#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 0.00 1.53 4.61 0.00 -1.26 -5.01 120.51 120.38 2ksm n ALA 74 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 2ksm n ALA 74 Cb 0.00 0.00 0.79 0.00 0.00 0.00 0.00 19.45 20.24 2ksm n ALA 74 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2ksm n SER 75 N 0.00 0.00 -3.16 0.00 3.41 -1.26 -4.97 113.62 107.64 2ksm n SER 75 Ca 0.00 -0.29 -0.09 0.00 -0.26 0.00 0.00 58.87 58.23 2ksm n SER 75 Cb 0.00 -0.23 0.01 0.00 -0.26 0.00 0.00 64.21 63.72 2ksm n SER 75 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ksm n ALA 76 N -1.23 -2.37 0.06 7.33 0.00 -1.26 -4.73 120.51 118.31 2ksm n ALA 76 Ca 0.16 0.22 0.21 0.00 0.00 0.00 0.00 53.44 54.03 2ksm n ALA 76 Cb 0.22 -1.14 0.73 0.00 0.00 0.00 0.00 19.45 19.26 2ksm n ALA 76 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2ksm h LEU 77 N 3.10 0.00 -8.58 0.00 4.07 -2.03 -3.35 115.31 108.52 2ksm h LEU 77 Ca -0.12 0.00 -0.64 0.00 0.08 0.00 0.00 57.88 57.20 2ksm h LEU 77 Cb 0.92 0.00 -0.14 0.00 1.08 0.00 0.00 40.66 42.52 2ksm h LEU 77 CO 0.08 0.00 0.30 -0.44 -1.08 0.00 0.00 178.44 177.30 2ksm s SER 78 N -5.26 6.36 0.71 -0.43 0.01 -1.26 -4.84 113.70 108.99 2ksm s SER 78 Ca -0.04 -0.27 -0.03 0.00 1.31 0.00 0.00 55.95 56.92 2ksm s SER 78 Cb 0.16 -2.37 0.11 0.00 0.21 0.00 0.00 66.02 64.13 2ksm s SER 78 CO 0.56 -0.92 0.99 -0.76 0.41 0.00 0.00 173.24 173.52 2ksm s LEU 79 N 3.21 2.98 0.96 2.44 1.02 -1.26 -5.02 118.68 123.01 2ksm s LEU 79 Ca 0.27 -0.11 -0.15 0.00 0.02 0.00 0.00 54.13 54.16 2ksm s LEU 79 Cb -0.13 -2.36 0.17 0.00 0.02 0.00 0.00 46.19 43.89 2ksm s LEU 79 CO 0.20 -1.77 1.20 -0.94 0.02 0.00 0.00 176.35 175.07 2ksm s SER 80 N -4.66 3.13 0.29 2.29 1.04 -1.23 -4.35 113.70 110.21 2ksm s SER 80 Ca 0.64 0.65 0.10 0.00 0.48 0.00 0.00 55.95 57.82 2ksm s SER 80 Cb -0.07 -0.98 -0.05 0.00 0.10 0.00 0.00 66.02 65.03 2ksm s SER 80 CO 0.44 -2.76 -0.06 -1.48 0.98 0.00 0.00 173.24 170.36 2ksm s LEU 81 N -6.06 2.96 0.17 2.42 2.34 -1.26 -4.25 118.68 115.01 2ksm s LEU 81 Ca 0.68 -0.84 0.10 0.00 0.06 0.00 0.00 54.13 54.12 2ksm s LEU 81 Cb -0.10 -1.44 -0.04 0.00 -0.56 0.00 0.00 46.19 44.05 2ksm s LEU 81 CO 0.53 -0.05 -0.21 -0.22 -1.06 0.00 0.00 176.35 175.35 2ksm s LEU 82 N -3.64 2.42 -0.04 1.48 2.96 0.21 -4.61 118.68 117.47 2ksm s LEU 82 Ca 0.32 -0.84 -0.01 0.00 -0.22 0.00 0.00 54.13 53.37 2ksm s LEU 82 Cb -0.04 -0.96 0.03 0.00 0.50 0.00 0.00 46.19 45.71 2ksm s LEU 82 CO 0.18 0.03 0.03 -0.55 -1.32 0.00 0.00 176.35 174.73 2ksm s SER 83 N -2.58 0.92 -0.06 3.68 0.15 -1.13 -2.10 113.70 112.57 2ksm s SER 83 Ca 0.17 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.84 2ksm s SER 83 Cb -0.07 -0.21 0.02 0.00 -1.71 0.00 0.00 66.02 64.06 2ksm s SER 83 CO 0.08 -0.19 -0.04 -0.63 1.20 0.00 0.00 173.24 173.66 2ksm s ILE 84 N 1.73 0.58 -0.06 6.45 1.01 0.12 -2.27 121.20 128.77 2ksm s ILE 84 Ca -0.00 -0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.59 2ksm s ILE 84 Cb -0.13 -0.65 0.01 0.00 0.01 0.00 0.00 42.46 41.71 2ksm s ILE 84 CO -0.03 0.26 -0.13 -0.44 0.00 0.00 0.00 174.94 174.61 2ksm s SER 85 N 1.37 1.82 -0.16 3.58 0.01 0.15 -1.44 113.70 119.03 2ksm s SER 85 Ca -0.04 -0.31 -0.04 0.00 1.31 0.00 0.00 55.95 56.88 2ksm s SER 85 Cb -0.13 -0.81 0.06 0.00 0.21 0.00 0.00 66.02 65.34 2ksm s SER 85 CO -0.03 0.05 0.07 -0.13 0.41 0.00 0.00 173.24 173.61 2ksm s ARG 86 N 0.60 0.24 -0.24 12.44 0.52 -0.95 -1.09 118.95 130.46 2ksm s ARG 86 Ca -0.14 -0.12 -0.05 0.00 -0.52 0.00 0.00 55.73 54.91 2ksm s ARG 86 Cb -0.15 -1.73 -0.13 0.00 0.52 0.00 0.00 34.95 33.46 2ksm s ARG 86 CO 0.04 -0.61 -0.26 0.43 0.02 0.00 0.00 175.30 174.92 2ksm n SER 87 N 5.21 2.00 0.00 0.23 7.64 -0.60 -1.92 113.62 126.18 2ksm n SER 87 Ca -0.07 0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2ksm n SER 87 Cb 0.49 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 2ksm n SER 87 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ksm n GLY 88 N 1.97 3.93 4.11 0.23 0.00 -1.07 -3.91 105.19 110.45 2ksm n GLY 88 Ca -0.44 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.16 2ksm n GLY 88 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ksm n ASN 89 N 0.00 0.00 -4.21 1.61 2.85 -1.26 -4.87 115.26 109.38 2ksm n ASN 89 Ca 0.00 0.00 -0.27 0.00 -0.11 0.00 0.00 54.58 54.20 2ksm n ASN 89 Cb 0.00 0.00 -0.15 0.00 1.24 0.00 0.00 39.78 40.87 2ksm n ASN 89 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 2ksm s THR 90 N 0.00 1.59 -0.03 -0.44 -4.23 -1.25 0.94 115.64 