#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k60 s SER -4 N 0.00 -0.14 0.11 1.61 0.01 0.76 -5.00 113.70 111.05 2k60 s SER -4 Ca 0.00 -0.12 0.10 0.00 1.31 0.00 0.00 55.95 57.24 2k60 s SER -4 Cb 0.00 0.34 -0.17 0.00 0.21 0.00 0.00 66.02 66.40 2k60 s SER -4 CO 0.00 -0.56 1.18 1.12 0.41 0.00 0.00 173.24 175.39 2k60 h HIS -3 N 3.42 0.00 -3.31 2.43 2.07 -2.01 -3.39 115.15 114.35 2k60 h HIS -3 Ca -0.31 0.00 -0.58 0.00 -2.85 0.00 0.00 60.37 56.63 2k60 h HIS -3 Cb 1.19 0.00 -0.07 0.00 2.57 0.00 0.00 27.41 31.10 2k60 h HIS -3 CO 0.48 0.91 0.76 0.00 -3.07 0.00 0.00 177.93 177.01 2k60 s MET -2 N -2.74 4.06 0.33 5.12 0.00 -1.26 -4.80 119.30 120.02 2k60 s MET -2 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 55.69 56.70 2k60 s MET -2 Cb 0.09 -3.73 0.00 0.00 0.00 0.00 0.00 34.83 31.19 2k60 s MET -2 CO 0.81 -0.84 0.00 0.00 0.00 0.00 0.00 175.02 174.99 2k60 n ALA -1 N 6.71 -1.89 -1.96 3.16 0.00 -1.24 -4.66 120.51 120.63 2k60 n ALA -1 Ca 0.11 0.46 -0.38 0.00 0.00 0.00 0.00 53.44 53.63 2k60 n ALA -1 Cb 0.47 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 19.03 2k60 n ALA -1 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2k60 s SER 0 N -5.51 5.16 -0.50 0.00 0.01 -1.26 -4.74 113.70 106.86 2k60 s SER 0 Ca 0.00 0.50 0.06 0.00 1.31 0.00 0.00 55.95 57.82 2k60 s SER 0 Cb 0.00 -2.52 0.19 0.00 0.21 0.00 0.00 66.02 63.89 2k60 s SER 0 CO 0.00 -2.43 0.65 -1.54 0.41 0.00 0.00 173.24 170.33 2k60 n SER 58 N 13.17 -2.85 0.00 2.44 3.41 -1.26 -4.86 113.62 123.66 2k60 n SER 58 Ca 0.23 -2.81 0.00 0.00 -0.26 0.00 0.00 58.87 56.03 2k60 n SER 58 Cb 0.52 1.29 0.00 0.00 -0.26 0.00 0.00 64.21 65.76 2k60 n SER 58 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2k60 n GLU 59 N 2.90 0.00 -3.20 4.33 0.28 -1.26 -0.17 120.64 123.52 2k60 n GLU 59 Ca 0.20 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.22 2k60 n GLU 59 Cb 0.54 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.40 2k60 n GLU 59 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2k60 s ASP 60 N -0.93 -1.44 -0.01 -1.84 2.15 -1.26 -3.49 116.67 109.85 2k60 s ASP 60 Ca 0.00 -0.47 0.11 0.00 0.43 0.00 0.00 52.55 52.62 2k60 s ASP 60 Cb 0.00 1.93 -0.15 0.00 -0.30 0.00 0.00 42.92 44.40 2k60 s ASP 60 CO 0.00 -0.22 0.34 -0.62 -0.17 0.00 0.00 175.17 174.50 2k60 n GLU 61 N 4.77 1.57 -2.25 4.34 1.02 -1.26 -4.97 120.64 123.86 2k60 n GLU 61 Ca 0.09 -0.06 -0.16 0.00 -0.02 0.00 0.00 57.16 57.01 2k60 n GLU 61 Cb 0.55 -1.17 -0.01 0.00 -0.02 0.00 0.00 31.44 30.79 2k60 n GLU 61 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2k60 n LYS 62 N -1.64 -1.23 -4.38 3.49 3.00 -1.26 -4.99 118.16 111.15 2k60 n LYS 62 Ca -0.00 0.77 -0.29 0.00 -0.00 0.00 0.00 58.31 58.79 2k60 n LYS 62 Cb 0.25 -5.12 -0.06 0.00 0.00 0.00 0.00 35.03 30.09 2k60 n LYS 62 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2k60 s LEU 63 N -4.42 2.61 0.00 3.14 2.96 -1.26 -5.04 118.68 116.66 2k60 s LEU 63 Ca 0.00 -1.41 0.18 0.00 -0.22 0.00 0.00 54.13 52.68 2k60 s LEU 63 Cb 0.00 -1.01 -0.06 0.00 0.50 0.00 0.00 46.19 45.62 2k60 s LEU 63 CO 0.00 -0.84 0.88 -1.20 -1.32 0.00 0.00 176.35 173.88 2k60 n SER 64 N -1.38 1.49 -0.11 3.68 7.64 -1.26 -4.12 113.62 119.56 2k60 n SER 64 Ca -0.10 -1.25 -0.11 0.00 1.01 0.00 0.00 58.87 58.42 2k60 n SER 64 Cb 0.66 0.63 -0.03 0.00 -1.01 0.00 0.00 64.21 64.46 2k60 n SER 64 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 2k60 h PHE 65 N 1.43 0.72 -0.56 1.43 3.57 -1.98 0.14 116.94 121.69 2k60 h PHE 65 Ca 0.00 -0.16 -0.03 0.00 3.53 0.00 0.00 57.97 61.31 2k60 h PHE 65 Cb 0.56 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.10 2k60 h PHE 65 CO 0.00 0.82 0.22 1.05 -2.23 0.00 0.00 178.31 178.17 2k60 h GLU 66 N 0.42 0.81 0.16 1.11 4.11 -1.95 -1.21 114.58 118.03 2k60 h GLU 66 Ca 0.08 -0.12 -0.01 0.00 0.07 0.00 0.00 59.36 59.38 2k60 h GLU 66 Cb 0.59 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2k60 h GLU 66 CO 0.03 0.67 -0.07 0.00 0.07 0.00 0.00 179.01 179.71 2k60 h ALA 67 N 1.44 -0.21 -0.51 1.06 0.00 -1.61 0.36 119.26 119.80 2k60 h ALA 67 Ca 0.19 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2k60 h ALA 67 Cb 0.16 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2k60 h ALA 67 CO -0.02 -0.49 0.30 -0.24 0.00 0.00 0.00 179.25 178.80 2k60 h VAL 68 N -0.46 1.04 0.00 0.00 3.04 -0.47 -0.75 116.25 118.65 2k60 h VAL 68 Ca -0.02 -0.20 -0.08 0.00 -1.01 0.00 0.00 66.70 65.39 2k60 h VAL 68 Cb 0.36 0.40 -0.01 0.00 -2.01 0.00 0.00 31.29 30.03 2k60 h VAL 68 CO 0.04 0.11 -0.36 0.08 -1.01 0.00 0.00 177.57 176.42 2k60 h ARG 69 N 0.59 0.00 0.05 4.17 0.11 -1.20 -1.62 114.38 116.48 2k60 h ARG 69 Ca 0.21 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.28 2k60 h ARG 69 Cb 0.