#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s4v s VAL 2 N 0.00 2.41 0.73 12.58 -7.23 -1.26 -4.96 120.40 122.67 1s4v s VAL 2 Ca 0.00 0.38 -0.15 0.00 -1.81 0.00 0.00 61.98 60.40 1s4v s VAL 2 Cb 0.00 -3.23 0.04 0.00 0.56 0.00 0.00 36.38 33.75 1s4v s VAL 2 CO 0.00 0.07 1.21 -2.16 -0.31 0.00 0.00 175.10 173.91 1s4v s PRO 3 N -2.19 2.12 0.76 4.82 0.04 -1.26 -4.94 135.00 134.34 1s4v s PRO 3 Ca 0.56 1.76 -0.14 0.00 0.04 0.00 0.00 61.00 63.22 1s4v s PRO 3 Cb -0.41 -1.83 0.05 0.00 0.04 0.00 0.00 34.50 32.35 1s4v s PRO 3 CO 0.54 -1.85 1.17 0.00 0.04 0.00 0.00 177.00 176.90 1s4v s ALA 4 N -1.99 2.06 0.10 8.56 0.00 -1.26 -4.95 121.76 124.29 1s4v s ALA 4 Ca 0.74 0.73 -0.25 0.00 0.00 0.00 0.00 51.96 53.19 1s4v s ALA 4 Cb -0.29 -3.43 0.08 0.00 0.00 0.00 0.00 23.12 19.48 1s4v s ALA 4 CO 0.46 -1.94 0.67 -1.54 0.00 0.00 0.00 175.76 173.40 1s4v s SER 5 N -2.33 -0.53 -0.10 0.00 1.04 -1.26 -4.67 113.70 105.85 1s4v s SER 5 Ca 0.71 0.06 -0.09 0.00 0.48 0.00 0.00 55.95 57.11 1s4v s SER 5 Cb -0.26 0.54 0.03 0.00 0.10 0.00 0.00 66.02 66.44 1s4v s SER 5 CO 0.48 -0.86 0.27 0.54 0.98 0.00 0.00 173.24 174.65 1s4v s VAL 6 N -3.37 -0.01 -0.31 5.02 0.11 -0.51 -4.98 120.40 116.36 1s4v s VAL 6 Ca 0.01 0.02 -0.02 0.00 -2.93 0.00 0.00 61.98 59.06 1s4v s VAL 6 Cb -0.01 -0.38 0.10 0.00 -1.53 0.00 0.00 36.38 34.56 1s4v s VAL 6 CO -0.10 0.01 0.13 -0.62 -3.33 0.00 0.00 175.10 171.18 1s4v s ASP 7 N 0.29 3.71 0.57 3.54 -1.08 -1.26 -0.95 116.67 121.49 1s4v s ASP 7 Ca -0.01 -1.54 0.33 0.00 -0.52 0.00 0.00 52.55 50.81 1s4v s ASP 7 Cb -0.03 -0.59 1.74 0.00 -1.46 0.00 0.00 42.92 42.58 1s4v s ASP 7 CO -0.01 -0.42 2.16 -0.50 0.52 0.00 0.00 175.17 176.92 1s4v h TRP 8 N 8.13 0.00 -0.16 -5.34 4.06 -1.32 -1.46 115.95 119.86 1s4v h TRP 8 Ca -0.15 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.75 1s4v h TRP 8 Cb 1.01 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.16 1s4v h TRP 8 CO 0.33 0.05 -0.08 0.00 -3.56 0.00 0.00 178.44 175.19 1s4v h ARG 9 N 0.00 0.34 -0.39 0.49 3.08 -1.92 0.27 114.38 116.25 1s4v h ARG 9 Ca -0.00 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 59.82 1s4v h ARG 9 Cb 0.24 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1s4v h ARG 9 CO 0.01 0.66 -0.10 -0.22 -1.07 0.00 0.00 179.97 179.25 1s4v h LYS 10 N 0.01 0.69 0.00 0.04 3.64 -1.81 -1.95 116.57 117.18 1s4v h LYS 10 Ca 0.04 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 1s4v h LYS 10 Cb 0.56 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1s4v h LYS 10 CO 0.02 0.77 0.00 1.63 -2.27 0.00 0.00 179.45 179.61 1s4v n LYS 11 N -4.18 0.18 -0.92 1.90 5.02 -0.60 -4.87 118.16 114.68 1s4v n LYS 11 Ca 0.01 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1s4v n LYS 11 Cb 0.34 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 1s4v n LYS 11 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s4v n GLY 12 N 0.09 0.48 1.09 0.72 0.00 -0.73 -4.96 105.19 101.88 1s4v n GLY 12 Ca 0.07 -0.93 0.08 0.00 0.00 0.00 0.00 46.02 45.24 1s4v n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s4v n ALA 13 N 0.45 2.64 -3.39 4.61 0.00 0.03 -4.70 120.51 120.14 1s4v n ALA 13 Ca 0.00 -1.51 -0.25 0.00 0.00 0.00 0.00 53.44 51.68 1s4v n ALA 13 Cb 0.03 -0.74 -0.17 0.00 0.00 0.00 0.00 19.45 18.58 1s4v n ALA 13 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1s4v s VAL 14 N -1.58 1.19 0.91 0.00 1.01 -1.24 -3.69 120.40 117.00 1s4v s VAL 14 Ca 0.39 -0.52 -0.11 0.00 0.00 0.00 0.00 61.98 61.74 1s4v s VAL 14 Cb 0.25 -1.08 0.20 0.00 0.00 0.00 0.00 36.38 35.75 1s4v s VAL 14 CO 0.20 0.37 1.24 0.35 0.00 0.00 0.00 175.10 177.26 1s4v n THR 15 N 3.73 0.00 -0.88 3.92 -2.24 -1.26 -4.92 114.28 112.62 1s4v n THR 15 Ca -0.22 -1.22 -0.32 0.00 -2.27 0.00 0.00 64.05 60.02 1s4v n THR 15 Cb 0.52 -1.28 0.15 0.00 -2.10 0.00 0.00 70.33 67.62 1s4v n THR 15 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1s4v n SER 16 N -3.54 0.58 -4.73 3.42 3.41 -1.26 -4.96 113.62 106.54 1s4v n SER 16 Ca 0.17 0.50 -0.41 0.00 -0.26 0.00 0.00 58.87 58.87 1s4v n SER 16 Cb 0.60 -1.48 -0.04 0.00 -0.26 0.00 0.00 64.21 63.02 1s4v n SER 16 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1s4v s VAL 17 N -2.38 4.10 0.45 -3.33 1.01 -1.26 -5.04 120.40 113.95 1s4v s VAL 17 Ca 0.70 1.74 0.07 0.00 0.00 0.00 0.00 61.98 64.49 1s4v s VAL 17 Cb -0.26 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 31.99 1s4v s VAL 17 CO 0.55 0.27 0.33 -0.54 0.00 0.00 0.00 175.10 175.71 1s4v s LYS 18 N -0.05 2.38 -0.15 2.72 -0.14 -1.26 -4.64 119.74 118.60 1s4v s LYS 18 Ca 0.50 -1.74 -0.01 0.00 -1.36 0.00 0.00 55.97 53.35 1s4v s LYS 18 Cb -0.27 -2.20 0.04 0.00 -1.68 0.00 0.00 37.83 33.72 1s4v s LYS 18 CO 0.33 -0.28 -0.02 0.34 -0.76 0.00 0.00 175.35 174.96 1s4v s ASP 19 N -4.11 2.50 0.07 2.83 -1.08 -1.26 -0.72 116.67 114.90 1s4v s ASP 19 Ca 0.43 -0.54 0.16 0.00 -0.52 0.00 0.00 52.55 52.07 1s4v s ASP 19 Cb -0.01 -0.70 0.67 0.00 -1.46 0.00 0.00 42.92 41.42 1s4v s ASP 19 CO 0.25 -0.22 1.49 0.00 0.52 0.00 0.00 175.17 177.21 1s4v n GLN 20 N 5.00 0.05 0.00 4.34 10.64 -0.09 -4.89 117.38 132.42 1s4v n GLN 20 Ca -0.10 0.33 0.00 0.00 -1.83 0.00 0.00 57.00 55.40 1s4v n GLN 20 Cb 0.48 -1.60 0.00 0.00 -0.86 0.00 0.00 30.24 28.26 1s4v n GLN 20 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1s4v n GLY 21 N -0.18 0.69 2.47 2.61 0.00 -1.26 -3.76 105.19 105.76 1s4v n GLY 21 Ca 0.03 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 44.88 1s4v n GLY 21 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s4v n GLN 22 N 0.00 4.43 -3.69 1.61 1.13 -1.26 -4.80 117.38 114.80 1s4v n GLN 22 Ca 0.00 -3.28 -0.11 0.00 -1.94 0.00 0.00 57.00 51.67 1s4v n GLN 22 Cb 0.00 -2.67 -0.12 0.00 0.11 0.00 0.00 30.24 27.56 1s4v n GLN 22 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1s4v n GLY 24 N 4.70 3.84 1.26 0.00 0.00 0.05 -4.51 105.19 110.53 1s4v n GLY 24 Ca -0.17 -1.33 0.07 0.00 0.00 0.00 0.00 46.02 44.58 1s4v n GLY 24 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1s4v n SER 25 N 4.63 4.48 -0.31 1.61 3.41 -1.26 -2.06 113.62 124.12 1s4v n SER 25 Ca 0.62 -3.03 0.19 0.00 -0.26 0.00 0.00 58.87 56.39 1s4v n SER 25 Cb 0.25 -0.60 0.45 0.00 -0.26 0.00 0.00 64.21 64.06 1s4v n SER 25 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1s4v h TRP 27 N 0.51 1.14 -0.32 0.00 5.08 -1.83 -0.01 115.95 120.51 1s4v h TRP 27 Ca 0.55 0.03 -0.11 0.00 1.08 0.00 0.00 58.89 60.44 1s4v h TRP 27 Cb 1.22 -0.38 -0.01 0.00 -3.00 0.00 0.00 29.16 26.99 1s4v h TRP 27 CO -0.00 0.69 -0.23 0.00 -1.28 0.00 0.00 178.44 177.62 1s4v h ALA 28 N 1.44 0.46 -0.57 0.11 0.00 -1.18 -2.21 119.26 117.32 1s4v h ALA 28 Ca 0.35 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1s4v h ALA 28 Cb -0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1s4v h ALA 28 CO -0.09 0.43 0.21 0.74 0.00 0.00 0.00 179.25 180.54 1s4v h PHE 29 N 0.49 0.88 -0.39 0.00 -1.00 -1.06 -1.15 116.94 114.71 1s4v h PHE 29 Ca 0.06 -0.07 0.02 0.00 2.81 0.00 0.00 57.97 60.79 1s4v h PHE 29 Cb 0.78 -0.26 -0.03 0.00 3.61 0.00 0.00 35.95 40.05 1s4v h PHE 29 CO 0.06 0.72 0.23 1.03 -1.61 0.00 0.00 178.31 178.74 1s4v h SER 30 N 0.79 0.36 -0.09 2.17 0.87 -0.97 -1.64 113.55 115.04 1s4v h SER 30 Ca 0.19 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1s4v h SER 30 Cb 0.23 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 1s4v h SER 30 CO -0.01 0.26 0.04 0.74 -0.53 0.00 0.00 176.83 177.33 1s4v h THR 31 N 0.46 0.99 -0.45 2.23 2.02 -1.15 -2.85 112.91 114.17 1s4v h THR 31 Ca 0.16 