.01 0.00 0.00 54.13 54.33 2ksp s LEU 81 Cb 0.00 -2.54 -0.11 0.00 0.01 0.00 0.00 46.19 43.55 2ksp s LEU 81 CO 0.00 0.29 1.52 -2.16 1.01 0.00 0.00 176.35 177.00 2ksp s PRO 82 N -1.68 4.10 0.42 1.29 0.04 -1.26 -4.80 135.00 133.10 2ksp s PRO 82 Ca 0.25 2.59 0.18 0.00 0.04 0.00 0.00 61.00 64.06 2ksp s PRO 82 Cb -0.13 -2.97 1.08 0.00 0.04 0.00 0.00 34.50 32.52 2ksp s PRO 82 CO 0.15 -0.57 1.85 -0.91 0.04 0.00 0.00 177.00 177.56 2ksp h ASN 83 N 3.34 0.41 -0.94 6.66 4.21 -1.97 0.24 115.58 127.53 2ksp h ASN 83 Ca -0.50 0.04 0.06 0.00 1.21 0.00 0.00 56.30 57.11 2ksp h ASN 83 Cb 1.24 -0.03 -0.06 0.00 -1.12 0.00 0.00 38.32 38.34 2ksp h ASN 83 CO 0.67 0.16 0.60 0.74 -1.29 0.00 0.00 177.43 178.31 2ksp h THR 84 N 0.41 1.09 -0.10 2.81 2.02 -1.99 0.11 112.91 117.26 2ksp h THR 84 Ca 0.48 -0.38 -0.23 0.00 0.77 0.00 0.00 66.41 67.05 2ksp h THR 84 Cb 1.19 -0.12 0.01 0.00 -1.74 0.00 0.00 68.15 67.49 2ksp h THR 84 CO -0.18 0.20 -0.84 0.58 0.37 0.00 0.00 175.52 175.65 2ksp h VAL 85 N 1.12 1.30 -0.47 3.16 2.07 -0.90 -2.28 116.25 120.26 2ksp h VAL 85 Ca 0.40 -2.10 0.02 0.00 0.82 0.00 0.00 66.70 65.84 2ksp h VAL 85 Cb 0.12 2.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 2ksp h VAL 85 CO -0.16 0.65 0.27 -0.07 0.02 0.00 0.00 177.57 178.29 2ksp h LEU 86 N 0.44 0.44 -1.04 2.57 4.07 -0.87 0.23 115.31 121.15 2ksp h LEU 86 Ca -0.07 0.01 0.02 0.00 0.08 0.00 0.00 57.88 57.92 2ksp h LEU 86 Cb 1.47 -0.09 -0.05 0.00 1.08 0.00 0.00 40.66 43.07 2ksp h LEU 86 CO 0.16 0.31 0.65 1.23 -1.08 0.00 0.00 178.44 179.72 2ksp h GLY 87 N 0.55 1.40 0.87 0.83 0.00 -0.65 0.23 103.07 106.30 2ksp h GLY 87 Ca 0.19 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.90 2ksp h GLY 87 CO -0.09 0.47 -0.32 0.50 0.00 0.00 0.00 176.54 177.10 2ksp h LYS 88 N 1.29 0.54 -0.36 4.80 1.57 -0.77 -0.10 116.57 123.55 2ksp h LYS 88 Ca 0.37 -0.34 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 2ksp h LYS 88 Cb -0.09 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 2ksp h LYS 88 CO -0.10 0.94 0.14 0.82 -0.57 0.00 0.00 179.45 180.69 2ksp h ILE 89 N 0.20 0.92 -0.50 1.86 1.08 -0.29 -1.61 117.51 119.17 2ksp h ILE 89 Ca 0.01 -0.10 -0.09 0.00 -0.39 0.00 0.00 64.86 64.29 2ksp h ILE 89 Cb 0.91 0.59 -0.02 0.00 -3.07 0.00 0.00 36.82 35.23 2ksp h ILE 89 CO 0.07 0.06 -0.05 -0.25 -0.69 0.00 0.00 178.15 177.29 2ksp h TRP 90 N 0.30 1.01 0.00 1.37 2.91 -0.92 0.15 115.95 120.78 2ksp h TRP 90 Ca 0.16 -0.19 -0.01 0.00 1.13 0.00 0.00 58.89 59.97 2ksp h TRP 90 Cb 0.12 -0.26 -0.00 0.00 -0.51 0.00 0.00 29.16 28.51 2ksp h TRP 90 CO -0.13 0.96 -0.06 -0.22 -1.03 0.00 0.00 178.44 177.96 2ksp h LYS 91 N 0.78 0.00 0.07 2.65 