112.22 2ksm s THR 90 Ca 0.00 -0.89 0.03 0.00 -1.18 0.00 0.00 61.69 59.65 2ksm s THR 90 Cb 0.00 -1.33 0.00 0.00 1.34 0.00 0.00 72.50 72.51 2ksm s THR 90 CO 0.00 0.42 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.69 2ksm s VAL 91 N -0.51 1.03 -0.19 2.29 1.01 -1.08 -3.70 120.40 119.25 2ksm s VAL 91 Ca 0.08 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.58 2ksm s VAL 91 Cb -0.08 -0.90 0.03 0.00 0.00 0.00 0.00 36.38 35.43 2ksm s VAL 91 CO -0.00 0.31 -0.18 -0.89 0.00 0.00 0.00 175.10 174.33 2ksm s THR 92 N 0.16 2.05 -0.07 3.92 2.01 -0.25 -0.40 115.64 123.06 2ksm s THR 92 Ca -0.04 -1.02 -0.01 0.00 0.31 0.00 0.00 61.69 60.93 2ksm s THR 92 Cb -0.10 -1.90 0.03 0.00 0.01 0.00 0.00 72.50 70.54 2ksm s THR 92 CO 0.01 0.45 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.17 2ksm s LEU 93 N 1.27 0.65 0.12 4.42 2.96 -0.74 -0.68 118.68 126.69 2ksm s LEU 93 Ca 0.03 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 53.89 2ksm s LEU 93 Cb -0.14 -0.45 -0.04 0.00 0.50 0.00 0.00 46.19 46.06 2ksm s LEU 93 CO -0.12 -0.18 -0.10 0.27 -1.32 0.00 0.00 176.35 174.90 2ksm s ILE 94 N 1.89 1.06 -5.00 6.68 -4.36 -0.96 -1.29 121.20 119.22 2ksm s ILE 94 Ca 0.04 -1.87 0.00 0.00 -0.26 0.00 0.00 60.65 58.56 2ksm s ILE 94 Cb -0.12 -1.63 0.00 0.00 1.25 0.00 0.00 42.46 41.96 2ksm s ILE 94 CO -0.05 -0.66 0.00 0.61 0.24 0.00 0.00 174.94 175.08 2ksm n GLY 95 N 0.15 0.42 2.93 6.27 0.00 -1.25 -2.86 105.19 110.86 2ksm n GLY 95 Ca -0.13 -1.43 -0.17 0.00 0.00 0.00 0.00 46.02 44.29 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 0.70 0.21 1.61 1.11 -1.26 -3.01 116.67 112.03 2ksm s ASP 96 Ca 0.00 -0.10 0.08 0.00 0.18 0.00 0.00 52.55 52.71 2ksm s ASP 96 Cb 0.00 -0.19 -0.04 0.00 1.07 0.00 0.00 42.92 43.76 2ksm s ASP 96 CO 0.00 0.02 0.02 -0.36 1.18 0.00 0.00 175.17 176.03 2ksm s PHE 97 N 0.28 2.84 0.01 4.23 0.40 0.28 -4.63 117.98 121.40 2ksm s PHE 97 Ca -0.03 -0.16 -0.18 0.00 -0.60 0.00 0.00 56.93 55.96 2ksm s PHE 97 Cb -0.07 -1.33 -0.28 0.00 0.51 0.00 0.00 43.02 41.85 2ksm s PHE 97 CO -0.00 0.55 1.04 -1.00 0.70 0.00 0.00 175.22 176.50 2ksm h PRO 98 N 2.30 0.47 -5.01 0.24 0.13 -1.82 -1.00 132.00 127.32 2ksm h PRO 98 Ca -0.46 -0.64 -0.56 0.00 -0.87 0.00 0.00 66.00 63.47 2ksm h PRO 98 Cb 1.22 0.21 -0.13 0.00 0.13 0.00 0.00 31.00 32.43 2ksm h PRO 98 CO 0.59 1.27 -0.50 0.34 -0.23 0.00 0.00 178.00 179.47 2ksm s ASP 99 N -7.11 2.69 -0.17 1.44 -1.08 -1.26 -3.69 116.67 107.49 2ksm s ASP 99 Ca -0.12 -1.72 0.04 0.00 -0.52 0.00 0.00 52.55 50.24 2ksm s ASP 99 Cb 0.04 0.57 -0.22 0.00 -1.46 0.00 0.00 42.92 41.84 2ksm s ASP 99 CO 0.87 -0.98 0.16 -1.84 0.52 0.00 0.00 175.17 173.91 2ksm n GLU 100 N -0.89 0.69 0.26 4.34 0.28 -1.26 -4.18 120.64 119.88 2ksm n GLU 100 Ca -0.04 0.18 0.09 0.00 -0.16 0.00 0.00 57.16 57.23 2ksm n GLU 100 Cb 0.64 -1.62 0.67 0.00 1.43 0.00 0.00 31.44 32.56 2ksm n GLU 100 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2ksm h ALA 101 N 0.39 1.81 -0.76 -1.84 0.00 -2.03 -1.62 119.26 115.21 2ksm h ALA 101 Ca -0.48 -0.04 0.22 0.00 0.00 0.00 0.00 54.91 54.61 2ksm h ALA 101 Cb 2.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 2ksm h ALA 101 CO 0.02 0.06 0.64 0.00 0.00 0.00 0.00 179.25 179.96 2ksm h ALA 102 N 1.96 2.62 -0.42 0.00 0.00 -2.00 0.46 119.26 121.86 2ksm h ALA 102 Ca -0.00 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2ksm h ALA 102 Cb 0.09 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2ksm h ALA 102 CO 0.01 -1.03 -0.13 1.57 0.00 0.00 0.00 179.25 179.67 2ksm h LYS 103 N 0.00 0.77 -0.70 0.00 2.10 -1.54 -3.05 116.57 114.15 2ksm h LYS 103 Ca 0.36 -0.27 0.07 0.00 -2.00 0.00 0.00 60.65 58.81 2ksm h LYS 103 Cb 1.63 -0.06 -0.06 0.00 -0.90 0.00 0.00 32.23 32.84 2ksm h LYS 103 CO -0.00 0.87 0.39 0.00 -2.00 0.00 0.00 179.45 178.70 2ksm h ALA 104 N 1.16 0.95 -0.50 0.07 0.00 -0.24 0.80 119.26 121.49 2ksm h ALA 104 Ca 0.11 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2ksm h ALA 104 Cb 0.61 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2ksm h ALA 104 CO 0.04 0.05 0.13 0.00 0.00 0.00 0.00 179.25 179.47 2ksm h ALA 105 N 1.38 1.29 0.06 0.00 0.00 -1.57 -0.80 119.26 119.61 2ksm h ALA 105 Ca 0.32 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2ksm h ALA 105 Cb 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2ksm h ALA 105 CO -0.20 0.50 -0.03 1.25 0.00 0.00 0.00 179.25 180.77 2ksm h LEU 106 N 0.73 -0.07 -0.69 0.00 6.46 -1.25 -3.32 115.31 117.17 2ksm h LEU 106 Ca 0.17 -0.55 0.15 0.00 -0.12 0.00 0.00 57.88 57.53 2ksm h LEU 106 Cb 0.26 0.02 -0.12 0.00 -0.73 0.00 0.00 40.66 40.08 2ksm h LEU 106 CO -0.00 0.64 -0.02 0.24 -0.62 0.00 0.00 178.44 178.67 2ksm h MET 107 N -0.90 0.09 -0.10 1.25 2.86 0.65 1.17 114.93 119.95 2ksm h MET 107 Ca -0.01 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.66 2ksm h MET 107 Cb 0.61 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.25 2ksm h MET 107 CO 0.01 0.06 0.52 1.15 1.06 0.00 0.00 176.91 179.71 2ksm h THR 108 N 0.09 0.05 0.24 2.22 2.02 -1.24 0.72 112.91 117.01 2ksm h THR 108 Ca 0.37 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 67.21 2ksm h THR 108 Cb 0.62 0.51 0.03 0.00 -1.74 0.00 0.00 68.15 67.57 2ksm h THR 108 CO -0.62 0.00 -1.51 0.00 0.37 0.00 0.00 175.52 173.76 2ksm h ALA 109 N 1.07 -0.10 -0.46 6.16 0.00 0.13 -3.27 119.26 122.79 2ksm h ALA 109 Ca 0.05 -0.91 0.07 0.00 0.00 0.00 0.00 54.91 54.12 2ksm h ALA 109 Cb 1.08 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2ksm h ALA 109 CO -0.00 0.77 0.31 -0.07 0.00 0.00 0.00 179.25 180.26 2ksm h LEU 110 N 0.14 0.28 -0.89 0.00 3.38 0.66 -1.64 115.31 117.24 2ksm h LEU 110 Ca -0.26 0.00 0.18 0.00 0.09 0.00 0.00 57.88 57.89 2ksm h LEU 110 Cb 2.15 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 42.82 2ksm h LEU 110 CO 0.26 0.18 1.04 0.78 0.09 0.00 0.00 178.44 180.79 2ksm h ASN 111 N 0.32 0.00 0.54 -0.43 2.35 -1.55 2.39 115.58 119.20 2ksm h ASN 111 Ca 0.21 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.67 2ksm h ASN 111 Cb 0.41 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 2ksm h ASN 111 CO -0.05 0.00 -1.49 1.23 -1.65 0.00 0.00 177.43 175.48 2ksm h GLY 112 N 0.00 0.18 0.91 2.83 0.00 -1.53 -3.33 103.07 102.13 2ksm h GLY 112 Ca 0.30 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2ksm h GLY 112 CO -0.00 0.41 -1.00 1.04 0.00 0.00 0.00 176.54 176.99 2ksm n LEU 113 N -3.36 0.73 -4.45 3.11 4.77 0.72 -4.88 117.00 113.65 2ksm n LEU 113 Ca -0.14 0.24 -0.47 0.00 -0.03 0.00 0.00 56.01 55.60 2ksm n LEU 113 Cb 1.03 -0.08 -0.08 0.00 -2.33 0.00 0.00 43.42 41.95 2ksm n LEU 113 CO 0.49 -0.12 1.91 -0.11 -1.33 0.00 0.00 177.39 178.23 2ksm n LEU 114 N -2.44 1.67 -4.61 2.23 7.94 0.32 -4.91 117.00 117.19 2ksm n LEU 114 Ca 0.01 0.24 -0.24 0.00 -1.11 0.00 0.00 56.01 54.90 2ksm n LEU 114 Cb 0.51 -1.21 -0.09 0.00 0.53 0.00 0.00 43.42 43.16 2ksm n LEU 114 CO 0.40 -0.88 -0.33 0.00 -1.11 0.00 0.00 177.39 175.47 2ksm s ALA 115 N 8.34 3.13 -0.07 1.96 0.00 -1.26 -5.00 121.76 128.85 2ksm s ALA 115 Ca 1.14 -1.89 -0.30 0.00 0.00 0.00 0.00 51.96 50.91 2ksm s ALA 115 Cb -0.89 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 2ksm s ALA 115 CO 0.47 0.14 1.45 -1.25 0.00 0.00 0.00 175.76 176.56 2ksm s PRO 116 N -3.68 4.23 0.00 0.00 0.04 -1.26 -2.42 135.00 131.91 2ksm s PRO 116 Ca 0.33 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.32 2ksm s PRO 116 Cb -0.02 -3.78 0.00 0.00 0.04 0.00 0.00 34.50 30.74 2ksm s PRO 116 CO 0.19 -0.71 0.00 0.41 0.04 0.00 0.00 177.00 176.93 2ksm n GLY 117 N 3.80 0.76 3.72 0.56 0.00 -1.26 -5.02 105.19 107.75 2ksm n GLY 117 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.78 4.21 -0.10 1.61 0.11 -1.02 -5.00 120.40 117.44 2ksm s VAL 118 Ca 0.00 1.67 -0.04 0.00 -2.93 0.00 0.00 61.98 60.67 2ksm s VAL 118 Cb 0.00 -4.07 -0.04 0.00 -1.53 0.00 0.00 36.38 30.75 2ksm s VAL 118 CO 0.00 0.17 0.07 0.20 -3.33 0.00 0.00 175.10 172.21 2ksm s ASN 119 N 0.71 5.79 -0.05 3.54 -0.87 0.27 -4.92 114.94 119.40 2ksm s ASN 119 Ca 0.54 0.30 0.05 0.00 -1.57 0.00 0.00 52.86 52.18 2ksm s ASN 119 Cb -0.27 -1.76 -0.02 0.00 -0.02 0.00 0.00 41.25 39.18 2ksm s ASN 119 CO 0.30 0.39 -0.20 -0.69 -2.57 0.00 0.00 177.10 174.33 2ksm s VAL 120 N -0.96 2.49 -0.51 1.60 1.01 -1.26 -2.64 120.40 120.13 2ksm s VAL 120 Ca 0.14 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.25 2ksm s VAL 120 Cb -0.12 -1.94 0.18 0.00 0.00 0.00 0.00 36.38 34.51 2ksm s VAL 120 CO 0.03 0.57 0.43 -0.38 0.00 0.00 0.00 175.10 175.76 2ksm n ILE 121 N 2.68 -0.10 -4.09 2.22 -0.00 0.47 -4.92 119.36 115.62 2ksm n ILE 121 Ca -0.17 -4.03 -0.33 0.00 -0.00 0.00 0.00 62.75 58.23 2ksm n ILE 121 Cb 0.52 -1.87 -0.15 0.00 -0.00 0.00 0.00 39.64 38.13 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 -0.69 3.86 -0.29 4.38 -4.77 -1.26 -1.79 116.67 116.11 2ksm s ASP 122 Ca 0.31 -1.05 0.03 0.00 -3.30 0.00 0.00 52.55 48.55 2ksm s ASP 122 Cb 0.04 -1.53 0.08 0.00 -1.09 0.00 0.00 42.92 40.42 2ksm s ASP 122 CO -0.17 -0.10 -0.03 -1.10 0.70 