#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksm n ALA 74 N 0.00 -1.24 -2.88 4.61 0.00 -1.26 -5.08 120.51 114.66 2ksm n ALA 74 Ca 0.00 -1.80 -0.31 0.00 0.00 0.00 0.00 53.44 51.33 2ksm n ALA 74 Cb 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 19.45 19.39 2ksm n ALA 74 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ksm s SER 75 N -5.79 6.14 0.16 0.00 0.01 -1.26 -4.97 113.70 107.99 2ksm s SER 75 Ca 0.75 0.21 0.16 0.00 1.31 0.00 0.00 55.95 58.38 2ksm s SER 75 Cb -0.02 -1.84 0.75 0.00 0.21 0.00 0.00 66.02 65.11 2ksm s SER 75 CO 0.52 0.18 1.50 0.00 0.41 0.00 0.00 173.24 175.85 2ksm n ALA 76 N 0.42 1.37 -0.25 1.44 0.00 -1.26 -2.55 120.51 119.69 2ksm n ALA 76 Ca -0.07 0.07 0.17 0.00 0.00 0.00 0.00 53.44 53.61 2ksm n ALA 76 Cb 0.51 -1.26 0.47 0.00 0.00 0.00 0.00 19.45 19.17 2ksm n ALA 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2ksm h LEU 77 N 0.00 0.49-10.40 0.00 5.85 -2.03 -3.42 115.31 105.80 2ksm h LEU 77 Ca 0.00 0.04 -0.46 0.00 0.84 0.00 0.00 57.88 58.31 2ksm h LEU 77 Cb 0.17 -0.05 0.15 0.00 0.37 0.00 0.00 40.66 41.30 2ksm h LEU 77 CO 0.00 0.21 0.24 -0.94 -0.34 0.00 0.00 178.44 177.61 2ksm s SER 78 N -5.68 3.04 0.11 1.25 1.04 -1.06 -5.03 113.70 107.39 2ksm s SER 78 Ca -0.09 1.14 -0.15 0.00 0.48 0.00 0.00 55.95 57.34 2ksm s SER 78 Cb 0.23 -1.79 -0.07 0.00 0.10 0.00 0.00 66.02 64.49 2ksm s SER 78 CO 0.78 -2.86 0.53 -0.76 0.98 0.00 0.00 173.24 171.91 2ksm s LEU 79 N -6.28 4.39 -0.40 2.42 1.02 -1.26 -5.04 118.68 113.52 2ksm s LEU 79 Ca 0.64 1.08 0.05 0.00 0.02 0.00 0.00 54.13 55.92 2ksm s LEU 79 Cb -0.17 -3.11 0.18 0.00 0.02 0.00 0.00 46.19 43.11 2ksm s LEU 79 CO 0.56 0.16 0.72 -0.55 0.02 0.00 0.00 176.35 177.26 2ksm s SER 80 N -1.55 -1.30 0.26 2.29 0.15 -1.26 -4.52 113.70 107.76 2ksm s SER 80 Ca 0.34 -0.74 0.10 0.00 0.70 0.00 0.00 55.95 56.35 2ksm s SER 80 Cb -0.16 1.67 -0.05 0.00 -1.71 0.00 0.00 66.02 65.77 2ksm s SER 80 CO 0.18 -0.13 -0.16 -0.76 1.20 0.00 0.00 173.24 173.57 2ksm s LEU 81 N 1.78 2.58 0.01 3.45 1.02 -1.26 -4.44 118.68 121.82 2ksm s LEU 81 Ca 0.17 -1.06 0.02 0.00 0.02 0.00 0.00 54.13 53.28 2ksm s LEU 81 Cb -0.02 -0.89 -0.01 0.00 0.02 0.00 0.00 46.19 45.29 2ksm s LEU 81 CO -0.08 -0.10 -0.06 -0.22 0.02 0.00 0.00 176.35 175.91 2ksm s LEU 82 N -3.44 2.06 -0.06 1.79 2.96 -1.14 -4.25 118.68 116.61 2ksm s LEU 82 Ca 0.27 -0.19 0.00 0.00 -0.22 0.00 0.00 54.13 54.00 2ksm s LEU 82 Cb -0.02 -0.25 0.02 0.00 0.50 0.00 0.00 46.19 46.45 2ksm s LEU 82 CO 0.12 0.01 -0.04 -0.55 -1.32 0.00 0.00 176.35 174.57 2ksm s SER 83 N -0.43 1.20 -0.05 3.68 0.15 -1.11 -2.19 113.70 114.95 2ksm s SER 83 Ca -0.01 -0.13 -0.02 0.00 0.70 0.00 0.00 55.95 56.50 2ksm s SER 83 Cb -0.04 -0.48 0.03 0.00 -1.71 0.00 0.00 66.02 63.83 2ksm s SER 83 CO -0.00 -0.09 0.05 -0.63 1.20 0.00 0.00 173.24 173.76 2ksm s ILE 84 N 1.24 0.01 -0.06 6.45 1.01 -0.62 -2.21 121.20 127.01 2ksm s ILE 84 Ca -0.06 0.32 0.05 0.00 0.00 0.00 0.00 60.65 60.96 2ksm s ILE 84 Cb -0.14 -0.27 -0.00 0.00 0.01 0.00 0.00 42.46 42.06 2ksm s ILE 84 CO -0.02 0.18 -0.21 -0.94 0.00 0.00 0.00 174.94 173.94 2ksm s SER 85 N 2.12 2.70 -0.17 3.58 1.04 0.20 -1.14 113.70 122.03 2ksm s SER 85 Ca 0.05 -0.46 -0.05 0.00 0.48 0.00 0.00 55.95 55.97 2ksm s SER 85 Cb -0.12 -0.89 0.06 0.00 0.10 0.00 0.00 66.02 65.17 2ksm s SER 85 CO -0.04 0.18 0.11 -0.60 0.98 0.00 0.00 173.24 173.87 2ksm s ARG 86 N 0.07 0.07 -0.30 4.02 3.52 -0.92 -1.87 118.95 123.54 2ksm s ARG 86 Ca -0.08 0.00 -0.09 0.00 -0.13 0.00 0.00 55.73 55.43 2ksm s ARG 86 Cb -0.14 -1.62 0.18 0.00 -1.56 0.00 0.00 34.95 31.81 2ksm s ARG 86 CO 0.04 -0.64 0.96 0.45 -0.81 0.00 0.00 175.30 175.31 2ksm s SER 87 N 2.17 -0.64 0.00 -2.12 0.15 -1.14 -1.55 113.70 110.57 2ksm s SER 87 Ca 0.03 0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.88 2ksm s SER 87 Cb -0.16 1.46 0.00 0.00 -1.71 0.00 0.00 66.02 65.61 2ksm s SER 87 CO -0.09 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2ksm n GLY 88 N 5.30 0.29 0.01 9.45 0.00 -1.25 -4.77 105.19 114.22 2ksm n GLY 88 Ca 0.02 -1.38 0.05 0.00 0.00 0.00 0.00 46.02 44.71 2ksm n GLY 88 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ksm n ASN 89 N 0.00 2.63 -4.57 1.61 3.02 -1.26 -5.01 115.26 111.68 2ksm n ASN 89 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.29 2ksm n ASN 89 Cb 0.00 1.46 -0.09 0.00 -0.61 0.00 0.00 39.78 40.54 2ksm n ASN 89 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2ksm s THR 90 N -2.71 3.12 -0.01 3.41 -4.23 -1.26 -2.44 115.64 111.52 2ksm s THR 90 Ca -0.04 -1.82 0.06 0.00 -1.18 