1.63 -0.54 0.22 116.57 121.38 2ksp h LYS 91 Ca 0.14 0.00 -0.36 0.00 -0.85 0.00 0.00 60.65 59.57 2ksp h LYS 91 Cb 0.58 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.18 2ksp h LYS 91 CO 0.03 0.06 -2.07 1.28 -3.45 0.00 0.00 179.45 175.30 2ksp n LEU 92 N -3.38 2.61 -0.18 5.20 7.99 -0.65 -4.50 117.00 124.09 2ksp n LEU 92 Ca -0.02 0.15 -0.10 0.00 -0.01 0.00 0.00 56.01 56.03 2ksp n LEU 92 Cb 0.21 -1.03 0.01 0.00 -0.11 0.00 0.00 43.42 42.49 2ksp n LEU 92 CO 0.27 0.80 0.77 0.00 -1.51 0.00 0.00 177.39 177.72 2ksp h ALA 93 N -0.07 0.70 -0.79 -1.18 0.00 -0.17 -3.32 119.26 114.44 2ksp h ALA 93 Ca -0.47 -0.32 -0.71 0.00 0.00 0.00 0.00 54.91 53.41 2ksp h ALA 93 Cb 1.90 -0.19 -0.10 0.00 0.00 0.00 0.00 17.79 19.40 2ksp h ALA 93 CO -0.02 0.56 2.27 -3.47 0.00 0.00 0.00 179.25 178.60 2ksp n ASP 94 N -4.25 4.72 0.02 0.00 2.03 0.73 -4.72 116.55 115.08 2ksp n ASP 94 Ca 0.01 -2.94 -0.04 0.00 0.52 0.00 0.00 54.79 52.34 2ksp n ASP 94 Cb 0.36 -1.64 0.18 0.00 -0.72 0.00 0.00 41.12 39.29 2ksp n ASP 94 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2ksp h VAL 95 N 4.63 1.28 0.00 5.18 2.07 -1.85 -2.94 116.25 124.62 2ksp h VAL 95 Ca 0.45 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.61 2ksp h VAL 95 Cb 0.76 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2ksp h VAL 95 CO 1.57 0.43 -0.22 -2.24 0.02 0.00 0.00 177.57 177.13 2ksp h ASP 96 N 0.42 0.00 -5.27 0.57 3.04 -1.94 -3.49 116.42 109.76 2ksp h ASP 96 Ca 0.05 -0.06 0.00 0.00 -3.24 0.00 0.00 57.03 53.78 2ksp h ASP 96 Cb 0.73 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.02 2ksp h ASP 96 CO 0.06 0.03 -0.12 0.29 -2.04 0.00 0.00 179.24 177.46 2ksp n LYS 97 N -2.30 -1.53 0.00 4.15 4.76 -1.11 -4.98 118.16 117.15 2ksp n LYS 97 Ca 0.05 1.62 0.00 0.00 -2.87 0.00 0.00 58.31 57.10 2ksp n LYS 97 Cb 0.44 -5.61 0.00 0.00 -1.84 0.00 0.00 35.03 28.02 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 -1.39 1.19 0.00 4.39 5.68 -1.26 -5.01 116.55 120.15 2ksp n ASP 98 Ca 0.03 -0.15 0.00 0.00 -0.50 0.00 0.00 54.79 54.17 2ksp n ASP 98 Cb 0.49 0.54 0.00 0.00 -1.14 0.00 0.00 41.12 41.00 2ksp n ASP 98 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ksp n GLY 99 N 0.89 0.76 3.33 6.12 0.00 -1.26 -5.03 105.19 110.00 2ksp n GLY 99 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 2.53 -0.17 0.99 1.43 -1.26 -2.97 118.68 119.23 2ksp s LEU 100 Ca 0.00 -1.04 0.01 0.00 -1.03 0.00 0.00 54.13 52.07 2ksp s LEU 100 Cb 0.00 -0.58 0.03 0.00 0.03 0.00 0.00 46.19 45.67 2ksp s LEU 100 CO 0.00 -0.23 -0.13 -0.76 0.23 0.00 0.00 176.35 175.46 2ksp s LEU 101 N -3.29 1.89 0.00 1.79 1.43 -0.44 -4.95 118.68 115.11 2ksp s LEU 101 