0.00 0.00 175.17 174.47 2ksm s GLN 123 N 1.19 1.83 -0.04 2.11 -1.52 -0.41 -4.97 119.66 117.85 2ksm s GLN 123 Ca -0.02 -1.55 0.03 0.00 -1.95 0.00 0.00 55.36 51.87 2ksm s GLN 123 Cb -0.17 -2.98 -0.03 0.00 -0.22 0.00 0.00 33.01 29.61 2ksm s GLN 123 CO -0.08 -0.74 -0.10 0.96 -0.25 0.00 0.00 175.29 175.07 2ksm s ILE 124 N 1.05 3.41 0.07 1.08 -0.00 -1.26 -3.79 121.20 121.76 2ksm s ILE 124 Ca 0.00 -0.69 0.03 0.00 -0.00 0.00 0.00 60.65 60.00 2ksm s ILE 124 Cb -0.19 -2.40 -0.04 0.00 -0.00 0.00 0.00 42.46 39.83 2ksm s ILE 124 CO -0.07 0.53 0.07 -1.00 -0.00 0.00 0.00 174.94 174.46 2ksm s HIS 125 N -0.84 3.17 0.13 1.37 3.76 -1.16 -4.86 115.29 116.87 2ksm s HIS 125 Ca 0.13 0.08 -0.16 0.00 -0.15 0.00 0.00 55.06 54.96 2ksm s HIS 125 Cb -0.11 -1.62 -0.07 0.00 1.11 0.00 0.00 32.58 31.89 2ksm s HIS 125 CO 0.03 0.52 0.57 0.08 -0.85 0.00 0.00 174.74 175.09 2ksm s VAL 126 N -1.35 4.79 -0.51 -0.90 1.01 -1.26 0.10 120.40 122.28 2ksm s VAL 126 Ca 0.28 0.99 0.06 0.00 0.00 0.00 0.00 61.98 63.32 2ksm s VAL 126 Cb -0.12 -3.79 0.20 0.00 0.00 0.00 0.00 36.38 32.66 2ksm s VAL 126 CO 0.21 0.33 0.77 0.47 0.00 0.00 0.00 175.10 176.88 2ksm n ASP 127 N 1.07 -3.31 0.00 3.32 8.00 -0.38 -4.90 116.55 120.35 2ksm n ASP 127 Ca -0.06 -2.93 0.00 0.00 0.71 0.00 0.00 54.79 52.51 2ksm n ASP 127 Cb 0.51 1.74 0.00 0.00 -0.02 0.00 0.00 41.12 43.36 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 2.70 0.00 -0.09 -0.24 -0.02 -1.24 -1.48 135.00 134.63 2ksm n PRO 128 Ca 0.16 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.47 2ksm n PRO 128 Cb 0.58 -1.37 -0.07 0.00 -0.02 0.00 0.00 33.50 32.62 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 -0.64 0.99 -0.35 -1.45 0.31 -1.26 -5.02 118.33 110.91 2ksm n VAL 129 Ca 0.00 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2ksm n VAL 129 Cb 0.00 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.37 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 -3.58 0.00 -3.88 2.52 0.24 -0.55 -5.08 118.33 108.00 2ksm n VAL 130 Ca -0.34 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 61.85 2ksm n VAL 130 Cb 0.77 -0.75 -0.10 0.00 -1.47 0.00 0.00 33.84 32.29 2ksm n VAL 130 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2ksm s ARG 131 N -2.79 0.53 0.23 7.34 0.52 -1.26 -4.88 118.95 118.64 2ksm s ARG 131 Ca 0.00 -0.52 0.00 0.00 -0.52 0.00 0.00 55.73 54.69 2ksm s ARG 131 Cb 0.00 0.22 -0.04 0.00 0.52 0.00 0.00 34.95 35.64 2ksm s ARG 131 CO 0.00 -0.13 0.12 0.45 0.02 0.00 0.00 175.30 175.75 2ksm s SER 132 N -1.66 0.62 0.30 0.23 0.15 -1.26 -3.54 113.70 108.53 2ksm s SER 132 Ca -0.11 -1.39 -0.30 0.00 0.70 0.00 0.00 55.95 54.85 2ksm s SER 132 Cb -0.05 0.28 -0.12 0.00 -1.71 0.00 0.00 66.02 64.42 2ksm s SER 132 CO -0.01 -0.79 1.43 -0.11 1.20 0.00 0.00 173.24 174.96 2ksm n LEU 133 N -0.36 3.74 -4.54 3.45 7.94 -1.26 -4.89 117.00 121.07 2ksm n LEU 133 Ca 0.01 1.17 -0.41 0.00 -1.11 0.00 0.00 56.01 55.67 2ksm n LEU 133 Cb 0.66 -1.51 -0.03 0.00 0.53 0.00 0.00 43.42 43.07 2ksm n LEU 133 CO 0.35 -0.25 1.18 1.51 -1.11 0.00 0.00 177.39 179.07 2ksm s ASP 134 N 0.14 6.23 0.00 1.96 1.47 -1.26 -4.83 116.67 120.38 2ksm s ASP 134 Ca 0.62 -0.72 0.26 0.00 1.18 0.00 0.00 52.55 53.89 2ksm s ASP 134 Cb -0.57 -2.55 1.04 0.00 -0.34 0.00 0.00 42.92 40.51 2ksm s ASP 134 CO 0.54 -1.73 1.73 0.49 0.68 0.00 0.00 175.17 176.88 2ksm n PHE 135 N 9.08 0.06 -0.50 2.11 3.01 -1.26 -4.26 117.46 125.70 2ksm n PHE 135 Ca 0.08 -0.03 0.41 0.00 1.01 0.00 0.00 57.45 58.92 2ksm n PHE 135 Cb 0.49 0.00 0.69 0.00 -0.01 0.00 0.00 39.48 40.65 2ksm n PHE 135 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2ksm h SER 136 N 2.02 0.18 -0.58 4.37 0.02 -1.93 2.08 113.55 119.71 2ksm h SER 136 Ca 0.00 0.12 -0.39 0.00 -0.84 0.00 0.00 61.79 60.68 2ksm h SER 136 Cb 0.43 0.11 -0.25 0.00 0.14 0.00 0.00 62.40 62.83 2ksm h SER 136 CO 0.00 -0.17 -0.24 -1.20 -1.14 0.00 0.00 176.83 174.08 2ksm n SER 137 N -4.56 4.18 0.12 3.07 7.64 -1.26 -4.63 113.62 118.19 2ksm n SER 137 Ca 0.39 -3.79 0.12 0.00 1.01 0.00 0.00 58.87 56.60 2ksm n SER 137 Cb 1.57 -0.57 0.06 0.00 -1.01 0.00 0.00 64.21 64.26 2ksm n SER 137 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ksm h ALA 138 N 1.61 0.62 -0.15 -0.43 0.00 0.31 -3.31 119.26 117.91 2ksm h ALA 138 Ca 0.33 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.27 2ksm h ALA 138 Cb 1.43 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 2ksm h ALA 138 CO 0.70 0.00 -0.04 0.93 0.00 0.00 0.00 179.25 180.84 2ksm h GLU 139 N 0.00 -0.01 -0.56 0.00 5.08 -1.81 1.64 114.58 118.92 2ksm h GLU 139 Ca 0.00 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2ksm h GLU 139 Cb 0.96 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.17 2ksm h GLU 139 CO 0.00 -0.00 0.31 -1.35 -1.00 0.00 0.00 179.01 176.96 2ksm h PRO 140 N -0.01 0.58 0.00 2.33 0.11 -1.95 1.09 132.00 134.15 2ksm h PRO 140 Ca 0.07 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.94 2ksm h PRO 140 Cb 0.12 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.09 2ksm h PRO 140 CO -0.16 0.38 -0.91 -0.39 -0.21 0.00 0.00 178.00 176.71 2ksm h VAL 141 N 0.59 1.45 0.06 3.15 -1.51 -1.47 -2.33 116.25 116.20 2ksm h VAL 141 Ca 0.24 -2.54 -0.27 0.00 -1.23 0.00 0.00 66.70 62.90 2ksm h VAL 141 Cb 0.11 2.45 0.02 0.00 -2.13 0.00 0.00 31.29 31.74 2ksm h VAL 141 CO -0.15 0.75 -1.09 0.15 -1.23 0.00 0.00 177.57 176.00 2ksm h PHE 142 N 0.16 0.98 0.00 5.19 3.57 0.26 -2.98 116.94 124.13 2ksm h PHE 142 Ca -0.06 -0.58 0.00 0.00 3.53 0.00 0.00 57.97 60.86 2ksm h PHE 142 Cb 1.54 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 40.19 2ksm h PHE 142 CO 0.04 1.42 0.00 1.79 -2.23 0.00 0.00 178.31 179.33 2ksm h THR 143 N 0.26 0.00 -0.09 4.41 1.35 0.12 -0.23 112.91 118.73 2ksm h THR 143 Ca -0.16 -0.33 -0.21 0.00 -0.55 0.00 0.00 66.41 65.17 2ksm h THR 143 Cb 1.77 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 2ksm h THR 143 CO 0.21 0.00 -0.81 0.00 -0.25 0.00 0.00 175.52 174.68 2ksm h ALA 144 N 2.03 0.41 -0.73 6.62 0.00 -1.27 -3.13 119.26 123.20 2ksm h ALA 144 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2ksm h ALA 144 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2ksm h ALA 144 CO 0.00 0.73 0.00 -1.13 0.00 0.00 0.00 179.25 178.85 2ksm n SER 145 N -3.86 3.91 -0.25 0.00 3.41 -0.74 -4.48 113.62 111.61 2ksm n SER 145 Ca -0.06 -2.01 -0.07 0.00 -0.26 0.00 0.00 58.87 56.47 2ksm n SER 145 Cb 0.76 -0.49 0.05 0.00 -0.26 0.00 0.00 64.21 64.26 2ksm n SER 145 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2ksm h VAL 146 N 4.26 1.24 0.00 -3.33 2.07 -1.01 -2.60 116.25 116.88 2ksm h VAL 146 Ca 0.00 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2ksm h VAL 146 Cb 0.98 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2ksm h VAL 146 CO 0.00 0.30 0.00 -0.81 0.02 0.00 0.00 177.57 177.08 2ksm n PRO 147 N -4.40 0.46 -3.47 1.57 -0.05 -1.26 -4.15 135.00 123.71 2ksm n PRO 147 Ca 0.05 0.00 -0.27 0.00 -0.05 0.00 0.00 63.50 63.23 2ksm n PRO 147 Cb 0.17 -1.21 -0.12 0.00 -0.05 0.00 0.00 33.50 32.29 2ksm n PRO 147 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 2ksm s ILE 148 N -1.09 0.02 -1.91 0.52 1.01 -0.98 -4.98 121.20 113.78 2ksm s ILE 148 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 60.65 59.28 2ksm s ILE 148 Cb 0.00 -1.03 0.00 0.00 0.01 0.00 0.00 42.46 41.44 2ksm s ILE 148 CO 0.00 -0.87 0.92 -0.81 0.00 0.00 0.00 174.94 174.18 2ksm n PRO 149 N 4.39 0.96 -0.85 2.79 -0.04 -1.26 -3.08 135.00 137.90 2ksm n PRO 149 Ca 0.07 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.52 2ksm n PRO 149 Cb 0.39 -1.04 0.18 0.00 -0.04 0.00 0.00 33.50 32.99 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 -0.46 2.38 -4.79 3.54 8.00 -1.10 -1.55 116.55 122.57 2ksm n ASP 150 Ca 0.00 -3.86 -0.25 0.00 0.71 0.00 0.00 54.79 51.39 2ksm n ASP 150 Cb 0.02 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 40.54 2ksm n ASP 150 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ksm s PHE 151 N -3.30 3.10 0.01 1.24 0.40 -0.81 -3.14 117.98 115.48 2ksm s PHE 151 Ca 0.42 -0.07 0.05 0.00 -0.60 0.00 0.00 56.93 56.73 2ksm s PHE 151 Cb 0.39 -1.45 -0.02 0.00 0.51 0.00 0.00 43.02 42.45 2ksm s PHE 151 CO -0.04 0.52 -0.16 0.20 0.70 0.00 0.00 175.22 176.45 2ksm s GLY 152 N -3.38 0.82 -0.10 4.36 0.00 0.01 -2.25 107.32 106.79 2ksm s GLY 152 Ca 0.31 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 44.27 2ksm s GLY 152 CO 0.23 -0.70 -0.12 -2.27 0.00 0.00 0.00 173.10 170.24 2ksm s LEU 153 N -0.76 1.56 -0.04 0.66 1.98 -0.52 -3.02 118.68 118.54 2ksm s LEU 153 Ca 0.05 -0.36 0.00 0.00 -2.89 0.00 0.00 54.13 50.93 2ksm s LEU 153 Cb -0.07 -0.95 0.02 0.00 0.66 0.00 0.00 46.19 45.85 2ksm s LEU 153 CO 0.00 -0.02 -0.02 -0.75 -1.89 0.00 0.00 176.35 173.67 2ksm s LYS 154 N 1.12 0.62 -0.08 1.98 2.20 -0.92 -0.70 119.74 123.96 2ksm s LYS 154 Ca -0.05 -0.01 0.03 0.00 -0.36 0.00 0.00 55.97 55.59 2ksm s LYS 154 Cb -0.14 -0.75 -0.02 0.00 -1.51 0.00 0.00 37.83 35.41 2ksm s LYS 154 CO -0.03 -0.14 -0.17 0.08 -0.36 0.00 