0.00 0.00 61.69 58.72 2ksm s THR 90 Cb 0.07 -2.58 -0.03 0.00 1.34 0.00 0.00 72.50 71.30 2ksm s THR 90 CO 0.43 -0.20 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.42 2ksm s VAL 91 N -1.92 2.54 -0.24 2.29 1.01 -1.09 -4.29 120.40 118.70 2ksm s VAL 91 Ca 0.27 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 61.23 2ksm s VAL 91 Cb -0.08 -1.97 0.06 0.00 0.00 0.00 0.00 36.38 34.39 2ksm s VAL 91 CO 0.16 0.52 -0.05 0.42 0.00 0.00 0.00 175.10 176.14 2ksm s THR 92 N -0.73 1.54 -0.13 3.92 -4.23 -0.78 -1.38 115.64 113.85 2ksm s THR 92 Ca 0.12 -1.24 -0.04 0.00 -1.18 0.00 0.00 61.69 59.34 2ksm s THR 92 Cb -0.10 -1.81 0.05 0.00 1.34 0.00 0.00 72.50 71.98 2ksm s THR 92 CO 0.01 -0.11 0.08 -1.48 -0.54 0.00 0.00 174.62 172.58 2ksm s LEU 93 N 1.39 0.29 0.23 4.79 2.34 -1.12 -0.63 118.68 125.97 2ksm s LEU 93 Ca -0.06 -0.40 0.09 0.00 0.06 0.00 0.00 54.13 53.82 2ksm s LEU 93 Cb -0.19 -0.22 -0.05 0.00 -0.56 0.00 0.00 46.19 45.18 2ksm s LEU 93 CO -0.06 -0.32 -0.17 -0.63 -1.06 0.00 0.00 176.35 174.11 2ksm s ILE 94 N 2.14 2.02 -5.00 1.48 1.01 -0.94 -2.62 121.20 119.29 2ksm s ILE 94 Ca 0.03 -2.25 0.00 0.00 0.00 0.00 0.00 60.65 58.43 2ksm s ILE 94 Cb -0.15 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.21 2ksm s ILE 94 CO -0.07 -0.49 0.00 0.61 0.00 0.00 0.00 174.94 174.99 2ksm n GLY 95 N -0.38 -0.95 3.20 6.18 0.00 -1.22 -2.74 105.19 109.28 2ksm n GLY 95 Ca -0.08 -1.31 -0.29 0.00 0.00 0.00 0.00 46.02 44.35 2ksm n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ksm s ASP 96 N -4.00 2.58 0.26 1.61 1.11 -1.26 -2.51 116.67 114.46 2ksm s ASP 96 Ca 0.00 -0.43 0.10 0.00 0.18 0.00 0.00 52.55 52.40 2ksm s ASP 96 Cb 0.00 -0.71 -0.04 0.00 1.07 0.00 0.00 42.92 43.23 2ksm s ASP 96 CO 0.00 0.20 -0.02 -0.36 1.18 0.00 0.00 175.17 176.16 2ksm s PHE 97 N -0.06 2.67 0.04 4.23 0.40 0.21 -4.66 117.98 120.80 2ksm s PHE 97 Ca -0.04 -0.23 -0.17 0.00 -0.60 0.00 0.00 56.93 55.90 2ksm s PHE 97 Cb -0.13 -1.19 -0.24 0.00 0.51 0.00 0.00 43.02 41.97 2ksm s PHE 97 CO 0.03 0.62 1.13 -1.00 0.70 0.00 0.00 175.22 176.70 2ksm h PRO 98 N 2.01 0.55 0.00 0.24 0.13 -1.83 0.19 132.00 133.28 2ksm h PRO 98 Ca -0.44 -0.61 -0.30 0.00 -0.87 0.00 0.00 66.00 63.77 2ksm h PRO 98 Cb 1.25 0.18 -0.07 0.00 0.13 0.00 0.00 31.00 32.48 2ksm h PRO 98 CO 0.60 1.23 -0.28 -0.25 -0.23 0.00 0.00 178.00 179.07 2ksm n ASP 99 N -4.02 0.20 -0.10 1.44 9.92 -1.26 -3.92 116.55 118.81 2ksm n ASP 99 Ca -0.11 -2.29 -0.13 0.00 -0.53 0.00 0.00 54.79 51.72 2ksm n ASP 99 Cb 0.80 0.84 -0.14 0.00 -0.64 0.00 0.00 41.12 41.97 2ksm n ASP 99 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2ksm n GLU 100 N -0.44 0.68 0.25 -1.24 -0.58 -1.26 -4.25 120.64 113.79 2ksm n GLU 100 Ca 0.01 0.08 0.10 0.00 -0.42 0.00 0.00 57.16 56.94 2ksm n GLU 100 Cb 0.36 -1.55 0.69 0.00 -0.57 0.00 0.00 31.44 30.37 2ksm n GLU 100 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ksm h ALA 101 N 0.61 1.95 -0.52 0.62 0.00 -2.03 -0.85 119.26 119.05 2ksm h ALA 101 Ca -0.53 -0.00 0.15 0.00 0.00 0.00 0.00 54.91 54.53 2ksm h ALA 101 Cb 2.10 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.87 2ksm h ALA 101 CO -0.00 -0.05 0.48 0.00 0.00 0.00 0.00 179.25 179.67 2ksm h ALA 102 N 1.98 2.31 -0.40 0.00 0.00 -2.00 0.26 119.26 121.40 2ksm h ALA 102 Ca 0.02 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2ksm h ALA 102 Cb 0.08 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2ksm h ALA 102 CO -0.00 -0.74 -0.16 1.57 0.00 0.00 0.00 179.25 179.92 2ksm h LYS 103 N 0.00 0.74 -0.86 0.00 2.10 -1.41 -3.04 116.57 114.11 2ksm h LYS 103 Ca 0.25 -0.26 0.07 0.00 -2.00 0.00 0.00 60.65 58.71 2ksm h LYS 103 Cb 1.20 -0.05 -0.07 0.00 -0.90 0.00 0.00 32.23 32.41 2ksm h LYS 103 CO -0.00 0.85 0.52 0.00 -2.00 0.00 0.00 179.45 178.83 2ksm h ALA 104 N 1.16 1.19 -0.50 0.07 0.00 -0.62 0.98 119.26 121.55 2ksm h ALA 104 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2ksm h ALA 104 Cb 0.63 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2ksm h ALA 104 CO 0.04 0.24 0.01 0.00 0.00 0.00 0.00 179.25 179.54 2ksm h ALA 105 N 1.42 1.07 0.12 0.00 0.00 -1.58 -2.16 119.26 118.14 2ksm h ALA 105 Ca 0.39 -0.27 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 2ksm h ALA 105 Cb 0.23 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 17.84 2ksm h ALA 105 CO -0.19 0.59 -0.79 1.25 0.00 0.00 0.00 179.25 180.10 2ksm h LEU 106 N 0.78 0.41 -0.61 0.00 6.46 -1.35 -3.33 115.31 117.66 2ksm h LEU 106 Ca 0.15 -0.95 0.13 0.00 -0.12 0.00 0.00 57.88 57.09 2ksm h LEU 106 Cb 0.46 -0.13 -0.11 0.00 -0.73 0.00 0.00 40.66 40.14 2ksm h LEU 106 CO 0.02 1.38 -0.11 0.24 -0.62 0.00 0.00 178.44 179.35 2ksm h MET 107 N -0.43 0.03 -0.40 1.25 2.86 0.10 1.16 114.93 119.50 2ksm h MET 107 Ca -0.14 -0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.61 2ksm h MET 107 Cb 1.59 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 33.23 2ksm h MET 107 CO 0.13 0.02 0.79 1.79 1.06 0.00 0.00 176.91 180.69 2ksm h THR 108 N 0.03 0.09 0.15 2.22 1.35 -1.50 2.10 112.91 117.35 2ksm h THR 108 Ca 0.30 0.00 -0.29 0.00 -0.55 0.00 0.00 66.41 65.87 2ksm h THR 108 Cb 0.48 0.30 0.02 0.00 -1.73 0.00 0.00 68.15 67.22 2ksm h THR 108 CO -0.60 0.00 -1.28 0.00 -0.25 0.00 0.00 175.52 173.39 2ksm h ALA 109 N 0.80 0.04 -0.94 6.62 0.00 0.12 -3.26 119.26 122.64 2ksm h ALA 109 Ca 0.19 -0.84 0.03 0.00 0.00 0.00 0.00 54.91 54.28 2ksm h ALA 109 Cb 1.76 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.56 2ksm h ALA 109 CO -0.00 0.84 0.62 -0.07 0.00 0.00 0.00 179.25 180.64 2ksm h LEU 110 N 0.14 1.04 -1.01 0.00 4.07 0.36 -2.22 115.31 117.69 2ksm h LEU 110 Ca -0.17 -0.01 0.41 0.00 0.08 0.00 0.00 57.88 58.19 2ksm h LEU 110 Cb 1.98 -0.24 -0.17 0.00 1.08 0.00 0.00 40.66 43.31 2ksm h LEU 110 CO 0.22 0.72 0.56 0.59 -1.08 0.00 0.00 178.44 179.46 2ksm n ASN 111 N -4.47 0.32 0.10 -0.43 4.13 -0.95 0.27 115.26 114.24 2ksm n ASN 111 Ca 0.12 1.57 -0.04 0.00 1.68 0.00 0.00 54.58 57.91 2ksm n ASN 111 Cb 0.07 -0.77 0.15 0.00 -1.54 0.00 0.00 39.78 37.70 2ksm n ASN 111 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 2ksm h GLY 112 N 0.00 0.19 1.50 7.41 0.00 -1.58 -3.11 103.07 107.47 2ksm h GLY 112 Ca 0.82 -0.23 -0.25 0.00 0.00 0.00 0.00 47.33 47.68 2ksm h GLY 112 CO -0.71 0.20 -1.34 1.41 0.00 0.00 0.00 176.54 176.11 2ksm h LEU 113 N 0.13 0.00 -6.36 3.11 3.38 0.38 -3.46 115.31 112.49 2ksm h LEU 113 Ca -0.00 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.57 2ksm h LEU 113 Cb 1.06 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.73 2ksm h LEU 113 CO 0.09 0.99 1.40 -0.11 0.09 0.00 0.00 178.44 180.89 2ksm n LEU 114 N -3.20 0.23 -4.70 1.67 0.00 0.32 -4.87 117.00 106.45 2ksm n LEU 114 Ca -0.08 0.15 -0.24 0.00 0.00 0.00 0.00 56.01 55.84 2ksm n LEU 114 Cb 0.99 -0.73 -0.07 0.00 0.00 0.00 0.00 43.42 43.61 2ksm n LEU 114 CO 0.46 -0.57 -0.22 0.00 0.00 0.00 0.00 177.39 177.06 2ksm s ALA 115 N 7.14 3.44 0.42 1.96 0.00 -1.26 -5.02 121.76 128.43 2ksm s ALA 115 Ca 1.08 -1.94 -0.24 0.00 0.00 0.00 0.00 51.96 50.86 2ksm s ALA 115 Cb -1.00 -0.53 -0.09 0.00 0.00 0.00 0.00 23.12 21.50 2ksm s ALA 115 CO 0.39 -0.01 1.07 -1.25 0.00 0.00 0.00 175.76 175.96 2ksm s PRO 116 N -3.82 4.06 0.00 0.00 0.04 -1.26 -3.15 135.00 130.87 2ksm s PRO 116 Ca 0.38 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2ksm s PRO 116 Cb -0.00 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 32.05 2ksm s PRO 116 CO 0.22 -0.24 0.00 0.41 0.04 0.00 0.00 177.00 177.43 2ksm n GLY 117 N 0.33 0.00 3.72 0.56 0.00 -1.26 -4.90 105.19 103.63 2ksm n GLY 117 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2ksm n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ksm s VAL 118 N -0.90 4.25 0.03 1.61 0.11 -1.19 -5.01 120.40 119.30 2ksm s VAL 118 Ca 0.00 1.66 -0.00 0.00 -2.93 0.00 0.00 61.98 60.70 2ksm s VAL 118 Cb 0.00 -4.06 -0.04 0.00 -1.53 0.00 0.00 36.38 30.75 2ksm s VAL 118 CO 0.00 0.15 0.15 0.20 -3.33 0.00 0.00 175.10 172.28 2ksm s ASN 119 N 0.87 6.09 -0.03 3.54 -0.87 -1.02 -4.94 114.94 118.58 2ksm s ASN 119 Ca 0.55 0.22 0.04 0.00 -1.57 0.00 0.00 52.86 52.11 2ksm s ASN 119 Cb -0.27 -1.83 -0.01 0.00 -0.02 0.00 0.00 41.25 39.13 2ksm s ASN 119 CO 0.30 0.22 -0.15 0.54 -2.57 0.00 0.00 177.10 175.43 2ksm s VAL 120 N -1.37 1.25 -0.52 1.60 0.11 -1.26 -2.67 120.40 117.53 2ksm s VAL 120 Ca 0.29 -0.64 0.05 0.00 -2.93 0.00 0.00 61.98 58.75 2ksm s VAL 120 Cb -0.13 -1.07 0.18 0.00 -1.53 0.00 0.00 36.38 33.84 2ksm s VAL 120 CO 0.22 0.36 0.43 -0.38 -3.33 0.00 0.00 175.10 172.39 2ksm n ILE 121 N 3.01 -0.05 -4.04 7.04 5.41 -0.48 -4.91 119.36 125.34 2ksm n ILE 121 Ca -0.17 -4.04 -0.33 0.00 1.00 0.00 0.00 62.75 59.21 2ksm n ILE 121 Cb 0.54 -1.88 -0.15 0.00 -0.71 0.00 0.00 39.64 37.44 2ksm n ILE 121 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 2ksm s ASP 122 N -0.67 3.88 -0.29 4.38 -4.77 -1.26 -2.81 116.67 115.13 2ksm s ASP 122 Ca 0.31 -0.85 0.03 0.00 -3.30 0.00 0.00 52.55 48.73 2ksm s ASP 122 Cb 0.03 -1.57 0.08 0.00 -1.09 0.00 0.00 42.92 40.36 2ksm s ASP 122 CO -0.18 -0.08 -0.03 -1.10 0.70 0.00 0.00 175.17 174.49 2ksm s GLN 123 N 1.28 1.74 -0.01 2.11 -1.52 -1.08 -5.02 119.66 117.16 2ksm s GLN 123 Ca 0.01 -1.47 0.06 0.00 -1.95 0.00 0.00 55.36 52.01 2ksm s GLN 123 Cb -0.16 -2.89 -0.03 0.00 -0.22 0.00 0.00 33.01 29.71 2ksm s GLN 123 CO -0.08 -0.74 -0.19 0.42 -0.25 0.00 0.00 175.29 174.45 2ksm s ILE 124 N 1.11 2.71 0.20 1.08 1.01 -1.26 -3.41 121.20 122.64 2ksm s ILE 124 Ca 0.00 -0.99 0.09 0.00 0.00 0.00 0.00 60.65 59.75 2ksm s ILE 124 Cb -0.19 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 2ksm s ILE 124 CO -0.08 0.49 -0.06 -1.00 0.00 0.00 0.00 174.94 174.29 2ksm s HIS 125 N -0.78 2.68 0.14 3.97 3.76 -1.04 -4.92 115.29 119.10 2ksm s HIS 125 Ca 0.12 -0.21 -0.17 0.00 -0.15 0.00 0.00 55.06 54.66 2ksm s HIS 125 Cb -0.10 -1.28 -0.07 0.00 1.11 0.00 0.00 32.58 32.23 2ksm s HIS 125 CO 0.02 0.54 0.59 0.08 -0.85 0.00 0.00 174.74 175.11 2ksm s VAL 126 N -1.83 4.77 -0.48 -0.90 1.01 -1.26 0.66 120.40 122.37 2ksm s VAL 126 Ca 0.27 1.02 0.06 0.00 0.00 0.00 0.00 61.98 63.33 2ksm s VAL 126 Cb -0.08 -3.80 0.20 0.00 0.00 0.00 0.00 36.38 32.69 2ksm s VAL 126 CO 0.17 0.31 0.63 0.47 0.00 0.00 0.00 175.10 176.68 2ksm n ASP 127 N 1.02 -2.28 0.00 3.32 8.00 0.66 -4.87 116.55 122.40 2ksm n ASP 127 Ca -0.06 -2.80 0.00 0.00 0.71 0.00 0.00 54.79 52.64 2ksm n ASP 127 Cb 0.51 0.94 0.00 0.00 -0.02 0.00 0.00 41.12 42.56 2ksm n ASP 127 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 2ksm n PRO 128 N 2.61 0.00 -0.12 -0.24 -0.02 -1.25 -1.69 135.00 134.30 2ksm n PRO 128 Ca 0.20 0.08 -0.21 0.00 -2.02 0.00 0.00 63.50 61.54 2ksm n PRO 128 Cb 0.55 -1.55 -0.09 0.00 -0.02 0.00 0.00 33.50 32.38 2ksm n PRO 128 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2ksm n VAL 129 N -0.92 1.29 -0.69 -1.45 0.31 -1.26 -5.00 118.33 110.60 2ksm n VAL 129 Ca 0.00 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 2ksm n VAL 129 Cb 0.05 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.38 2ksm n VAL 129 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 2ksm n VAL 130 N -3.69 0.00 -3.97 2.52 0.24 -0.68 -4.69 118.33 108.07 2ksm n VAL 130 Ca -0.44 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 61.77 2ksm n VAL 130 Cb 0.87 -1.55 -0.06 0.00 -1.47 0.00 0.00 33.84 31.62 2ksm n VAL 130 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ksm s ARG 131 N -2.67 1.27 0.18 7.34 3.03 -1.26 -4.81 118.95 122.02 2ksm s ARG 131 Ca 0.00 -1.19 0.01 0.00 2.03 0.00 0.00 55.73 56.57 2ksm s ARG 131 Cb 0.00 0.40 -0.05 0.00 -1.03 0.00 0.00 34.95 34.28 2ksm s ARG 131 CO 0.00 -0.49 0.03 0.45 -1.13 0.00 0.00 175.30 174.17 2ksm s SER 132 N -2.98 0.95 0.53 -2.89 0.15 -1.26 -4.64 113.70 103.56 2ksm s SER 132 Ca 0.19 -1.22 -0.22 0.00 0.70 0.00 0.00 55.95 55.40 2ksm s SER 132 Cb 0.02 0.18 -0.06 0.00 -1.71 0.00 0.00 66.02 64.45 2ksm s SER 132 CO 0.03 -0.64 1.28 -0.11 1.20 0.00 0.00 173.24 174.99 2ksm n LEU 133 N -0.24 4.94 -4.50 3.45 7.94 -1.26 -4.90 117.00 122.43 2ksm n LEU 133 Ca -0.05 0.97 -0.42 0.00 -1.11 0.00 0.00 56.01 55.40 2ksm n LEU 133 Cb 0.64 -1.53 -0.03 0.00 0.53 0.00 0.00 43.42 43.03 2ksm n LEU 133 CO 0.33 -0.82 1.00 -0.62 -1.11 0.00 0.00 177.39 176.17 2ksm s ASP 134 N -0.90 6.23 0.00 1.96 -1.08 -1.26 -4.82 116.67 116.80 2ksm s ASP 134 Ca 0.70 -0.90 0.23 0.00 -0.52 0.00 0.00 52.55 52.07 2ksm s ASP 134 Cb -0.44 -2.49 0.48 0.00 -1.46 0.00 0.00 42.92 39.02 2ksm s ASP 134 CO 0.50 -1.57 1.42 2.22 0.52 0.00 0.00 175.17 178.26 2ksm n PHE 135 N 8.37 0.29 -0.56 -5.34 1.16 -1.26 -4.45 117.46 115.67 2ksm n PHE 135 Ca 0.04 -0.14 0.46 0.00 -1.87 0.00 0.00 57.45 55.94 2ksm n PHE 135 Cb 0.48 0.00 0.75 0.00 -1.61 0.00 0.00 39.48 39.10 2ksm n PHE 135 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 2ksm h SER 136 N 3.94 0.00 -0.52 5.98 0.02 -1.92 2.34 113.55 123.40 2ksm h SER 136 Ca 0.00 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.59 2ksm h SER 136 Cb 0.86 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.15 2ksm h SER 136 CO 0.00 0.00 -0.41 -0.24 -1.14 0.00 0.00 176.83 175.04 2ksm n SER 137 N -3.84 3.91 0.13 3.07 2.88 -1.26 -4.59 113.62 113.92 2ksm n SER 137 Ca 0.38 -3.80 0.12 0.00 -1.33 0.00 0.00 58.87 54.23 2ksm n SER 137 Cb 1.81 -0.52 0.09 0.00 -0.75 0.00 0.00 64.21 64.85 2ksm n SER 137 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ksm h ALA 138 N 1.63 0.67 0.66 -1.46 0.00 0.37 -3.27 119.26 117.85 2ksm h ALA 138 Ca 0.28 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 2ksm h ALA 138 Cb 1.38 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2ksm h ALA 138 CO 0.59 0.00 -0.42 0.93 0.00 0.00 0.00 179.25 180.35 