Ca 0.22 -0.62 -0.07 0.00 -1.03 0.00 0.00 54.13 52.63 2ksp s LEU 101 Cb 0.01 -1.21 0.11 0.00 0.03 0.00 0.00 46.19 45.13 2ksp s LEU 101 CO 0.06 -0.08 0.67 -0.90 0.23 0.00 0.00 176.35 176.33 2ksp n ASP 102 N 4.74 0.21 0.17 2.29 5.68 -1.26 -0.97 116.55 127.41 2ksp n ASP 102 Ca -0.16 -1.34 0.05 0.00 -0.50 0.00 0.00 54.79 52.84 2ksp n ASP 102 Cb 0.49 -0.50 0.52 0.00 -1.14 0.00 0.00 41.12 40.48 2ksp n ASP 102 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 2ksp h ASP 103 N -0.80 0.14 0.30 -1.12 2.03 -1.99 0.10 116.42 115.09 2ksp h ASP 103 Ca -0.22 -0.01 -0.01 0.00 -0.73 0.00 0.00 57.03 56.05 2ksp h ASP 103 Cb 0.64 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.11 2ksp h ASP 103 CO 0.17 0.19 -0.14 -0.08 -1.03 0.00 0.00 179.24 178.34 2ksp h GLU 104 N 0.16 -0.39 -0.63 4.15 4.81 -1.98 -2.03 114.58 118.67 2ksp h GLU 104 Ca 0.04 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.36 2ksp h GLU 104 Cb 0.13 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.54 2ksp h GLU 104 CO 0.00 -0.10 0.32 0.93 -0.73 0.00 0.00 179.01 179.43 2ksp h GLU 105 N -1.01 0.57 -0.47 1.92 5.08 -1.79 0.04 114.58 118.92 2ksp h GLU 105 Ca -0.04 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.18 2ksp h GLU 105 Cb 0.46 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2ksp h GLU 105 CO 0.07 0.38 -0.12 0.35 -1.00 0.00 0.00 179.01 178.68 2ksp h PHE 106 N 0.59 0.97 -0.49 4.33 3.57 -0.89 -0.05 116.94 124.96 2ksp h PHE 106 Ca 0.29 -0.19 -0.12 0.00 3.53 0.00 0.00 57.97 61.48 2ksp h PHE 106 Cb 0.24 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 2ksp h PHE 106 CO -0.10 0.94 -0.16 0.00 -2.23 0.00 0.00 178.31 176.76 2ksp h ALA 107 N 1.07 0.78 -0.62 2.41 0.00 -0.73 -1.39 119.26 120.79 2ksp h ALA 107 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2ksp h ALA 107 Cb 0.64 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2ksp h ALA 107 CO 0.04 0.66 0.41 -0.07 0.00 0.00 0.00 179.25 180.29 2ksp h LEU 108 N 0.85 0.71 0.21 0.00 -0.00 -0.66 0.37 115.31 116.79 2ksp h LEU 108 Ca 0.12 -0.02 0.01 0.00 -0.00 0.00 0.00 57.88 57.99 2ksp h LEU 108 Cb 0.71 -0.18 -0.04 0.00 -0.00 0.00 0.00 40.66 41.16 2ksp h LEU 108 CO 0.05 0.52 -0.44 0.00 -0.00 0.00 0.00 178.44 178.58 2ksp h ALA 109 N 1.22 -0.84 -0.18 1.53 0.00 -0.62 0.20 119.26 120.57 2ksp h ALA 109 Ca 0.23 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2ksp h ALA 109 Cb -0.09 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2ksp h ALA 109 CO -0.05 -1.03 -0.28 -0.91 0.00 0.00 0.00 179.25 176.98 2ksp h ASN 110 N -0.73 0.34 -0.31 0.00 2.35 -1.12 -1.48 115.58 114.63 2ksp h ASN 110 Ca -0.00 