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.12 2k60 h ARG 69 CO -0.10 0.36 -0.02 -0.97 0.10 0.00 0.00 179.97 179.34 2k60 h ASN 70 N 0.00 -0.05 0.41 0.08 -0.73 0.46 0.34 115.58 116.09 2k60 h ASN 70 Ca -0.00 -0.29 -0.08 0.00 1.87 0.00 0.00 56.30 57.79 2k60 h ASN 70 Cb 0.69 0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.29 2k60 h ASN 70 CO 0.05 0.27 -0.38 0.40 -0.37 0.00 0.00 177.43 177.40 2k60 h ILE 71 N -0.38 1.24 -0.31 2.57 5.03 -1.04 0.22 117.51 124.84 2k60 h ILE 71 Ca -0.01 -1.32 -0.18 0.00 -0.12 0.00 0.00 64.86 63.24 2k60 h ILE 71 Cb 0.34 1.72 -0.00 0.00 -3.03 0.00 0.00 36.82 35.85 2k60 h ILE 71 CO 0.01 0.37 -0.49 0.45 -0.68 0.00 0.00 178.15 177.81 2k60 h HIS 72 N 0.00 1.10 0.00 1.37 3.86 -1.11 -3.07 115.15 117.29 2k60 h HIS 72 Ca -0.00 -0.37 -0.04 0.00 -1.16 0.00 0.00 60.37 58.79 2k60 h HIS 72 Cb 0.69 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.94 2k60 h HIS 72 CO 0.00 1.20 -0.19 1.57 0.86 0.00 0.00 177.93 181.37 2k60 h LYS 73 N 0.68 0.00 -0.46 2.45 5.09 0.25 -3.15 116.57 121.42 2k60 h LYS 73 Ca 0.03 0.00 0.13 0.00 0.09 0.00 0.00 60.65 60.90 2k60 h LYS 73 Cb 1.10 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.41 2k60 h LYS 73 CO 0.11 0.19 0.40 1.25 -2.09 0.00 0.00 179.45 179.32 2k60 h LEU 74 N 0.00 0.00 0.17 7.07 5.85 -0.87 -1.84 115.31 125.70 2k60 h LEU 74 Ca -0.00 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.45 2k60 h LEU 74 Cb 0.54 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.59 2k60 h LEU 74 CO 0.02 0.00 -1.23 0.24 -0.34 0.00 0.00 178.44 177.13 2k60 h MET 75 N 0.00 0.36 -6.88 1.25 2.86 -1.71 -3.46 114.93 107.36 2k60 h MET 75 Ca 0.22 -0.62 -0.54 0.00 -2.06 0.00 0.00 59.70 56.70 2k60 h MET 75 Cb 1.02 0.23 0.10 0.00 0.06 0.00 0.00 31.60 33.01 2k60 h MET 75 CO -0.00 1.30 0.83 0.34 1.06 0.00 0.00 176.91 180.44 2k60 s ASP 76 N -7.19 6.34 0.05 1.22 2.15 -0.69 -3.68 116.67 114.88 2k60 s ASP 76 Ca -0.14 3.02 -0.15 0.00 0.43 0.00 0.00 52.55 55.70 2k60 s ASP 76 Cb 0.03 -2.65 -0.28 0.00 -0.30 0.00 0.00 42.92 39.71 2k60 s ASP 76 CO 0.85 -0.90 1.11 -0.78 -0.17 0.00 0.00 175.17 175.28 2k60 h ASP 77 N 3.82 0.87 0.16 -0.34 3.58 -1.81 -3.29 116.42 119.40 2k60 h ASP 77 Ca -0.49 -0.81 0.00 0.00 0.42 0.00 0.00 57.03 56.15 2k60 h ASP 77 Cb 1.23 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 42.01 2k60 h ASP 77 CO 0.71 1.58 -0.84 -0.90 -2.88 0.00 0.00 179.24 176.91 2k60 n ASP 78 N -3.83 0.84 -3.17 2.28 5.75 -1.26 -5.01 116.55 112.15 2k60 n ASP 78 Ca -0.13 -0.76 -0.17 0.00 -0.01 0.00 0.00 54.79 53.71 2k60 n ASP 78 Cb 0.95 0.76 0.02 0.00 -1.03 0.00 0.00 41.12 41.82 2k60 n ASP 78 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k60 n ALA 79 N -1.50 -2.71 -0.03 2.12 0.00 -1.24 -4.50 120.51 112.65 2k60 n ALA 79 Ca 0.04 0.61 0.06 0.00 0.00 0.00 0.00 53.44 54.15 2k60 n ALA 79 Cb 0.33 -2.68 0.13 0.00 0.00 0.00 0.00 19.45 17.23 2k60 n ALA 79 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2k60 n ASN 80 N -0.74 2.73 0.00 0.00 6.94 -1.26 -3.60 115.26 119.33 2k60 n ASN 80 Ca -0.00 -1.88 0.00 0.00 -0.02 0.00 0.00 54.58 52.67 2k60 n ASN 80 Cb 0.56 -0.19 0.00 0.00 -2.36 0.00 0.00 39.78 37.79 2k60 n ASN 80 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2k60 n GLY 81 N 0.57 1.06 2.94 4.83 0.00 -1.26 -5.02 105.19 108.31 2k60 n GLY 81 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 2k60 n GLY 81 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k60 s ASP 82 N -1.70 -0.09 -0.40 1.61 1.47 -1.26 -2.75 116.67 113.56 2k60 s ASP 82 Ca 0.00 0.21 -0.12 0.00 1.18 0.00 0.00 52.55 53.82 2k60 s ASP 82 Cb 0.00 0.17 0.04 0.00 -0.34 0.00 0.00 42.92 42.79 2k60 s ASP 82 CO 0.00 -0.08 0.25 -0.69 0.68 0.00 0.00 175.17 175.33 2k60 s VAL 83 N 0.49 4.68 0.49 2.11 1.01 0.11 -4.85 120.40 124.44 2k60 s VAL 83 Ca -0.04 -0.95 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 2k60 s VAL 83 Cb -0.05 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 2k60 s VAL 83 CO -0.02 -0.33 0.77 -0.62 0.00 0.00 0.00 175.10 174.90 2k60 s ASP 84 N 1.78 6.09 0.52 3.32 2.15 -1.26 -0.00 116.67 129.27 2k60 s ASP 84 Ca 0.03 0.78 0.21 0.00 0.43 0.00 0.00 52.55 54.00 2k60 s ASP 84 Cb -0.20 -2.05 1.34 0.00 -0.30 0.00 0.00 42.92 41.71 2k60 s ASP 84 CO 0.06 -0.66 2.06 -0.37 -0.17 0.00 0.00 175.17 176.09 2k60 h VAL 85 N 0.21 0.84 0.00 1.11 -1.51 -1.91 0.21 116.25 115.21 2k60 h VAL 85 Ca -0.47 -0.00 -0.20 0.00 -1.23 0.00 0.00 66.70 64.80 2k60 h VAL 85 Cb 1.22 0.83 -0.03 0.00 -2.13 0.00 0.00 31.29 31.19 2k60 h VAL 85 CO 0.61 0.00 -0.94 -0.33 -1.23 0.00 0.00 177.57 175.68 2k60 h GLU 86 N 0.01 0.00 0.02 5.19 5.08 -1.96 -3.11 114.58 119.81 2k60 h GLU 86 Ca 0.15 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.33 2k60 h GLU 86 Cb 0.60 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.87 2k60 h GLU 86 CO -0.00 0.94 -0.70 0.93 -1.00 0.00 0.00 179.01 179.17 2k60 h GLU 87 N 0.00 0.45 -0.02 2.33 5.08 -1.36 -3.19 114.58 117.87 2k60 h GLU 87 Ca -0.01 -0.50 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2k60 h GLU 87 Cb 1.70 0.15 0.00 0.00 0.50 0.00 0.00 28.75 31.09 2k60 h GLU 87 CO 0.12 1.16 0.00 -1.13 -1.00 0.00 0.00 179.01 178.16 2k60 n SER 88 N -4.15 0.29 -0.26 1.42 3.41 -0.57 -3.40 113.62 110.36 2k60 n SER 88 Ca -0.11 -1.34 -0.07 0.00 -0.26 0.00 0.00 58.87 57.09 2k60 n SER 88 Cb 0.73 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.60 2k60 n SER 88 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2k60 n ASP 89 N -0.66 -0.66 0.03 4.04 2.03 -1.17 -0.83 116.55 119.33 2k60 n ASP 89 Ca 0.17 1.40 -0.21 0.00 0.52 0.00 0.00 54.79 56.68 2k60 n ASP 89 Cb 0.13 -0.29 -0.14 0.00 -0.72 0.00 0.00 41.12 40.09 2k60 n ASP 89 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2k60 h GLU 90 N 0.00 0.27 0.00 -0.67 4.57 -1.88 -3.40 114.58 113.47 2k60 h GLU 90 Ca 0.10 -0.46 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 