0.00 175.35 174.74 2ksm s VAL 155 N 1.15 2.79 0.00 4.02 1.01 -0.89 -0.32 120.40 128.16 2ksm s VAL 155 Ca -0.08 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.11 2ksm s VAL 155 Cb -0.14 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.14 2ksm s VAL 155 CO -0.01 0.57 0.00 -0.62 0.00 0.00 0.00 175.10 175.03 2ksm n GLU 156 N 2.84 3.83 0.03 2.72 1.02 0.13 -0.62 120.64 130.59 2ksm n GLU 156 Ca -0.17 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 56.95 2ksm n GLU 156 Cb 0.52 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.94 2ksm n GLU 156 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ksm h ARG 157 N 0.00 -0.08 -0.07 3.49 3.08 -1.76 -3.36 114.38 115.68 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 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2ksm h ARG 157 CO 0.00 -0.06 0.00 -0.40 -1.07 0.00 0.00 179.97 178.44 2ksm n ASP 158 N -2.61 2.09 -4.39 7.04 5.75 -1.26 -4.08 116.55 119.09 2ksm n ASP 158 Ca -0.01 -1.90 -0.20 0.00 -0.01 0.00 0.00 54.79 52.67 2ksm n ASP 158 Cb 0.03 -0.05 -0.10 0.00 -1.03 0.00 0.00 41.12 39.98 2ksm n ASP 158 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2ksm s THR 159 N -0.91 1.66 -0.03 2.12 2.01 -1.26 -4.05 115.64 115.17 2ksm s THR 159 Ca 0.05 -2.16 0.01 0.00 0.31 0.00 0.00 61.69 59.90 2ksm s THR 159 Cb 0.03 -2.29 0.02 0.00 0.01 0.00 0.00 72.50 70.26 2ksm s THR 159 CO 0.03 -0.41 -0.02 -0.69 -0.69 0.00 0.00 174.62 172.84 2ksm s VAL 160 N -3.01 0.31 0.05 3.82 1.01 0.17 0.20 120.40 122.95 2ksm s VAL 160 Ca 0.27 -0.03 0.08 0.00 0.00 0.00 0.00 61.98 62.30 2ksm s VAL 160 Cb 0.02 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 2ksm s VAL 160 CO 0.10 0.16 -0.22 -0.89 0.00 0.00 0.00 175.10 174.25 2ksm s THR 161 N 0.74 2.53 -0.10 3.92 2.01 0.56 -0.94 115.64 124.36 2ksm s THR 161 Ca -0.08 -1.30 0.01 0.00 0.31 0.00 0.00 61.69 60.63 2ksm s THR 161 Cb -0.11 -2.05 0.02 0.00 0.01 0.00 0.00 72.50 70.37 2ksm s THR 161 CO -0.01 0.33 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.92 2ksm s LEU 162 N -1.43 1.48 -0.04 4.42 0.20 0.23 -2.17 118.68 121.38 2ksm s LEU 162 Ca 0.14 -0.33 -0.01 0.00 0.69 0.00 0.00 54.13 54.61 2ksm s LEU 162 Cb -0.10 -0.90 0.03 0.00 -0.43 0.00 0.00 46.19 44.79 2ksm s LEU 162 CO 0.04 -0.04 0.07 0.42 -0.29 0.00 0.00 176.35 176.56 2ksm s THR 163 N 1.19 -0.07 -0.24 3.68 -4.23 -1.17 -2.34 115.64 112.46 2ksm s THR 163 Ca -0.04 0.24 -0.21 0.00 -1.18 0.00 0.00 61.69 60.50 2ksm s THR 163 Cb -0.14 -0.14 0.06 0.00 1.34 0.00 0.00 72.50 73.62 2ksm s THR 163 CO -0.03 0.10 0.63 -0.83 -0.54 0.00 0.00 174.62 173.95 2ksm s GLY 164 N 1.28 -0.49 -0.21 3.99 0.00 -1.26 -0.81 107.32 109.83 2ksm s GLY 164 Ca -0.07 1.84 -0.29 0.00 0.00 0.00 0.00 44.72 46.20 2ksm s GLY 164 CO -0.04 1.64 1.51 -0.51 0.00 0.00 0.00 173.10 175.70 2ksm s THR 165 N 0.52 3.85 -0.50 0.90 -4.23 -1.19 -4.41 115.64 110.58 2ksm s THR 165 Ca -0.01 0.98 0.03 0.00 -1.18 0.00 0.00 61.69 61.51 2ksm s THR 165 Cb -0.05 -3.81 0.16 0.00 1.34 0.00 0.00 72.50 70.14 2ksm s THR 165 CO -0.02 -0.28 0.35 0.00 -0.54 0.00 0.00 174.62 174.13 2ksm s ALA 166 N 4.66 2.26 -1.18 3.99 0.00 -1.26 -4.85 121.76 125.38 2ksm s ALA 166 Ca 0.66 -2.84 0.00 0.00 0.00 0.00 0.00 51.96 49.78 2ksm s ALA 166 Cb -0.24 -1.84 0.00 0.00 0.00 0.00 0.00 23.12 21.04 2ksm s ALA 166 CO 0.26 -2.04 0.40 -2.30 0.00 0.00 0.00 175.76 172.08 2ksm n PRO 167 N 2.88 0.00 0.00 0.00 -0.02 -1.26 -4.41 135.00 132.19 2ksm n PRO 167 Ca 0.20 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2ksm n PRO 167 Cb 0.40 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 2ksm n PRO 167 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2ksm n SER 168 N -0.90 0.00 0.00 2.55 2.88 -1.26 -4.99 113.62 111.90 2ksm n SER 168 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2ksm n SER 168 Cb 0.03 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2ksm n SER 168 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ksm n SER 169 N 0.00 0.00 0.22 -3.46 2.88 -1.26 -4.91 113.62 107.10 2ksm n SER 169 Ca 0.00 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 2ksm n SER 169 Cb 0.00 0.00 0.60 0.00 -0.75 0.00 0.00 64.21 64.06 2ksm n SER 169 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2ksm h GLU 170 N 0.00 0.00 -0.02 -1.46 4.81 -2.01 0.63 114.58 116.53 2ksm h GLU 170 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2ksm h GLU 170 Cb 0.00 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 2ksm h GLU 170 CO 0.00 0.00 0.05 