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1s4v h THR 31 Cb 0.01 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1s4v h THR 31 CO -0.08 0.02 0.26 0.40 0.37 0.00 0.00 175.52 176.49 1s4v h ILE 32 N 0.10 1.14 -0.61 3.11 1.08 -0.90 -1.85 117.51 119.58 1s4v h ILE 32 Ca 0.04 -0.32 -0.01 0.00 -0.39 0.00 0.00 64.86 64.18 1s4v h ILE 32 Cb 0.01 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 34.24 1s4v h ILE 32 CO -0.03 0.14 0.35 0.58 -0.69 0.00 0.00 178.15 178.51 1s4v h VAL 33 N 0.62 1.18 -0.54 1.67 2.07 -1.07 0.14 116.25 120.32 1s4v h VAL 33 Ca 0.16 -0.43 -0.11 0.00 0.82 0.00 0.00 66.70 67.14 1s4v h VAL 33 Cb -0.00 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 1s4v h VAL 33 CO -0.03 0.19 -0.10 0.00 0.02 0.00 0.00 177.57 177.65 1s4v h ALA 34 N 1.18 0.79 -0.19 1.67 0.00 -1.37 -1.22 119.26 120.12 1s4v h ALA 34 Ca 0.22 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 1s4v h ALA 34 Cb 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1s4v h ALA 34 CO -0.04 0.67 -0.26 0.28 0.00 0.00 0.00 179.25 179.90 1s4v h VAL 35 N 0.91 1.34 -0.89 0.00 2.07 -1.00 -1.62 116.25 117.06 1s4v h VAL 35 Ca 0.14 -1.46 0.05 0.00 0.82 0.00 0.00 66.70 66.25 1s4v h VAL 35 Cb 0.66 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 32.22 1s4v h VAL 35 CO 0.05 0.45 0.58 -0.33 0.02 0.00 0.00 177.57 178.33 1s4v h GLU 36 N 0.17 1.04 0.39 1.57 5.08 -0.69 -1.20 114.58 120.93 1s4v h GLU 36 Ca 0.02 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1s4v h GLU 36 Cb 0.83 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1s4v h GLU 36 CO 0.06 0.69 -0.19 0.78 -1.00 0.00 0.00 179.01 179.35 1s4v h GLY 37 N 1.07 -0.54 2.00 -3.84 0.00 -1.09 -2.71 103.07 97.95 1s4v h GLY 37 Ca 0.36 0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.87 1s4v h GLY 37 CO -0.12 -0.20 -0.14 1.19 0.00 0.00 0.00 176.54 177.27 1s4v h ILE 38 N -0.81 1.08 -0.31 2.60 2.10 -1.14 -2.02 117.51 119.01 1s4v h ILE 38 Ca -0.05 -0.50 -0.03 0.00 1.08 0.00 0.00 64.86 65.36 1s4v h ILE 38 Cb 0.53 1.27 -0.01 0.00 -1.09 0.00 0.00 36.82 37.52 1s4v h ILE 38 CO 0.09 0.14 0.07 -1.13 -1.08 0.00 0.00 178.15 176.24 1s4v h ASN 39 N 0.00 0.48 -0.23 2.19 -1.24 -1.19 -1.27 115.58 114.31 1s4v h ASN 39 Ca -0.00 -0.24 -0.09 0.00 0.71 0.00 0.00 56.30 56.68 1s4v h ASN 39 Cb 0.26 -0.13 -0.02 0.00 0.73 0.00 0.00 38.32 39.17 1s4v h ASN 39 CO 0.02 0.59 -0.14 -0.61 -1.29 0.00 0.00 177.43 176.00 1s4v h GLN 40 N 0.34 0.65 -0.69 6.67 -0.00 -1.12 0.11 115.11 121.07 1s4v h GLN 40 Ca 0.10 -0.21 -0.07 0.00 -0.00 0.00 0.00 58.65 58.46 1s4v h GLN 40 Cb 0.30 -0.05 -0.03 0.00 0.00 0.00 0.00 27.48 27.70 1s4v h GLN 40 CO 0.00 0.77 0.15 0.82 0.00 0.00 0.00 178.83 180.57 1s4v h ILE 41 N 0.59 1.26 0.00 2.39 2.04 -1.18 0.24 117.51 122.85 1s4v h ILE 41 Ca 0.10 -1.00 -0.22 0.00 1.00 0.00 0.00 64.86 64.74 1s4v h ILE 41 Cb 0.58 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1s4v h ILE 41 CO 0.04 0.38 -1.31 0.11 0.00 0.00 0.00 178.15 177.37 1s4v h LYS 42 N 1.06 0.00 -0.00 2.37 1.79 -0.99 -3.39 116.57 117.41 1s4v h LYS 42 Ca 0.22 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.69 1s4v h LYS 42 Cb 0.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 1s4v h LYS 42 CO 0.01 0.61 -0.35 0.25 -1.08 0.00 0.00 179.45 178.89 1s4v n THR 43 N -3.13 0.00 -1.23 -0.16 -2.24 0.37 -4.68 114.28 103.21 1s4v n THR 43 Ca -0.08 -0.33 -0.08 0.00 -2.27 0.00 0.00 64.05 61.29 1s4v n THR 43 Cb 0.95 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 70.15 1s4v n THR 43 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1s4v n ASN 44 N -1.13 -4.43 -4.01 3.42 5.15 0.84 -5.00 115.26 110.11 1s4v n ASN 44 Ca 0.02 0.20 -0.26 0.00 -0.60 0.00 0.00 54.58 53.93 1s4v n ASN 44 Cb 0.12 -2.63 -0.17 0.00 -0.53 0.00 0.00 39.78 36.57 1s4v n ASN 44 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1s4v s LYS 45 N -2.41 1.80 -0.32 1.20 2.20 -1.25 -5.03 119.74 115.93 1s4v s LYS 45 Ca 0.00 -0.42 -0.21 0.00 -0.36 0.00 0.00 55.97 54.98 1s4v s LYS 45 Cb 0.00 -1.56 -0.00 0.00 -1.51 0.00 0.00 37.83 34.76 1s4v s LYS 45 CO 0.00 -0.05 0.69 -1.17 -0.36 0.00 0.00 175.35 174.46 1s4v s LEU 46 N 0.94 4.14 -0.07 5.43 2.96 -1.26 -3.73 118.68 127.09 1s4v s LEU 46 Ca -0.09 0.46 0.05 0.00 -0.22 0.00 0.00 54.13 54.33 1s4v s LEU 46 Cb -0.15 -2.91 -0.01 0.00 0.50 0.00 0.00 46.19 43.62 1s4v s LEU 46 CO 0.00 -0.56 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.55 1s4v s VAL 47 N 2.77 2.13 -0.04 1.68 1.01 -1.26 -5.08 120.40 121.61 1s4v s VAL 47 Ca 0.28 -1.03 -0.26 0.00 0.00 0.00 0.00 61.98 60.98 1s4v s VAL 47 Cb -0.14 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 1s4v s VAL 47 CO 0.13 0.57 0.79 -0.44 0.00 0.00 0.00 175.10 176.14 1s4v s SER 48 N -0.02 7.12 0.36 3.32 0.01 -1.26 -4.78 113.70 118.46 1s4v s SER 48 Ca -0.08 1.35 0.08 0.00 1.31 0.00 0.00 55.95 58.61 1s4v s SER 48 Cb -0.15 -2.46 -0.03 0.00 0.21 0.00 0.00 66.02 63.59 1s4v s SER 48 CO 0.05 -0.15 0.30 -0.76 0.41 0.00 0.00 173.24 173.09 1s4v s LEU 49 N 0.79 3.49 -0.67 2.44 1.43 -1.26 -1.15 118.68 123.74 1s4v s LEU 49 Ca 0.42 -0.61 -0.26 0.00 -1.03 0.00 0.00 54.13 52.65 1s4v s LEU 49 Cb -0.19 -2.10 0.04 0.00 0.03 0.00 0.00 46.19 43.97 1s4v s LEU 49 CO 0.22 -0.44 1.14 -0.55 0.23 0.00 0.00 176.35 176.95 1s4v s SER 50 N -4.02 6.23 0.20 2.29 0.15 -0.50 -4.06 113.70 113.99 1s4v s SER 50 Ca 0.43 -0.50 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 1s4v s SER 50 Cb -0.04 -2.51 0.12 0.00 -1.71 0.00 0.00 66.02 61.88 1s4v s SER 50 CO 0.26 -1.60 1.49 -0.33 1.20 0.00 0.00 173.24 174.26 1s4v h GLU 51 N 9.74 0.43 -0.71 5.44 3.07 -1.89 -3.09 114.58 127.58 1s4v h GLU 51 Ca -0.28 -0.30 0.02 0.00 -0.50 0.00 0.00 59.36 58.30 1s4v h GLU 51 Cb 1.06 0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.98 1s4v h GLU 51 CO 1.22 0.92 0.47 0.37 -1.40 0.00 0.00 179.01 180.58 1s4v h GLN 52 N 0.31 0.90 -0.81 2.33 5.75 -1.86 -1.69 115.11 120.03 1s4v h GLN 52 Ca -0.01 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.43 1s4v h GLN 52 Cb 1.18 -0.20 -0.04 0.00 1.07 0.00 0.00 27.48 29.49 1s4v h GLN 52 CO 0.11 0.59 0.47 1.49 -2.65 0.00 0.00 178.83 178.84 1s4v h GLU 53 N 0.92 1.12 0.06 1.69 4.81 -1.77 0.42 114.58 121.83 1s4v h GLU 53 Ca 0.27 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1s4v h GLU 53 Cb -0.05 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.10 1s4v h GLU 53 CO -0.07 0.81 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.92 1s4v h LEU 54 N 1.12 -0.06 -0.25 1.64 3.38 -1.43 0.32 115.31 120.03 1s4v h LEU 54 Ca 0.29 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.16 1s4v h LEU 54 Cb -0.01 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 1s4v h LEU 54 CO -0.05 0.12 -0.18 0.58 0.09 0.00 0.00 178.44 179.00 1s4v h VAL 55 N -0.25 0.49 -0.07 1.22 2.07 -0.87 -0.26 116.25 118.58 1s4v h VAL 55 Ca -0.01 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.31 1s4v h VAL 55 Cb 0.22 0.49 0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1s4v h VAL 55 CO 0.01 0.00 -0.74 0.44 0.02 0.00 0.00 177.57 177.30 1s4v h ASP 56 N -0.17 0.78 0.03 0.57 3.32 -0.87 -3.35 116.42 116.73 1s4v h ASP 56 Ca 0.14 -0.68 -0.37 0.00 0.02 0.00 0.00 57.03 56.14 1s4v h ASP 56 Cb 0.39 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 1s4v h ASP 56 CO -0.35 1.35 -2.35 0.00 -1.72 0.00 0.00 179.24 176.16 1s4v s ASP 58 N -5.62 6.79 0.00 0.00 3.68 -0.11 -4.71 116.67 116.71 1s4v s ASP 58 Ca -0.12 -2.30 0.06 0.00 2.13 0.00 0.00 52.55 52.33 1s4v s ASP 58 Cb 0.06 -2.56 