#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 4.67 0.92 12.58 -7.23 -1.26 -5.09 120.40 125.00 1s4v s VAL 2 Ca 0.00 -0.37 -0.10 0.00 -1.81 0.00 0.00 61.98 59.70 1s4v s VAL 2 Cb 0.00 -3.10 0.15 0.00 0.56 0.00 0.00 36.38 33.99 1s4v s VAL 2 CO 0.00 0.40 1.13 -2.16 -0.31 0.00 0.00 175.10 174.16 1s4v s PRO 3 N -1.57 0.95 0.35 4.82 0.04 -1.26 -4.88 135.00 133.45 1s4v s PRO 3 Ca 0.21 1.42 0.02 0.00 0.04 0.00 0.00 61.00 62.69 1s4v s PRO 3 Cb -0.12 -1.73 0.65 0.00 0.04 0.00 0.00 34.50 33.34 1s4v s PRO 3 CO 0.11 -2.63 2.01 0.00 0.04 0.00 0.00 177.00 176.53 1s4v h ALA 4 N -1.87 1.55 -2.40 8.56 0.00 -1.98 -3.44 119.26 119.68 1s4v h ALA 4 Ca -0.45 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 1s4v h ALA 4 Cb 1.27 -0.25 -0.18 0.00 0.00 0.00 0.00 17.79 18.64 1s4v h ALA 4 CO 0.44 0.41 -0.02 -1.54 0.00 0.00 0.00 179.25 178.54 1s4v s SER 5 N -6.49 -0.41 -0.03 0.00 1.04 -1.26 -4.61 113.70 101.94 1s4v s SER 5 Ca -0.10 0.24 -0.01 0.00 0.48 0.00 0.00 55.95 56.56 1s4v s SER 5 Cb 0.18 0.45 0.03 0.00 0.10 0.00 0.00 66.02 66.78 1s4v s SER 5 CO 0.76 -0.64 0.06 -0.69 0.98 0.00 0.00 173.24 173.71 1s4v s VAL 6 N -1.99 -0.05 -0.34 5.02 1.01 -0.62 -4.99 120.40 118.45 1s4v s VAL 6 Ca -0.08 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1s4v s VAL 6 Cb -0.01 -0.11 0.11 0.00 0.00 0.00 0.00 36.38 36.36 1s4v s VAL 6 CO 0.02 0.08 0.11 -0.62 0.00 0.00 0.00 175.10 174.68 1s4v s ASP 7 N 0.99 4.15 0.58 3.32 -1.08 -1.26 -0.59 116.67 122.77 1s4v s ASP 7 Ca -0.08 -1.91 0.33 0.00 -0.52 0.00 0.00 52.55 50.37 1s4v s ASP 7 Cb -0.11 -1.07 1.77 0.00 -1.46 0.00 0.00 42.92 42.05 1s4v s ASP 7 CO -0.03 -0.38 2.18 -0.50 0.52 0.00 0.00 175.17 176.95 1s4v h TRP 8 N 7.77 0.00 -0.09 -5.34 4.06 -1.34 -0.32 115.95 120.69 1s4v h TRP 8 Ca -0.10 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.82 1s4v h TRP 8 Cb 1.00 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.16 1s4v h TRP 8 CO 0.40 0.05 -0.06 0.00 -3.56 0.00 0.00 178.44 175.28 1s4v h ARG 9 N 0.00 0.20 -0.06 0.49 3.08 -1.92 0.46 114.38 116.63 1s4v h ARG 9 Ca -0.00 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 59.89 1s4v h ARG 9 Cb 0.20 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1s4v h ARG 9 CO 0.01 0.58 -0.30 0.87 -1.07 0.00 0.00 179.97 180.06 1s4v h LYS 10 N -0.18 0.11 0.00 0.04 1.57 -1.80 -1.80 116.57 114.51 1s4v h LYS 10 Ca 0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1s4v h LYS 10 Cb 0.52 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1s4v h LYS 10 CO 0.02 0.40 0.00 1.63 -0.57 0.00 0.00 179.45 180.92 1s4v n LYS 11 N -4.16 0.82 -0.89 3.15 5.02 -0.18 -4.91 118.16 117.01 1s4v n LYS 11 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1s4v n LYS 11 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 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 1.07 0.45 1.08 0.72 0.00 -0.68 -4.97 105.19 102.86 1s4v n GLY 12 Ca 0.21 -0.95 0.08 0.00 0.00 0.00 0.00 46.02 45.37 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 0.67 2.58 -3.31 4.61 0.00 0.10 -4.72 120.51 120.44 1s4v n ALA 13 Ca 0.00 -1.47 -0.26 0.00 0.00 0.00 0.00 53.44 51.71 1s4v n ALA 13 Cb 0.00 -0.73 -0.16 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.50 1.32 0.84 0.00 1.01 -1.24 -3.71 120.40 117.12 1s4v s VAL 14 Ca 0.39 -0.60 -0.10 0.00 0.00 0.00 0.00 61.98 61.67 1s4v s VAL 14 Cb 0.24 -1.17 0.18 0.00 0.00 0.00 0.00 36.38 35.63 1s4v s VAL 14 CO 0.21 0.39 1.14 0.35 0.00 0.00 0.00 175.10 177.19 1s4v n THR 15 N 3.63 0.00 -0.96 3.92 -2.24 -1.26 -4.92 114.28 112.45 1s4v n THR 15 Ca -0.21 -1.16 -0.33 0.00 -2.27 0.00 0.00 64.05 60.08 1s4v n THR 15 Cb 0.52 -1.29 0.14 0.00 -2.10 0.00 0.00 70.33 67.61 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 -3.46 0.83 -4.72 3.42 3.41 -1.26 -4.94 113.62 106.90 1s4v n SER 16 Ca 0.16 0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 58.88 1s4v n SER 16 Cb 0.55 -1.50 -0.03 0.00 -0.26 0.00 0.00 64.21 62.97 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 -2.29 4.20 0.48 -3.33 1.01 -1.26 -5.03 120.40 114.17 1s4v s VAL 17 Ca 0.71 1.67 0.08 0.00 0.00 0.00 0.00 61.98 64.44 1s4v s VAL 17 Cb -0.27 -4.07 0.02 0.00 0.00 0.00 0.00 36.38 32.06 1s4v s VAL 17 CO 0.53 0.18 0.52 -0.54 0.00 0.00 0.00 175.10 175.79 1s4v s LYS 18 N 0.60 2.49 -0.13 2.72 -0.14 -1.26 -4.56 119.74 119.46 1s4v s LYS 18 Ca 0.54 -1.59 -0.01 0.00 -1.36 0.00 0.00 55.97 53.54 1s4v s LYS 18 Cb -0.27 -2.47 0.04 0.00 -1.68 0.00 0.00 37.83 33.45 1s4v s LYS 18 CO 0.31 -0.45 -0.02 0.34 -0.76 0.00 0.00 175.35 174.77 1s4v s ASP 19 N -4.33 2.25 0.11 2.83 -1.08 -1.26 -1.15 116.67 114.05 1s4v s ASP 19 Ca 0.50 -0.41 0.19 0.00 -0.52 0.00 0.00 52.55 52.31 1s4v s ASP 19 Cb -0.05 -0.64 0.79 0.00 -1.46 0.00 0.00 42.92 41.56 1s4v s ASP 19 CO 0.30 -0.20 1.59 0.00 0.52 0.00 0.00 175.17 177.37 1s4v n GLN 20 N 5.03 0.09 0.00 4.34 10.64 0.07 -4.90 117.38 132.66 1s4v n GLN 20 Ca -0.09 0.31 0.00 0.00 -1.83 0.00 0.00 57.00 55.39 1s4v n GLN 20 Cb 0.49 -1.66 0.00 0.00 -0.86 0.00 0.00 30.24 28.21 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 0.07 0.70 2.49 2.61 0.00 -1.26 -3.73 105.19 106.06 1s4v n GLY 21 Ca 0.03 -0.77 -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 4.27 -3.69 1.61 1.13 -1.26 -4.80 117.38 114.63 1s4v n GLN 22 Ca 0.00 -3.17 -0.11 0.00 -1.94 0.00 0.00 57.00 51.78 1s4v n GLN 22 Cb 0.00 -2.71 -0.12 0.00 0.11 0.00 0.00 30.24 27.52 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 4.66 3.90 1.30 0.00 0.00 0.10 -4.53 105.19 110.63 1s4v n GLY 24 Ca -0.18 -1.36 0.06 0.00 0.00 0.00 0.00 46.02 44.54 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 4.59 4.46 -0.33 1.61 3.41 -1.26 -2.13 113.62 123.97 1s4v n SER 25 Ca 0.63 -3.05 0.17 0.00 -0.26 0.00 0.00 58.87 56.36 1s4v n SER 25 Cb 0.26 -0.61 0.40 0.00 -0.26 0.00 0.00 64.21 64.00 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 0.60 1.06 -0.28 0.00 5.08 -1.83 0.03 115.95 120.60 1s4v h TRP 27 Ca 0.58 0.03 -0.11 0.00 1.08 0.00 0.00 58.89 60.46 1s4v h TRP 27 Cb 1.12 -0.35 -0.00 0.00 -3.00 0.00 0.00 29.16 26.92 1s4v h TRP 27 CO -0.00 0.59 -0.26 0.00 -1.28 0.00 0.00 178.44 177.48 1s4v h ALA 28 N 1.49 0.42 -0.60 0.11 0.00 -1.24 -2.24 119.26 117.20 1s4v h ALA 28 Ca 0.37 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1s4v h ALA 28 Cb 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1s4v h ALA 28 CO -0.13 0.41 0.18 0.74 0.00 0.00 0.00 179.25 180.46 1s4v h PHE 29 N 0.42 0.97 -0.33 0.00 -1.00 -1.08 -0.98 116.94 114.95 1s4v h PHE 29 Ca 0.05 -0.10 0.01 0.00 2.81 0.00 0.00 57.97 60.74 1s4v h PHE 29 Cb 0.83 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 40.09 1s4v h PHE 29 CO 0.07 0.80 0.19 1.03 -1.61 0.00 0.00 178.31 178.79 1s4v h SER 30 N 0.85 0.30 -0.08 2.17 0.87 -0.97 -1.89 113.55 114.80 1s4v h SER 30 Ca 0.19 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1s4v h SER 30 Cb 0.29 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 1s4v h SER 30 CO -0.01 0.22 0.03 0.74 -0.53 0.00 0.00 176.83 177.28 1s4v h THR 31 N 0.38 0.98 -0.44 2.23 2.02 -1.16 -2.89 112.91 114.03 1s4v h THR 31 Ca 0.13 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.29 1s4v h THR 31 Cb 0.01 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1s4v h THR 31 CO -0.06 0.01 0.27 0.40 0.37 0.00 0.00 175.52 176.51 1s4v h ILE 32 N 0.07 1.12 -0.54 3.11 1.08 -0.93 -1.87 117.51 119.54 1s4v h ILE 32 Ca 0.03 -0.26 -0.00 0.00 -0.39 0.00 0.00 64.86 64.24 1s4v h ILE 32 Cb 0.02 0.49 -0.03 0.00 -3.07 0.00 0.00 36.82 34.23 1s4v h ILE 32 CO -0.04 0.12 0.32 0.58 -0.69 0.00 0.00 178.15 178.45 1s4v h VAL 33 N 0.60 1.17 -0.57 1.67 2.07 -1.14 0.16 116.25 120.21 1s4v h VAL 33 Ca 0.16 -0.39 -0.10 0.00 0.82 0.00 0.00 66.70 67.20 1s4v h VAL 33 Cb -0.04 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1s4v h VAL 33 CO -0.03 0.17 -0.03 0.00 0.02 0.00 0.00 177.57 177.70 1s4v h ALA 34 N 1.16 0.77 -0.20 1.67 0.00 -1.38 -1.36 119.26 119.92 1s4v h ALA 34 Ca 0.19 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1s4v h ALA 34 Cb -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1s4v h ALA 34 CO -0.04 0.63 -0.21 0.28 0.00 0.00 0.00 179.25 179.91 1s4v h VAL 35 N 0.91 1.33 -0.95 0.00 2.07 -1.01 -1.69 116.25 116.91 1s4v h VAL 35 Ca 0.16 -1.38 0.07 0.00 0.82 0.00 0.00 66.70 66.37 1s4v h VAL 35 Cb 0.59 1.76 -0.06 0.00 -1.52 0.00 0.00 31.29 32.06 1s4v h VAL 35 CO 0.04 0.42 0.62 -0.33 0.02 0.00 0.00 177.57 178.33 1s4v h GLU 36 N 0.18 1.05 0.47 1.57 5.08 -0.64 -1.47 114.58 120.83 1s4v h GLU 36 Ca 0.03 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1s4v h GLU 36 Cb 0.76 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1s4v h GLU 36 CO 0.05 0.70 -0.23 0.78 -1.00 0.00 0.00 179.01 179.31 1s4v h GLY 37 N 1.08 -0.66 1.74 -3.84 0.00 -1.09 -2.69 103.07 97.62 1s4v h GLY 37 Ca 0.41 0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.99 1s4v h GLY 37 CO -0.16 -0.24 0.15 1.19 0.00 0.00 0.00 176.54 177.48 1s4v h ILE 38 N -0.91 1.08 -0.36 2.60 6.09 -1.18 -1.68 117.51 123.16 1s4v h ILE 38 Ca -0.06 -0.18 -0.01 0.00 -1.37 0.00 0.00 64.86 63.23 1s4v h ILE 38 Cb 0.58 0.71 -0.02 0.00 0.47 0.00 0.00 36.82 38.57 1s4v h ILE 38 CO 0.11 0.08 0.17 -1.13 -3.07 0.00 0.00 178.15 174.30 1s4v h ASN 39 N 0.36 0.47 -0.21 2.19 -1.24 -1.24 -0.86 115.58 115.04 1s4v h ASN 39 Ca 0.10 -0.13 -0.11 0.00 0.71 0.00 0.00 56.30 56.86 1s4v h ASN 39 Cb -0.01 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 38.91 1s4v h ASN 39 CO -0.02 0.47 -0.22 -0.61 -1.29 0.00 0.00 177.43 175.76 1s4v h GLN 40 N 0.43 0.67 -0.59 6.67 -0.00 -1.06 0.14 115.11 121.38 1s4v h GLN 40 Ca 0.12 -0.26 -0.06 0.00 -0.00 0.00 0.00 58.65 58.46 1s4v h GLN 40 Cb 0.13 -0.04 -0.03 0.00 0.00 0.00 0.00 27.48 27.55 1s4v h GLN 40 CO -0.01 0.84 0.14 0.82 0.00 0.00 0.00 178.83 180.62 1s4v h ILE 41 N 0.59 1.24 0.13 2.39 2.04 -1.05 0.26 117.51 123.12 1s4v h ILE 41 Ca 0.09 -0.86 -0.27 0.00 1.00 0.00 0.00 64.86 64.82 1s4v h ILE 41 Cb 0.70 0.63 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1s4v h ILE 41 CO 0.05 0.32 -1.33 0.11 0.00 0.00 0.00 178.15 177.31 1s4v h LYS 42 N 0.87 0.28 -0.00 2.37 1.79 -0.88 -3.39 116.57 117.61 1s4v h LYS 42 Ca 0.19 -0.48 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 1s4v h LYS 42 Cb 0.31 0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 1s4v h LYS 42 CO -0.00 1.23 -0.91 0.25 -1.08 0.00 0.00 179.45 178.94 1s4v n THR 43 N -3.93 0.00 -1.27 -0.16 -2.24 0.46 -4.75 114.28 102.39 1s4v n THR 43 Ca -0.22 -0.04 -0.09 0.00 -2.27 0.00 0.00 64.05 61.43 1s4v n THR 43 Cb 0.91 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 70.12 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 -1.29 -4.46 -4.03 3.42 5.15 0.92 -5.00 115.26 109.98 1s4v n ASN 44 Ca 0.05 0.23 -0.28 0.00 -0.60 0.00 0.00 54.58 53.97 1s4v n ASN 44 Cb 0.35 -2.78 -0.17 0.00 -0.53 0.00 0.00 39.78 36.65 1s4v n ASN 44 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1s4v s LYS 45 N -2.60 2.10 -0.34 1.20 1.02 -1.25 -5.03 119.74 114.84 1s4v s LYS 45 Ca 0.00 -0.51 -0.21 0.00 0.02 0.00 0.00 55.97 55.27 1s4v s LYS 45 Cb 0.00 -1.86 -0.00 0.00 -0.52 0.00 0.00 37.83 35.45 1s4v s LYS 45 CO 0.00 -0.12 0.67 -1.17 -0.92 0.00 0.00 175.35 173.80 1s4v s LEU 46 N 1.17 4.19 -0.11 3.17 2.96 -1.26 -3.77 118.68 125.03 1s4v s LEU 46 Ca -0.03 0.31 0.03 0.00 -0.22 0.00 0.00 54.13 54.21 1s4v s LEU 46 Cb -0.14 -2.85 -0.00 0.00 0.50 0.00 0.00 46.19 43.69 1s4v s LEU 46 CO -0.04 -0.58 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.51 1s4v s VAL 47 N 2.75 2.33 -0.04 1.68 1.01 -1.26 -5.09 120.40 121.78 1s4v s VAL 47 Ca 0.26 -0.92 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 1s4v s VAL 47 Cb -0.14 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 1s4v s VAL 47 CO 0.14 0.55 0.92 -0.55 0.00 0.00 0.00 175.10 176.16 1s4v s SER 48 N 0.34 7.25 0.41 3.32 0.15 -1.26 -4.77 113.70 119.13 1s4v s SER 48 Ca -0.17 1.52 0.08 0.00 0.70 0.00 0.00 55.95 58.08 1s4v s SER 48 Cb -0.17 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.59 1s4v s SER 48 CO 0.08 -0.26 0.41 -0.76 1.20 0.00 0.00 173.24 173.90 1s4v s LEU 49 N 1.16 3.48 -0.70 3.45 1.43 -1.26 -1.42 118.68 124.82 1s4v s LEU 49 Ca 0.48 -0.64 -0.25 0.00 -1.03 0.00 0.00 54.13 52.69 1s4v s LEU 49 Cb -0.20 -2.21 0.05 0.00 0.03 0.00 0.00 46.19 43.86 1s4v s LEU 49 CO 0.24 -0.63 1.14 -0.55 0.23 0.00 0.00 176.35 176.77 1s4v s SER 50 N -4.16 6.17 0.23 2.29 0.15 -0.44 -4.01 113.70 113.94 1s4v s SER 50 Ca 0.49 -0.68 0.01 0.00 0.70 0.00 0.00 55.95 56.47 1s4v s SER 50 Cb -0.05 -2.50 0.25 0.00 -1.71 0.00 0.00 66.02 62.01 1s4v s SER 50 CO 0.29 -1.65 1.58 -0.33 1.20 0.00 0.00 173.24 174.33 1s4v h GLU 51 N 9.81 0.40 -0.68 5.44 3.07 -1.89 -3.05 114.58 127.69 1s4v h GLU 51 Ca -0.28 -0.23 -0.00 0.00 -0.50 0.00 0.00 59.36 58.35 1s4v h GLU 51 Cb 1.06 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.95 1s4v h GLU 51 CO 1.23 0.81 0.42 0.37 -1.40 0.00 0.00 179.01 180.44 1s4v