0.45 -0.73 0.00 0.00 179.01 178.78 2ksm h HIS 171 N 0.00 0.00 0.00 0.92 3.86 -1.98 0.14 115.15 118.09 2ksm h HIS 171 Ca 0.09 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.21 2ksm h HIS 171 Cb 1.25 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.70 2ksm h HIS 171 CO 0.00 0.00 -0.55 1.57 0.86 0.00 0.00 177.93 179.81 2ksm h LYS 172 N 0.00 0.00 -0.28 2.45 2.10 -0.09 -3.30 116.57 117.45 2ksm h LYS 172 Ca 0.01 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.53 2ksm h LYS 172 Cb 0.11 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.42 2ksm h LYS 172 CO -0.00 0.42 -0.35 0.22 -2.00 0.00 0.00 179.45 177.74 2ksm h ASP 173 N 0.00 0.66 -0.82 7.07 1.82 -0.83 -2.97 116.42 121.34 2ksm h ASP 173 Ca -0.02 -0.28 0.22 0.00 -0.39 0.00 0.00 57.03 56.56 2ksm h ASP 173 Cb 1.36 -0.18 -0.04 0.00 0.68 0.00 0.00 39.33 41.14 2ksm h ASP 173 CO 0.06 0.95 0.57 0.00 -1.61 0.00 0.00 179.24 179.21 2ksm h ALA 174 N 1.08 2.54 -0.37 -0.78 0.00 -1.62 0.19 119.26 120.30 2ksm h ALA 174 Ca 0.05 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2ksm h ALA 174 Cb 0.85 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2ksm h ALA 174 CO 0.07 -0.78 -0.28 0.28 0.00 0.00 0.00 179.25 178.54 2ksm h VAL 175 N 0.15 1.28 -0.25 0.00 2.07 -1.72 -2.50 116.25 115.29 2ksm h VAL 175 Ca 0.41 -1.42 -0.07 0.00 0.82 0.00 0.00 66.70 66.43 2ksm h VAL 175 Cb 1.37 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 2ksm h VAL 175 CO -0.07 0.47 -0.13 0.50 0.02 0.00 0.00 177.57 178.37 2ksm h LYS 176 N 0.67 0.53 -0.83 1.57 3.64 -0.76 -2.96 116.57 118.43 2ksm h LYS 176 Ca 0.08 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2ksm h LYS 176 Cb 0.81 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.58 2ksm h LYS 176 CO 0.07 0.79 0.53 0.00 -2.27 0.00 0.00 179.45 178.57 2ksm h ARG 177 N 0.25 1.10 -0.95 1.90 2.47 -1.34 -1.08 114.38 116.71 2ksm h ARG 177 Ca 0.05 -0.08 0.02 0.00 -1.26 0.00 0.00 59.98 58.72 2ksm h ARG 177 Cb 0.64 -0.24 -0.05 0.00 -1.65 0.00 0.00 29.97 28.66 2ksm h ARG 177 CO 0.04 0.74 0.63 0.00 0.56 0.00 0.00 179.97 181.94 2ksm h ALA 178 N 1.29 1.35 -0.07 0.04 0.00 -1.41 -2.82 119.26 117.65 2ksm h ALA 178 Ca 0.30 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 2ksm h ALA 178 Cb -0.11 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.33 2ksm h ALA 178 CO -0.06 0.57 -0.30 0.00 0.00 0.00 0.00 179.25 179.46 2ksm h ALA 179 N 1.43 0.13 -0.73 0.00 0.00 -1.27 -3.12 119.26 115.71 2ksm h ALA 179 Ca 0.37 -0.43 0.15 0.00 0.00 0.00 0.00 54.91 55.00 2ksm h ALA 179 Cb -0.07 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 17.58 2ksm h ALA 179 CO -0.10 0.17 -0.11 1.79 0.00 0.00 0.00 179.25 181.00 2ksm h THR 180 N -0.16 0.31 -0.05 0.00 1.35 -0.99 0.84 112.91 114.20 2ksm h THR 180 Ca -0.02 -0.01 -0.04 0.00 -0.55 0.00 0.00 66.41 65.79 2ksm h THR 180 Cb 0.94 0.27 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 2ksm h THR 180 CO 0.06 0.01 -0.16 0.77 -0.25 0.00 0.00 175.52 175.95 2ksm h SER 181 N 0.04 0.08 0.57 5.36 4.64 -1.56 -0.35 113.55 122.33 2ksm h SER 181 Ca 0.37 -0.01 -0.28 0.00 -0.47 0.00 0.00 61.79 61.39 2ksm h SER 181 Cb 0.60 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.64 2ksm h SER 181 CO -0.71 0.24 -1.50 0.74 -0.87 0.00 0.00 176.83 174.73 2ksm h THR 182 N 0.08 1.14 -2.09 2.95 2.02 0.13 -3.40 112.91 113.75 2ksm h THR 182 Ca 0.02 -2.88 -0.52 0.00 0.77 0.00 0.00 66.41 63.79 2ksm h THR 182 Cb 0.33 2.64 -0.41 0.00 -1.74 0.00 0.00 68.15 68.98 2ksm h THR 182 CO 0.02 0.74 -1.01 0.79 0.37 0.00 0.00 175.52 176.43 2ksm n TRP 183 N -3.29 1.32 0.01 3.16 8.01 0.24 -4.94 117.44 121.95 2ksm n TRP 183 Ca -0.14 -3.86 -0.09 0.00 -1.31 0.00 0.00 57.50 52.10 2ksm n TRP 183 Cb 1.02 -0.44 0.06 0.00 -2.01 0.00 0.00 31.31 29.95 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 3.15 0.54 0.00 -0.99 0.13 -1.26 -3.02 132.00 130.55 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 0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2ksm h PRO 184 CO 0.60 0.94 0.00 -3.47 -0.23 0.00 0.00 178.00 175.84 2ksm n ASP 185 N -3.96 0.00 -4.43 1.44 2.03 -1.26 -4.71 116.55 105.67 2ksm n ASP 185 Ca -0.03 -0.57 -0.33 0.00 0.52 0.00 0.00 54.79 54.38 2ksm n ASP 185 Cb 0.60 -0.13 -0.13 0.00 -0.72 0.00 0.00 41.12 40.74 2ksm n ASP 185 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2ksm s MET 186 N -2.26 3.23 -0.00 -0.67 1.00 -1.14 -5.07 119.30 114.39 2ksm s MET 186 Ca 0.37 -0.65 -0.32 0.00 0.00 0.00 0.00 55.69 55.09 2ksm s MET 186 