0.16 0.00 -1.45 0.00 0.00 42.92 39.13 1s4v s ASP 58 CO 0.81 -1.20 1.10 0.35 0.13 0.00 0.00 175.17 176.36 1s4v n THR 59 N 6.32 0.90 -0.26 1.71 -2.24 -1.26 -4.08 114.28 115.36 1s4v n THR 59 Ca 0.44 -0.95 -0.06 0.00 -2.27 0.00 0.00 64.05 61.22 1s4v n THR 59 Cb 0.47 0.56 0.06 0.00 -2.10 0.00 0.00 70.33 69.32 1s4v n THR 59 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1s4v h ASP 60 N 1.14 0.91 0.00 3.42 3.32 -1.99 -3.40 116.42 119.83 1s4v h ASP 60 Ca 0.00 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1s4v h ASP 60 Cb 0.59 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1s4v h ASP 60 CO 0.00 0.75 -0.60 0.00 -1.72 0.00 0.00 179.24 177.68 1s4v n GLN 61 N -4.47 0.00 -2.07 3.56 6.02 -1.26 -5.07 117.38 114.09 1s4v n GLN 61 Ca 0.06 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.69 1s4v n GLN 61 Cb 0.10 -0.67 0.02 0.00 1.02 0.00 0.00 30.24 30.71 1s4v n GLN 61 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1s4v s ASN 62 N -3.96 5.38 -0.44 1.08 0.01 -1.26 -4.98 114.94 110.77 1s4v s ASN 62 Ca 0.00 2.36 0.06 0.00 -0.71 0.00 0.00 52.86 54.57 1s4v s ASN 62 Cb 0.00 -2.60 0.42 0.00 0.41 0.00 0.00 41.25 39.48 1s4v s ASN 62 CO 0.00 -1.46 1.09 0.00 -1.51 0.00 0.00 177.10 175.21 1s4v n GLN 63 N -1.42 3.26 0.00 -0.60 6.02 -0.06 -4.28 117.38 120.29 1s4v n GLN 63 Ca 0.13 -4.44 0.00 0.00 -0.01 0.00 0.00 57.00 52.67 1s4v n GLN 63 Cb 0.50 -2.18 0.00 0.00 1.02 0.00 0.00 30.24 29.58 1s4v n GLN 63 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s4v n GLY 64 N -0.44 2.60 0.00 1.08 0.00 -1.25 -0.63 105.19 106.56 1s4v n GLY 64 Ca 0.36 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.38 1s4v n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s4v n ASN 66 N -1.09 4.62 0.00 0.00 4.05 0.20 -0.77 115.26 122.28 1s4v n ASN 66 Ca 0.05 -2.44 0.00 0.00 0.45 0.00 0.00 54.58 52.64 1s4v n ASN 66 Cb 0.04 -0.56 0.00 0.00 1.23 0.00 0.00 39.78 40.49 1s4v n ASN 66 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1s4v n GLY 67 N 1.04 1.62 0.00 8.20 0.00 -0.69 -4.84 105.19 110.51 1s4v n GLY 67 Ca 0.25 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1s4v n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s4v n GLY 68 N 1.68 1.09 2.93 -0.02 0.00 -1.26 -0.88 105.19 108.73 1s4v n GLY 68 Ca 0.00 -0.79 -0.16 0.00 0.00 0.00 0.00 46.02 45.07 1s4v n GLY 68 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1s4v s LEU 69 N 0.00 1.81 0.22 0.99 2.96 -1.26 -4.76 118.68 118.65 1s4v s LEU 69 Ca 0.00 -0.09 -0.07 0.00 -0.22 0.00 0.00 54.13 53.75 1s4v s LEU 69 Cb 0.00 -0.28 0.32 0.00 0.50 0.00 0.00 46.19 46.73 1s4v s LEU 69 CO 0.00 0.03 1.78 0.24 -1.32 0.00 0.00 176.35 177.08 1s4v h MET 70 N 6.33 0.59 -0.67 1.98 2.86 -1.98 -2.46 114.93 121.58 1s4v h MET 70 Ca -0.31 -0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.39 1s4v h MET 70 Cb 1.18 -0.13 -0.07 0.00 0.06 0.00 0.00 31.60 32.63 1s4v h MET 70 CO 0.50 0.39 0.30 -0.44 1.06 0.00 0.00 176.91 178.72 1s4v h ASP 71 N 0.61 0.36 -0.18 1.22 3.45 -1.97 -0.44 116.42 119.48 1s4v h ASP 71 Ca 0.34 0.07 -0.07 0.00 0.43 0.00 0.00 57.03 57.80 1s4v h ASP 71 Cb 0.34 0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 39.11 1s4v h ASP 71 CO -0.26 0.21 -0.09 1.88 -1.57 0.00 0.00 179.24 179.41 1s4v h TYR 72 N 0.52 0.56 -0.45 4.55 0.05 -1.89 -2.58 116.97 117.73 1s4v h TYR 72 Ca 0.34 -0.08 -0.14 0.00 0.05 0.00 0.00 58.73 58.90 1s4v h TYR 72 Cb 0.38 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 1s4v h TYR 72 CO -0.13 0.60 -0.26 0.00 -1.05 0.00 0.00 178.16 177.32 1s4v h ALA 73 N 1.42 0.69 -0.79 3.88 0.00 -0.85 -1.82 119.26 121.79 1s4v h ALA 73 Ca 0.09 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1s4v h ALA 73 Cb 0.45 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1s4v h ALA 73 CO 0.02 0.67 0.33 0.74 0.00 0.00 0.00 179.25 181.01 1s4v h PHE 74 N 0.81 1.18 -0.74 0.00 0.04 -0.90 -1.02 116.94 116.31 1s4v h PHE 74 Ca 0.10 -0.08 -0.04 0.00 2.80 0.00 0.00 57.97 60.75 1s4v h PHE 74 Cb 0.84 -0.36 -0.03 0.00 2.20 0.00 0.00 35.95 38.60 1s4v h PHE 74 CO 0.05 0.88 0.30 0.93 -0.60 0.00 0.00 178.31 179.88 1s4v h GLU 75 N 1.14 1.10 0.02 1.51 5.08 -1.22 -1.18 114.58 121.04 1s4v h GLU 75 Ca 0.26 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1s4v h GLU 75 Cb 0.19 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1s4v h GLU 75 CO -0.02 0.90 -0.07 0.35 -1.00 0.00 0.00 179.01 179.17 1s4v h PHE 76 N 1.06 -0.17 -1.00 4.33 3.57 -0.65 0.51 116.94 124.59 1s4v h PHE 76 Ca 0.25 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.79 1s4v h PHE 76 Cb 0.20 0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.96 1s4v h PHE 76 CO 0.02 -0.11 0.66 0.82 -2.23 0.00 0.00 178.31 177.47 1s4v h ILE 77 N -0.13 1.18 -0.07 1.41 2.04 -0.95 -0.17 117.51 120.82 1s4v h ILE 77 Ca 0.02 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1s4v h ILE 77 Cb 0.15 -0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.02 1s4v h ILE 77 CO -0.06 0.23 0.01 0.50 0.00 0.00 0.00 178.15 178.84 1s4v h LYS 78 N 1.28 0.11 -0.95 2.37 3.64 -0.73 0.72 116.57 123.00 1s4v h LYS 78 Ca 0.40 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.79 1s4v h LYS 78 Cb -0.01 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.74 1s4v h LYS 78 CO -0.12 0.32 0.63 1.96 -2.27 0.00 0.00 179.45 179.96 1s4v h GLN 79 N -0.12 1.16 -0.00 1.90 4.20 -0.29 -2.01 115.11 119.95 1s4v h GLN 79 Ca 0.02 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1s4v h GLN 79 Cb 0.26 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1s4v h GLN 79 CO 0.00 0.77 -0.03 0.54 -0.67 0.00 0.00 178.83 179.44 1s4v n ARG 80 N -4.44 0.82 -0.92 1.46 5.12 -0.13 -4.88 116.66 113.69 1s4v n ARG 80 Ca 0.13 -0.14 0.00 0.00 -1.93 0.00 0.00 57.85 55.91 1s4v n ARG 80 Cb 0.10 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 29.91 1s4v n ARG 80 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1s4v n GLY 81 N 1.16 0.53 0.00 -0.13 0.00 -0.76 -4.90 105.19 101.10 1s4v n GLY 81 Ca 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1s4v n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s4v n GLY 82 N -2.92 0.99 3.19 -0.02 0.00 0.22 -4.36 105.19 102.28 1s4v n GLY 82 Ca 0.00 -1.94 -0.25 0.00 0.00 0.00 0.00 46.02 43.83 1s4v n GLY 82 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1s4v s ILE 83 N -1.10 1.45 0.87 -0.61 1.10 -0.06 -4.75 121.20 118.09 1s4v s ILE 83 Ca 0.00 -0.84 -0.13 0.00 -0.51 0.00 0.00 60.65 59.17 1s4v s ILE 83 Cb 0.00 -1.22 0.13 0.00 0.15 0.00 0.00 42.46 41.53 1s4v s ILE 83 CO 0.00 0.36 1.23 0.28 -2.11 0.00 0.00 174.94 174.70 1s4v s THR 84 N -0.49 2.02 0.66 4.00 -1.32 -1.26 -0.64 115.64 118.61 1s4v s THR 84 Ca 0.07 -0.03 -0.11 0.00 -1.21 0.00 0.00 61.69 60.40 1s4v s THR 84 Cb -0.07 -2.99 -0.02 0.00 -1.51 0.00 0.00 72.50 67.91 1s4v s THR 84 CO -0.00 0.00 1.05 0.42 -2.21 0.00 0.00 174.62 173.87 1s4v s THR 85 N -3.68 4.30 0.18 5.08 -4.23 -1.26 -1.41 115.64 114.62 1s4v s THR 85 Ca 0.67 0.77 -0.12 0.00 -1.18 0.00 0.00 61.69 61.84 1s4v s THR 85 Cb -0.08 -3.59 0.08 0.00 1.34 0.00 0.00 72.50 70.26 1s4v s THR 85 CO 0.50 -0.95 1.74 -0.08 -0.54 0.00 0.00 174.62 175.30 1s4v h GLU 86 N -0.46 0.91 -0.91 3.99 4.57 -1.28 -1.50 114.58 119.90 1s4v h GLU 86 Ca -0.44 -0.16 0.06 0.00 -1.18 0.00 0.00 59.36 57.64 1s4v h GLU 86 Cb 1.20 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 29.58 1s4v h GLU 86 CO 0.59 0.76 0.58 0.00 -1.18 0.00 0.00 179.01 179.75 1s4v h ALA 87 N 1.10 1.25 -0.01 2.92 0.00 -1.93 0.39 119.26 