h GLN 52 N 0.32 0.90 -0.64 2.33 5.75 -1.86 -1.51 115.11 120.40 1s4v h GLN 52 Ca 0.01 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1s4v h GLN 52 Cb 0.99 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 29.31 1s4v h GLN 52 CO 0.09 0.63 0.41 1.49 -2.65 0.00 0.00 178.83 178.79 1s4v h GLU 53 N 0.92 0.85 0.07 1.69 4.81 -1.77 0.84 114.58 121.99 1s4v h GLU 53 Ca 0.24 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1s4v h GLU 53 Cb -0.06 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.14 1s4v h GLU 53 CO -0.05 0.58 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.71 1s4v h LEU 54 N 0.86 -0.08 -0.24 1.64 3.38 -1.45 0.36 115.31 119.78 1s4v h LEU 54 Ca 0.23 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.17 1s4v h LEU 54 Cb -0.07 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 1s4v h LEU 54 CO -0.05 0.04 -0.16 0.58 0.09 0.00 0.00 178.44 178.94 1s4v h VAL 55 N -0.20 0.53 -0.08 1.22 2.07 -0.82 -0.44 116.25 118.52 1s4v h VAL 55 Ca -0.01 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.32 1s4v h VAL 55 Cb 0.17 0.53 0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1s4v h VAL 55 CO 0.02 0.00 -0.70 0.44 0.02 0.00 0.00 177.57 177.34 1s4v h ASP 56 N -0.15 0.77 0.06 0.57 3.32 -0.74 -3.36 116.42 116.88 1s4v h ASP 56 Ca 0.14 -0.67 -0.21 0.00 0.02 0.00 0.00 57.03 56.30 1s4v h ASP 56 Cb 0.36 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 1s4v h ASP 56 CO -0.33 1.32 -2.16 0.00 -1.72 0.00 0.00 179.24 176.35 1s4v n ASP 58 N -2.57 5.06 -0.50 0.00 4.64 -0.18 -4.69 116.55 118.31 1s4v n ASP 58 Ca -0.20 -2.96 0.06 0.00 -1.38 0.00 0.00 54.79 50.31 1s4v n ASP 58 Cb 0.90 -1.64 0.07 0.00 -1.04 0.00 0.00 41.12 39.41 1s4v n ASP 58 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1s4v n THR 59 N 5.29 0.21 -0.26 5.18 -2.24 -1.26 -4.07 114.28 117.13 1s4v n THR 59 Ca 0.42 -0.60 0.03 0.00 -2.27 0.00 0.00 64.05 61.63 1s4v n THR 59 Cb 0.44 1.09 0.16 0.00 -2.10 0.00 0.00 70.33 69.91 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 2.22 0.50 0.00 3.42 3.32 -2.00 -3.40 116.42 120.48 1s4v h ASP 60 Ca 0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1s4v h ASP 60 Cb 0.53 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1s4v h ASP 60 CO 0.00 0.27 -0.40 0.00 -1.72 0.00 0.00 179.24 177.39 1s4v n GLN 61 N -4.85 0.00 -1.71 3.56 3.00 -1.26 -5.08 117.38 111.04 1s4v n GLN 61 Ca 0.12 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.74 1s4v n GLN 61 Cb 0.30 -0.42 0.06 0.00 0.00 0.00 0.00 30.24 30.18 1s4v n GLN 61 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1s4v n ASN 62 N -2.34 1.87 -1.91 1.08 3.02 -1.26 -4.95 115.26 110.76 1s4v n ASN 62 Ca 0.00 0.83 -0.22 0.00 -0.03 0.00 0.00 54.58 55.16 1s4v n ASN 62 Cb 0.20 -1.53 0.06 0.00 -0.61 0.00 0.00 39.78 37.90 1s4v n ASN 62 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s4v n GLN 63 N -1.67 3.20 0.00 3.52 6.02 0.17 -4.42 117.38 124.20 1s4v n GLN 63 Ca 0.15 -3.90 0.00 0.00 -0.01 0.00 0.00 57.00 53.24 1s4v n GLN 63 Cb 0.48 -2.20 0.00 0.00 1.02 0.00 0.00 30.24 29.53 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 -0.80 3.23 0.00 1.08 0.00 -1.25 -0.28 105.19 107.17 1s4v n GLY 64 Ca 0.45 0.24 0.09 0.00 0.00 0.00 0.00 46.02 46.79 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 -1.15 4.76 0.00 0.00 5.15 0.62 -0.72 115.26 123.92 1s4v n ASN 66 Ca 0.11 -2.68 0.00 0.00 -0.60 0.00 0.00 54.58 51.40 1s4v n ASN 66 Cb 0.10 -0.58 0.00 0.00 -0.53 0.00 0.00 39.78 38.77 1s4v n ASN 66 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1s4v n GLY 67 N 0.59 2.19 0.00 8.20 0.00 -0.90 -4.79 105.19 110.48 1s4v n GLY 67 Ca 0.24 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.33 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 1.64 0.99 2.96 -0.02 0.00 -1.26 0.45 105.19 109.95 1s4v n GLY 68 Ca 0.00 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 45.04 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 2.00 0.21 0.99 2.96 -1.26 -4.75 118.68 118.82 1s4v s LEU 69 Ca 0.00 -0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 53.70 1s4v s LEU 69 Cb 0.00 -0.29 0.16 0.00 0.50 0.00 0.00 46.19 46.56 1s4v s LEU 69 CO 0.00 0.07 1.87 0.24 -1.32 0.00 0.00 176.35 177.21 1s4v h MET 70 N 6.02 0.95 -0.81 1.98 2.86 -1.98 -2.70 114.93 121.25 1s4v h MET 70 Ca -0.28 -0.06 0.09 0.00 -2.06 0.00 0.00 59.70 57.39 1s4v h MET 70 Cb 1.19 -0.21 -0.07 0.00 0.06 0.00 0.00 31.60 32.56 1s4v h MET 70 CO 0.50 0.63 0.46 -0.44 1.06 0.00 0.00 176.91 179.12 1s4v h ASP 71 N 0.98 0.67 0.04 1.22 3.45 -1.97 -0.19 116.42 120.62 1s4v h ASP 71 Ca 0.27 0.05 -0.10 0.00 0.43 0.00 0.00 57.03 57.68 1s4v h ASP 71 Cb -0.09 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.58 1s4v h ASP 71 CO -0.07 0.39 -0.29 1.88 -1.57 0.00 0.00 179.24 179.58 1s4v h TYR 72 N 0.79 0.44 -0.35 4.55 0.05 -1.94 -2.37 116.97 118.14 1s4v h TYR 72 Ca 0.39 -0.10 -0.14 0.00 0.05 0.00 0.00 58.73 58.93 1s4v h TYR 72 Cb 0.34 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 1s4v h TYR 72 CO -0.06 0.65 -0.35 0.00 -1.05 0.00 0.00 178.16 177.35 1s4v h ALA 73 N 1.35 0.73 -0.70 3.88 0.00 -0.88 -1.10 119.26 122.54 1s4v h ALA 73 Ca 0.05 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 1s4v h ALA 73 Cb 0.69 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1s4v h ALA 73 CO 0.05 0.66 0.18 0.74 0.00 0.00 0.00 179.25 180.89 1s4v h PHE 74 N 0.67 1.16 -0.70 0.00 0.04 -0.85 -1.32 116.94 115.94 1s4v h PHE 74 Ca 0.07 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 1s4v h PHE 74 Cb 0.90 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.68 1s4v h PHE 74 CO 0.05 0.93 0.41 1.49 -0.60 0.00 0.00 178.31 180.59 1s4v h GLU 75 N 1.06 0.95 -0.03 1.51 4.57 -1.17 -0.20 114.58 121.27 1s4v h GLU 75 Ca 0.22 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.32 1s4v h GLU 75 Cb 0.35 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1s4v h GLU 75 CO -0.00 0.68 -0.00 0.35 -1.18 0.00 0.00 179.01 178.86 1s4v h PHE 76 N 0.95 -0.01 -0.97 0.92 3.57 -0.57 -0.46 116.94 120.38 1s4v h PHE 76 Ca 0.25 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.76 1s4v h PHE 76 Cb -0.01 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 1s4v h PHE 76 CO -0.01 -0.01 0.64 0.82 -2.23 0.00 0.00 178.31 177.52 1s4v h ILE 77 N 0.00 1.25 -0.09 1.41 2.04 -0.92 0.34 117.51 121.54 1s4v h ILE 77 Ca 0.01 -0.47 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 1s4v h ILE 77 Cb 0.02 -0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 35.92 1s4v h ILE 77 CO -0.02 0.25 0.04 0.50 0.00 0.00 0.00 178.15 178.91 1s4v h LYS 78 N 1.32 0.14 0.00 2.37 3.64 -0.66 0.73 116.57 124.12 1s4v h LYS 78 Ca 0.36 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.63 1s4v h LYS 78 Cb -0.14 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 1s4v h LYS 78 CO -0.08 0.26 -0.37 1.96 -2.27 0.00 0.00 179.45 178.95 1s4v h GLN 79 N -0.01 0.00 -0.00 1.90 4.20 -0.68 -2.83 115.11 117.69 1s4v h GLN 79 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1s4v h GLN 79 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1s4v h GLN 79 CO -0.00 0.37 -0.13 0.54 -0.67 0.00 0.00 178.83 178.94 1s4v n ARG 80 N -3.85 0.47 -0.77 1.46 5.12 0.07 -4.88 116.66 114.28 1s4v n ARG 80 Ca -0.01 -0.15 0.00 0.00 -1.93 0.00 0.00 57.85 55.76 1s4v n ARG 80 Cb 0.44 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.24 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 1.34 0.64 0.00 -0.13 0.00 -1.07 -4.92 105.19 101.05 1s4v n GLY 81 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.70 1.03 3.20 -0.02 0.00 0.23 -4.33 105.19 102.58 1s4v n GLY 82 Ca 0.00 -1.95 -0.26 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.07 1.50 0.85 -0.61 1.10 -0.14 -4.75 121.20 118.08 1s4v s ILE 83 Ca 0.00 -0.86 -0.12 0.00 -0.51 0.00 0.00 60.65 59.16 1s4v s ILE 83 Cb 0.00 -1.26 0.12 0.00 0.15 0.00 0.00 42.46 41.48 1s4v s ILE 83 CO 0.00 0.38 1.21 0.28 -2.11 0.00 0.00 174.94 174.70 1s4v s THR 84 N -0.50 2.04 0.68 4.00 -1.32 -1.26 -0.79 115.64 118.49 1s4v s THR 84 Ca 0.07 -0.05 -0.11 0.00 -1.21 0.00 0.00 61.69 60.39 1s4v s THR 84 Cb -0.07 -2.98 0.00 0.00 -1.51 0.00 0.00 72.50 67.93 1s4v s THR 84 CO -0.00 0.00 1.06 0.42 -2.21 0.00 0.00 174.62 173.88 1s4v s THR 85 N -3.64 4.11 0.17 5.08 -4.23 -1.26 -1.32 115.64 114.55 1s4v s THR 85 Ca 0.66 0.69 -0.12 0.00 -1.18 0.00 0.00 61.69 61.74 1s4v s THR 85 Cb -0.08 -3.50 0.08 0.00 1.34 0.00 0.00 72.50 70.33 1s4v s THR 85 CO 0.50 -0.90 1.73 -0.08 -0.54 0.00 0.00 174.62 175.34 1s4v h GLU 86 N -0.64 0.88 -0.74 3.99 4.57 -1.37 -1.46 114.58 119.80 1s4v h GLU 86 Ca -0.44 -0.15 0.06 0.00 -1.18 0.00 0.00 59.36 57.65 1s4v h GLU 86 Cb 1.21 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 29.60 1s4v h GLU 86 CO 0.59 0.75 0.43 0.00 -1.18 0.00 0.00 179.01 179.59 1s4v h ALA 87 N 1.09 1.02 -0.01 2.92 0.00 -1.93 0.57 119.26 122.92 1s4v h ALA 87 Ca 0.20 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.95 1s4v h ALA 87 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1s4v h ALA 87 CO -0.02 0.12 -0.77 -0.97 0.00 0.00 0.00 179.25 177.61 1s4v h ASN 88 N 0.78 0.14 -2.27 0.00 -1.24 -1.86 -3.38 115.58 107.75 1s4v h ASN 88 Ca 0.33 -0.10 -0.58 0.00 0.71 0.00 0.00 56.30 56.66 1s4v h ASN 88 Cb 0.20 -0.04 -0.39 0.00 0.73 0.00 0.00 38.32 38.83 1s4v h ASN 88 CO -0.19 0.85 -0.99 0.00 -1.29 0.00 0.00 177.43 175.82 1s4v n TYR 89 N -3.69 -0.37 -2.06 0.67 4.19 -0.58 -4.95 117.16 110.38 1s4v n TYR 89 Ca -0.02 -3.47 -0.37 0.00 3.31 0.00 0.00 57.90 57.35 1s4v n TYR 89 Cb 0.74 -0.02 0.02 0.00 0.49 0.00 0.00 39.34 40.57 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 3.30 -0.02 2.98 0.04 0.15 -4.44 135.00 136.48 1s4v s PRO 90 Ca 0.33 1.90 -0.30 0.00 0.04 0.00 0.00 61.00 62.97 1s4v s PRO 90 Cb 0.08 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1s4v s PRO 90 CO -0.16 -0.96 1.22 -0.47 0.04 0.00 0.00 177.00 176.67 1s4v s TYR 91 N -1.52 3.21 -0.05 0.56 5.04 -1.26 -4.78 117.35 118.55 1s4v s TYR 91 Ca 0.71 1.19 0.07 0.00 -2.44 0.00 0.00 57.07 56.60 1s4v s TYR 91 Cb -0.32 -3.45 0.11 0.00 0.35 0.00 0.00 41.96 38.66 1s4v s TYR 91 CO 0.37 -1.43 1.00 0.39 -1.34 0.00 0.00 175.55 174.54 1s4v n GLU 92 N 4.94 1.65 -3.95 4.97 1.02 -1.26 -5.04 120.64 122.97 1s4v n GLU 92 Ca 0.11 -1.73 -0.41 0.00 -0.02 0.00 0.00 57.16 55.10 1s4v n GLU 92 Cb 0.46 -1.07 0.02 0.00 -0.02 0.00 0.00 31.44 30.83 1s4v n GLU 92 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s4v n ALA 93 N -0.74 -2.56 -3.72 0.62 0.00 -1.26 -4.97 120.51 107.87 1s4v n ALA 93 Ca 0.06 -0.47 -0.07 0.00 0.00 0.00 0.00 53.44 52.96 1s4v n ALA 93 Cb 0.48 -3.05 -0.02 0.00 0.00 0.00 0.00 19.45 16.86 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 -3.54 -0.26 -0.64 0.00 -0.85 -1.26 -4.63 117.35 106.17 1s4v s TYR 94 Ca 0.47 -0.10 -0.22 0.00 -0.52 0.00 0.00 57.07 56.70 1s4v s TYR 94 Cb -0.23 0.65 0.08 0.00 0.38 0.00 0.00 41.96 42.84 1s4v s TYR 94 CO 0.94 -1.02 0.91 -0.51 -1.52 0.00 0.00 175.55 174.35 1s4v s ASP 95 N -2.86 6.17 0.43 -0.18 1.11 -1.26 -4.83 116.67 115.25 1s4v s ASP 95 Ca 0.09 -1.09 0.05 0.00 0.18 0.00 0.00 52.55 51.77 1s4v s ASP 95 Cb -0.04 -2.39 0.01 0.00 1.07 0.00 0.00 42.92 41.57 1s4v s ASP 95 CO 0.01 -1.37 0.60 -0.83 1.18 0.00 0.00 175.17 174.76 1s4v s GLY 96 N 3.67 1.75 0.13 0.21 0.00 -1.26 -5.06 107.32 106.76 1s4v s GLY 96 Ca 0.20 -1.43 -0.28 0.00 0.00 0.00 0.00 44.72 43.21 1s4v s GLY 96 CO 0.09 -1.26 0.88 -1.59 0.00 0.00 0.00 173.10 171.22 1s4v s THR 97 N -2.42 4.44 -0.18 0.90 2.01 -1.26 -4.45 115.64 114.67 1s4v s THR 97 Ca 0.51 1.91 -0.35 0.00 0.31 0.00 0.00 61.69 64.07 1s4v s THR 97 Cb -0.10 -4.24 -0.11 0.00 0.01 0.00 0.00 72.50 68.05 1s4v s THR 97 CO 0.34 0.40 1.97 0.00 -0.69 0.00 0.00 174.62 176.64 1s4v s ASP 99 N 5.15 6.37 0.35 0.00 -1.08 -1.26 -4.88 116.67 121.33 1s4v s ASP 99 Ca 0.98 -1.33 0.10 0.00 -0.52 0.00 0.00 52.55 51.78 1s4v s ASP 99 Cb -0.74 -2.46 0.85 0.00 -1.46 0.00 0.00 42.92 39.11 1s4v s ASP 99 CO 0.51 -1.39 1.84 0.58 0.52 0.00 0.00 175.17 177.24 1s4v h VAL 100 N 6.08 0.77 -0.67 1.11 2.07 -1.98 -0.42 116.25 123.21 1s4v h VAL 100 Ca -0.06 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 1s4v h VAL 100 Cb 1.04 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1s4v h VAL 100 CO 1.21 0.12 0.40 0.77 0.02 0.00 0.00 177.57 180.10 1s4v h SER 101 N 0.66 0.80 0.65 0.57 4.64 -1.97 -1.69 113.55 117.20 1s4v h SER 101 Ca 0.49 -0.04 -0.27 0.00 -0.47 0.00 0.00 61.79 61.50 1s4v h SER 101 Cb 0.86 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.72 1s4v h SER 101 CO -0.24 0.61 -1.42 0.11 -0.87 0.00 0.00 176.83 175.02 1s4v h LYS 102 N 0.92 0.06 -0.03 4.77 1.57 -1.65 -3.32 116.57 118.90 1s4v h LYS 102 Ca 0.24 -0.11 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1s4v h LYS 102 Cb -0.04 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1s4v h LYS 102 CO -0.05 0.83 -0.30 1.49 -0.57 0.00 0.00 179.45 180.86 1s4v h GLU 103 N 0.02 0.05 -0.95 3.15 4.81 -0.83 -2.90 114.58 117.92 1s4v h GLU 103 Ca -0.18 -0.01 -0.23 0.00 -0.13 0.00 0.00 59.36 58.80 1s4v h GLU 103 Cb 1.93 -0.00 -0.14 0.00 0.63 0.00 0.00 28.75 31.17 1s4v h GLU 103 CO 0.12 0.34 0.30 0.09 -0.73 0.00 0.00 179.01 179.12 1s4v n ASN 104 N -4.17 3.48 -2.69 1.04 3.02 -0.66 -4.08 115.26 111.19 1s4v n ASN 104 Ca -0.02 -2.83 -0.21 0.00 -0.03 0.00 0.00 54.58 51.49 1s4v n ASN 104 Cb 0.35 -0.67 -0.00 0.00 -0.61 0.00 0.00 39.78 38.85 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 -0.27 4.21 -1.71 5.41 0.00 -1.09 -5.07 120.51 121.99 1s4v n ALA 105 Ca 0.30 -3.96 -0.40 0.00 0.00 0.00 0.00 53.44 49.38 1s4v n ALA 105 Cb 1.09 -0.73 0.03 0.00 0.00 0.00 0.00 19.45 19.84 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 -0.24 1.75 -0.02 0.00 -0.04 -1.26 -4.33 135.00 130.87 1s4v n PRO 106 Ca 0.28 0.63 -0.00 0.00 -0.04 0.00 0.00 63.50 64.37 1s4v n PRO 106 Cb 0.66 -2.43 -0.04 0.00 -0.04 0.00 0.00 33.50 31.65 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 -0.64 2.00 -3.71 0.55 0.00 0.03 -4.85 120.51 113.90 1s4v n ALA 107 Ca 0.08 -0.27 -0.20 0.00 0.00 0.00 0.00 53.44 53.06 1s4v n ALA 107 Cb 0.42 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.70 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 -2.24 0.10 0.29 0.00 1.01 -0.85 -4.85 120.40 113.85 1s4v s VAL 108 Ca -0.02 0.24 0.07 0.00 0.00 0.00 0.00 61.98 62.27 1s4v s VAL 108 Cb 0.02 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.10 1s4v s VAL 108 CO 0.23 0.19 0.28 -0.94 0.00 0.00 0.00 175.10 174.86 1s4v s SER 109 N 1.74 5.59 0.03 3.32 1.04 -1.26 -0.97 113.70 123.19 1s4v s SER 109 Ca 0.00 -0.29 -0.01 0.00 0.48 0.00 0.00 55.95 56.14 1s4v s SER 109 Cb -0.13 -1.29 -0.02 0.00 0.10 0.00 0.00 66.02 64.68 1s4v s SER 109 CO -0.03 -0.19 -0.02 0.27 0.98 0.00 0.00 173.24 174.24 1s4v s ILE 110 N -2.18 0.13 -0.43 -1.02 -4.36 -1.26 -4.95 121.20 107.13 1s4v s ILE 110 Ca 0.37 -1.10 0.23 0.00 -0.26 0.00 0.00 60.65 59.90 1s4v s ILE 110 Cb -0.07 -0.55 0.11 0.00 1.25 0.00 0.00 42.46 43.20 1s4v s ILE 110 CO 0.27 -0.61 1.30 0.44 0.24 0.00 0.00 174.94 176.58 1s4v h ASP 111 N 4.30 0.00 0.00 4.36 3.32 -0.72 -3.41 116.42 124.26 1s4v h ASP 111 Ca -0.32 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1s4v h ASP 111 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1s4v h ASP 111 CO 0.47 0.03 0.00 0.61 -1.72 0.00 0.00 179.24 178.63 1s4v n GLY 112 N 1.22 -0.51 3.39 2.75 0.00 -1.23 -4.98 105.19 105.84 1s4v n GLY 112 Ca 0.02 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 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 -3.19 -0.15 0.06 1.61 -3.43 -1.26 -1.03 115.29 107.90 1s4v s HIS 113 Ca 0.00 -0.18 -0.09 0.00 -0.80 0.00 0.00 55.06 53.99 1s4v s HIS 113 Cb 0.00 0.30 0.00 0.00 -1.43 0.00 0.00 32.58 31.45 1s4v s HIS 113 CO 0.00 -0.78 0.19 -2.00 -2.00 0.00 0.00 174.74 170.15 1s4v s GLU 114 N -3.84 0.75 -0.01 -0.38 2.56 -0.60 -4.93 118.70 112.24 1s4v s GLU 114 Ca 0.06 -0.74 -0.03 0.00 0.00 0.00 0.00 54.97 54.26 1s4v s GLU 114 Cb 0.01 0.31 -0.04 0.00 2.00 0.00 0.00 34.13 36.41 1s4v s GLU 114 CO -0.08 -0.22 0.17 -0.80 -0.56 0.00 0.00 175.26 173.76 1s4v s ASN 115 N -2.36 6.27 0.18 -1.70 -0.87 -1.26 -1.37 114.94 113.83 1s4v s ASN 115 Ca -0.02 0.32 -0.29 0.00 -1.57 0.00 0.00 52.86 51.31 1s4v s ASN 115 Cb 0.01 -1.95 -0.08 0.00 -0.02 0.00 0.00 41.25 39.21 1s4v s ASN 115 CO -0.06 0.27 0.90 -0.69 -2.57 0.00 0.00 177.10 174.94 1s4v s VAL 116 N -1.29 4.28 0.19 1.60 1.01 0.31 -4.95 120.40 121.54 1s4v s VAL 116 Ca 0.26 1.97 -0.32 0.00 0.00 0.00 0.00 61.98 63.89 1s4v s VAL 116 Cb -0.12 -4.27 -0.15 0.00 0.00 0.00 0.00 36.38 31.83 1s4v s VAL 116 CO 0.17 0.46 1.15 -2.65 0.00 0.00 0.00 175.10 174.23 1s4v n PRO 117 N 1.89 1.21 -2.02 2.72 -0.02 -1.26 -4.64 135.00 132.89 1s4v n PRO 117 Ca -0.02 0.43 -0.35 0.00 -2.02 0.00 0.00 63.50 61.54 1s4v n PRO 117 Cb 0.48 -1.92 0.03 0.00 -0.02 0.00 0.00 33.50 32.07 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 -0.50 3.01 -1.42 -0.52 -1.05 -1.26 -3.81 118.70 113.15 1s4v s GLU 118 Ca 0.71 1.70 -0.03 0.00 -0.15 0.00 0.00 54.97 57.21 1s4v s GLU 118 Cb -0.83 -1.95 0.00 0.00 -0.44 0.00 0.00 34.13 30.92 1s4v s GLU 118 CO 0.53 -1.15 0.33 0.09 0.95 0.00 0.00 175.26 176.01 1s4v n ASN 119 N -1.68 -0.40 -3.36 0.83 3.02 -0.50 -4.94 115.26 108.22 1s4v n ASN 119 Ca 0.13 -1.11 -0.23 0.00 -0.03 0.00 0.00 54.58 53.34 1s4v n ASN 119 Cb 0.50 -2.56 -0.09 0.00 -0.61 0.00 0.00 39.78 37.02 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 -4.28 1.65 0.64 6.41 -1.08 -1.25 -4.70 116.67 114.06 1s4v s ASP 120 Ca 0.05 -2.20 0.43 0.00 -0.52 0.00 0.00 52.55 50.31 1s4v s ASP 120 Cb -0.02 0.07 2.26 0.00 -1.46 0.00 0.00 42.92 43.77 1s4v s ASP 120 CO 0.92 -0.24 2.31 -0.33 0.52 0.00 0.00 175.17 178.35 1s4v h GLU 121 N 6.52 0.00 -0.03 4.34 5.08 -1.91 -0.64 114.58 127.94 1s4v h GLU 121 Ca 0.11 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.24 1s4v h GLU 121 Cb 0.99 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.26 1s4v h GLU 121 CO 0.25 0.00 -0.91 -0.97 -1.00 0.00 0.00 179.01 176.38 1s4v h ASN 122 N 0.00 0.85 -0.63 1.42 -1.24 -1.98 0.11 115.58 114.11 1s4v h ASN 122 Ca 0.00 -0.72 -0.09 0.00 0.71 0.00 0.00 56.30 56.20 1s4v h ASN 122 Cb 0.08 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 38.84 1s4v h ASN 122 CO 0.00 1.46 0.04 0.00 -1.29 0.00 0.00 177.43 177.63 1s4v h ALA 123 N 0.42 0.86 -0.80 1.57 0.00 -1.61 -2.04 119.26 117.65 1s4v h ALA 123 Ca -0.11 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1s4v h ALA 123 Cb 1.57 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 1s4v h ALA 123 CO 0.18 0.67 0.38 1.25 0.00 0.00 0.00 179.25 181.74 1s4v h LEU 124 N 1.01 1.06 -0.41 0.00 5.85 -1.08 -1.78 115.31 119.95 1s4v h LEU 124 Ca 0.18 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1s4v h LEU 124 Cb 0.52 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1s4v h LEU 124 CO 0.03 0.90 0.25 0.25 -0.34 0.00 0.00 178.44 179.53 1s4v h LEU 125 N 1.14 0.49 -1.19 2.25 5.85 -0.56 -0.49 115.31 122.79 1s4v h LEU 125 Ca 0.28 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 1s4v h LEU 125 Cb 0.13 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1s4v h LEU 125 CO -0.03 0.39 0.37 0.11 -0.34 0.00 0.00 178.44 178.94 1s4v h LYS 126 N 0.54 0.92 -0.27 1.25 1.57 -1.07 -0.92 116.57 118.61 1s4v h LYS 126 Ca 0.15 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1s4v h LYS 126 Cb -0.01 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1s4v h LYS 126 CO -0.03 0.68 -0.15 0.00 -0.57 0.00 0.00 179.45 179.38 1s4v h ALA 127 N 1.47 0.38 -0.06 3.86 0.00 -0.83 -3.07 119.26 121.02 1s4v h ALA 127 Ca 0.24 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1s4v h ALA 127 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1s4v h ALA 127 CO -0.04 0.27 -0.30 0.28 0.00 0.00 0.00 179.25 179.46 1s4v h VAL 128 N 0.30 1.24 0.00 0.00 2.07 -0.80 -2.29 116.25 116.77 1s4v h VAL 128 Ca 0.06 -1.