2ksm h GLU 139 N 0.00 -0.99 -0.76 0.00 4.39 -1.81 2.56 114.58 117.98 2ksm h GLU 139 Ca 0.00 0.07 0.09 0.00 0.34 0.00 0.00 59.36 59.85 2ksm h GLU 139 Cb 0.95 0.22 -0.07 0.00 -0.10 0.00 0.00 28.75 29.75 2ksm h GLU 139 CO 0.00 -0.66 0.42 -1.35 -1.16 0.00 0.00 179.01 176.26 2ksm h PRO 140 N -1.02 0.69 0.10 2.33 0.11 -1.94 -0.14 132.00 132.12 2ksm h PRO 140 Ca -0.08 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.98 2ksm h PRO 140 Cb 0.83 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.79 2ksm h PRO 140 CO 0.07 0.46 -0.05 0.28 -0.21 0.00 0.00 178.00 178.55 2ksm h VAL 141 N 0.71 0.00 -1.02 3.15 2.07 -1.51 -2.97 116.25 116.68 2ksm h VAL 141 Ca 0.36 -0.41 0.30 0.00 0.82 0.00 0.00 66.70 67.78 2ksm h VAL 141 Cb 0.33 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.96 2ksm h VAL 141 CO -0.24 0.00 0.59 0.15 0.02 0.00 0.00 177.57 178.09 2ksm h PHE 142 N -0.54 0.93 -0.80 1.57 3.57 0.44 1.46 116.94 123.56 2ksm h PHE 142 Ca -0.01 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 2ksm h PHE 142 Cb 0.10 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.55 2ksm h PHE 142 CO 0.02 -0.10 0.33 1.79 -2.23 0.00 0.00 178.31 178.12 2ksm h THR 143 N 0.39 1.26 0.00 4.41 1.35 -1.06 0.17 112.91 119.42 2ksm h THR 143 Ca 0.71 -0.81 -0.07 0.00 -0.55 0.00 0.00 66.41 65.69 2ksm h THR 143 Cb 1.58 0.29 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 2ksm h THR 143 CO -0.55 0.33 -0.43 0.00 -0.25 0.00 0.00 175.52 174.63 2ksm h ALA 144 N 1.19 0.77 -0.68 6.62 0.00 0.11 -3.23 119.26 124.04 2ksm h ALA 144 Ca 0.27 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2ksm h ALA 144 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2ksm h ALA 144 CO -0.02 0.42 0.00 -1.13 0.00 0.00 0.00 179.25 178.51 2ksm n SER 145 N -3.14 3.66 -1.91 0.00 3.41 0.42 -4.33 113.62 111.73 2ksm n SER 145 Ca 0.02 -2.01 -0.08 0.00 -0.26 0.00 0.00 58.87 56.54 2ksm n SER 145 Cb 0.67 -0.46 0.06 0.00 -0.26 0.00 0.00 64.21 64.22 2ksm n SER 145 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 2ksm n VAL 146 N 1.49 1.78 0.26 -3.33 3.14 0.53 -4.80 118.33 117.39 2ksm n VAL 146 Ca 0.23 -3.24 0.15 0.00 -2.96 0.00 0.00 64.34 58.52 2ksm n VAL 146 Cb 0.58 0.01 0.56 0.00 -1.06 0.00 0.00 33.84 33.93 2ksm n VAL 146 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 2ksm h PRO 147 N 1.92 0.00 -5.33 1.45 0.13 -1.75 -3.42 132.00 125.00 2ksm h PRO 147 Ca 0.08 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.53 2ksm h PRO 147 Cb 1.41 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.23 2ksm h PRO 147 CO 0.36 0.06 -0.85 0.42 -0.23 0.00 0.00 178.00 177.77 2ksm s ILE 148 N -3.61 2.32 -1.39 -3.56 1.01 -1.26 -5.01 121.20 109.70 2ksm s ILE 148 Ca 0.02 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.74 2ksm s ILE 148 Cb 0.09 -1.91 0.00 0.00 0.01 0.00 0.00 42.46 40.65 2ksm s ILE 148 CO 0.58 0.55 0.49 -0.81 0.00 0.00 0.00 174.94 175.76 2ksm n PRO 149 N 3.55 0.71 -0.97 2.79 -0.04 -1.26 -3.08 135.00 136.70 2ksm n PRO 149 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2ksm n PRO 149 Cb 0.53 -1.22 0.16 0.00 -0.04 0.00 0.00 33.50 32.93 2ksm n PRO 149 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ksm n ASP 150 N -0.11 2.22 -4.88 3.54 9.92 -1.20 -2.88 116.55 123.17 2ksm n ASP 150 Ca 0.00 -3.70 -0.26 0.00 -0.53 0.00 0.00 54.79 50.30 2ksm n ASP 150 Cb 0.11 -0.48 -0.04 0.00 -0.64 0.00 0.00 41.12 40.07 2ksm n ASP 150 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2ksm s PHE 151 N -3.06 3.33 0.04 1.24 0.40 -0.59 -3.70 117.98 115.63 2ksm s PHE 151 Ca 0.40 0.05 0.04 0.00 -0.60 0.00 0.00 56.93 56.83 2ksm s PHE 151 Cb 0.38 -1.59 -0.02 0.00 0.51 0.00 0.00 43.02 42.29 2ksm s PHE 151 CO -0.06 0.52 -0.13 0.20 0.70 0.00 0.00 175.22 176.45 2ksm s GLY 152 N -3.17 0.74 -0.08 4.36 0.00 -0.42 -2.17 107.32 106.57 2ksm s GLY 152 Ca 0.33 -0.80 0.02 0.00 0.00 0.00 0.00 44.72 44.27 2ksm s GLY 152 CO 0.26 -0.78 -0.14 -2.27 0.00 0.00 0.00 173.10 170.17 2ksm s LEU 153 N -1.15 1.66 -0.04 0.66 1.98 -0.29 -3.12 118.68 118.36 2ksm s LEU 153 Ca 0.00 -0.36 0.02 0.00 -2.89 0.00 0.00 54.13 50.91 2ksm s LEU 153 Cb -0.08 -0.95 0.01 0.00 0.66 0.00 0.00 46.19 45.84 2ksm s LEU 153 CO 0.01 0.02 -0.07 -0.75 -1.89 0.00 0.00 176.35 173.67 2ksm s LYS 154 N 0.83 1.05 -0.06 1.98 2.20 -1.06 -1.59 119.74 123.08 2ksm s LYS 154 Ca -0.11 -0.22 0.06 0.00 -0.36 0.00 0.00 55.97 55.34 2ksm s LYS 154 Cb -0.15 -0.96 -0.01 0.00 -1.51 0.00 0.00 37.83 35.19 2ksm s LYS 154 CO 0.02 -0.00 -0.24 0.08 -0.36 0.00 0.00 175.35 174.84 2ksm s VAL 