122.98 1s4v h ALA 87 Ca 0.21 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.92 1s4v h ALA 87 Cb 0.18 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1s4v h ALA 87 CO -0.02 0.35 -0.81 -0.97 0.00 0.00 0.00 179.25 177.80 1s4v h ASN 88 N 1.06 0.22 -2.27 0.00 -1.24 -1.84 -3.38 115.58 108.13 1s4v h ASN 88 Ca 0.39 -0.17 -0.58 0.00 0.71 0.00 0.00 56.30 56.65 1s4v h ASN 88 Cb 0.14 -0.07 -0.39 0.00 0.73 0.00 0.00 38.32 38.74 1s4v h ASN 88 CO -0.16 0.94 -0.99 0.00 -1.29 0.00 0.00 177.43 175.93 1s4v n TYR 89 N -3.69 -0.38 -2.05 0.67 4.19 -0.60 -5.02 117.16 110.27 1s4v n TYR 89 Ca -0.03 -3.47 -0.37 0.00 3.31 0.00 0.00 57.90 57.34 1s4v n TYR 89 Cb 0.76 -0.02 0.02 0.00 0.49 0.00 0.00 39.34 40.59 1s4v n TYR 89 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 1s4v s PRO 90 N -0.53 3.40 0.05 2.98 0.04 0.08 -4.43 135.00 136.61 1s4v s PRO 90 Ca 0.34 1.95 -0.31 0.00 0.04 0.00 0.00 61.00 63.02 1s4v s PRO 90 Cb 0.08 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 32.29 1s4v s PRO 90 CO -0.16 -0.89 1.44 -0.47 0.04 0.00 0.00 177.00 176.96 1s4v s TYR 91 N -1.47 2.92 -0.08 0.56 5.04 -1.26 -4.77 117.35 118.29 1s4v s TYR 91 Ca 0.69 0.78 0.01 0.00 -2.44 0.00 0.00 57.07 56.11 1s4v s TYR 91 Cb -0.33 -3.72 0.00 0.00 0.35 0.00 0.00 41.96 38.26 1s4v s TYR 91 CO 0.39 -2.68 0.35 0.39 -1.34 0.00 0.00 175.55 172.67 1s4v n GLU 92 N 4.88 1.79 -3.52 4.97 -0.58 -1.26 -5.04 120.64 121.88 1s4v n GLU 92 Ca 0.13 -0.36 -0.20 0.00 -0.42 0.00 0.00 57.16 56.31 1s4v n GLU 92 Cb 0.43 -0.85 0.08 0.00 -0.57 0.00 0.00 31.44 30.53 1s4v n GLU 92 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1s4v n ALA 93 N -0.33 -1.74 -3.50 0.62 0.00 -1.26 -5.02 120.51 109.29 1s4v n ALA 93 Ca 0.00 0.12 -0.14 0.00 0.00 0.00 0.00 53.44 53.42 1s4v n ALA 93 Cb 0.02 -3.61 -0.04 0.00 0.00 0.00 0.00 19.45 15.82 1s4v n ALA 93 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1s4v s TYR 94 N -3.36 -0.53 -0.61 0.00 -0.85 -1.26 -4.61 117.35 106.13 1s4v s TYR 94 Ca 0.24 0.68 -0.28 0.00 -0.52 0.00 0.00 57.07 57.18 1s4v s TYR 94 Cb -0.10 0.48 0.02 0.00 0.38 0.00 0.00 41.96 42.74 1s4v s TYR 94 CO 0.74 -0.62 1.30 -0.51 -1.52 0.00 0.00 175.55 174.94 1s4v s ASP 95 N -1.82 6.25 0.49 -0.18 1.11 -1.26 -4.82 116.67 116.44 1s4v s ASP 95 Ca -0.04 0.04 0.05 0.00 0.18 0.00 0.00 52.55 52.79 1s4v s ASP 95 Cb -0.01 -2.55 0.05 0.00 1.07 0.00 0.00 42.92 41.48 1s4v s ASP 95 CO -0.01 -1.66 0.38 0.61 1.18 0.00 0.00 175.17 175.68 1s4v n GLY 96 N 5.21 2.73 3.71 0.21 0.00 -1.26 -5.06 105.19 110.73 1s4v n GLY 96 Ca 0.09 -2.28 -0.42 0.00 0.00 0.00 0.00 46.02 43.41 1s4v n GLY 96 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s4v s THR 97 N -2.40 3.94 -0.09 2.61 2.01 -1.26 -4.65 115.64 115.79 1s4v s THR 97 Ca 0.29 1.40 -0.29 0.00 0.31 0.00 0.00 61.69 63.40 1s4v s THR 97 Cb -0.02 -3.90 -0.06 0.00 0.01 0.00 0.00 72.50 68.52 1s4v s THR 97 CO 0.18 0.12 1.94 0.00 -0.69 0.00 0.00 174.62 176.18 1s4v s ASP 99 N 5.41 6.27 0.43 0.00 -1.08 -1.26 -4.86 116.67 121.58 1s4v s ASP 99 Ca 0.87 -0.80 0.11 0.00 -0.52 0.00 0.00 52.55 52.21 1s4v s ASP 99 Cb -0.36 -2.55 0.96 0.00 -1.46 0.00 0.00 42.92 39.51 1s4v s ASP 99 CO 0.36 -1.71 2.02 0.58 0.52 0.00 0.00 175.17 176.94 1s4v h VAL 100 N 6.26 0.99 -0.27 1.11 2.07 -1.98 0.39 116.25 124.82 1s4v h VAL 100 Ca -0.13 -0.16 -0.11 0.00 0.82 0.00 0.00 66.70 67.13 1s4v h VAL 100 Cb 1.04 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1s4v h VAL 100 CO 1.32 0.08 -0.28 0.77 0.02 0.00 0.00 177.57 179.48 1s4v h SER 101 N 0.46 0.55 0.39 0.57 4.64 -1.97 -0.65 113.55 117.54 1s4v h SER 101 Ca 0.21 -0.20 -0.25 0.00 -0.47 0.00 0.00 61.79 61.08 1s4v h SER 101 Cb 0.26 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 62.21 1s4v h SER 101 CO -0.06 0.81 -1.07 0.11 -0.87 0.00 0.00 176.83 175.75 1s4v h LYS 102 N 0.47 0.40 -0.11 4.77 1.57 -1.74 -3.06 116.57 118.86 1s4v h LYS 102 Ca 0.06 -0.50 -0.04 0.00 -1.87 0.00 0.00 60.65 58.30 1s4v h LYS 102 Cb 0.73 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 1s4v h LYS 102 CO 0.06 1.18 -0.13 1.49 -0.57 0.00 0.00 179.45 181.48 1s4v h GLU 103 N 0.19 0.18 -0.63 3.15 4.81 -0.72 -1.10 114.58 120.46 1s4v h GLU 103 Ca -0.11 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1s4v h GLU 103 Cb 1.74 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 31.09 1s4v h GLU 103 CO 0.19 0.31 0.00 0.09 -0.73 0.00 0.00 179.01 178.87 1s4v n ASN 104 N -4.30 2.51 -2.57 1.04 3.02 -0.27 -4.03 115.26 110.66 1s4v n ASN 104 Ca -0.01 -2.25 -0.23 0.00 -0.03 0.00 0.00 54.58 52.07 1s4v n ASN 104 Cb 0.25 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.98 1s4v n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s4v n ALA 105 N 0.32 4.61 -1.69 5.41 0.00 -0.42 -5.05 120.51 123.70 1s4v n ALA 105 Ca 0.11 -4.06 -0.40 0.00 0.00 0.00 0.00 53.44 49.09 1s4v n ALA 105 Cb 0.51 -0.65 0.03 0.00 0.00 0.00 0.00 19.45 19.33 1s4v n ALA 105 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1s4v n PRO 106 N -0.35 1.63 -0.03 0.00 -0.04 -1.26 -4.43 135.00 130.52 1s4v n PRO 106 Ca 0.31 0.59 -0.02 0.00 -0.04 0.00 0.00 63.50 64.35 1s4v n PRO 106 Cb 0.68 -2.37 -0.06 0.00 -0.04 0.00 0.00 33.50 31.71 1s4v n PRO 106 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1s4v n ALA 107 N -0.73 1.93 -3.71 0.55 0.00 0.19 -4.52 120.51 114.22 1s4v n ALA 107 Ca 0.09 -0.42 -0.20 0.00 0.00 0.00 0.00 53.44 52.91 1s4v n ALA 107 Cb 0.42 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.71 1s4v n ALA 107 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1s4v s VAL 108 N -2.27 0.27 0.28 0.00 1.01 -0.89 -4.24 120.40 114.56 1s4v s VAL 108 Ca -0.03 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.12 1s4v s VAL 108 Cb 0.03 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 1s4v s VAL 108 CO 0.31 0.20 0.21 -0.94 0.00 0.00 0.00 175.10 174.89 1s4v s SER 109 N 1.48 5.40 0.04 3.32 1.04 -1.26 -0.89 113.70 122.83 1s4v s SER 109 Ca -0.03 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.06 1s4v s SER 109 Cb -0.13 -1.25 -0.03 0.00 0.10 0.00 0.00 66.02 64.71 1s4v s SER 109 CO -0.03 -0.13 -0.04 0.27 0.98 0.00 0.00 173.24 174.29 1s4v s ILE 110 N -2.20 0.26 -0.52 -1.02 -4.36 -1.26 -4.93 121.20 107.17 1s4v s ILE 110 Ca 0.35 -1.32 0.24 0.00 -0.26 0.00 0.00 60.65 59.66 1s4v s ILE 110 Cb -0.07 -0.85 0.03 0.00 1.25 0.00 0.00 42.46 42.82 1s4v s ILE 110 CO 0.25 -0.68 1.22 0.44 0.24 0.00 0.00 174.94 176.41 1s4v h ASP 111 N 3.99 0.00 0.00 4.36 3.32 -0.74 -3.41 116.42 123.94 1s4v h ASP 111 Ca -0.33 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1s4v h ASP 111 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1s4v h ASP 111 CO 0.51 0.08 0.00 0.61 -1.72 0.00 0.00 179.24 178.72 1s4v n GLY 112 N 1.29 -0.42 3.51 2.75 0.00 -1.23 -4.97 105.19 106.12 1s4v n GLY 112 Ca 0.02 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.98 1s4v n GLY 112 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1s4v s HIS 113 N -3.58 -0.07 0.02 1.61 -3.43 -1.26 -1.08 115.29 107.50 1s4v s HIS 113 Ca 0.00 -0.28 -0.03 0.00 -0.80 0.00 0.00 55.06 53.95 1s4v s HIS 113 Cb 0.00 0.35 -0.01 0.00 -1.43 0.00 0.00 32.58 31.49 1s4v s HIS 113 CO 0.00 -0.90 0.04 -2.00 -2.00 0.00 0.00 174.74 169.88 1s4v s GLU 114 N -3.88 0.40 -0.06 -0.38 2.12 -0.47 -4.92 118.70 111.51 1s4v s GLU 114 Ca 0.10 -0.56 -0.05 0.00 0.36 0.00 0.00 54.97 54.83 1s4v s GLU 114 Cb -0.01 0.15 -0.04 0.00 0.26 0.00 0.00 34.13 34.50 1s4v s GLU 114 CO -0.02 -0.08 0.16 -0.80 -0.54 0.00 0.00 175.26 173.97 1s4v s