2k60 h GLU 90 Cb 0.25 0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 2k60 h GLU 90 CO -0.58 1.22 0.00 1.19 -1.18 0.00 0.00 179.01 179.66 2k60 n PHE 91 N -4.05 0.00 -0.35 0.92 3.72 -0.43 -1.89 117.46 115.38 2k60 n PHE 91 Ca -0.19 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.32 2k60 n PHE 91 Cb 0.85 -0.19 0.28 0.00 -0.94 0.00 0.00 39.48 39.48 2k60 n PHE 91 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2k60 h LEU 92 N 0.00 0.78 0.08 4.37 5.85 -1.22 0.48 115.31 125.65 2k60 h LEU 92 Ca 0.00 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.81 2k60 h LEU 92 Cb 0.00 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2k60 h LEU 92 CO 0.00 0.33 -0.30 0.03 -0.34 0.00 0.00 178.44 178.16 2k60 h ARG 93 N 0.81 -0.42 0.03 1.25 3.08 -1.63 -2.14 114.38 115.36 2k60 h ARG 93 Ca 0.54 0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.61 2k60 h ARG 93 Cb 0.73 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.88 2k60 h ARG 93 CO -0.34 -0.28 -0.01 0.93 -1.07 0.00 0.00 179.97 179.19 2k60 h GLU 94 N -0.43 -0.04 -0.96 0.04 5.08 -0.82 0.74 114.58 118.18 2k60 h GLU 94 Ca -0.01 0.00 0.30 0.00 -1.00 0.00 0.00 59.36 58.66 2k60 h GLU 94 Cb 0.43 0.01 -0.15 0.00 0.50 0.00 0.00 28.75 29.54 2k60 h GLU 94 CO -0.16 0.64 0.45 0.22 -1.00 0.00 0.00 179.01 179.16 2k60 h ASP 95 N -0.79 0.32 0.00 1.42 3.58 0.07 -1.73 116.42 119.29 2k60 h ASP 95 Ca -0.00 0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.65 2k60 h ASP 95 Cb 0.69 0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2k60 h ASP 95 CO 0.01 -0.16 0.00 0.00 -2.88 0.00 0.00 179.24 176.20 2k60 n LEU 96 N -5.13 0.00 -0.02 2.28 -0.00 -0.83 -4.20 117.00 109.10 2k60 n LEU 96 Ca 0.29 0.00 0.05 0.00 -0.00 0.00 0.00 56.01 56.34 2k60 n LEU 96 Cb 0.90 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 44.26 2k60 n LEU 96 CO 0.08 0.00 -0.01 -3.20 -0.00 0.00 0.00 177.39 174.26 2k60 n ASN 97 N 0.00 0.53 0.00 1.45 4.05 -0.23 -4.75 115.26 116.31 2k60 n ASN 97 Ca 0.00 -0.77 0.00 0.00 0.45 0.00 0.00 54.58 54.26 2k60 n ASN 97 Cb 0.22 0.96 0.00 0.00 1.23 0.00 0.00 39.78 42.19 2k60 n ASN 97 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 2k60 n TYR 98 N -1.17 0.00 0.00 1.20 4.02 0.24 -4.16 117.16 117.29 2k60 n TYR 98 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 2k60 n TYR 98 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 2k60 n TYR 98 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 2k60 n HIS 99 N 0.00 0.00 -4.82 -0.72 8.25 -1.25 -3.93 115.22 112.75 2k60 n HIS 99 Ca 0.00 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.19 2k60 n HIS 99 Cb 0.00 -0.00 -0.17 0.00 1.12 0.00 0.00 29.99 30.94 2k60 n HIS 99 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2k60 s ASP 100 N -1.05 2.23 0.00 0.41 -4.77 -1.26 -4.68 116.67 107.55 2k60 s ASP 100 Ca 0.00 -0.38 0.29 0.00 -3.30 0.00 0.00 52.55 49.16 2k60 s ASP 100 Cb 0.00 -0.91 1.35 0.00 -1.09 0.00 0.00 42.92 42.27 2k60 s ASP 100 CO 0.00 0.10 1.91 -0.81 0.70 0.00 0.00 175.17 177.07 2k60 n PRO 101 N 3.55 1.39 -0.08 2.11 -0.04 -1.26 -3.75 135.00 136.91 2k60 n PRO 101 Ca -0.21 -0.60 0.10 0.00 -0.04 0.00 0.00 63.50 62.75 2k60 n PRO 101 Cb 0.52 -1.49 0.47 0.00 -0.04 0.00 0.00 33.50 32.97 2k60 n PRO 101 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2k60 h THR 102 N 1.47 0.94 0.52 0.52 2.02 -1.97 0.39 112.91 116.79 2k60 h THR 102 Ca 0.00 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 2k60 h THR 102 Cb 0.32 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 2k60 h THR 102 CO 0.00 0.09 -0.32 0.58 0.37 0.00 0.00 175.52 176.23 2k60 h VAL 103 N 0.47 0.34 -0.45 3.16 2.07 -1.99 0.64 116.25 120.47 2k60 h VAL 103 Ca 0.26 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.64 2k60 h VAL 103 Cb 0.43 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2k60 h VAL 103 CO -0.07 0.00 -0.27 0.11 0.02 0.00 0.00 177.57 177.36 2k60 h LYS 104 N -0.80 0.98 0.18 1.57 1.79 -1.54 -0.16 116.57 118.59 2k60 h LYS 104 Ca -0.06 -0.44 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 2k60 h LYS 104 Cb 0.66 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.27 2k60 h LYS 104 CO 0.06 1.11 -0.18 0.45 -1.08 0.00 0.00 179.45 179.81 2k60 h HIS 105 N 0.83 -0.47 0.00 -1.35 3.86 -0.19 0.22 115.15 118.04 2k60 h HIS 105 Ca 0.10 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.18 2k60 h HIS 105 Cb 0.85 0.18 -0.02 0.00 1.06 0.00 0.00 27.41 29.49 2k60 h HIS 105 CO 0.06 -0.27 -0.60 0.66 0.86 0.00 0.00 177.93 178.63 2k60 h SER 106 N -0.39 0.00 -0.11 2.45 4.64 -0.88 -0.47 113.55 118.78 2k60 h SER 106 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.29 2k60 h SER 106 Cb 0.37 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2k60 h SER 106 CO -0.05 0.60 -0.07 0.74 -0.87 0.00 0.00 176.83 177.19 2k60 h THR 107 N 0.00 1.33 0.30 2.95 2.02 -0.81 -1.44 112.91 117.26 2k60 h THR 107 Ca -0.01 -1.14 -0.01 0.00 0.77 0.00 0.00 66.41 66.02 2k60 h THR 107 Cb 1.16 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.43 2k60 h THR 107 CO 0.08 0.32 -0.14 0.15 0.37 0.00 0.00 175.52 176.30 2k60 h PHE 108 N -0.13 -0.37 -0.03 3.16 3.57 -0.54 -3.38 116.94 119.22 2k60 h PHE 108 Ca 0.02 -0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.39 2k60 h PHE 108 Cb 