155 N 0.65 2.13 0.00 4.02 1.01 -0.93 -1.04 120.40 126.24 2ksm s VAL 155 Ca -0.10 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 60.84 2ksm s VAL 155 Cb -0.13 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.47 2ksm s VAL 155 CO 0.01 0.57 0.00 -0.62 0.00 0.00 0.00 175.10 175.06 2ksm n GLU 156 N 2.94 3.94 0.07 2.72 4.71 0.12 -2.86 120.64 132.28 2ksm n GLU 156 Ca -0.17 0.00 -0.03 0.00 -0.01 0.00 0.00 57.16 56.95 2ksm n GLU 156 Cb 0.52 0.00 -0.01 0.00 -1.01 0.00 0.00 31.44 30.94 2ksm n GLU 156 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ksm h ARG 157 N 0.00 -0.19 0.00 3.49 3.08 -2.01 -3.41 114.38 115.34 2ksm h ARG 157 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ksm h ARG 157 Cb 0.00 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2ksm h ARG 157 CO 0.00 -0.13 -0.06 -3.47 -1.07 0.00 0.00 179.97 175.24 2ksm n ASP 158 N -2.81 1.77 -4.31 7.04 -0.08 -1.26 -4.94 116.55 111.96 2ksm n ASP 158 Ca -0.02 -2.43 -0.18 0.00 -1.51 0.00 0.00 54.79 50.64 2ksm n ASP 158 Cb 0.08 -0.22 -0.10 0.00 2.34 0.00 0.00 41.12 43.21 2ksm n ASP 158 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2ksm s THR 159 N -1.68 1.61 -0.04 5.18 2.01 -1.26 -4.12 115.64 117.34 2ksm s THR 159 Ca 0.15 -2.05 0.00 0.00 0.31 0.00 0.00 61.69 60.10 2ksm s THR 159 Cb 0.13 -1.89 0.03 0.00 0.01 0.00 0.00 72.50 70.77 2ksm s THR 159 CO 0.01 -0.53 -0.00 -0.69 -0.69 0.00 0.00 174.62 172.72 2ksm s VAL 160 N -2.70 0.25 0.02 3.82 1.01 -0.52 0.13 120.40 122.42 2ksm s VAL 160 Ca 0.18 0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.29 2ksm s VAL 160 Cb -0.02 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.97 2ksm s VAL 160 CO 0.05 0.18 -0.10 -0.89 0.00 0.00 0.00 175.10 174.35 2ksm s THR 161 N 1.24 3.41 -0.10 3.92 2.01 -0.21 -2.21 115.64 123.71 2ksm s THR 161 Ca -0.07 -0.92 0.03 0.00 0.31 0.00 0.00 61.69 61.04 2ksm s THR 161 Cb -0.13 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 69.90 2ksm s THR 161 CO -0.02 0.35 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.84 2ksm s LEU 162 N -1.51 1.94 -0.05 4.42 0.20 0.00 -2.56 118.68 121.13 2ksm s LEU 162 Ca 0.17 -0.49 -0.02 0.00 0.69 0.00 0.00 54.13 54.49 2ksm s LEU 162 Cb -0.11 -1.23 0.04 0.00 -0.43 0.00 0.00 46.19 44.45 2ksm s LEU 162 CO 0.08 0.10 0.10 0.42 -0.29 0.00 0.00 176.35 176.76 2ksm s THR 163 N 0.55 -0.06 -0.25 3.68 -4.23 -1.18 -2.62 115.64 111.52 2ksm s THR 163 Ca -0.15 0.21 -0.17 0.00 -1.18 0.00 0.00 61.69 60.39 2ksm s THR 163 Cb -0.17 -0.18 0.07 0.00 1.34 0.00 0.00 72.50 73.56 2ksm s THR 163 CO 0.05 0.09 0.62 -0.83 -0.54 0.00 0.00 174.62 174.01 2ksm s GLY 164 N 1.21 -0.53 -0.18 3.99 0.00 -1.26 -1.31 107.32 109.25 2ksm s GLY 164 Ca -0.08 2.04 -0.29 0.00 0.00 0.00 0.00 44.72 46.39 2ksm s GLY 164 CO -0.05 1.96 1.49 -0.51 0.00 0.00 0.00 173.10 175.99 2ksm s THR 165 N 1.10 3.89 -0.39 0.90 -4.23 -1.24 -4.42 115.64 111.25 2ksm s THR 165 Ca -0.06 1.04 0.01 0.00 -1.18 0.00 0.00 61.69 61.50 2ksm s THR 165 Cb -0.05 -3.79 0.14 0.00 1.34 0.00 0.00 72.50 70.14 2ksm s THR 165 CO -0.11 -0.22 0.24 0.00 -0.54 0.00 0.00 174.62 173.99 2ksm s ALA 166 N 4.35 1.42 -0.95 3.99 0.00 -1.26 -4.90 121.76 124.42 2ksm s ALA 166 Ca 0.65 -2.20 0.00 0.00 0.00 0.00 0.00 51.96 50.41 2ksm s ALA 166 Cb -0.25 -1.70 0.00 0.00 0.00 0.00 0.00 23.12 21.17 2ksm s ALA 166 CO 0.24 -2.08 0.32 -2.30 0.00 0.00 0.00 175.76 171.94 2ksm n PRO 167 N 3.71 0.00 0.00 0.00 -0.02 -1.26 -4.23 135.00 133.19 2ksm n PRO 167 Ca 0.13 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 2ksm n PRO 167 Cb 0.37 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 2ksm n PRO 167 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2ksm n SER 168 N -0.82 0.00 0.00 2.55 7.64 -1.26 -4.93 113.62 116.80 2ksm n SER 168 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2ksm n SER 168 Cb 0.03 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 2ksm n SER 168 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2ksm n SER 169 N 0.00 0.00 0.22 6.43 3.41 -1.26 -4.79 113.62 117.62 2ksm n SER 169 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.73 2ksm n SER 169 Cb 0.00 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 64.37 2ksm n SER 169 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2ksm h GLU 170 N 0.00 0.00 -0.42 4.33 5.08 -2.00 0.22 114.58 121.78 2ksm h GLU 170 Ca 0.00 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.48 2ksm h GLU 170 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2ksm h GLU 170 CO 0.00 0.00 0.67 1.25 -1.00 0.00 0.00 