Cb 0.20 -2.63 -0.11 0.00 0.00 0.00 0.00 34.83 32.29 2ksm s MET 186 CO 0.39 0.33 1.88 1.63 0.00 0.00 0.00 175.02 179.25 2ksm n LYS 187 N 3.20 2.48 -4.05 2.03 5.02 -1.26 -4.80 118.16 120.78 2ksm n LYS 187 Ca -0.18 0.91 -0.34 0.00 -2.02 0.00 0.00 58.31 56.67 2ksm n LYS 187 Cb 0.53 -2.79 -0.14 0.00 -0.02 0.00 0.00 35.03 32.60 2ksm n LYS 187 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2ksm s ILE 188 N 3.76 3.14 -0.32 -0.18 1.01 -1.26 0.46 121.20 127.81 2ksm s ILE 188 Ca 0.89 -0.58 0.03 0.00 0.00 0.00 0.00 60.65 60.99 2ksm s ILE 188 Cb -0.58 -2.40 0.09 0.00 0.01 0.00 0.00 42.46 39.57 2ksm s ILE 188 CO 0.46 0.45 0.02 0.68 0.00 0.00 0.00 174.94 176.55 2ksm s VAL 189 N 1.30 2.37 -0.59 2.92 -7.23 -0.12 -5.01 120.40 114.04 2ksm s VAL 189 Ca 0.04 -2.09 -0.08 0.00 -1.81 0.00 0.00 61.98 58.04 2ksm s VAL 189 Cb -0.14 -2.63 0.15 0.00 0.56 0.00 0.00 36.38 34.32 2ksm s VAL 189 CO -0.04 -0.43 0.46 0.20 -0.31 0.00 0.00 175.10 174.98 2ksm s ASN 190 N 1.05 5.74 -0.70 4.85 0.01 -1.26 -0.60 114.94 124.03 2ksm s ASN 190 Ca 0.05 -2.40 -0.03 0.00 -0.71 0.00 0.00 52.86 49.77 2ksm s ASN 190 Cb -0.20 -1.99 0.18 0.00 0.41 0.00 0.00 41.25 39.65 2ksm s ASN 190 CO -0.07 -0.55 0.53 0.54 -1.51 0.00 0.00 177.10 176.04 2ksm s ASN 191 N 1.85 5.45 0.15 -1.22 6.03 -0.99 -4.98 114.94 121.23 2ksm s ASN 191 Ca 0.12 -3.06 -0.08 0.00 -1.03 0.00 0.00 52.86 48.81 2ksm s ASN 191 Cb -0.21 -1.88 -0.06 0.00 -3.03 0.00 0.00 41.25 36.07 2ksm s ASN 191 CO -0.03 -0.33 0.44 -0.63 -2.03 0.00 0.00 177.10 174.51 2ksm s ILE 192 N -0.37 5.07 -0.00 0.54 1.01 -1.26 -4.74 121.20 121.45 2ksm s ILE 192 Ca 0.19 0.30 0.00 0.00 0.00 0.00 0.00 60.65 61.15 2ksm s ILE 192 Cb -0.17 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.67 2ksm s ILE 192 CO -0.06 0.09 -0.00 -0.70 0.00 0.00 0.00 174.94 174.27 2ksm s GLU 193 N -2.46 0.06 -0.23 2.79 2.12 -1.26 -5.05 118.70 114.67 2ksm s GLU 193 Ca 0.40 -0.01 -0.29 0.00 0.36 0.00 0.00 54.97 55.44 2ksm s GLU 193 Cb -0.12 -0.09 -0.01 0.00 0.26 0.00 0.00 34.13 34.17 2ksm s GLU 193 CO 0.22 -0.00 1.29 0.14 -0.54 0.00 0.00 175.26 176.36 2ksm s VAL 194 N 0.10 4.21 0.09 3.70 -7.23 -1.26 -4.26 120.40 115.75 2ksm s VAL 194 Ca -0.01 1.42 -0.16 0.00 -1.81 0.00 0.00 61.98 61.42 2ksm s VAL 194 Cb -0.02 -4.06 -0.07 0.00 0.56 0.00 0.00 36.38 32.79 2ksm s VAL 194 CO -0.00 -0.29 0.52 0.42 -0.31 0.00 0.00 175.10 175.43 2ksm s THR 195 N 3.94 4.87 0.00 5.32 -4.23 -1.26 -4.66 115.64 119.62 2ksm s THR 195 Ca 0.56 0.92 0.00 0.00 -1.18 0.00 0.00 61.69 61.99 2ksm s THR 195 Cb -0.19 -3.77 0.00 0.00 1.34 0.00 0.00 72.50 69.87 2ksm s THR 195 CO 0.19 0.41 0.00 0.61 -0.54 0.00 0.00 174.62 175.28 2ksm n GLY 196 N 1.29 0.94 1.46 3.99 0.00 -1.26 -4.86 105.19 106.75 2ksm n GLY 196 Ca -0.09 -0.73 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 2ksm n GLY 196 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ksm n GLN 197 N 0.00 -1.21 -1.59 1.61 3.00 -1.26 -4.86 117.38 113.07 2ksm n GLN 197 Ca 0.00 0.25 -0.31 0.00 -0.01 0.00 0.00 57.00 56.94 2ksm n GLN 197 Cb 0.00 -4.20 0.07 0.00 0.00 0.00 0.00 30.24 26.11 2ksm n GLN 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2ksm s ALA 198 N -1.25 2.52 0.76 -1.58 0.00 -1.26 -5.04 121.76 115.91 2ksm s ALA 198 Ca 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.79 2ksm s ALA 198 Cb 0.00 -3.14 0.04 0.00 0.00 0.00 0.00 23.12 20.03 2ksm s ALA 198 CO 0.00 -1.42 1.08 -1.25 0.00 0.00 0.00 175.76 174.17 2ksm s PRO 199 N -5.11 2.43 0.87 0.00 0.04 -1.26 -5.02 135.00 126.95 2ksm s PRO 199 Ca 0.59 0.92 -0.15 0.00 0.04 0.00 0.00 61.00 62.40 2ksm s PRO 199 Cb -0.14 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 2ksm s PRO 199 CO 0.54 -1.45 -0.41 -2.30 0.04 0.00 0.00 177.00 173.42 2ksm n PRO 200 N -3.36 -0.80 -0.14 0.56 -0.02 -1.26 -4.97 135.00 125.01 2ksm n PRO 200 Ca 0.08 -0.23 -0.03 0.00 -2.02 0.00 0.00 63.50 61.29 2ksm n PRO 200 Cb 0.54 -1.21 0.02 0.00 -0.02 0.00 0.00 33.50 32.83 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 2.89 -1.95 3.47 -1.23 0.00 -1.26 -4.99 105.19 102.11 2ksm n GLY 201 Ca 0.01 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 44.15 2ksm n GLY 201 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ksm n PRO 202 N -1.61 -0.15 0.00 1.61 -0.02 -1.26 -5.30 135.00 128.27 2ksm n PRO 202 Ca 0.02 0.01 0.08 0.00 -2.02 0.00 0.00 63.50 61.59 2ksm n PRO 202 Cb 0.06 -1.94 0.49 0.00 -0.02 0.00 0.00 33.50 32.09 2ksm n PRO 202 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13