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 2ksp h ASN 110 Cb 0.72 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 2ksp h ASN 110 CO -0.20 0.62 0.09 -0.74 -1.65 0.00 0.00 177.43 175.56 2ksp h HIS 111 N 0.30 0.50 -0.81 1.19 2.76 -0.69 -1.24 115.15 117.15 2ksp h HIS 111 Ca 0.04 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.15 2ksp h HIS 111 Cb 0.66 -0.14 -0.04 0.00 1.55 0.00 0.00 27.41 29.44 2ksp h HIS 111 CO 0.02 0.52 0.48 -0.07 -1.30 0.00 0.00 177.93 177.58 2ksp h LEU 112 N 0.34 0.98 -0.48 0.26 3.38 -0.40 0.15 115.31 119.54 2ksp h LEU 112 Ca 0.10 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.00 2ksp h LEU 112 Cb 0.26 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2ksp h LEU 112 CO -0.00 0.76 0.32 0.40 0.09 0.00 0.00 178.44 180.00 2ksp h ILE 113 N 1.11 1.12 -0.41 1.22 2.04 -1.15 -1.53 117.51 119.92 2ksp h ILE 113 Ca 0.29 -0.22 -0.07 0.00 1.00 0.00 0.00 64.86 65.86 2ksp h ILE 113 Cb -0.03 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 2ksp h ILE 113 CO -0.05 0.12 -0.02 0.50 0.00 0.00 0.00 178.15 178.70 2ksp h LYS 114 N 0.65 0.67 -0.71 2.37 3.64 -0.52 0.60 116.57 123.26 2ksp h LYS 114 Ca 0.18 -0.17 0.11 0.00 -1.27 0.00 0.00 60.65 59.49 2ksp h LYS 114 Cb -0.07 -0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 31.59 2ksp h LYS 114 CO -0.04 0.70 0.33 0.28 -2.27 0.00 0.00 179.45 178.45 2ksp h VAL 115 N 0.63 0.79 -0.41 2.00 2.07 -0.15 0.36 116.25 121.53 2ksp h VAL 115 Ca 0.13 -0.19 -0.08 0.00 0.82 0.00 0.00 66.70 67.38 2ksp h VAL 115 Cb 0.42 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 2ksp h VAL 115 CO 0.02 0.10 -0.05 0.11 0.02 0.00 0.00 177.57 177.77 2ksp h LYS 116 N 0.54 0.76 0.00 1.57 1.79 -0.26 0.55 116.57 121.53 2ksp h LYS 116 Ca 0.36 -0.27 -0.08 0.00 -2.18 0.00 0.00 60.65 58.48 2ksp h LYS 116 Cb 0.44 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.02 2ksp h LYS 116 CO -0.31 0.87 -0.38 -0.07 -1.08 0.00 0.00 179.45 178.48 2ksp h LEU 117 N 0.58 0.00 0.00 2.94 3.38 -0.10 -2.20 115.31 119.92 2ksp h LEU 117 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2ksp h LEU 117 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2ksp h LEU 117 CO 0.03 0.38 0.00 -0.62 0.09 0.00 0.00 178.44 178.32 2ksp n GLU 118 N -3.69 0.24 -0.23 1.13 1.02 0.12 -4.86 120.64 114.37 2ksp n GLU 118 Ca -0.01 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2ksp n GLU 118 Cb 0.47 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.39 2ksp n GLU 118 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ksp n GLY 119 N 0.79 0.86 3.88 0.62 0.00 -0.83 -5.08 105.19 105.44 2ksp n GLY 119 Ca 0.10 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.00 