0.55 0.12 0.01 0.00 2.79 0.00 0.00 35.95 39.42 2k60 h PHE 108 CO 0.07 -0.23 -0.47 1.25 -2.23 0.00 0.00 178.31 176.70 2k60 h HIS 109 N -1.04 0.54 0.00 0.41 2.76 -1.24 -3.48 115.15 113.09 2k60 h HIS 109 Ca -0.04 -0.27 0.00 0.00 -2.20 0.00 0.00 60.37 57.86 2k60 h HIS 109 Cb 0.31 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.20 2k60 h HIS 109 CO 0.00 1.06 0.00 0.41 -1.30 0.00 0.00 177.93 178.11 2k60 n GLY 110 N 0.93 2.78 0.46 5.26 0.00 -0.54 -4.70 105.19 109.38 2k60 n GLY 110 Ca -0.09 -0.76 0.05 0.00 0.00 0.00 0.00 46.02 45.22 2k60 n GLY 110 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2k60 n GLU 111 N 0.00 1.58 -2.20 1.61 2.13 -1.26 -4.62 120.64 117.88 2k60 n GLU 111 Ca 0.00 -0.90 -0.01 0.00 0.66 0.00 0.00 57.16 56.91 2k60 n GLU 111 Cb 0.00 -1.24 0.00 0.00 0.27 0.00 0.00 31.44 30.48 2k60 n GLU 111 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2k60 n ASP 112 N 0.20 -4.74 0.00 4.31 -0.08 -1.25 -4.95 116.55 110.03 2k60 n ASP 112 Ca 0.10 0.05 0.00 0.00 -1.51 0.00 0.00 54.79 53.43 2k60 n ASP 112 Cb 0.22 -3.04 0.00 0.00 2.34 0.00 0.00 41.12 40.65 2k60 n ASP 112 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2k60 n LYS 113 N -1.09 0.00 -2.90 -0.67 5.02 -1.25 -4.86 118.16 112.41 2k60 n LYS 113 Ca 0.02 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.91 2k60 n LYS 113 Cb 0.42 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.37 2k60 n LYS 113 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2k60 s LEU 114 N 0.00 4.59 -0.25 -0.35 1.02 -1.25 -4.22 118.68 118.22 2k60 s LEU 114 Ca 0.00 1.72 -0.06 0.00 0.02 0.00 0.00 54.13 55.81 2k60 s LEU 114 Cb 0.00 -3.40 -0.01 0.00 0.02 0.00 0.00 46.19 42.80 2k60 s LEU 114 CO 0.00 0.16 0.04 -0.63 0.02 0.00 0.00 176.35 175.94 2k60 s ILE 115 N -0.98 3.97 -0.04 -0.59 -1.09 0.99 -4.54 121.20 118.92 2k60 s ILE 115 Ca 0.38 -0.37 0.05 0.00 -2.23 0.00 0.00 60.65 58.48 2k60 s ILE 115 Cb -0.24 -2.89 -0.01 0.00 -1.58 0.00 0.00 42.46 37.75 2k60 s ILE 115 CO 0.28 0.31 -0.18 -0.94 -1.23 0.00 0.00 174.94 173.18 2k60 s SER 116 N 1.55 2.17 0.15 3.58 1.04 -1.26 0.04 113.70 120.97 2k60 s SER 116 Ca 0.05 -0.35 -0.19 0.00 0.48 0.00 0.00 55.95 55.94 2k60 s SER 116 Cb -0.15 -0.50 0.03 0.00 0.10 0.00 0.00 66.02 65.50 2k60 s SER 116 CO 0.01 0.18 1.68 1.62 0.98 0.00 0.00 173.24 177.71 2k60 h VAL 117 N 5.09 0.65 -0.80 5.02 3.04 -1.87 -0.03 116.25 127.34 2k60 h VAL 117 Ca -0.34 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.31 2k60 h VAL 117 Cb 1.17 0.65 -0.04 0.00 -2.01 0.00 0.00 31.29 31.06 2k60 h VAL 117 CO 0.48 0.00 0.33 1.05 -1.01 0.00 0.00 177.57 178.42 2k60 h GLU 118 N -0.05 1.19 -0.16 4.17 4.11 -1.97 0.54 114.58 122.42 2k60 h GLU 118 Ca 0.14 -0.21 -0.17 0.00 0.07 0.00 0.00 59.36 59.19 2k60 h GLU 118 Cb 0.26 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2k60 h GLU 118 CO -0.31 0.96 -0.61 0.22 0.07 0.00 0.00 179.01 179.34 2k60 h ASP 119 N 1.16 0.60 -0.43 3.06 3.58 -1.91 -1.56 116.42 120.92 2k60 h ASP 119 Ca 0.27 -0.34 -0.01 0.00 0.42 0.00 0.00 57.03 57.37 2k60 h ASP 119 Cb 0.21 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 2k60 h ASP 119 CO -0.02 1.06 0.25 -0.07 -2.88 0.00 0.00 179.24 177.57 2k60 h LEU 120 N 0.39 0.53 -0.51 2.28 3.38 -0.51 -0.35 115.31 120.52 2k60 h LEU 120 Ca -0.00 -0.08 0.09 0.00 0.09 0.00 0.00 57.88 57.98 2k60 h LEU 120 Cb 1.16 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.71 2k60 h LEU 120 CO 0.11 0.45 0.11 -0.25 0.09 0.00 0.00 178.44 178.96 2k60 h TRP 121 N 0.56 0.19 -0.11 1.13 7.01 0.45 0.56 115.95 125.74 2k60 h TRP 121 Ca 0.15 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.18 2k60 h TRP 121 Cb 0.03 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.08 2k60 h TRP 121 CO -0.03 0.01 0.07 0.87 -2.79 0.00 0.00 178.44 176.57 2k60 h LYS 122 N 0.26 0.14 -0.15 2.65 6.56 -0.99 -1.54 116.57 123.49 2k60 h LYS 122 Ca 0.26 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 2k60 h LYS 122 Cb 0.34 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.96 2k60 h LYS 122 CO -0.33 0.11 0.09 0.00 -2.06 0.00 0.00 179.45 177.27 2k60 h ALA 123 N 1.02 0.19 -0.45 3.86 0.00 0.04 -1.74 119.26 122.18 2k60 h ALA 123 Ca 0.04 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.98 2k60 h ALA 123 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2k60 h ALA 123 CO -0.01 -0.31 0.16 2.35 0.00 0.00 0.00 179.25 181.44 2k60 h TRP 124 N 0.18 0.28 0.00 0.00 7.01 0.12 0.27 115.95 123.80 2k60 h TRP 124 Ca 0.05 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 2k60 h TRP 124 Cb 0.01 -0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 27.01 2k60 h TRP 124 CO -0.06 0.10 -0.06 0.87 -2.79 0.00 0.00 178.44 176.50 2k60 h LYS 125 N 0.33 0.00 -0.03 2.65 1.57 -1.01 -1.43 116.57 118.65 2k60 h LYS 125 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2k60 h LYS 125 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2k60 h LYS 125 CO -0.22 0.06 -0.14 0.45 -0.57 0.00 0.00 179.45 179.02 2k60 n SER 126 N -3.34 2.66 -4.97 0.86 2.88 -0.08 -4.81 113.62 106.82 2k60 n SER 126 Ca -0.01 -1.83 -0.20 0.00 -1.33 0.00 0.00 58.87 55.50 2k60 n SER 126 Cb 0.22 0.14 -0.01 0.00 -0.75 0.00 0.00 64.21 63.81 2k60 n SER 126 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2k60 s SER 127 N -2.15 5.96 0.59 -3.46 0.01 0.76 -4.98 113.70 110.44 2k60 s SER 127 Ca 0.25 -0.17 0.31 0.00 1.31 0.00 0.00 55.95 57.66 2k60 s SER 127 Cb 0.19 -1.33 1.85 0.00 0.21 0.00 0.00 66.02 66.95 2k60 s SER 127 CO 0.38 -0.34 2.25 -0.33 0.41 0.00 0.00 173.24 175.61 2k60 h GLU 128 N 1.00 0.00 0.01 12.44 4.39 -1.90 -2.74 114.58 127.77 2k60 h GLU 128 Ca -0.47 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.26 2k60 h GLU 128 Cb 1.25 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.84 2k60 h GLU 128 CO 0.55 0.01 -0.48 0.28 -1.16 0.00 0.00 179.01 178.21 2k60 h VAL 129 N 0.00 0.07 0.00 3.13 2.07 -1.90 0.34 116.25 119.96 2k60 h VAL 129 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2k60 h VAL 129 Cb 0.04 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 2k60 h VAL 129 CO 0.00 0.00 0.00 0.22 0.02 0.00 0.00 177.57 177.81 2k60 h TYR 130 N -0.64 0.00 0.00 1.57 3.20 -1.46 -2.32 116.97 117.32 2k60 h TYR 130 Ca 0.03 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.78 2k60 h TYR 130 Cb 0.70 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.95 2k60 h TYR 130 CO -0.47 0.00 -0.60 -0.97 -1.64 0.00 0.00 178.16 174.48 2k60 h ASN 131 N 0.00 0.00 -2.44 -2.11 -1.24 -1.15 -3.42 115.58 105.22 2k60 h ASN 131 Ca 0.00 0.00 -0.53 0.00 0.71 0.00 0.00 56.30 56.48 2k60 h ASN 131 Cb 0.64 0.00 0.03 0.00 0.73 0.00 0.00 38.32 39.73 2k60 h ASN 131 CO 0.00 0.56 1.17 0.79 -1.29 0.00 0.00 177.43 178.66 2k60 n TRP 132 N -3.22 2.59 -1.52 0.67 8.01 0.11 -4.93 117.44 119.15 2k60 n TRP 132 Ca 0.01 -0.25 -0.11 0.00 -1.31 0.00 0.00 57.50 55.85 2k60 n TRP 132 Cb 0.76 -2.76 0.07 0.00 -2.01 0.00 0.00 31.31 27.37 2k60 n TRP 132 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.69 174.31 2k60 n THR 133 N 5.05 0.00 -0.09 -0.99 5.66 -1.26 -1.26 114.28 121.39 2k60 n THR 133 Ca 0.19 -0.41 -0.10 0.00 -3.05 0.00 0.00 64.05 60.68 2k60 n THR 133 Cb 0.39 -1.71 -0.02 0.00 -1.55 0.00 0.00 70.33 67.43 2k60 n THR 133 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 2k60 h VAL 134 N -1.16 1.13 -0.82 1.08 2.07 -1.95 -1.83 116.25 114.77 2k60 h VAL 134 Ca -0.16 -0.35 0.08 0.00 0.82 0.00 0.00 66.70 67.08 2k60 h VAL 134 Cb 0.46 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 2k60 h VAL 134 CO 0.12 0.13 0.49 -0.78 0.02 0.00 0.00 177.57 177.55 2k60 h ASP 135 N 0.35 0.73 -0.03 0.57 3.58 -1.94 0.14 116.42 119.81 2k60 h ASP 135 Ca 0.10 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.58 2k60 h ASP 135 Cb 0.07 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2k60 h ASP 135 CO -0.02 0.44 0.01 -0.33 -2.88 0.00 0.00 179.24 176.47 2k60 h GLU 136 N 0.85 0.05 -0.26 0.28 4.39 -1.82 -1.19 114.58 116.88 2k60 h GLU 136 Ca 0.38 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.98 2k60 h GLU 136 Cb 0.27 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 2k60 h GLU 136 CO -0.21 0.25 -0.19 -0.24 -1.16 0.00 0.00 179.01 177.46 2k60 h VAL 137 N -0.15 1.24 -0.03 3.13 3.04 -1.04 -0.77 116.25 121.67 2k60 h VAL 137 Ca 0.01 -1.13 -0.00 0.00 -1.01 0.00 0.00 66.70 64.57 2k60 h VAL 137 Cb 0.22 1.25 -0.00 0.00 -2.01 0.00 0.00 31.29 30.74 2k60 h VAL 137 CO -0.00 0.36 0.02 0.58 -1.01 0.00 0.00 177.57 177.52 2k60 h VAL 138 N 0.43 1.08 0.00 1.51 2.07 -0.72 0.40 116.25 121.01 2k60 h VAL 138 Ca 0.07 -0.22 -0.10 0.00 0.82 0.00 0.00 66.70 67.27 2k60 h VAL 138 Cb 0.57 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 2k60 h VAL 138 CO 0.04 0.06 -0.50 0.06 0.02 0.00 0.00 177.57 177.25 2k60 h GLN 139 N -0.04 0.00 -0.15 1.57 3.07 -0.99 -1.57 115.11 117.00 2k60 h GLN 139 Ca 0.01 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.67 2k60 h GLN 139 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.64 2k60 h GLN 139 CO -0.00 0.50 -0.22 2.35 0.09 0.00 0.00 178.83 181.54 2k60 h TRP 140 N 0.00 0.51 -0.71 0.06 2.91 -0.75 -0.86 115.95 117.12 2k60 h TRP 140 Ca -0.00 -0.17 -0.07 0.00 1.13 0.00 0.00 58.89 59.77 2k60 h TRP 140 Cb 0.88 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 29.40 2k60 h TRP 140 CO 0.00 0.84 0.16 1.37 -1.03 0.00 0.00 178.44 179.78 2k60 h LEU 141 N 0.03 1.08 -0.12 0.65 8.10 0.01 0.20 115.31 125.26 2k60 h LEU 141 Ca 0.01 -0.24 -0.10 0.00 0.11 0.00 0.00 57.88 57.66 2k60 h LEU 141 Cb 0.79 -0.29 0.00 0.00 -0.44 0.00 0.00 40.66 40.73 2k60 h LEU 141 CO 0.05 1.04 -0.32 0.16 -4.11 0.00 0.00 178.44 175.26 2k60 h ILE 142 N 1.07 1.38 0.00 0.15 3.07 -1.26 0.42 117.51 122.33 2k60 h ILE 142 Ca 0.22 -1.62 -0.03 0.00 1.55 0.00 0.00 64.86 64.97 2k60 h ILE 142 Cb 0.39 2.10 -0.00 0.00 -0.27 0.00 0.00 36.82 39.03 2k60 h ILE 142 CO 0.00 0.48 -0.16 0.00 -1.05 0.00 0.00 178.15 177.42 2k60 h THR 143 N 0.02 0.50 0.00 0.16 1.03 -0.92 -0.59 112.91 113.10 2k60 h THR 143 Ca -0.01 -0.82 -0.21 0.00 -0.01 0.00 0.00 66.41 65.36 2k60 h THR 143 Cb 0.93 1.57 -0.03 0.00 -1.07 0.00 0.00 68.15 69.55 2k60 h THR 143 CO 0.07 0.16 -1.73 -1.22 -0.01 0.00 0.00 175.52 172.79 2k60 n TYR 144 N -3.45 0.00 0.09 0.00 4.01 0.04 -4.67 117.16 113.19 2k60 n TYR 144 Ca -0.01 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.71 2k60 n TYR 144 Cb 0.34 -0.47 -0.06 0.00 -0.31 0.00 0.00 39.34 38.84 2k60 n TYR 144 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2k60 h VAL 145 N -0.37 1.25 -2.50 -0.72 2.07 -0.30 -3.48 116.25 112.21 2k60 h VAL 145 Ca -0.32 -2.80 -0.22 