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1s4v h VAL 128 Cb 0.67 1.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1s4v h VAL 128 CO 0.04 0.33 -0.00 0.00 0.02 0.00 0.00 177.57 177.96 1s4v h ALA 129 N 1.61 1.70 0.10 1.67 0.00 -1.07 -2.74 119.26 120.53 1s4v h ALA 129 Ca 0.01 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.60 1s4v h ALA 129 Cb 0.58 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1s4v h ALA 129 CO 0.04 0.01 -1.69 -0.91 0.00 0.00 0.00 179.25 176.70 1s4v h ASN 130 N 0.00 0.34 -5.57 0.00 -0.26 -1.45 -3.50 115.58 105.14 1s4v h ASN 130 Ca -0.00 -0.57 0.26 0.00 -0.56 0.00 0.00 56.30 55.43 1s4v h ASN 130 Cb 0.01 -0.11 -0.10 0.00 -1.06 0.00 0.00 38.32 37.06 1s4v h ASN 130 CO 0.00 1.49 0.67 0.00 -1.06 0.00 0.00 177.43 178.53 1s4v s GLN 131 N -2.60 0.78 0.50 0.81 -2.07 -1.03 -5.05 119.66 111.01 1s4v s GLN 131 Ca -0.12 -0.44 -0.22 0.00 -1.82 0.00 0.00 55.36 52.76 1s4v s GLN 131 Cb 0.07 0.26 -0.06 0.00 -1.09 0.00 0.00 33.01 32.19 1s4v s GLN 131 CO 0.83 -0.36 1.26 -2.14 -1.32 0.00 0.00 175.29 173.56 1s4v s PRO 132 N -2.80 3.46 -0.06 9.60 0.02 -1.26 -4.14 135.00 139.83 1s4v s PRO 132 Ca 0.14 2.01 0.05 0.00 0.02 0.00 0.00 61.00 63.22 1s4v s PRO 132 Cb 0.02 -2.34 -0.01 0.00 0.02 0.00 0.00 34.50 32.19 1s4v s PRO 132 CO -0.01 -0.87 -0.21 0.08 -0.33 0.00 0.00 177.00 175.67 1s4v s VAL 133 N -1.42 1.75 0.14 3.83 1.01 -0.65 -4.74 120.40 120.32 1s4v s VAL 133 Ca 0.67 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 1s4v s VAL 133 Cb -0.35 -1.50 -0.07 0.00 0.00 0.00 0.00 36.38 34.47 1s4v s VAL 133 CO 0.41 0.49 1.04 -0.44 0.00 0.00 0.00 175.10 176.60 1s4v s SER 134 N 0.02 7.37 0.06 3.32 0.01 -0.23 -0.55 113.70 123.71 1s4v s SER 134 Ca -0.06 1.95 -0.03 0.00 1.31 0.00 0.00 55.95 59.11 1s4v s SER 134 Cb -0.13 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 1s4v s SER 134 CO 0.04 -0.15 0.03 0.68 0.41 0.00 0.00 173.24 174.25 1s4v s VAL 135 N -0.09 0.19 0.02 3.43 -7.23 -0.54 -0.90 120.40 115.28 1s4v s VAL 135 Ca 0.48 -1.57 0.06 0.00 -1.81 0.00 0.00 61.98 59.14 1s4v s VAL 135 Cb -0.26 -1.38 -0.03 0.00 0.56 0.00 0.00 36.38 35.27 1s4v s VAL 135 CO 0.32 -0.87 -0.14 0.00 -0.31 0.00 0.00 175.10 174.11 1s4v s ALA 136 N -3.70 2.74 0.24 1.32 0.00 -1.22 -0.80 121.76 120.34 1s4v s ALA 136 Ca 0.05 -1.12 -0.05 0.00 0.00 0.00 0.00 51.96 50.84 1s4v s ALA 136 Cb 0.06 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.27 1s4v s ALA 136 CO -0.09 0.58 0.30 0.96 0.00 0.00 0.00 175.76 177.51 1s4v s ILE 137 N -0.93 0.00 -0.50 0.00 -4.36 0.21 -3.90 121.20 111.72 1s4v s ILE 137 Ca 0.15 -1.76 -0.17 0.00 -0.26 0.00 0.00 60.65 58.62 1s4v s ILE 137 Cb -0.11 -2.41 0.07 0.00 1.25 0.00 0.00 42.46 41.26 1s4v s ILE 137 CO 0.06 0.00 0.51 -0.62 0.24 0.00 0.00 174.94 175.12 1s4v s ASP 138 N -3.13 6.18 -0.12 4.36 3.68 0.04 -1.10 116.67 126.57 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 0.03 -2.23 0.44 0.00 -1.45 0.00 0.00 42.92 39.71 1s4v s ASP 138 CO 0.13 -0.78 1.35 0.00 0.13 0.00 0.00 175.17 175.99 1s4v n ALA 139 N 5.63 2.70 1.63 3.66 0.00 -1.26 -4.65 120.51 128.22 1s4v n ALA 139 Ca -0.10 -1.99 0.15 0.00 0.00 0.00 0.00 53.44 51.49 1s4v n ALA 139 Cb 0.44 -0.59 0.82 0.00 0.00 0.00 0.00 19.45 20.11 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 -0.32 -1.12 3.96 0.00 0.00 -1.26 -4.60 105.19 101.85 1s4v n GLY 140 Ca 0.18 -0.16 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.31 1.26 0.19 -0.02 0.00 -1.26 -5.02 107.32 100.17 1s4v s GLY 141 Ca 0.36 -1.10 -0.09 0.00 0.00 0.00 0.00 44.72 43.90 1s4v s GLY 141 CO 0.41 -1.08 1.69 1.76 0.00 0.00 0.00 173.10 175.87 1s4v h SER 142 N 0.99 1.07 -0.24 1.64 0.02 -1.90 -1.48 113.55 113.65 1s4v h SER 142 Ca -0.51 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 60.21 1s4v h SER 142 Cb 1.23 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.46 1s4v h SER 142 CO 0.61 1.05 0.07 0.44 -1.14 0.00 0.00 176.83 177.86 1s4v h ASP 143 N 1.04 0.06 -0.20 3.07 3.45 -1.92 -0.80 116.42 121.11 1s4v h ASP 143 Ca 0.21 0.03 -0.04 0.00 0.43 0.00 0.00 57.03 57.66 1s4v h ASP 143 Cb 0.43 0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 39.22 1s4v h ASP 143 CO 0.01 0.07 -0.02 0.15 -1.57 0.00 0.00 179.24 177.88 1s4v h PHE 144 N 0.17 0.41 -0.71 4.55 3.04 -1.74 -2.82 116.94 119.84 1s4v h PHE 144 Ca 0.11 -0.08 0.06 0.00 3.98 0.00 0.00 57.97 62.03 1s4v h PHE 144 Cb 0.08 -0.10 -0.04 0.00 2.56 0.00 0.00 35.95 38.45 1s4v h PHE 144 CO -0.13 0.58 0.47 1.96 -2.02 0.00 0.00 178.31 179.16 1s4v h GLN 145 N 0.12 0.74 -0.68 1.11 4.20 -1.01 -2.47 115.11 117.12 1s4v h GLN 145 Ca 0.06 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1s4v h GLN 145 Cb 0.43 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1s4v h GLN 145 CO 0.01 0.49 0.00 1.19 -0.67 0.00 0.00 178.83 179.86 1s4v n PHE 146 N -4.47 1.20 -1.69 2.96 3.01 -0.33 -4.97 117.46 113.17 1s4v n PHE 146 Ca 0.10 -0.52 -0.44 0.00 1.01 0.00 0.00 57.45 57.60 1s4v n PHE 146 Cb 0.20 -0.13 -0.02 0.00 -0.01 0.00 0.00 39.48 39.53 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 1.30 2.27 0.00 1.38 9.36 -0.93 -4.90 117.16 125.64 1s4v n TYR 147 Ca 0.24 0.46 0.00 0.00 3.32 0.00 0.00 57.90 61.92 1s4v n TYR 147 Cb 0.73 -2.46 0.00 0.00 -0.63 0.00 0.00 39.34 36.98 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 1.62 2.86 -3.58 2.98 2.88 -1.26 -3.25 113.62 115.87 1s4v n SER 148 Ca 0.09 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.53 1s4v n SER 148 Cb 0.34 0.01 -0.02 0.00 -0.75 0.00 0.00 64.21 63.78 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 -1.71 1.35 0.69 -1.46 -1.05 -1.26 -3.43 118.70 111.82 1s4v s GLU 149 Ca 0.00 -0.61 0.00 0.00 -0.15 0.00 0.00 54.97 54.21 1s4v s GLU 149 Cb 0.00 0.55 0.00 0.00 -0.44 0.00 0.00 34.13 34.24 1s4v s GLU 149 CO 0.00 -0.60 0.00 0.41 0.95 0.00 0.00 175.26 176.02 1s4v n GLY 150 N -0.39 -1.89 3.53 -3.83 0.00 -1.26 -4.78 105.19 96.56 1s4v n GLY 150 Ca -0.11 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 