179.01 179.93 2ksm h HIS 171 N 0.00 0.00 0.00 4.33 2.76 -1.97 1.56 115.15 121.83 2ksm h HIS 171 Ca 0.10 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.19 2ksm h HIS 171 Cb 1.61 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.56 2ksm h HIS 171 CO 0.00 0.00 -0.59 1.57 -1.30 0.00 0.00 177.93 177.61 2ksm h LYS 172 N 0.00 0.00 -0.19 5.26 5.09 -0.95 -3.35 116.57 122.43 2ksm h LYS 172 Ca 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.93 2ksm h LYS 172 Cb 1.53 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.85 2ksm h LYS 172 CO -0.00 0.28 0.09 0.22 -2.09 0.00 0.00 179.45 177.95 2ksm h ASP 173 N 0.00 0.25 -0.66 7.07 1.82 0.21 -2.49 116.42 122.61 2ksm h ASP 173 Ca -0.03 -0.12 0.19 0.00 -0.39 0.00 0.00 57.03 56.69 2ksm h ASP 173 Cb 1.28 -0.06 -0.03 0.00 0.68 0.00 0.00 39.33 41.20 2ksm h ASP 173 CO 0.04 0.29 0.48 0.00 -1.61 0.00 0.00 179.24 178.44 2ksm h ALA 174 N 0.96 2.62 -0.09 -0.78 0.00 -1.69 0.09 119.26 120.37 2ksm h ALA 174 Ca 0.07 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 2ksm h ALA 174 Cb 0.11 0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.97 2ksm h ALA 174 CO -0.01 -0.82 -0.88 0.28 0.00 0.00 0.00 179.25 177.82 2ksm h VAL 175 N 0.00 1.28 -0.37 0.00 2.07 -1.64 -2.99 116.25 114.60 2ksm h VAL 175 Ca 0.31 -2.08 -0.03 0.00 0.82 0.00 0.00 66.70 65.72 2ksm h VAL 175 Cb 1.27 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 33.16 2ksm h VAL 175 CO -0.00 0.65 0.13 0.50 0.02 0.00 0.00 177.57 178.87 2ksm h LYS 176 N 0.48 0.57 -0.80 1.57 3.64 -0.77 -2.22 116.57 119.04 2ksm h LYS 176 Ca -0.08 -0.12 0.01 0.00 -1.27 0.00 0.00 60.65 59.19 2ksm h LYS 176 Cb 1.51 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 33.21 2ksm h LYS 176 CO 0.18 0.58 0.53 0.00 -2.27 0.00 0.00 179.45 178.46 2ksm h ARG 177 N 0.45 1.06 -0.45 1.90 3.08 -1.46 0.35 114.38 119.31 2ksm h ARG 177 Ca 0.12 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 2ksm h ARG 177 Cb 0.24 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2ksm h ARG 177 CO -0.01 0.70 0.10 0.00 -1.07 0.00 0.00 179.97 179.69 2ksm h ALA 178 N 1.50 0.60 -0.14 0.04 0.00 -1.34 -2.75 119.26 117.16 2ksm h ALA 178 Ca 0.29 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2ksm h ALA 178 Cb -0.12 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 2ksm h ALA 178 CO -0.06 0.29 -0.09 0.00 0.00 0.00 0.00 179.25 179.39 2ksm h ALA 179 N 0.96 0.20 -0.75 0.00 0.00 -0.91 -2.77 119.26 115.99 2ksm h ALA 179 Ca 0.14 -0.28 0.17 0.00 0.00 0.00 0.00 54.91 54.94 2ksm h ALA 179 Cb 0.34 -0.05 -0.13 0.00 0.00 0.00 0.00 17.79 17.95 2ksm h ALA 179 CO 0.00 0.02 0.01 1.79 0.00 0.00 0.00 179.25 181.08 2ksm h THR 180 N -0.04 0.35 -0.18 0.00 1.35 -0.90 0.69 112.91 114.18 2ksm h THR 180 Ca 0.03 -0.04 -0.06 0.00 -0.55 0.00 0.00 66.41 65.79 2ksm h THR 180 Cb 0.57 0.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.21 2ksm h THR 180 CO 0.02 0.02 -0.15 0.28 -0.25 0.00 0.00 175.52 175.44 2ksm h SER 181 N 0.11 0.28 0.64 5.36 0.02 -1.43 -0.73 113.55 117.80 2ksm h SER 181 Ca 0.41 -0.06 -0.27 0.00 -0.84 0.00 0.00 61.79 61.03 2ksm h SER 181 Cb 0.73 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 2ksm h SER 181 CO -0.66 0.46 -1.29 0.74 -1.14 0.00 0.00 176.83 174.93 2ksm h THR 182 N 0.27 1.42 -2.07 -2.27 2.02 0.24 -3.39 112.91 109.13 2ksm h THR 182 Ca 0.05 -3.04 -0.55 0.00 0.77 0.00 0.00 66.41 63.64 2ksm h THR 182 Cb 0.43 2.87 -0.40 0.00 -1.74 0.00 0.00 68.15 69.31 2ksm h THR 182 CO 0.03 0.87 -0.98 0.79 0.37 0.00 0.00 175.52 176.60 2ksm n TRP 183 N -3.47 1.08 0.06 3.16 8.01 0.19 -4.94 117.44 121.53 2ksm n TRP 183 Ca -0.09 -3.80 -0.10 0.00 -1.31 0.00 0.00 57.50 52.20 2ksm n TRP 183 Cb 1.02 -0.43 0.01 0.00 -2.01 0.00 0.00 31.31 29.90 2ksm n TRP 183 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2ksm h PRO 184 N 3.64 0.37 0.00 -0.99 0.13 -1.34 -3.13 132.00 130.68 2ksm h PRO 184 Ca 0.11 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2ksm h PRO 184 Cb 0.82 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2ksm h PRO 184 CO 0.59 0.99 0.00 -0.40 -0.23 0.00 0.00 178.00 178.95 2ksm n ASP 185 N -3.79 0.00 -4.42 1.44 5.75 -1.26 -4.71 116.55 109.56 2ksm n ASP 185 Ca -0.05 -0.33 -0.33 0.00 -0.01 0.00 0.00 54.79 54.08 2ksm n ASP 185 Cb 0.75 -0.20 -0.14 0.00 -1.03 0.00 0.00 41.12 40.50 2ksm n ASP 185 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 2ksm s MET 186 N -2.40 2.74 0.10 0.11 -1.94 -1.18 -5.08 119.30 111.64 2ksm s MET 186 Ca 0.30 -0.72 -0.31 0.00 -1.71 0.00 0.00 55.69 53.25 2ksm s MET 