0.00 0.82 0.00 0.00 66.70 64.18 2k60 h VAL 145 Cb 1.32 2.61 0.03 0.00 -1.52 0.00 0.00 31.29 33.73 2k60 h VAL 145 CO -0.17 0.71 -0.32 -0.62 0.02 0.00 0.00 177.57 177.20 2k60 n GLU 146 N -3.26 -2.43 -3.48 1.57 1.02 -0.23 -4.98 120.64 108.86 2k60 n GLU 146 Ca -0.00 0.49 -0.43 0.00 -0.02 0.00 0.00 57.16 57.21 2k60 n GLU 146 Cb 0.85 -4.49 -0.08 0.00 -0.02 0.00 0.00 31.44 27.70 2k60 n GLU 146 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2k60 s LEU 147 N -3.73 5.73 -0.01 -4.62 1.98 -1.25 -4.95 118.68 111.84 2k60 s LEU 147 Ca 0.14 -1.75 0.00 0.00 -2.89 0.00 0.00 54.13 49.64 2k60 s LEU 147 Cb -0.06 -2.08 0.02 0.00 0.66 0.00 0.00 46.19 44.73 2k60 s LEU 147 CO 0.18 -0.71 0.86 -0.81 -1.89 0.00 0.00 176.35 173.98 2k60 n PRO 148 N 5.04 1.07 -0.28 0.98 -0.05 -1.26 -3.60 135.00 136.89 2k60 n PRO 148 Ca -0.10 -0.09 0.10 0.00 -0.05 0.00 0.00 63.50 63.35 2k60 n PRO 148 Cb 0.41 -1.21 0.27 0.00 -0.05 0.00 0.00 33.50 32.93 2k60 n PRO 148 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 175.50 176.39 2k60 n GLN 149 N 0.30 2.39 -0.31 0.54 -0.06 -1.26 -4.62 117.38 114.36 2k60 n GLN 149 Ca 0.02 -2.15 0.03 0.00 -2.00 0.00 0.00 57.00 52.89 2k60 n GLN 149 Cb 0.45 -1.48 0.17 0.00 -4.06 0.00 0.00 30.24 25.32 2k60 n GLN 149 CO 0.00 0.00 0.00 0.10 -0.20 0.00 0.00 177.06 176.96 2k60 h TYR 150 N 3.63 0.95 -0.08 3.69 -0.00 -1.96 -0.54 116.97 122.66 2k60 h TYR 150 Ca 0.00 0.03 -0.01 0.00 -0.00 0.00 0.00 58.73 58.75 2k60 h TYR 150 Cb 0.82 -0.30 -0.00 0.00 -0.00 0.00 0.00 36.73 37.25 2k60 h TYR 150 CO 0.37 0.42 0.02 1.49 -0.00 0.00 0.00 178.16 180.45 2k60 h GLU 151 N 0.89 0.14 -0.84 0.10 4.81 -1.93 0.16 114.58 117.91 2k60 h GLU 151 Ca 0.41 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.57 2k60 h GLU 151 Cb 0.32 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 2k60 h GLU 151 CO -0.22 0.35 0.40 0.93 -0.73 0.00 0.00 179.01 179.73 2k60 h GLU 152 N -0.09 1.21 -0.04 1.92 4.39 -1.79 -1.27 114.58 118.90 2k60 h GLU 152 Ca 0.03 -0.18 -0.24 0.00 0.34 0.00 0.00 59.36 59.30 2k60 h GLU 152 Cb 0.27 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2k60 h GLU 152 CO 0.00 0.93 -0.94 0.00 -1.16 0.00 0.00 179.01 177.85 2k60 h THR 153 N 1.20 1.31 -0.34 1.13 1.03 -0.87 0.04 112.91 116.41 2k60 h THR 153 Ca 0.29 -2.21 -0.09 0.00 -0.01 0.00 0.00 66.41 64.39 2k60 h THR 153 Cb 0.13 2.27 -0.02 0.00 -1.07 0.00 0.00 68.15 69.46 2k60 h THR 153 CO -0.04 0.68 -0.16 2.19 -0.01 0.00 0.00 175.52 178.19 2k60 h PHE 154 N 0.39 0.66 0.00 0.00 -5.15 -0.47 -0.84 116.94 111.54 2k60 h PHE 154 Ca -0.09 -0.12 -0.07 0.00 -0.20 0.00 0.00 57.97 57.48 2k60 h PHE 154 Cb 1.57 -0.17 -0.01 0.00 0.22 0.00 0.00 35.95 37.56 2k60 h PHE 154 CO 0.09 0.73 -0.35 0.07 -2.00 0.00 0.00 178.31 176.85 2k60 h ARG 155 N 0.55 0.00 0.05 6.09 0.11 -1.14 0.20 114.38 120.24 2k60 h ARG 155 Ca 0.09 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.17 2k60 h ARG 155 Cb 0.59 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.67 2k60 h ARG 155 CO 0.04 0.35 -0.03 0.87 0.10 0.00 0.00 179.97 181.31 2k60 h LYS 156 N 0.00 -0.07 0.00 0.08 1.79 -0.03 -3.41 116.57 114.93 2k60 h LYS 156 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k60 h LYS 156 Cb 0.98 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 2k60 h LYS 156 CO 0.05 0.50 -0.48 1.47 -1.08 0.00 0.00 179.45 179.90 2k60 n LEU 157 N -4.83 0.00 -2.58 2.94 -0.00 -0.41 -5.09 117.00 107.03 2k60 n LEU 157 Ca -0.09 -0.21 -0.02 0.00 -0.00 0.00 0.00 56.01 55.69 2k60 n LEU 157 Cb 0.30 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.70 2k60 n LEU 157 CO 0.31 0.00 -0.53 0.00 -0.00 0.00 0.00 177.39 177.18 2k60 n GLN 158 N -1.15 -3.65 -3.57 1.47 6.02 0.70 -5.03 117.38 112.17 2k60 n GLN 158 Ca 0.00 2.87 -0.23 0.00 -0.01 0.00 0.00 57.00 59.63 2k60 n GLN 158 Cb 0.00 -4.95 -0.02 0.00 1.02 0.00 0.00 30.24 26.29 2k60 n GLN 158 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 2k60 s LEU 159 N -1.16 4.12 0.00 1.08 2.34 -1.26 -4.88 118.68 118.92 2k60 s LEU 159 Ca -0.11 0.35 0.00 0.00 0.06 0.00 0.00 54.13 54.43 2k60 s LEU 159 Cb 0.01 -3.18 0.00 0.00 -0.56 0.00 0.00 46.19 42.46 2k60 s LEU 159 CO 0.73 -0.21 0.00 -1.54 -1.06 0.00 0.00 176.35 174.27 2k60 n SER 160 N -1.56 0.00 0.31 1.48 3.41 -1.26 -3.62 113.62 112.38 2k60 n SER 160 Ca -0.06 -0.04 0.19 0.00 -0.26 0.00 0.00 58.87 58.70 2k60 n SER 160 Cb 0.56 0.00 1.05 0.00 -0.26 0.00 0.00 64.21 65.56 2k60 n SER 160 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2k60 h GLY 161 N 0.00 0.00 1.29 5.00 0.00 -1.23 0.23 103.07 108.36 2k60 h GLY 161 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 2k60 h GLY 161 CO 0.00 0.00 -1.49 0.84 0.00 0.00 0.00 176.54 175.89 2k60 h HIS 162 N 0.00 0.27 -0.06 5.60 -0.00 -1.84 -3.31 115.15 115.81 2k60 h HIS 162 Ca -0.00 -0.20 -0.15 0.00 -0.00 0.00 0.00 60.37 60.02 2k60 h HIS 162 Cb 0.07 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.45 2k60 h HIS 162 CO 0.00 1.25 -0.63 0.00 -0.00 0.00 0.00 177.93 178.55 2k60 h ALA 163 N 0.68 0.82 -0.56 5.26 0.00 -1.52 -2.20 119.26 121.75 2k60 h ALA 163 Ca -0.22 -0.56 0.08 0.00 0.00 0.00 0.00 54.91 54.22 2k60 h ALA 163 Cb 1.97 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 19.57 2k60 h ALA 163 CO 0.13 0.75 -0.45 0.52 0.00 0.00 0.00 179.25 180.21 2k60 h MET 164 