ASN 115 N -1.51 6.34 0.16 -1.70 -0.87 -1.26 -1.37 114.94 114.73 1s4v s ASN 115 Ca -0.14 0.39 -0.30 0.00 -1.57 0.00 0.00 52.86 51.24 1s4v s ASN 115 Cb -0.08 -2.01 -0.07 0.00 -0.02 0.00 0.00 41.25 39.06 1s4v s ASN 115 CO -0.00 0.33 0.98 -0.69 -2.57 0.00 0.00 177.10 175.14 1s4v s VAL 116 N -1.18 4.27 0.10 1.60 1.01 0.56 -4.94 120.40 121.82 1s4v s VAL 116 Ca 0.21 2.00 -0.36 0.00 0.00 0.00 0.00 61.98 63.83 1s4v s VAL 116 Cb -0.12 -4.28 -0.17 0.00 0.00 0.00 0.00 36.38 31.81 1s4v s VAL 116 CO 0.12 0.36 1.31 -2.65 0.00 0.00 0.00 175.10 174.24 1s4v n PRO 117 N 2.34 1.14 -1.82 2.72 -0.02 -1.26 -4.64 135.00 133.46 1s4v n PRO 117 Ca 0.01 0.41 -0.35 0.00 -2.02 0.00 0.00 63.50 61.55 1s4v n PRO 117 Cb 0.48 -2.03 0.05 0.00 -0.02 0.00 0.00 33.50 31.98 1s4v n PRO 117 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1s4v s GLU 118 N 0.35 2.71 -1.48 -0.52 -1.05 -1.26 -3.72 118.70 113.72 1s4v s GLU 118 Ca 0.83 1.78 -0.04 0.00 -0.15 0.00 0.00 54.97 57.38 1s4v s GLU 118 Cb -0.94 -1.90 0.04 0.00 -0.44 0.00 0.00 34.13 30.89 1s4v s GLU 118 CO 0.48 -1.40 0.49 0.09 0.95 0.00 0.00 175.26 175.86 1s4v n ASN 119 N -1.99 -1.01 -3.37 0.83 3.02 -0.44 -4.93 115.26 107.37 1s4v n ASN 119 Ca 0.13 -1.02 -0.24 0.00 -0.03 0.00 0.00 54.58 53.42 1s4v n ASN 119 Cb 0.50 -2.93 -0.10 0.00 -0.61 0.00 0.00 39.78 36.64 1s4v n ASN 119 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1s4v s ASP 120 N -4.11 1.68 0.58 6.41 -1.08 -1.24 -4.74 116.67 114.16 1s4v s ASP 120 Ca 0.18 -2.44 0.38 0.00 -0.52 0.00 0.00 52.55 50.16 1s4v s ASP 120 Cb -0.10 -0.09 2.03 0.00 -1.46 0.00 0.00 42.92 43.30 1s4v s ASP 120 CO 0.90 -0.22 2.17 -0.33 0.52 0.00 0.00 175.17 178.21 1s4v h GLU 121 N 6.28 0.00 -0.11 4.34 5.08 -1.90 -0.42 114.58 127.86 1s4v h GLU 121 Ca 0.15 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.42 1s4v h GLU 121 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1s4v h GLU 121 CO 0.28 0.00 -0.27 -0.91 -1.00 0.00 0.00 179.01 177.11 1s4v h ASN 122 N 0.00 0.42 -0.68 1.42 2.35 -1.97 0.08 115.58 117.20 1s4v h ASN 122 Ca 0.00 -0.59 -0.08 0.00 -0.55 0.00 0.00 56.30 55.09 1s4v h ASN 122 Cb 0.07 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 1s4v h ASN 122 CO 0.00 0.93 0.13 0.00 -1.65 0.00 0.00 177.43 176.85 1s4v h ALA 123 N 0.50 0.91 -0.91 -0.83 0.00 -1.61 -2.28 119.26 115.03 1s4v h ALA 123 Ca -0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1s4v h ALA 123 Cb 0.88 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1s4v h ALA 123 CO 0.06 0.66 0.50 1.25 0.00 0.00 0.00 179.25 181.72 1s4v h LEU 124 N 1.05 1.13 -0.52 0.00 5.85 -1.01 -1.73 115.31 120.08 1s4v h LEU 124 Ca 0.21 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1s4v h LEU 124 Cb 0.42 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1s4v h LEU 124 CO 0.01 0.90 0.29 0.25 -0.34 0.00 0.00 178.44 179.55 1s4v h LEU 125 N 1.27 0.65 -1.21 2.25 5.85 -0.51 -0.61 115.31 123.00 1s4v h LEU 125 Ca 0.32 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 1s4v h LEU 125 Cb 0.02 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1s4v h LEU 125 CO -0.05 0.54 0.36 0.11 -0.34 0.00 0.00 178.44 179.06 1s4v h LYS 126 N 0.70 0.90 -0.18 1.25 1.57 -1.01 -0.64 116.57 119.16 1s4v h LYS 126 Ca 0.18 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.80 1s4v h LYS 126 Cb 0.04 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 1s4v h LYS 126 CO -0.03 0.66 -0.17 0.00 -0.57 0.00 0.00 179.45 179.34 1s4v h ALA 127 N 1.48 0.26 -0.06 3.86 0.00 -0.82 -3.13 119.26 120.86 1s4v h ALA 127 Ca 0.23 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1s4v h ALA 127 Cb 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1s4v h ALA 127 CO -0.04 0.17 -0.21 0.28 0.00 0.00 0.00 179.25 179.45 1s4v h VAL 128 N 0.09 1.18 0.00 0.00 2.07 -0.75 -2.03 116.25 116.82 1s4v h VAL 128 Ca 0.03 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 1s4v h VAL 128 Cb 0.71 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1s4v h VAL 128 CO 0.04 0.25 -0.02 0.00 0.02 0.00 0.00 177.57 177.87 1s4v h ALA 129 N 1.70 1.74 0.12 1.67 0.00 -1.07 -2.83 119.26 120.59 1s4v h ALA 129 Ca 0.02 -0.01 -0.33 0.00 0.00 0.00 0.00 54.91 54.59 1s4v h ALA 129 Cb 0.43 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1s4v h ALA 129 CO 0.03 0.02 -1.70 -0.91 0.00 0.00 0.00 179.25 176.69 1s4v h ASN 130 N 0.00 0.39 -5.50 0.00 -0.26 -1.42 -3.50 115.58 105.28 1s4v h ASN 130 Ca -0.00 -0.64 0.23 0.00 -0.56 0.00 0.00 56.30 55.33 1s4v h ASN 130 Cb 0.03 -0.13 -0.09 0.00 -1.06 0.00 0.00 38.32 37.08 1s4v h ASN 130 CO 0.00 1.55 0.62 0.00 -1.06 0.00 0.00 177.43 178.55 1s4v s GLN 131 N -2.59 0.91 0.47 0.81 -2.07 -1.07 -5.05 119.66 111.07 1s4v s GLN 131 Ca -0.13 -0.52 -0.23 0.00 -1.82 0.00 0.00 55.36 52.66 1s4v s GLN 131 Cb 0.07 0.30 -0.07 0.00 -1.09 0.00 0.00 33.01 32.22 1s4v s GLN 131 CO 0.83 -0.42 1.26 -2.14 -1.32 0.00 0.00 175.29 173.50 1s4v s PRO 132 N -2.86 3.63 -0.05 9.60 0.02 -1.26 -4.13 135.00 139.95 1s4v s PRO 132 Ca 0.14 2.01 0.05 0.00 0.02 0.00 0.00 61.00 63.23 1s4v s PRO 132 Cb 0.01 -2.46 -0.01 0.00 0.02 0.00 0.00 34.50 32.06 1s4v s PRO 132 CO 0.00 -0.72 -0.22 0.08 -0.33 0.00 0.00 177.00 175.82 1s4v s VAL 133 N -1.40 1.79 0.14 3.83 1.01 -0.69 -4.73 120.40 120.35 1s4v s VAL 133 Ca 0.64 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 1s4v s VAL 133 Cb -0.35 -1.52 -0.07 0.00 0.00 0.00 0.00 36.38 34.45 1s4v s VAL 133 CO 0.42 0.50 1.05 -0.44 0.00 0.00 0.00 175.10 176.64 1s4v s SER 134 N -0.06 7.34 0.06 3.32 0.01 -0.24 -0.50 113.70 123.62 1s4v s SER 134 Ca -0.04 1.96 -0.03 0.00 1.31 0.00 0.00 55.95 59.15 1s4v s SER 134 Cb -0.13 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.48 1s4v s SER 134 CO 0.03 -0.18 0.04 0.68 0.41 0.00 0.00 173.24 174.22 1s4v s VAL 135 N -0.01 0.18 -0.01 3.43 -7.23 -0.49 -0.85 120.40 115.42 1s4v s VAL 135 Ca 0.49 -1.52 0.05 0.00 -1.81 0.00 0.00 61.98 59.19 1s4v s VAL 135 Cb -0.27 -1.33 -0.03 0.00 0.56 0.00 0.00 36.38 35.31 1s4v s VAL 135 CO 0.32 -0.84 -0.14 0.00 -0.31 0.00 0.00 175.10 174.13 1s4v s ALA 136 N -3.60 2.71 0.21 1.32 0.00 -1.20 -0.85 121.76 120.33 1s4v s ALA 136 Ca 0.04 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.91 1s4v s ALA 136 Cb 0.05 -0.93 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 1s4v s ALA 136 CO -0.09 0.57 0.21 0.96 0.00 0.00 0.00 175.76 177.42 1s4v s ILE 137 N -0.83 0.01 -0.52 0.00 -4.36 0.42 -3.82 121.20 112.10 1s4v s ILE 137 Ca 0.13 -1.83 -0.18 0.00 -0.26 0.00 0.00 60.65 58.52 1s4v s ILE 137 Cb -0.11 -2.37 0.08 0.00 1.25 0.00 0.00 42.46 41.31 1s4v s ILE 137 CO 0.03 -0.04 0.57 -0.62 0.24 0.00 0.00 174.94 175.12 1s4v s ASP 138 N -3.11 6.19 -0.11 4.36 3.68 0.15 -1.34 116.67 126.48 1s4v s ASP 138 Ca 0.33 -1.22 0.15 0.00 2.13 0.00 0.00 52.55 53.94 1s4v s ASP 138 Cb 0.05 -2.26 0.47 0.00 -1.45 0.00 0.00 42.92 39.73 1s4v s ASP 138 CO 0.10 -0.87 1.38 0.00 0.13 0.00 0.00 175.17 175.92 1s4v n ALA 139 N 5.85 2.73 1.81 3.66 0.00 -1.26 -4.64 120.51 128.66 1s4v n ALA 139 Ca -0.09 -1.83 0.15 0.00 0.00 0.00 0.00 53.44 51.67 1s4v n ALA 139 Cb 0.44 -0.64 0.88 0.00 0.00 0.00 0.00 19.45 20.13 1s4v n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s4v n GLY 140 N -0.00 -1.08 3.95 0.00 0.00 -1.26 -4.59 105.19 102.21 1s4v n GLY 140 Ca 0.18 -0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1s4v n GLY 140 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1s4v s GLY 141 N -2.18 1.34 0.20 -0.02 0.00 -1.26 -5.02 107.32 100.39 1s4v s GLY 141 Ca 0.42 -1.03 -0.07 0.00 0.00 0.00 0.00 44.72 44.04 1s4v s GLY 141 CO 0.39 -1.00 1.67 1.76 0.00 0.00 0.00 173.10 175.92 1s4v h SER 142 N 1.08 0.97 -0.31 1.64 0.02 -1.90 -1.57 113.55 113.48 1s4v h SER 142 Ca -0.50 -0.28 0.01 0.00 -0.84 0.00 0.00 61.79 60.18 1s4v h SER 142 Cb 1.22 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 1s4v h SER 142 CO 0.62 1.04 0.17 0.44 -1.14 0.00 0.00 176.83 177.96 1s4v h ASP 143 N 0.91 0.27 -0.10 3.07 3.45 -1.93 -0.80 116.42 121.28 1s4v h ASP 143 Ca 0.16 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.61 1s4v h ASP 143 Cb 0.56 -0.05 -0.00 0.00 -0.56 0.00 0.00 39.33 39.27 1s4v h ASP 143 CO 0.03 0.20 -0.01 0.15 -1.57 0.00 0.00 179.24 178.04 1s4v h PHE 144 N 0.35 0.21 -0.74 4.55 3.04 -1.76 -2.79 116.94 119.81 1s4v h PHE 144 Ca 0.12 -0.04 0.07 0.00 3.98 0.00 0.00 57.97 62.11 1s4v h PHE 144 Cb 0.01 -0.05 -0.05 0.00 2.56 0.00 0.00 35.95 38.42 1s4v h PHE 144 CO -0.08 0.47 0.48 1.96 -2.02 0.00 0.00 178.31 179.12 1s4v h GLN 145 N -0.11 0.72 -0.67 1.11 4.20 -1.06 -2.11 115.11 117.19 1s4v h GLN 145 Ca 0.03 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1s4v h GLN 145 Cb 0.39 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1s4v h GLN 145 CO 0.01 0.47 0.00 1.19 -0.67 0.00 0.00 178.83 179.83 1s4v n PHE 146 N -4.49 1.11 -1.68 2.96 3.01 -0.32 -4.96 117.46 113.09 1s4v n PHE 146 Ca 0.11 -0.50 -0.44 0.00 1.01 0.00 0.00 57.45 57.64 1s4v n PHE 146 Cb 0.26 -0.09 -0.02 0.00 -0.01 0.00 0.00 39.48 39.61 1s4v n PHE 146 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1s4v n TYR 147 N 1.32 2.20 0.00 1.38 9.36 -0.80 -4.90 117.16 125.72 1s4v n TYR 147 Ca 0.23 0.47 0.00 0.00 3.32 0.00 0.00 57.90 61.92 1s4v n TYR 147 Cb 0.68 -2.45 0.00 0.00 -0.63 0.00 0.00 39.34 36.95 1s4v n TYR 147 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1s4v n SER 148 N 1.71 2.77 -3.60 2.98 2.88 -1.26 -3.30 113.62 115.80 1s4v n SER 148 Ca 0.09 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.54 1s4v n SER 148 Cb 0.33 0.02 -0.02 0.00 -0.75 0.00 0.00 64.21 63.79 1s4v n SER 148 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1s4v s GLU 149 N -1.68 1.42 0.72 -1.46 -1.05 -1.26 -3.43 118.70 111.96 1s4v s GLU 149 Ca 0.00 -0.65 0.00 0.00 -0.15 0.00 0.00 54.97 54.17 1s4v s GLU 149 Cb 0.00 0.57 0.00 0.00 -0.44 0.00 0.00 34.13 34.26 1s4v s GLU 149 CO 0.00 -0.64 0.00 0.41 0.95 0.00 0.00 175.26 175.98 1s4v n GLY 150 N -0.40 -1.91 3.51 -3.83 0.00 -1.26 -4.77 105.19 96.53 1s4v n GLY 150 Ca -0.11 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 1s4v n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s4v s VAL 151 N 0.00 5.07 0.21 1.61 1.01 -1.26 -4.20 120.40 122.84 1s4v s VAL 151 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.59 1s4v s VAL 151 Cb 0.00 -3.99 -0.10 0.00 0.00 0.00 0.00 36.38 32.30 1s4v s VAL 151 CO 0.00 -0.32 1.43 0.12 0.00 0.00 0.00 175.10 176.33 1s4v s PHE 152 N 2.22 3.10 -0.01 5.22 5.36 0.10 -4.81 117.98 129.16 1s4v s PHE 152 Ca 0.14 0.99 0.01 0.00 -0.96 0.00 0.00 56.93 57.12 1s4v s PHE 152 Cb -0.16 -3.78 0.02 0.00 -0.34 0.00 0.00 43.02 38.76 1s4v s PHE 152 CO 0.14 -2.59 0.86 0.25 -1.46 0.00 0.00 175.22 172.41 1s4v n THR 153 N 2.85 0.72 0.00 0.12 -2.24 -1.26 -0.94 114.28 113.53 1s4v n THR 153 Ca 0.08 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 1s4v n THR 153 Cb 0.41 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1s4v n THR 153 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1s4v n GLY 154 N -0.40 0.56 3.90 3.38 0.00 -1.26 -4.92 105.19 106.45 1s4v n GLY 154 Ca 0.01 -2.31 -0.31 0.00 0.00 0.00 0.00 46.02 43.41 1s4v n GLY 154 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1s4v s SER 155 N -1.97 6.47 -0.07 1.61 1.04 -1.26 -4.89 113.70 114.64 1s4v s SER 155 Ca 0.00 0.55 -0.27 0.00 0.48 0.00 0.00 55.95 56.71 1s4v s SER 155 Cb 0.00 -2.08 0.06 0.00 0.10 0.00 0.00 66.02 64.10 1s4v s SER 155 CO 0.00 0.06 0.60 0.00 0.98 0.00 0.00 173.24 174.88 1s4v n GLY 157 N 1.20 -0.33 0.49 0.00 0.00 -1.26 -4.49 105.19 100.79 1s4v n GLY 157 Ca -0.19 -1.77 0.07 0.00 0.00 0.00 0.00 46.02 44.13 1s4v n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1s4v n THR 158 N -1.37 1.92 -3.05 2.61 -2.24 -1.26 -4.09 114.28 106.79 1s4v n THR 158 Ca 0.00 -2.72 -0.45 0.00 -2.27 0.00 0.00 64.05 58.61 1s4v n THR 158 Cb 0.00 -0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.06 1s4v n THR 158 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1s4v s GLU 159 N -2.84 3.57 0.12 -0.78 2.02 -1.26 -4.84 118.70 114.69 1s4v s GLU 159 Ca 0.35 -1.94 -0.34 0.00 0.02 0.00 0.00 54.97 53.06 1s4v s GLU 159 Cb 0.33 -4.73 -0.14 0.00 0.10 0.00 0.00 34.13 29.69 1s4v s GLU 159 CO -0.04 -1.62 1.62 1.28 0.02 0.00 0.00 175.26 176.52 1s4v n LEU 160 N 5.78 3.14 0.00 1.80 4.77 -1.26 -4.31 117.00 126.91 1s4v n LEU 160 Ca 0.19 1.07 0.00 0.00 -0.03 0.00 0.00 56.01 57.24 1s4v n LEU 160 Cb 0.48 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.15 1s4v n LEU 160 CO 0.46 -0.26 0.09 -0.90 -1.33 0.00 0.00 177.39 175.44 1s4v n ASP 161 N 3.88 0.00 -3.73 -1.43 3.85 -0.45 -4.92 116.55 113.74 1s4v n ASP 161 Ca 0.18 -1.00 -0.13 0.00 -0.71 0.00 0.00 54.79 53.13 1s4v n ASP 161 Cb 0.29 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 39.92 1s4v n ASP 161 CO 0.00 0.00 0.00 -2.28 -1.01 0.00 0.00 177.20 173.91 1s4v s HIS 162 N 0.00 -0.25 -0.24 2.11 5.04 -0.46 -4.87 115.29 116.62 1s4v s HIS 162 Ca 0.00 0.64 -0.10 0.00 -1.54 0.00 0.00 55.06 54.06 1s4v s HIS 162 Cb 0.00 -0.03 -0.05 0.00 0.04 0.00 0.00 32.58 32.54 1s4v s HIS 162 CO 0.00 -0.20 0.15 0.20 -2.34 0.00 0.00 174.74 172.54 1s4v s GLY 163 N 1.28 1.95 0.00 1.59 0.00 -1.26 -0.44 107.32 110.44 1s4v s GLY 163 Ca -0.09 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.72 1s4v s GLY 163 CO -0.07 0.40 0.00 3.33 0.00 0.00 0.00 173.10 176.76 1s4v n VAL 164 N 4.36 0.00 -3.78 1.40 0.24 -0.03 -4.35 118.33 116.15 1s4v n VAL 164 Ca -0.15 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.02 1s4v n VAL 164 Cb 0.52 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.78 1s4v n VAL 164 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1s4v s ALA 165 N -2.00 -0.65 -0.16 2.33 0.00 -1.20 -1.40 121.76 118.68 1s4v s ALA 165 Ca 0.00 0.68 -0.21 0.00 0.00 0.00 0.00 51.96 52.43 1s4v s ALA 165 Cb 0.00 -0.38 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1s4v s ALA 165 CO 0.00 -0.14 0.63 0.42 0.00 0.00 0.00 175.76 176.67 1s4v s ILE 166 N -0.01 5.04 -0.40 0.00 1.01 0.34 -0.68 121.20 126.49 1s4v s ILE 166 Ca -0.01 1.22 0.10 0.00 0.00 0.00 0.00 60.65 61.96 1s4v s ILE 166 Cb -0.02 -3.95 0.27 0.00 0.01 0.00 0.00 42.46 38.77 1s4v s ILE 166 CO 0.01 0.16 1.21 1.33 0.00 0.00 0.00 174.94 177.64 1s4v n VAL 167 N 4.42 1.41 0.00 2.92 0.24 0.10 -1.71 118.33 125.72 1s4v n VAL 167 Ca -0.02 -1.38 0.00 0.00 -2.04 0.00 0.00 64.34 60.90 1s4v n VAL 167 Cb 0.50 0.23 0.00 0.00 -1.47 0.00 0.00 33.84 33.10 1s4v n VAL 167 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1s4v n GLY 168 N -0.26 -0.25 3.42 7.63 0.00 -1.18 -0.69 105.19 113.85 1s4v n GLY 168 Ca 0.11 -1.17 -0.13 0.00 0.00 0.00 0.00 46.02 44.84 1s4v n GLY 168 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1s4v s TYR 169 N -2.00 -0.52 0.00 1.61 -0.85 -0.13 -0.39 117.35 115.08 1s4v s TYR 169 Ca 0.00 0.39 0.00 0.00 -0.52 0.00 0.00 57.07 56.94 1s4v s TYR 169 Cb 0.00 0.50 0.00 0.00 0.38 0.00 0.00 41.96 42.84 1s4v s TYR 169 CO 0.00 -0.80 0.00 0.41 -1.52 0.00 0.00 175.55 173.64 1s4v n GLY 170 N -0.17 