1.90 -0.02 1.61 3.76 0.18 -5.02 115.29 115.69 2ksp s HIS 120 Ca 0.00 -0.76 0.00 0.00 -0.15 0.00 0.00 55.06 54.15 2ksp s HIS 120 Cb 0.00 -1.96 0.03 0.00 1.11 0.00 0.00 32.58 31.76 2ksp s HIS 120 CO 0.00 -0.35 0.02 -1.83 -0.85 0.00 0.00 174.74 171.74 2ksp s GLU 121 N -4.22 0.02 -0.02 1.40 -1.05 -1.26 -3.76 118.70 109.81 2ksp s GLU 121 Ca 0.37 0.16 -0.30 0.00 -0.15 0.00 0.00 54.97 55.04 2ksp s GLU 121 Cb -0.02 -0.27 -0.04 0.00 -0.44 0.00 0.00 34.13 33.37 2ksp s GLU 121 CO 0.22 -0.15 1.22 -0.48 0.95 0.00 0.00 175.26 177.02 2ksp s LEU 122 N 0.98 4.30 0.00 1.83 2.34 -1.26 -4.91 118.68 121.96 2ksp s LEU 122 Ca -0.08 1.89 0.00 0.00 0.06 0.00 0.00 54.13 55.99 2ksp s LEU 122 Cb -0.12 -3.56 0.00 0.00 -0.56 0.00 0.00 46.19 41.95 2ksp s LEU 122 CO -0.03 -0.57 0.71 -0.81 -1.06 0.00 0.00 176.35 174.60 2ksp n PRO 123 N 4.93 0.88 -1.40 1.48 -0.04 -1.26 -4.77 135.00 134.82 2ksp n PRO 123 Ca 0.11 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.43 2ksp n PRO 123 Cb 0.46 -1.17 -0.06 0.00 -0.04 0.00 0.00 33.50 32.69 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 -0.28 -0.21 -2.68 0.55 0.00 -1.26 -5.00 120.51 111.63 2ksp n ALA 124 Ca 0.00 0.22 -0.33 0.00 0.00 0.00 0.00 53.44 53.33 2ksp n ALA 124 Cb 0.09 -1.54 -0.12 0.00 0.00 0.00 0.00 19.45 17.87 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 -2.81 4.42 -0.81 0.00 1.01 -1.26 -5.07 116.67 112.15 2ksp s ASP 125 Ca 0.00 -0.12 -0.13 0.00 0.71 0.00 0.00 52.55 53.01 2ksp s ASP 125 Cb 0.00 -1.24 0.22 0.00 1.01 0.00 0.00 42.92 42.91 2ksp s ASP 125 CO 0.00 0.30 0.74 -0.76 0.21 0.00 0.00 175.17 175.67 2ksp s LEU 126 N -0.47 6.65 0.64 1.23 1.43 -1.26 -5.08 118.68 121.82 2ksp s LEU 126 Ca 0.07 -2.71 -0.15 0.00 -1.03 0.00 0.00 54.13 50.31 2ksp s LEU 126 Cb -0.12 -2.18 -0.01 0.00 0.03 0.00 0.00 46.19 43.91 2ksp s LEU 126 CO 0.02 -0.56 1.09 -2.16 0.23 0.00 0.00 176.35 174.98 2ksp s PRO 127 N 0.14 2.95 0.01 1.29 0.04 -1.26 -4.82 135.00 133.35 2ksp s PRO 127 Ca 0.18 1.33 0.05 0.00 0.04 0.00 0.00 61.00 62.60 2ksp s PRO 127 Cb -0.11 -1.98 0.23 0.00 0.04 0.00 0.00 34.50 32.69 2ksp s PRO 127 CO -0.08 -1.12 1.17 -0.35 0.04 0.00 0.00 177.00 176.65 2ksp n PRO 128 N -2.32 0.00 -0.03 0.56 -0.04 -1.26 -0.88 135.00 131.04 2ksp n PRO 128 Ca 0.10 0.42 0.13 0.00 -0.04 0.00 0.00 63.50 64.11 2ksp n PRO 128 Cb 0.52 -1.51 0.39 0.00 -0.04 0.00 0.00 33.50 32.85 2ksp n PRO 128 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2ksp n HIS 129 N -1.52 0.07 -0.02 0.54 1.44 -1.26 -4.09 115.22 110.38 2ksp n HIS 129 Ca 0.01 -0.03 -0.02 0.00 -2.01 0.00 0.00 57.72 55.67 2ksp n HIS 129 Cb 0.06 