N 0.16 -0.24 -0.31 0.00 2.86 -0.71 0.73 114.93 117.44 2k60 h MET 164 Ca -0.01 0.02 -0.18 0.00 -2.06 0.00 0.00 59.70 57.47 2k60 h MET 164 Cb 1.14 0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 2k60 h MET 164 CO 0.10 -0.16 -0.51 -1.00 1.06 0.00 0.00 176.91 176.39 2k60 h PRO 165 N -0.24 0.88 0.00 -0.22 0.13 -1.73 -2.12 132.00 128.70 2k60 h PRO 165 Ca 0.17 -0.54 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 2k60 h PRO 165 Cb 0.56 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.75 2k60 h PRO 165 CO -0.68 1.18 -0.06 0.07 -0.23 0.00 0.00 178.00 178.29 2k60 h ARG 166 N 0.69 0.00 0.00 0.86 -0.00 -0.59 -2.18 114.38 113.16 2k60 h ARG 166 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.00 2k60 h ARG 166 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.09 2k60 h ARG 166 CO 0.12 0.06 -1.21 1.47 -0.00 0.00 0.00 179.97 180.41 2k60 n LEU 167 N -3.56 0.58 0.14 0.08 -0.00 0.25 -4.22 117.00 110.26 2k60 n LEU 167 Ca -0.02 -0.11 0.12 0.00 -0.00 0.00 0.00 56.01 56.00 2k60 n LEU 167 Cb 0.17 -0.06 0.50 0.00 -0.00 0.00 0.00 43.42 44.04 2k60 n LEU 167 CO 0.27 0.07 0.86 0.00 -0.00 0.00 0.00 177.39 178.60 2k60 n ALA 168 N -1.85 1.63 -3.92 1.47 0.00 -0.80 -4.47 120.51 112.57 2k60 n ALA 168 Ca 0.01 0.10 -0.34 0.00 0.00 0.00 0.00 53.44 53.21 2k60 n ALA 168 Cb 0.44 -1.39 -0.15 0.00 0.00 0.00 0.00 19.45 18.35 2k60 n ALA 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k60 s VAL 169 N -3.34 2.49 0.20 0.00 0.11 -1.24 -4.11 120.40 114.51 2k60 s VAL 169 Ca 0.04 -0.81 0.00 0.00 -2.93 0.00 0.00 61.98 58.27 2k60 s VAL 169 Cb 0.09 -2.09 0.00 0.00 -1.53 0.00 0.00 36.38 32.85 2k60 s VAL 169 CO 0.39 0.48 0.00 0.35 -3.33 0.00 0.00 175.10 172.99 2k60 n THR 170 N 4.67-12.42 -0.30 5.04 -2.24 -1.26 -4.62 114.28 103.15 2k60 n THR 170 Ca -0.20 3.16 -0.02 0.00 -2.27 0.00 0.00 64.05 64.72 2k60 n THR 170 Cb 0.50 -5.20 0.14 0.00 -2.10 0.00 0.00 70.33 63.67 2k60 n THR 170 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 2k60 h ASN 171 N 3.94 1.04 -0.73 3.42 -1.24 -1.86 -2.35 115.58 117.80 2k60 h ASN 171 Ca 0.00 -0.07 0.13 0.00 0.71 0.00 0.00 56.30 57.07 2k60 h ASN 171 Cb 0.00 -0.26 -0.05 0.00 0.73 0.00 0.00 38.32 38.74 2k60 h ASN 171 CO 0.00 0.81 0.49 0.74 -1.29 0.00 0.00 177.43 178.18 2k60 h THR 172 N 1.19 0.84 -0.19 -3.57 2.02 -1.90 0.32 112.91 111.63 2k60 h THR 172 Ca 0.31 -0.17 -0.21 0.00 0.77 0.00 0.00 66.41 67.11 2k60 h THR 172 Cb -0.02 0.32 0.01 0.00 -1.74 0.00 0.00 68.15 66.72 2k60 h THR 172 CO -0.05 0.09 -0.71 0.74 0.37 0.00 0.00 175.52 175.95 2k60 h THR 173 N 0.48 1.28 0.16 3.16 2.02 -1.68 -3.34 112.91 114.99 2k60 h THR 173 Ca 0.35 -1.90 -0.21 0.00 0.77 0.00 0.00 66.41 65.42 2k60 h THR 173 Cb 0.71 1.90 0.02 0.00 -1.74 0.00 0.00 68.15 69.04 2k60 h THR 173 CO -0.12 0.61 -0.94 -0.03 0.37 0.00 0.00 175.52 175.41 2k60 h MET 174 N 0.57 0.34 -6.68 6.66 1.85 -1.14 -3.46 114.93 113.06 2k60 h MET 174 Ca -0.04 -0.58 -0.53 0.00 -0.61 0.00 0.00 59.70 57.95 2k60 h MET 174 Cb 1.34 0.22 0.04 0.00 0.43 0.00 0.00 31.60 33.63 2k60 h MET 174 CO 0.15 1.28 0.75 -0.08 -0.40 0.00 0.00 176.91 178.61 2k60 s THR 175 N -2.46 2.85 0.05 -0.77 -1.32 0.99 -4.91 115.64 110.07 2k60 s THR 175 Ca -0.13 0.68 -0.05 0.00 -1.21 0.00 0.00 61.69 60.97 2k60 s THR 175 Cb 0.01 -3.43 -0.29 0.00 -1.51 0.00 0.00 72.50 67.28 2k60 s THR 175 CO 0.85 0.09 1.03 1.23 -2.21 0.00 0.00 174.62 175.61 2k60 h GLY 176 N 5.67 0.34 0.00 6.08 0.00 -1.89 -3.47 103.07 109.80 2k60 h GLY 176 Ca -0.45 -0.87 0.00 0.00 0.00 0.00 0.00 47.33 46.01 2k60 h GLY 176 CO 0.81 0.76 0.00 2.41 0.00 0.00 0.00 176.54 180.53 2k60 n THR 177 N -3.53 0.00 -3.54 4.70 -1.04 -1.26 -5.04 114.28 104.57 2k60 n THR 177 Ca -0.12 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.60 2k60 n THR 177 Cb 1.04 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 69.43 2k60 n THR 177 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2k60 s VAL 178 N 0.00 0.56 0.24 12.58 1.01 -1.26 -4.94 120.40 128.59 2k60 s VAL 178 Ca 0.00 -2.06 0.04 0.00 0.00 0.00 0.00 61.98 59.97 2k60 s VAL 178 Cb 0.00 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 2k60 s VAL 178 CO 0.00 -0.98 1.56 0.25 0.00 0.00 0.00 175.10 175.93 2k60 h LEU 179 N 6.82 0.27 -7.17 3.92 5.85 -1.95 -3.44 115.31 119.61 2k60 h LEU 179 Ca 0.05 -0.16 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 2k60 h LEU 179 Cb 0.95 -0.08 -0.23 0.00 0.37 0.00 0.00 40.66 41.67 2k60 h LEU 179 CO 0.34 0.81 -0.09 -0.75 -0.34 0.00 0.00 178.44 178.41 2k60 s LYS 180 N -3.76 0.61 0.32 1.25 2.47 -1.26 -4.88 119.74 114.50 2k60 s LYS 180 Ca -0.04 0.80 0.01 0.00 -1.56 0.00 0.00 55.97 55.19 2k60 s LYS 180 Cb 0.12 0.26 0.56 0.00 -1.46 0.00 0.00 37.83 37.31 2k60 s LYS 180 CO 0.80 -0.09 1.96 0.52 0.16 0.00 0.00 175.35 178.69 2k60 h MET 181 N 5.65 0.94 -5.21 4.03 2.86 -2.00 -3.39 114.93 117.82 2k60 h MET 181 Ca -0.29 -0.06 -0.67 0.00 -2.06 0.00 0.00 59.70 56.63 2k60 h MET 181 Cb 1.18 -0.21 -0.16 0.00 0.06 0.00 0.00 31.60 32.46 2k60 h MET 181 CO 0.18 0.62 0.13 0.95 1.06 0.00 0.00 176.91 179.85 2k60 s THR 182 N -5.84 4.81 0.13 2.22 -4.23 -1.26 -4.93 115.64 106.54 2k60 s THR 182 Ca -0.11 -0.21 -0.21 0.00 -1.18 0.00 0.00 61.69 59.98 2k60 s THR 182 Cb 0.19 -4.29 -0.03 0.00 1.34 0.00 0.00 72.50 69.71 2k60 s THR 182 CO 0.79 -0.77 