186 Cb 0.18 -2.41 -0.09 0.00 2.01 0.00 0.00 34.83 34.52 2ksm s MET 186 CO 0.38 0.48 1.76 0.15 -0.01 0.00 0.00 175.02 177.78 2ksm s LYS 187 N -0.37 4.16 -0.18 2.03 1.02 -1.26 -4.85 119.74 120.30 2ksm s LYS 187 Ca 0.04 2.48 -0.01 0.00 0.02 0.00 0.00 55.97 58.50 2ksm s LYS 187 Cb -0.12 -3.60 -0.00 0.00 -0.52 0.00 0.00 37.83 33.58 2ksm s LYS 187 CO 0.02 -0.80 -0.12 0.42 -0.92 0.00 0.00 175.35 173.96 2ksm s ILE 188 N 2.71 2.91 -0.31 2.17 1.01 -1.26 -1.44 121.20 126.99 2ksm s ILE 188 Ca 0.78 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 60.79 2ksm s ILE 188 Cb -0.43 -2.26 0.09 0.00 0.01 0.00 0.00 42.46 39.86 2ksm s ILE 188 CO 0.35 0.49 0.01 0.54 0.00 0.00 0.00 174.94 176.33 2ksm s VAL 189 N 1.00 2.10 -0.60 2.92 0.11 -0.94 -5.03 120.40 119.97 2ksm s VAL 189 Ca -0.01 -2.04 -0.07 0.00 -2.93 0.00 0.00 61.98 56.93 2ksm s VAL 189 Cb -0.15 -2.46 0.15 0.00 -1.53 0.00 0.00 36.38 32.40 2ksm s VAL 189 CO -0.02 -0.44 0.45 0.20 -3.33 0.00 0.00 175.10 171.96 2ksm s ASN 190 N 1.03 5.69 -0.71 3.54 0.01 -1.26 -0.82 114.94 122.43 2ksm s ASN 190 Ca 0.05 -2.45 -0.03 0.00 -0.71 0.00 0.00 52.86 49.72 2ksm s ASN 190 Cb -0.19 -1.97 0.18 0.00 0.41 0.00 0.00 41.25 39.68 2ksm s ASN 190 CO -0.08 -0.53 0.54 0.54 -1.51 0.00 0.00 177.10 176.06 2ksm s ASN 191 N 1.72 5.48 0.14 -1.22 2.20 -1.08 -4.99 114.94 117.19 2ksm s ASN 191 Ca 0.13 -3.10 -0.08 0.00 -0.94 0.00 0.00 52.86 48.87 2ksm s ASN 191 Cb -0.20 -1.88 -0.06 0.00 -2.00 0.00 0.00 41.25 37.10 2ksm s ASN 191 CO -0.04 -0.32 0.43 -0.63 -2.94 0.00 0.00 177.10 173.60 2ksm s ILE 192 N -0.42 5.07 0.00 0.54 1.01 -1.26 -4.75 121.20 121.39 2ksm s ILE 192 Ca 0.20 0.33 -0.00 0.00 0.00 0.00 0.00 60.65 61.17 2ksm s ILE 192 Cb -0.16 -3.64 -0.00 0.00 0.01 0.00 0.00 42.46 38.67 2ksm s ILE 192 CO -0.06 0.11 -0.00 -1.61 0.00 0.00 0.00 174.94 173.38 2ksm s GLU 193 N -2.39 0.07 -0.26 2.79 2.02 -1.26 -5.05 118.70 114.62 2ksm s GLU 193 Ca 0.39 -0.12 -0.29 0.00 0.02 0.00 0.00 54.97 54.98 2ksm s GLU 193 Cb -0.13 0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.13 2ksm s GLU 193 CO 0.21 -0.01 1.19 0.14 0.02 0.00 0.00 175.26 176.81 2ksm s VAL 194 N -0.29 4.36 0.14 2.63 -7.23 -1.26 -4.15 120.40 114.60 2ksm s VAL 194 Ca -0.03 1.59 -0.01 0.00 -1.81 0.00 0.00 61.98 61.72 2ksm s VAL 194 Cb -0.02 -4.21 -0.04 0.00 0.56 0.00 0.00 36.38 32.66 2ksm s VAL 194 CO -0.00 -0.35 0.33 0.42 -0.31 0.00 0.00 175.10 175.19 2ksm s THR 195 N 3.78 5.25 0.00 5.32 -4.23 -1.26 -4.67 115.64 119.83 2ksm s THR 195 Ca 0.51 -0.30 0.00 0.00 -1.18 0.00 0.00 61.69 60.72 2ksm s THR 195 Cb -0.16 -3.68 0.00 0.00 1.34 0.00 0.00 72.50 70.00 2ksm s THR 195 CO 0.16 -0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2ksm n GLY 196 N -0.21 4.01 0.58 3.99 0.00 -1.26 -4.79 105.19 107.51 2ksm n GLY 196 Ca -0.04 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2ksm n GLY 196 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2ksm n GLN 197 N 0.00 0.68 -0.79 1.61 -0.06 -1.26 -4.87 117.38 112.69 2ksm n GLN 197 Ca 0.00 0.00 -0.33 0.00 -2.00 0.00 0.00 57.00 54.67 2ksm n GLN 197 Cb 0.00 -1.31 0.12 0.00 -4.06 0.00 0.00 30.24 24.99 2ksm n GLN 197 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2ksm n ALA 198 N 0.24 -2.84 -1.44 1.69 0.00 -1.26 -4.95 120.51 111.95 2ksm n ALA 198 Ca 0.00 -0.68 -0.31 0.00 0.00 0.00 0.00 53.44 52.45 2ksm n ALA 198 Cb 0.20 -1.75 0.08 0.00 0.00 0.00 0.00 19.45 17.97 2ksm n ALA 198 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2ksm s PRO 199 N -3.57 2.46 0.46 0.00 0.04 -1.26 -4.96 135.00 128.16 2ksm s PRO 199 Ca 0.56 0.96 -0.20 0.00 0.04 0.00 0.00 61.00 62.37 2ksm s PRO 199 Cb -0.20 -1.93 -0.14 0.00 0.04 0.00 0.00 34.50 32.26 2ksm s PRO 199 CO 0.68 -1.44 0.09 -2.30 0.04 0.00 0.00 177.00 174.06 2ksm n PRO 200 N -3.36 0.10 -3.59 0.56 -0.02 -1.26 -3.35 135.00 124.08 2ksm n PRO 200 Ca 0.08 0.04 -0.33 0.00 -2.02 0.00 0.00 63.50 61.27 2ksm n PRO 200 Cb 0.54 -1.12 0.02 0.00 -0.02 0.00 0.00 33.50 32.93 2ksm n PRO 200 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ksm n GLY 201 N 2.30 -0.42 0.25 -1.23 0.00 -1.26 -4.84 105.19 99.99 2ksm n GLY 201 Ca 0.10 0.96 -0.01 0.00 0.00 0.00 0.00 46.02 47.07 2ksm n GLY 201 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ksm h PRO 202 N 1.21 0.61 -0.01 1.61 0.11 -1.93 -3.54 132.00 130.06 2ksm h PRO 202 Ca -0.57 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.50 2ksm h PRO 202 Cb 1.39 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2ksm h PRO 202 CO 0.28 0.40 0.00 -0.35 -0.21 0.00 0.00 178.00 178.12