1.32 2.98 5.49 0.00 -0.87 -1.42 105.19 112.52 1s4v n GLY 170 Ca -0.17 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 1s4v n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s4v s THR 171 N -2.32 -0.04 0.96 2.61 2.01 -1.26 -1.16 115.64 116.44 1s4v s THR 171 Ca 0.00 0.16 -0.12 0.00 0.31 0.00 0.00 61.69 62.03 1s4v s THR 171 Cb 0.00 -0.30 0.17 0.00 0.01 0.00 0.00 72.50 72.38 1s4v s THR 171 CO 0.00 0.06 1.11 0.42 -0.69 0.00 0.00 174.62 175.53 1s4v s THR 172 N 1.15 2.02 0.22 -0.82 -4.23 0.24 -4.86 115.64 109.35 1s4v s THR 172 Ca -0.09 0.01 -0.08 0.00 -1.18 0.00 0.00 61.69 60.35 1s4v s THR 172 Cb -0.10 -2.61 0.17 0.00 1.34 0.00 0.00 72.50 71.29 1s4v s THR 172 CO -0.07 -0.01 1.82 0.40 -0.54 0.00 0.00 174.62 176.22 1s4v h ILE 173 N -1.74 0.97 0.00 2.99 2.04 -2.02 0.19 117.51 119.95 1s4v h ILE 173 Ca -0.53 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1s4v h ILE 173 Cb 1.33 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1s4v h ILE 173 CO 0.60 0.14 0.00 0.47 0.00 0.00 0.00 178.15 179.35 1s4v n ASP 174 N -4.75 0.00 0.00 1.72 10.43 -1.26 -4.87 116.55 117.82 1s4v n ASP 174 Ca 0.10 0.36 0.00 0.00 2.57 0.00 0.00 54.79 57.82 1s4v n ASP 174 Cb 0.19 -0.43 0.00 0.00 1.84 0.00 0.00 41.12 42.72 1s4v n ASP 174 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1s4v n GLY 175 N 0.04 1.04 3.67 0.44 0.00 0.06 -5.08 105.19 105.36 1s4v n GLY 175 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1s4v n GLY 175 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s4v s THR 176 N -2.00 5.12 0.27 2.61 2.01 -1.25 -4.79 115.64 117.60 1s4v s THR 176 Ca 0.00 0.96 -0.28 0.00 0.31 0.00 0.00 61.69 62.68 1s4v s THR 176 Cb 0.00 -3.84 -0.09 0.00 0.01 0.00 0.00 72.50 68.58 1s4v s THR 176 CO 0.00 0.20 0.93 -0.54 -0.69 0.00 0.00 174.62 174.52 1s4v s LYS 177 N 1.47 4.74 0.19 4.92 1.02 -1.26 -0.59 119.74 130.22 1s4v s LYS 177 Ca 0.24 1.41 -0.08 0.00 0.02 0.00 0.00 55.97 57.56 1s4v s LYS 177 Cb -0.15 -3.09 -0.01 0.00 -0.52 0.00 0.00 37.83 34.05 1s4v s LYS 177 CO 0.10 0.43 0.30 1.52 -0.92 0.00 0.00 175.35 176.78 1s4v s TYR 178 N -1.35 0.54 -0.01 3.18 -0.85 -0.31 -0.75 117.35 117.80 1s4v s TYR 178 Ca 0.44 -0.88 0.06 0.00 -0.52 0.00 0.00 57.07 56.18 1s4v s TYR 178 Cb -0.23 -0.09 -0.03 0.00 0.38 0.00 0.00 41.96 41.99 1s4v s TYR 178 CO 0.28 -0.77 -0.19 -1.58 -1.52 0.00 0.00 175.55 171.77 1s4v s TRP 179 N -4.02 2.54 -0.25 -3.49 0.52 0.71 -2.04 118.94 112.91 1s4v s TRP 179 Ca 0.23 -0.27 -0.08 0.00 0.02 0.00 0.00 56.10 55.99 1s4v s TRP 179 Cb 0.03 -1.54 -0.03 0.00 -1.15 0.00 0.00 33.47 30.78 1s4v s TRP 179 CO 0.05 0.14 0.09 0.99 0.02 0.00 0.00 176.95 178.24 1s4v s THR 180 N -0.76 4.52 -0.11 2.01 2.01 0.48 -0.97 115.64 122.82 1s4v s THR 180 Ca 0.12 -0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.03 1s4v s THR 180 Cb -0.10 -3.12 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 1s4v s THR 180 CO 0.02 0.33 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.44 1s4v s VAL 181 N 1.61 2.96 -0.29 3.82 1.01 0.08 0.01 120.40 129.59 1s4v s VAL 181 Ca 0.06 -0.71 -0.17 0.00 0.00 0.00 0.00 61.98 61.16 1s4v s VAL 181 Cb -0.15 -2.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 1s4v s VAL 181 CO 0.05 0.54 0.47 -0.75 0.00 0.00 0.00 175.10 175.41 1s4v s LYS 182 N 0.09 3.93 0.40 2.72 2.20 0.14 -1.26 119.74 127.95 1s4v s LYS 182 Ca -0.06 0.10 0.06 0.00 -0.36 0.00 0.00 55.97 55.70 1s4v s LYS 182 Cb -0.15 -3.70 0.00 0.00 -1.51 0.00 0.00 37.83 32.48 1s4v s LYS 182 CO 0.05 -0.41 0.56 1.21 -0.36 0.00 0.00 175.35 176.39 1s4v s ASN 183 N 1.63 5.79 -0.38 1.43 3.84 -0.89 -3.23 114.94 123.13 1s4v s ASN 183 Ca 0.19 -0.18 0.05 0.00 0.21 0.00 0.00 52.86 53.12 1s4v s ASN 183 Cb -0.16 -1.06 0.45 0.00 -0.55 0.00 0.00 41.25 39.94 1s4v s ASN 183 CO 0.11 -0.64 1.38 -1.54 -2.79 0.00 0.00 177.10 173.62 1s4v n SER 184 N -1.83 5.55 -0.81 -4.21 3.41 -1.26 -4.45 113.62 110.02 1s4v n SER 184 Ca 0.03 -3.76 0.03 0.00 -0.26 0.00 0.00 58.87 54.92 1s4v n SER 184 Cb 0.58 -0.49 0.21 0.00 -0.26 0.00 0.00 64.21 64.25 1s4v n SER 184 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1s4v n TRP 185 N -0.74 0.70 0.00 7.33 8.01 -1.12 -0.91 117.44 130.70 1s4v n TRP 185 Ca 0.48 -1.27 0.00 0.00 -1.31 0.00 0.00 57.50 55.40 1s4v n TRP 185 Cb 0.88 -0.35 0.00 0.00 -2.01 0.00 0.00 31.31 29.83 1s4v n TRP 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1s4v n GLY 186 N -1.01 -1.26 0.07 6.99 0.00 0.10 -4.37 105.19 105.71 1s4v n GLY 186 Ca 0.25 -1.58 0.11 0.00 0.00 0.00 0.00 46.02 44.80 1s4v n GLY 186 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1s4v n PRO 187 N -0.97 0.13 0.25 1.61 -0.04 -1.26 -2.78 135.00 131.93 1s4v n PRO 187 Ca 0.00 0.28 0.14 0.00 -0.04 0.00 0.00 63.50 63.88 1s4v n PRO 187 Cb 0.00 -1.71 0.56 0.00 -0.04 0.00 0.00 33.50 32.31 1s4v n PRO 187 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1s4v h GLU 188 N 0.00 0.00 -6.34 0.54 4.57 -1.89 -3.01 114.58 108.44 1s4v h GLU 188 Ca 0.00 0.00 -0.56 0.00 -1.18 0.00 0.00 59.36 57.62 1s4v h GLU 188 Cb 0.43 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.98 1s4v h GLU 188 CO 0.00 0.09 0.03 -0.46 -1.18 0.00 0.00 179.01 177.49 1s4v s TRP 189 N -3.63 3.80 0.00 0.92 -0.00 -1.12 -4.88 118.94 114.04 1s4v s TRP 189 Ca 0.01 1.36 0.00 0.00 -0.00 0.00 0.00 56.10 57.47 1s4v s TRP 189 Cb 0.09 -2.56 0.00 0.00 -0.00 0.00 0.00 33.47 31.00 1s4v s TRP 189 CO 0.59 0.54 0.00 0.41 -0.00 0.00 0.00 176.95 178.49 1s4v n GLY 190 N 1.53 2.25 3.43 5.86 0.00 -1.21 0.29 105.19 117.35 1s4v n GLY 190 Ca -0.08 -0.39 -0.44 0.00 0.00 0.00 0.00 46.02 45.10 1s4v n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s4v s GLU 191 N 0.00 3.80 -1.48 1.61 2.02 0.44 -4.35 118.70 120.74 1s4v s GLU 191 Ca 0.00 -2.21 -0.05 0.00 0.02 0.00 0.00 54.97 52.73 1s4v s GLU 191 Cb 0.00 -4.87 0.02 0.00 0.10 0.00 0.00 34.13 29.38 1s4v s GLU 191 CO 0.00 -1.67 0.46 1.63 0.02 0.00 0.00 175.26 175.70 1s4v n LYS 192 N 5.65 -3.95 0.00 1.61 5.02 -1.24 -1.88 118.16 123.37 1s4v n LYS 192 Ca 0.27 0.79 0.00 0.00 -2.02 0.00 0.00 58.31 57.35 1s4v n LYS 192 Cb 0.46 -5.58 0.00 0.00 -0.02 0.00 0.00 35.03 29.90 1s4v n LYS 192 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s4v n GLY 193 N -1.32 0.29 3.77 0.72 0.00 0.15 -4.63 105.19 104.16 1s4v n GLY 193 Ca -0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 1s4v n GLY 193 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s4v s TYR 194 N -2.06 2.73 -0.04 1.61 1.51 -0.79 -2.09 117.35 118.22 1s4v s TYR 194 Ca 0.00 -0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 55.64 1s4v s TYR 194 Cb 0.00 -1.76 0.03 0.00 -0.11 0.00 0.00 41.96 40.12 1s4v s TYR 194 CO 0.00 0.24 0.09 -1.50 -1.11 0.00 0.00 175.55 173.27 1s4v s ILE 195 N -2.43 -0.05 -0.25 2.71 2.07 -0.39 -0.42 121.20 122.45 1s4v s ILE 195 Ca 0.40 0.18 -0.15 0.00 -1.41 0.00 0.00 60.65 59.67 1s4v s ILE 195 Cb -0.02 -0.16 -0.04 0.00 0.13 0.00 0.00 42.46 42.37 1s4v s ILE 195 CO 0.24 0.07 0.35 -0.13 -1.91 0.00 0.00 174.94 173.56 1s4v s ARG 196 N 1.01 4.07 -0.09 3.50 0.52 -1.26 -0.74 118.95 125.96 1s4v s ARG 196 Ca -0.08 0.05 0.01 0.00 -0.52 0.00 0.00 55.73 55.19 1s4v s ARG 196 Cb -0.11 -3.61 -0.02 0.00 0.52 0.00 0.00 34.95 31.73 1s4v s ARG 196 CO -0.04 -0.16 -0.12 -1.64 0.02 0.00 0.00 175.30 173.36 1s4v s MET 197 N 1.71 2.92 0.23 3.54 -1.94 -0.15 0.01 119.30 125.62 1s4v s MET 197 Ca 0.15 -0.66 -0.31 0.00 -1.71 0.00 0.00 55.69 53.16 1s4v s MET 197 Cb -0.15 -2.53 -0.14 0.00 2.01 0.00 0.00 34.83 34.02 1s4v s MET 197 CO 0.09 