1.68 -0.78 -0.54 0.00 0.00 174.62 175.00 2k60 h ASP 183 N 8.99 -0.37 -0.17 3.99 3.58 -2.00 0.03 116.42 130.48 2k60 h ASP 183 Ca -0.27 0.08 -0.04 0.00 0.42 0.00 0.00 57.03 57.22 2k60 h ASP 183 Cb 1.09 0.19 -0.01 0.00 1.72 0.00 0.00 39.33 42.32 2k60 h ASP 183 CO 0.95 -0.15 -0.05 0.08 -2.88 0.00 0.00 179.24 177.19 2k60 h ARG 184 N -0.13 0.34 -0.46 0.28 -0.00 -1.96 -0.97 114.38 111.49 2k60 h ARG 184 Ca 0.09 -0.14 -0.04 0.00 -0.00 0.00 0.00 59.98 59.90 2k60 h ARG 184 Cb 0.26 -0.02 -0.02 0.00 -0.00 0.00 0.00 29.97 30.19 2k60 h ARG 184 CO -0.22 0.62 0.11 0.77 -0.00 0.00 0.00 179.97 181.25 2k60 h SER 185 N 0.04 0.63 0.66 0.08 0.02 -1.95 0.38 113.55 113.41 2k60 h SER 185 Ca 0.04 -0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2k60 h SER 185 Cb 0.50 -0.16 0.01 0.00 0.14 0.00 0.00 62.40 62.89 2k60 h SER 185 CO 0.02 0.62 -0.32 -0.74 -1.14 0.00 0.00 176.83 175.28 2k60 h HIS 186 N 0.66 -0.82 -0.06 3.45 -0.00 -0.82 -1.34 115.15 116.22 2k60 h HIS 186 Ca 0.15 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.47 2k60 h HIS 186 Cb 0.24 0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.92 2k60 h HIS 186 CO 0.01 -0.48 -0.13 0.07 -0.00 0.00 0.00 177.93 177.40 2k60 h ARG 187 N -1.15 0.10 -0.20 5.26 0.11 -0.83 0.14 114.38 117.81 2k60 h ARG 187 Ca -0.09 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 59.94 2k60 h ARG 187 Cb 0.71 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.77 2k60 h ARG 187 CO 0.15 0.23 0.01 1.96 0.10 0.00 0.00 179.97 182.43 2k60 h GLN 188 N 0.09 0.34 -0.18 0.08 1.08 -0.21 0.31 115.11 116.62 2k60 h GLN 188 Ca 0.02 -0.10 -0.04 0.00 -1.45 0.00 0.00 58.65 57.08 2k60 h GLN 188 Cb 0.29 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 2k60 h GLN 188 CO 0.02 0.52 -0.03 0.87 -0.95 0.00 0.00 178.83 179.26 2k60 h LYS 189 N 0.11 0.35 -0.51 1.46 1.79 -0.55 -0.39 116.57 118.82 2k60 h LYS 189 Ca 0.06 -0.12 -0.01 0.00 -2.18 0.00 0.00 60.65 58.39 2k60 h LYS 189 Cb 0.36 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 2k60 h LYS 189 CO 0.01 0.59 0.28 -0.07 -1.08 0.00 0.00 179.45 179.17 2k60 h LEU 190 N 0.07 0.63 -0.48 2.94 -0.00 -0.73 -1.52 115.31 116.22 2k60 h LEU 190 Ca 0.05 -0.09 -0.11 0.00 -0.00 0.00 0.00 57.88 57.73 2k60 h LEU 190 Cb 0.45 -0.16 -0.02 0.00 -0.00 0.00 0.00 40.66 40.94 2k60 h LEU 190 CO 0.02 0.55 -0.11 0.06 -0.00 0.00 0.00 178.44 178.95 2k60 h GLN 191 N 0.67 0.93 0.03 1.13 3.07 -0.35 0.32 115.11 120.92 2k60 h GLN 191 Ca 0.18 -0.35 0.02 0.00 0.09 0.00 0.00 58.65 58.59 2k60 h GLN 191 Cb 0.05 -0.05 -0.04 0.00 0.08 0.00 0.00 27.48 27.52 2k60 h GLN 191 CO -0.03 1.01 -0.21 1.25 0.09 0.00 0.00 178.83 180.95 2k60 h LEU 192 N 0.78 -0.60 0.02 0.06 7.12 -0.74 0.30 115.31 122.26 2k60 h LEU 192 Ca 0.12 0.08 -0.11 0.00 0.13 0.00 0.00 57.88 58.10 2k60 h LEU 192 Cb 0.67 0.24 0.01 0.00 -0.53 0.00 0.00 40.66 41.05 2k60 h LEU 192 CO 0.05 -0.28 -0.46 0.11 -0.13 0.00 0.00 178.44 177.73 2k60 h LYS 193 N -0.35 0.27 -0.34 1.25 6.56 -1.18 -1.67 116.57 121.10 2k60 h LYS 193 Ca 0.05 -0.32 -0.13 0.00 -1.06 0.00 0.00 60.65 59.19 2k60 h LYS 193 Cb 0.41 0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 32.16 2k60 h LYS 193 CO -0.17 1.05 -0.29 0.00 -2.06 0.00 0.00 179.45 177.98 2k60 h ALA 194 N 0.24 0.49 -0.31 3.86 0.00 -0.31 0.46 119.26 123.69 2k60 h ALA 194 Ca -0.06 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 2k60 h ALA 194 Cb 1.23 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2k60 h ALA 194 CO 0.09 0.52 -0.19 1.25 0.00 0.00 0.00 179.25 180.91 2k60 h LEU 195 N 0.58 0.71 -1.17 0.00 5.85 -0.50 0.21 115.31 120.98 2k60 h LEU 195 Ca 0.06 -0.43 0.11 0.00 0.84 0.00 0.00 57.88 58.46 2k60 h LEU 195 Cb 0.86 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.62 2k60 h LEU 195 CO 0.07 0.98 0.59 -0.78 -0.34 0.00 0.00 178.44 178.97 2k60 h ASP 196 N 0.44 0.81 -0.00 1.25 3.58 -1.17 -0.66 116.42 120.67 2k60 h ASP 196 Ca 0.06 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.54 2k60 h ASP 196 Cb 0.73 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 41.65 2k60 h ASP 196 CO 0.05 0.46 -0.01 0.74 -2.88 0.00 0.00 179.24 177.61 2k60 h THR 197 N 0.89 1.43 0.00 2.25 2.02 -0.29 0.46 112.91 119.67 2k60 h THR 197 Ca 0.44 -1.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.31 2k60 h THR 197 Cb 0.47 2.29 -0.00 0.00 -1.74 0.00 0.00 68.15 69.16 2k60 h THR 197 CO -0.20 0.33 -0.16 -0.37 0.37 0.00 0.00 175.52 175.49 2k60 h VAL 198 N -0.53 0.54 0.00 3.16 -1.51 -0.30 -1.29 116.25 116.32 2k60 h VAL 198 Ca 0.00 -0.79 -0.10 0.00 -1.23 0.00 0.00 66.70 64.59 2k60 h VAL 198 Cb 0.55 1.53 -0.01 0.00 -2.13 0.00 0.00 31.29 31.22 2k60 h VAL 198 CO 0.00 0.16 -0.80 -0.07 -1.23 0.00 0.00 177.57 175.63 2k60 h LEU 199 N 0.00 0.00 0.00 4.19 3.38 -1.11 -3.42 115.31 118.35 2k60 h LEU 199 Ca -0.00 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.57 2k60 h LEU 199 Cb 0.51 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 2k60 h LEU 199 CO 0.02 1.06 -1.47 0.33 0.09 0.00 0.00 178.44 178.47 2k60 n PHE 200 N -4.55 0.00 -0.81 1.13 -0.00 0.15 -4.93 117.46 108.45 2k60 n PHE 200 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.28 2k60 n PHE 200 Cb 0.43 -0.59 0.00 0.00 -0.00 0.00 0.00 39.48 39.32 2k60 n PHE 200 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17