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 5.09 0.10 1.61 1.01 -1.26 -4.18 120.40 122.76 1s4v s VAL 151 Ca 0.00 -0.00 -0.31 0.00 0.00 0.00 0.00 61.98 61.67 1s4v s VAL 151 Cb 0.00 -3.94 -0.08 0.00 0.00 0.00 0.00 36.38 32.36 1s4v s VAL 151 CO 0.00 -0.25 1.45 0.12 0.00 0.00 0.00 175.10 176.42 1s4v s PHE 152 N 2.18 3.07 -0.03 5.22 5.36 0.11 -4.81 117.98 129.09 1s4v s PHE 152 Ca 0.14 0.81 0.00 0.00 -0.96 0.00 0.00 56.93 56.93 1s4v s PHE 152 Cb -0.16 -3.75 0.00 0.00 -0.34 0.00 0.00 43.02 38.77 1s4v s PHE 152 CO 0.13 -2.72 0.43 0.25 -1.46 0.00 0.00 175.22 171.85 1s4v n THR 153 N 4.14 0.00 -0.04 0.12 -2.24 -1.26 -0.69 114.28 114.31 1s4v n THR 153 Ca 0.13 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1s4v n THR 153 Cb 0.42 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 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 0.17 0.16 3.86 3.38 0.00 -1.26 -4.92 105.19 106.58 1s4v n GLY 154 Ca 0.00 -1.81 -0.37 0.00 0.00 0.00 0.00 46.02 43.84 1s4v n GLY 154 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1s4v s SER 155 N -0.18 6.29 -0.03 1.61 0.15 -1.26 -4.83 113.70 115.45 1s4v s SER 155 Ca 0.00 0.44 -0.22 0.00 0.70 0.00 0.00 55.95 56.87 1s4v s SER 155 Cb 0.00 -2.02 0.04 0.00 -1.71 0.00 0.00 66.02 62.34 1s4v s SER 155 CO 0.00 0.41 0.47 0.00 1.20 0.00 0.00 173.24 175.32 1s4v n GLY 157 N 1.12 0.13 0.12 0.00 0.00 -1.26 -4.55 105.19 100.74 1s4v n GLY 157 Ca -0.20 -1.82 0.08 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.96 1.62 -2.90 2.61 -2.24 -1.26 -4.05 114.28 107.10 1s4v n THR 158 Ca 0.00 -1.94 -0.43 0.00 -2.27 0.00 0.00 64.05 59.41 1s4v n THR 158 Cb 0.00 -0.12 -0.05 0.00 -2.10 0.00 0.00 70.33 68.07 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 -2.46 3.30 0.14 -0.78 2.02 -1.26 -4.81 118.70 114.85 1s4v s GLU 159 Ca 0.27 -0.37 -0.32 0.00 0.02 0.00 0.00 54.97 54.57 1s4v s GLU 159 Cb 0.24 -4.06 -0.11 0.00 0.10 0.00 0.00 34.13 30.29 1s4v s GLU 159 CO 0.03 -1.42 1.78 1.28 0.02 0.00 0.00 175.26 176.95 1s4v n LEU 160 N 7.18 3.91 0.00 1.80 4.77 -1.26 -4.16 117.00 129.24 1s4v n LEU 160 Ca 0.00 1.02 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 1s4v n LEU 160 Cb 0.47 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 1s4v n LEU 160 CO 0.62 0.12 0.01 -0.90 -1.33 0.00 0.00 177.39 175.91 1s4v n ASP 161 N 4.95 0.00 -3.78 -1.43 3.85 -0.26 -4.94 116.55 114.94 1s4v n ASP 161 Ca 0.17 -1.00 -0.14 0.00 -0.71 0.00 0.00 54.79 53.12 1s4v n ASP 161 Cb 0.35 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 39.98 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 -0.10 -0.22 2.11 5.04 -0.38 -4.88 115.29 116.86 1s4v s HIS 162 Ca 0.00 0.34 -0.09 0.00 -1.54 0.00 0.00 55.06 53.77 1s4v s HIS 162 Cb 0.00 -0.09 -0.05 0.00 0.04 0.00 0.00 32.58 32.48 1s4v s HIS 162 CO 0.00 -0.12 0.12 0.20 -2.34 0.00 0.00 174.74 172.60 1s4v s GLY 163 N 0.87 1.96 0.00 1.59 0.00 -1.26 -0.62 107.32 109.86 1s4v s GLY 163 Ca -0.07 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.82 1s4v s GLY 163 CO -0.04 0.27 0.00 3.33 0.00 0.00 0.00 173.10 176.67 1s4v n VAL 164 N 4.00 0.00 -3.77 1.40 0.24 0.02 -4.38 118.33 115.84 1s4v n VAL 164 Ca -0.16 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 -0.74 -0.17 2.33 0.00 -1.20 -1.47 121.76 118.52 1s4v s ALA 165 Ca 0.00 0.85 -0.22 0.00 0.00 0.00 0.00 51.96 52.60 1s4v s ALA 165 Cb 0.00 -0.50 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 1s4v s ALA 165 CO 0.00 -0.14 0.67 0.42 0.00 0.00 0.00 175.76 176.70 1s4v s ILE 166 N 0.20 5.01 -0.57 0.00 1.01 0.29 -0.70 121.20 126.43 1s4v s ILE 166 Ca -0.00 1.29 0.11 0.00 0.00 0.00 0.00 60.65 62.04 1s4v s ILE 166 Cb -0.02 -3.98 0.31 0.00 0.01 0.00 0.00 42.46 38.77 1s4v s ILE 166 CO 0.00 0.13 1.25 1.33 0.00 0.00 0.00 174.94 177.65 1s4v n VAL 167 N 4.51 1.34 0.00 2.92 0.24 0.11 -1.64 118.33 125.81 1s4v n VAL 167 Ca -0.01 -1.27 0.00 0.00 -2.04 0.00 0.00 64.34 61.02 1s4v n VAL 167 Cb 0.50 0.29 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 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 0.02 -0.12 3.38 7.63 0.00 -1.17 -0.73 105.19 114.21 1s4v n GLY 168 Ca 0.12 -1.17 -0.11 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.41 0.00 1.61 -0.85 0.25 -0.25 117.35 115.69 1s4v s TYR 169 Ca 0.00 0.16 0.00 0.00 -0.52 0.00 0.00 57.07 56.71 1s4v s TYR 169 Cb 0.00 0.45 0.00 0.00 0.38 0.00 0.00 41.96 42.79 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 -0.32 1.03 2.89 5.49 0.00 -0.87 -1.58 105.19 111.83 1s4v n GLY 170 Ca -0.17 -0.72 -0.15 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.23 -0.13 0.95 2.61 2.01 -1.26 -1.19 115.64 116.39 1s4v s THR 171 Ca 0.00 0.25 -0.11 0.00 0.31 0.00 0.00 61.69 62.13 1s4v s THR 171 Cb 0.00 -0.27 0.16 0.00 0.01 0.00 0.00 72.50 72.41 1s4v s THR 171 CO 0.00 0.10 1.09 0.42 -0.69 0.00 0.00 174.62 175.54 1s4v s THR 172 N 1.62 2.44 0.44 -0.82 -4.23 -0.43 -4.85 115.64 109.80 1s4v s THR 172 Ca -0.04 0.14 0.14 0.00 -1.18 0.00 0.00 61.69 60.75 1s4v s THR 172 Cb -0.12 -2.46 0.33 0.00 1.34 0.00 0.00 72.50 71.60 1s4v s THR 172 CO -0.06 -0.18 1.98 -0.29 -0.54 0.00 0.00 174.62 175.53 1s4v h ILE 173 N -1.82 0.89 0.00 2.99 6.09 -2.01 0.12 117.51 123.76 1s4v h ILE 173 Ca -0.51 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 62.85 1s4v h ILE 173 Cb 1.29 0.47 0.00 0.00 0.47 0.00 0.00 36.82 39.05 1s4v h ILE 173 CO 0.51 0.07 0.00 0.47 -3.07 0.00 0.00 178.15 176.13 1s4v n ASP 174 N -4.47 0.00 0.00 2.19 10.43 -1.26 -4.88 116.55 118.56 1s4v n ASP 174 Ca 0.10 -0.78 0.00 0.00 2.57 0.00 0.00 54.79 56.68 1s4v n ASP 174 Cb 0.37 -0.02 0.00 0.00 1.84 0.00 0.00 41.12 43.31 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 0.69 0.82 3.59 0.44 0.00 0.03 -5.06 105.19 105.70 1s4v n GLY 175 Ca 0.19 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 4.88 0.34 2.61 2.01 -1.25 -4.81 115.64 117.42 1s4v s THR 176 Ca 0.00 0.77 -0.27 0.00 0.31 0.00 0.00 61.69 62.50 1s4v s THR 176 Cb 0.00 -4.07 -0.09 0.00 0.01 0.00 0.00 72.50 68.35 1s4v s THR 176 CO 0.00 -0.26 1.15 -0.54 -0.69 0.00 0.00 174.62 174.28 1s4v s LYS 177 N 2.73 4.33 0.19 4.92 1.02 -1.26 -1.32 119.74 130.36 1s4v s LYS 177 Ca 0.26 1.85 -0.11 0.00 0.02 0.00 0.00 55.97 57.99 1s4v s LYS 177 Cb -0.14 -2.91 -0.00 0.00 -0.52 0.00 0.00 37.83 34.25 1s4v s LYS 177 CO 0.14 -0.08 0.36 1.52 -0.92 0.00 0.00 175.35 176.36 1s4v s TYR 178 N -1.30 0.35 -0.02 3.18 -0.85 -0.34 -0.74 117.35 117.62 1s4v s TYR 178 Ca 0.51 -0.70 0.06 