0.46 1.27 -1.91 -0.01 0.00 0.00 175.02 174.92 1s4v n GLU 198 N 2.81 1.66 -4.31 2.03 2.13 -0.12 -0.21 120.64 124.64 1s4v n GLU 198 Ca -0.18 0.59 -0.31 0.00 0.66 0.00 0.00 57.16 57.92 1s4v n GLU 198 Cb 0.52 -2.16 -0.09 0.00 0.27 0.00 0.00 31.44 29.99 1s4v n GLU 198 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1s4v s ARG 199 N -0.62 2.57 -0.66 5.31 3.52 0.07 -4.55 118.95 124.60 1s4v s ARG 199 Ca 0.68 -0.75 -0.03 0.00 -0.13 0.00 0.00 55.73 55.50 1s4v s ARG 199 Cb -0.72 -2.53 0.00 0.00 -1.56 0.00 0.00 34.95 30.14 1s4v s ARG 199 CO 0.52 0.58 0.57 0.41 -0.81 0.00 0.00 175.30 176.58 1s4v n GLY 200 N 1.18 0.12 3.87 8.12 0.00 -1.26 -4.67 105.19 112.55 1s4v n GLY 200 Ca -0.14 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 1s4v n GLY 200 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1s4v s ILE 201 N -3.17 2.05 0.50 -0.61 -4.36 -1.26 -4.97 121.20 109.38 1s4v s ILE 201 Ca 0.17 0.02 0.23 0.00 -0.26 0.00 0.00 60.65 60.81 1s4v s ILE 201 Cb -0.08 -2.96 0.28 0.00 1.25 0.00 0.00 42.46 40.96 1s4v s ILE 201 CO 0.37 -0.02 2.13 0.77 0.24 0.00 0.00 174.94 178.43 1s4v h SER 202 N -1.15 0.00 -3.18 4.36 4.64 -2.00 -3.37 113.55 112.85 1s4v h SER 202 Ca -0.47 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.24 1s4v h SER 202 Cb 1.33 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.29 1s4v h SER 202 CO 0.65 0.07 0.54 -0.62 -0.87 0.00 0.00 176.83 176.60 1s4v s ASP 203 N -6.54 6.33 0.04 4.97 -1.08 -1.26 -4.90 116.67 114.23 1s4v s ASP 203 Ca -0.04 -0.41 0.02 0.00 -0.52 0.00 0.00 52.55 51.60 1s4v s ASP 203 Cb 0.15 -2.43 0.11 0.00 -1.46 0.00 0.00 42.92 39.30 1s4v s ASP 203 CO 0.62 -1.22 0.96 0.29 0.52 0.00 0.00 175.17 176.34 1s4v n LYS 204 N 7.41 0.01 0.00 4.34 5.02 -1.26 -0.47 118.16 133.21 1s4v n LYS 204 Ca 0.01 0.42 0.12 0.00 -2.02 0.00 0.00 58.31 56.84 1s4v n LYS 204 Cb 0.47 -1.66 0.57 0.00 -0.02 0.00 0.00 35.03 34.40 1s4v n LYS 204 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1s4v n GLU 205 N -1.49 0.08 0.00 1.97 1.02 -1.26 -3.90 120.64 117.06 1s4v n GLU 205 Ca -0.00 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1s4v n GLU 205 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1s4v n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s4v n GLY 206 N 1.11 -1.11 3.68 0.62 0.00 0.38 -0.51 105.19 109.36 1s4v n GLY 206 Ca 0.07 -1.53 -0.47 0.00 0.00 0.00 0.00 46.02 44.10 1s4v n GLY 206 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1s4v n LEU 207 N -1.21 3.37 -1.25 0.99 7.94 -1.26 0.39 117.00 125.97 1s4v n LEU 207 Ca 0.00 1.02 -0.16 0.00 -1.11 0.00 0.00 56.01 55.75 1s4v n LEU 207 Cb 0.00 -1.41 -0.07 0.00 0.53 0.00 0.00 43.42 42.47 1s4v n LEU 207 CO 0.00 -0.13 -0.16 0.00 -1.11 0.00 0.00 177.39 176.00 1s4v n GLY 209 N -0.63 0.58 0.36 0.00 0.00 0.16 -0.68 105.19 104.97 1s4v n GLY 209 Ca -0.16 -0.70 0.17 0.00 0.00 0.00 0.00 46.02 45.33 1s4v n GLY 209 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1s4v h ILE 210 N 0.00 0.17 -0.02 -0.61 2.10 -1.31 -0.83 117.51 117.00 1s4v h ILE 210 Ca -0.05 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.89 1s4v h ILE 210 Cb 0.20 0.67 0.00 0.00 -1.09 0.00 0.00 36.82 36.59 1s4v h ILE 210 CO 0.07 0.00 -0.04 0.00 -1.08 0.00 0.00 178.15 177.11 1s4v n ALA 211 N -2.08 2.58 0.04 0.18 0.00 0.34 -4.46 120.51 117.11 1s4v n ALA 211 Ca 0.02 -0.60 -0.14 0.00 0.00 0.00 0.00 53.44 52.72 1s4v n ALA 211 Cb 0.47 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.95 1s4v n ALA 211 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1s4v h MET 212 N 3.71 0.50 -2.01 0.00 2.86 -1.11 -1.17 114.93 117.70 1s4v h MET 212 Ca 0.00 -0.48 -0.53 0.00 -2.06 0.00 0.00 59.70 56.63 1s4v h MET 212 Cb 0.81 0.12 -0.40 0.00 0.06 0.00 0.00 31.60 32.19 1s4v h MET 212 CO 0.00 1.11 -1.11 -1.91 1.06 0.00 0.00 176.91 176.06 1s4v n GLU 213 N -3.82 0.93 -3.91 1.72 4.07 -1.26 -4.67 120.64 113.70 1s4v n GLU 213 Ca -0.07 -3.37 -0.36 0.00 -0.06 0.00 0.00 57.16 53.30 1s4v n GLU 213 Cb 0.79 -1.45 -0.07 0.00 -0.06 0.00 0.00 31.44 30.65 1s4v n GLU 213 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1s4v s ALA 214 N -1.72 3.74 0.16 4.31 0.00 -1.26 -3.26 121.76 123.73 1s4v s ALA 214 Ca 0.37 -0.68 -0.13 0.00 0.00 0.00 0.00 51.96 51.53 1s4v s ALA 214 Cb 0.23 -1.96 0.01 0.00 0.00 0.00 0.00 23.12 21.41 1s4v s ALA 214 CO -0.10 0.47 0.37 -1.54 0.00 0.00 0.00 175.76 174.97 1s4v s SER 215 N -0.58 -0.10 0.12 0.00 1.04 -0.03 -0.32 113.70 113.83 1s4v s SER 215 Ca 0.12 -0.61 -0.12 0.00 0.48 0.00 0.00 55.95 55.82 1s4v s SER 215 Cb -0.12 0.48 0.01 0.00 0.10 0.00 0.00 66.02 66.49 1s4v s SER 215 CO 0.02 -0.92 0.29 -0.72 0.98 0.00 0.00 173.24 172.90 1s4v s TYR 216 N -3.89 0.08 0.49 5.02 -0.85 -0.47 -1.08 117.35 116.65 1s4v s TYR 216 Ca 0.10 -0.46 -0.07 0.00 -0.52 0.00 0.00 57.07 56.12 1s4v s TYR 216 Cb 0.02 0.07 -0.04 0.00 0.38 0.00 0.00 41.96 42.38 1s4v s TYR 216 CO -0.05 -0.65 0.83 -1.25 -1.52 0.00 0.00 175.55 172.91 1s4v s PRO 217 N -3.87 3.60 -0.10 -3.49 0.04 -1.26 -1.36 135.00 128.56 1s4v s PRO 217 Ca 0.07 0.35 0.02 0.00 0.04 0.00 0.00 61.00 61.48 1s4v s PRO 217 Cb 0.03 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 1s4v s PRO 217 CO -0.08 -0.24 -0.14 0.42 0.04 0.00 0.00 177.00 176.99 1s4v s ILE 218 N -2.75 2.98 -0.25 0.56 1.01 -0.24 -4.87 121.20 117.63 1s4v s ILE 218 Ca 0.49 -0.72 -0.02 0.00 0.00 0.00 0.00 60.65 60.41 1s4v s ILE 218 Cb -0.10 -2.21 0.12 0.00 0.01 0.00 0.00 42.46 40.28 1s4v s ILE 218 CO 0.44 0.55 0.29 -0.75 0.00 0.00 0.00 174.94 175.47 1s4v s LYS 219 N -0.07 0.29 -0.10 2.79 2.20 -1.26 0.09 119.74 123.68 1s4v s LYS 219 Ca -0.03 0.09 -0.03 0.00 -0.36 0.00 0.00 55.97 55.64 1s4v s LYS 219 Cb -0.14 -0.80 -0.01 0.00 -1.51 0.00 0.00 37.83 35.37 1s4v s LYS 219 CO 0.04 -0.84 -0.06 0.87 -0.36 0.00 0.00 175.35 175.00 1s4v h LYS 220 N 8.26 0.00 -7.15 4.03 1.57 -1.98 -3.48 116.57 117.83 1s4v h LYS 220 Ca -0.16 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.09 1s4v h LYS 220 Cb 1.12 0.00 0.14 0.00 0.08 0.00 0.00 32.23 33.57 1s4v h LYS 220 CO 0.31 0.00 0.43 0.45 -0.57 0.00 0.00 179.45 180.06 1s4v s SER 221 N -5.26 4.55 0.00 0.86 0.15 -1.26 -4.91 113.70 107.83 1s4v s SER 221 Ca -0.05 2.37 0.19 0.00 0.70 0.00 0.00 55.95 59.16 1s4v s SER 221 Cb 0.01 -2.59 0.51 0.00 -1.71 0.00 0.00 66.02 62.24 1s4v s SER 221 CO 0.07 -2.03 1.43 -1.54 1.20 0.00 0.00 173.24 172.37 1s4v n SER 222 N -2.32 2.83 -4.94 5.45 3.41 -1.26 -4.92 113.62 111.87 1s4v n SER 222 Ca 0.14 -1.96 -0.25 0.00 -0.26 0.00 0.00 58.87 56.54 1s4v n SER 222 Cb 0.50 -0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 64.12 1s4v n SER 222 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1s4v s ASN 223 N -1.17 6.34 0.04 4.04 2.47 -1.26 -4.65 114.94 120.74 1s4v s ASN 223 Ca 0.36 0.43 -0.04 0.00 0.42 0.00 0.00 52.86 54.04 1s4v s ASN 223 Cb 0.19 -2.02 -0.02 0.00 -1.45 0.00 0.00 41.25 37.95 1s4v s ASN 223 CO 0.26 -0.20 0.05 0.20 -3.72 0.00 0.00 177.10 173.69 1s4v s ASN 224 N -3.73 0.24 0.53 -4.21 0.01 -1.26 -4.81 114.94 101.71 1s4v s ASN 224 Ca 0.39 -0.61 -0.20 0.00 -0.71 0.00 0.00 52.86 51.74 1s4v s ASN 224 Cb -0.10 0.20 -0.06 0.00 0.41 0.00 0.00 41.25 41.70 1s4v s ASN 224 CO 0.33 -0.49 1.13 -2.16 -1.51 0.00 0.00 177.10 174.40 1s4v s PRO 225 N -2.62 3.43 0.00 -0.60 0.04 -1.26 -5.04 135.00 128.94 1s4v s PRO 225 Ca -0.05 1.61 0.28 0.00 0.04 0.00 0.00 61.00 62.88 1s4v s PRO 225 Cb -0.01 -2.05 1.67 0.00 0.04 0.00 0.00 34.50 34.15 1s4v s PRO 225 CO -0.05 -0.79 2.02 0.45 0.04 0.00 0.00 177.00 178.67