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.15 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 0.55 1.59 -4.67 2.39 4.77 -0.06 -4.23 117.00 117.34 2ksp n LEU 130 Ca 0.17 -0.01 -0.40 0.00 -0.03 0.00 0.00 56.01 55.74 2ksp n LEU 130 Cb 0.42 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 2ksp n LEU 130 CO 0.16 0.33 0.39 -0.69 -1.33 0.00 0.00 177.39 176.24 2ksp s VAL 131 N -2.07 5.02 0.66 4.08 1.01 -0.89 -4.96 120.40 123.24 2ksp s VAL 131 Ca -0.03 1.23 -0.16 0.00 0.00 0.00 0.00 61.98 63.02 2ksp s VAL 131 Cb 0.01 -3.96 -0.00 0.00 0.00 0.00 0.00 36.38 32.43 2ksp s VAL 131 CO 0.09 0.12 1.14 -2.84 0.00 0.00 0.00 175.10 173.61 2ksp s PRO 132 N 1.83 2.74 0.00 2.72 0.02 -1.26 -4.79 135.00 136.25 2ksp s PRO 132 Ca 0.30 1.53 0.00 0.00 0.02 0.00 0.00 61.00 62.85 2ksp s PRO 132 Cb -0.16 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.43 2ksp s PRO 132 CO 0.11 -1.32 0.37 -0.35 -0.33 0.00 0.00 177.00 175.47 2ksp n PRO 133 N -2.29 0.39 0.08 5.54 -0.04 -1.26 -3.00 135.00 134.43 2ksp n PRO 133 Ca 0.11 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.47 2ksp n PRO 133 Cb 0.51 -1.03 -0.02 0.00 -0.04 0.00 0.00 33.50 32.93 2ksp n PRO 133 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ksp h SER 134 N 0.08 0.36 -0.03 3.54 4.64 -2.01 -3.26 113.55 116.86 2ksp h SER 134 Ca 0.00 -0.29 -0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2ksp h SER 134 Cb 0.03 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2ksp h SER 134 CO 0.00 1.09 -0.04 2.29 -0.87 0.00 0.00 176.83 179.30 2ksp n LYS 135 N -3.70 1.49 -4.02 4.77 0.00 -1.16 -5.01 118.16 110.53 2ksp n LYS 135 Ca -0.05 -2.67 -0.31 0.00 -0.00 0.00 0.00 58.31 55.28 2ksp n LYS 135 Cb 0.81 -1.55 -0.06 0.00 -0.00 0.00 0.00 35.03 34.23 2ksp n LYS 135 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2ksp s ARG 136 N -2.91 3.03 0.49 -1.58 0.52 -1.23 -5.03 118.95 112.24 2ksp s ARG 136 Ca 0.34 -0.62 -0.05 0.00 -0.52 0.00 0.00 55.73 54.88 2ksp s ARG 136 Cb 0.30 -2.81 -0.03 0.00 0.52 0.00 0.00 34.95 32.93 2ksp s ARG 136 CO 0.03 0.58 0.79 -0.98 0.02 0.00 0.00 175.30 175.73 2ksp s ARG 137 N -2.42 3.42 -0.29 3.54 1.70 -1.26 -4.94 118.95 118.70 2ksp s ARG 137 Ca 0.31 0.11 -0.06 0.00 -0.47 0.00 0.00 55.73 55.61 2ksp s ARG 137 Cb -0.12 -2.38 0.01 0.00 -0.57 0.00 0.00 34.95 31.89 2ksp s ARG 137 CO 0.24 -0.27 0.07 -1.58 -1.08 0.00 0.00 175.30 172.67 2ksp s HIS 138 N -2.75 3.14 -2.78 5.89 5.65 -1.26 -5.13 115.29 118.05 2ksp s HIS 138 Ca 0.48 -1.03 0.26 0.00 0.25 0.00 0.00 55.06 55.01 2ksp s HIS 138 Cb -0.10 -2.23 0.56 0.00 -1.18 0.00 0.00 32.58 29.62 2ksp s HIS 138 CO 0.44 -0.59 1.47 0.39 -0.65 0.00 0.00 174.74 175.80