0.00 -0.52 0.00 0.00 57.07 56.42 1s4v s TYR 178 Cb -0.32 0.04 -0.03 0.00 0.38 0.00 0.00 41.96 42.04 1s4v s TYR 178 CO 0.41 -0.81 -0.18 -1.58 -1.52 0.00 0.00 175.55 171.87 1s4v s TRP 179 N -3.97 2.57 -0.26 -3.49 0.52 0.62 -2.04 118.94 112.89 1s4v s TRP 179 Ca 0.18 -0.25 -0.08 0.00 0.02 0.00 0.00 56.10 55.97 1s4v s TRP 179 Cb 0.02 -1.56 -0.03 0.00 -1.15 0.00 0.00 33.47 30.75 1s4v s TRP 179 CO 0.02 0.14 0.09 0.99 0.02 0.00 0.00 176.95 178.22 1s4v s THR 180 N -0.75 4.48 -0.12 2.01 2.01 0.65 -1.03 115.64 122.90 1s4v s THR 180 Ca 0.12 -0.15 0.00 0.00 0.31 0.00 0.00 61.69 61.98 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 0.01 0.30 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.43 1s4v s VAL 181 N 1.64 3.10 -0.29 3.82 1.01 -0.13 0.05 120.40 129.59 1s4v s VAL 181 Ca 0.06 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.21 1s4v s VAL 181 Cb -0.15 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1s4v s VAL 181 CO 0.05 0.54 0.49 -0.75 0.00 0.00 0.00 175.10 175.43 1s4v s LYS 182 N 0.15 3.92 0.40 2.72 2.20 0.12 -1.31 119.74 127.94 1s4v s LYS 182 Ca -0.07 0.12 0.05 0.00 -0.36 0.00 0.00 55.97 55.71 1s4v s LYS 182 Cb -0.15 -3.70 0.00 0.00 -1.51 0.00 0.00 37.83 32.47 1s4v s LYS 182 CO 0.05 -0.43 0.57 1.21 -0.36 0.00 0.00 175.35 176.38 1s4v s ASN 183 N 1.63 5.80 -0.38 1.43 3.84 -0.94 -3.21 114.94 123.12 1s4v s ASN 183 Ca 0.19 -0.11 0.05 0.00 0.21 0.00 0.00 52.86 53.20 1s4v s ASN 183 Cb -0.16 -1.14 0.46 0.00 -0.55 0.00 0.00 41.25 39.86 1s4v s ASN 183 CO 0.11 -0.63 1.41 -1.54 -2.79 0.00 0.00 177.10 173.65 1s4v n SER 184 N -1.85 5.49 -0.96 -4.21 3.41 -1.26 -4.52 113.62 109.71 1s4v n SER 184 Ca 0.03 -3.76 0.01 0.00 -0.26 0.00 0.00 58.87 54.89 1s4v n SER 184 Cb 0.58 -0.51 0.21 0.00 -0.26 0.00 0.00 64.21 64.24 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 -0.78 0.91 0.00 7.33 8.01 -1.21 -0.75 117.44 130.96 1s4v n TRP 185 Ca 0.48 -1.33 0.00 0.00 -1.31 0.00 0.00 57.50 55.34 1s4v n TRP 185 Cb 0.89 -0.40 0.00 0.00 -2.01 0.00 0.00 31.31 29.79 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 -0.97 -1.10 0.13 6.99 0.00 -0.30 -4.32 105.19 105.63 1s4v n GLY 186 Ca 0.28 -1.55 0.11 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.61 0.17 0.26 1.61 -0.04 -1.26 -2.57 135.00 132.56 1s4v n PRO 187 Ca 0.00 0.47 0.16 0.00 -0.04 0.00 0.00 63.50 64.10 1s4v n PRO 187 Cb 0.00 -1.87 0.61 0.00 -0.04 0.00 0.00 33.50 32.20 1s4v n PRO 187 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1s4v h GLU 188 N 0.00 0.00 -6.19 0.54 3.07 -1.88 -2.83 114.58 107.29 1s4v h GLU 188 Ca 0.00 0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 58.28 1s4v h GLU 188 Cb 0.25 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.12 1s4v h GLU 188 CO 0.00 0.00 -0.20 -0.46 -1.40 0.00 0.00 179.01 176.95 1s4v s TRP 189 N -3.59 3.57 0.00 4.33 -0.00 -1.06 -4.88 118.94 117.30 1s4v s TRP 189 Ca 0.02 0.84 0.00 0.00 -0.00 0.00 0.00 56.10 56.97 1s4v s TRP 189 Cb 0.08 -2.21 0.00 0.00 -0.00 0.00 0.00 33.47 31.35 1s4v s TRP 189 CO 0.55 0.47 0.00 0.41 -0.00 0.00 0.00 176.95 178.38 1s4v n GLY 190 N 0.72 2.07 3.44 5.86 0.00 -1.20 0.32 105.19 116.39 1s4v n GLY 190 Ca -0.06 -0.40 -0.44 0.00 0.00 0.00 0.00 46.02 45.12 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 3.70 -1.45 1.61 2.02 0.43 -4.31 118.70 120.70 1s4v s GLU 191 Ca 0.00 -2.02 -0.02 0.00 0.02 0.00 0.00 54.97 52.95 1s4v s GLU 191 Cb 0.00 -4.87 0.01 0.00 0.10 0.00 0.00 34.13 29.37 1s4v s GLU 191 CO 0.00 -1.70 0.20 1.63 0.02 0.00 0.00 175.26 175.41 1s4v n LYS 192 N 6.00 -2.80 0.00 1.61 5.02 -1.25 -1.52 118.16 125.23 1s4v n LYS 192 Ca 0.25 0.79 0.00 0.00 -2.02 0.00 0.00 58.31 57.33 1s4v n LYS 192 Cb 0.48 -5.49 0.00 0.00 -0.02 0.00 0.00 35.03 30.00 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 -1.09 0.78 3.79 0.72 0.00 0.15 -4.61 105.19 104.94 1s4v n GLY 193 Ca -0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.14 2.74 -0.04 1.61 1.51 -0.57 -2.21 117.35 118.25 1s4v s TYR 194 Ca 0.00 -0.41 -0.02 0.00 -1.01 0.00 0.00 57.07 55.63 1s4v s TYR 194 Cb 0.00 -1.82 0.03 0.00 -0.11 0.00 0.00 41.96 40.06 1s4v s TYR 194 CO 0.00 0.19 0.09 -1.50 -1.11 0.00 0.00 175.55 173.22 1s4v s ILE 195 N -2.43 -0.05 -0.26 2.71 2.07 -0.42 -0.43 121.20 122.39 1s4v s ILE 195 Ca 0.41 0.17 -0.15 0.00 -1.41 0.00 0.00 60.65 59.68 1s4v s ILE 195 Cb -0.03 -0.16 -0.04 0.00 0.13 0.00 0.00 42.46 42.36 1s4v s ILE 195 CO 0.25 0.07 0.37 -0.13 -1.91 0.00 0.00 174.94 173.58 1s4v s ARG 196 N 1.00 4.03 -0.10 3.50 0.52 -1.26 -0.96 118.95 125.69 1s4v s ARG 196 Ca -0.08 0.04 -0.00 0.00 -0.52 0.00 0.00 55.73 55.17 1s4v s ARG 196 Cb -0.11 -3.64 -0.03 0.00 0.52 0.00 0.00 34.95 31.69 1s4v s ARG 196 CO -0.04 -0.25 -0.08 -1.64 0.02 0.00 0.00 175.30 173.31 1s4v s MET 197 N 1.98 3.06 0.22 3.54 -1.94 -0.19 0.10 119.30 126.06 1s4v s MET 197 Ca 0.15 -0.58 -0.32 0.00 -1.71 0.00 0.00 55.69 53.24 1s4v s MET 197 Cb -0.16 -2.66 -0.14 0.00 2.01 0.00 0.00 34.83 33.88 1s4v s MET 197 CO 0.10 0.49 1.31 -1.91 -0.01 0.00 0.00 175.02 175.00 1s4v n GLU 198 N 2.76 1.71 -4.20 2.03 2.13 0.13 -0.28 120.64 124.92 1s4v n GLU 198 Ca -0.18 0.61 -0.30 0.00 0.66 0.00 0.00 57.16 57.95 1s4v n GLU 198 Cb 0.53 -2.21 -0.09 0.00 0.27 0.00 0.00 31.44 29.94 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 -0.41 2.33 -1.03 5.31 3.52 0.08 -4.54 118.95 124.22 1s4v s ARG 199 Ca 0.70 -0.92 -0.03 0.00 -0.13 0.00 0.00 55.73 55.35 1s4v s ARG 199 Cb -0.72 -2.42 0.00 0.00 -1.56 0.00 0.00 34.95 30.25 1s4v s ARG 199 CO 0.51 0.53 0.87 0.41 -0.81 0.00 0.00 175.30 176.80 1s4v n GLY 200 N 0.70 -0.23 3.90 8.12 0.00 -1.26 -4.60 105.19 111.82 1s4v n GLY 200 Ca -0.12 0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.28 1.96 -1.68 -0.61 -4.36 -1.26 -4.96 121.20 107.01 1s4v s ILE 201 Ca 0.17 0.00 0.24 0.00 -0.26 0.00 0.00 60.65 60.80 1s4v s ILE 201 Cb -0.07 -2.96 0.54 0.00 1.25 0.00 0.00 42.46 41.22 1s4v s ILE 201 CO 0.60 0.00 1.80 -1.54 0.24 0.00 0.00 174.94 176.04 1s4v n SER 202 N -3.87 0.00 -4.61 4.36 3.41 -1.26 -4.68 113.62 106.97 1s4v n SER 202 Ca 0.15 -0.37 -0.34 0.00 -0.26 0.00 0.00 58.87 58.05 1s4v n SER 202 Cb 0.59 -0.16 -0.10 0.00 -0.26 0.00 0.00 64.21 64.28 1s4v n SER 202 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1s4v s ASP 203 N -2.32 5.52 0.54 4.04 -0.00 -1.26 -4.99 116.67 118.21 1s4v s ASP 203 Ca 0.29 0.05 0.22 0.00 -0.00 0.00 0.00 52.55 53.10 1s4v s ASP 203 Cb 0.16 -1.94 1.47 0.00 -0.00 0.00 0.00 42.92 42.61 1s4v s ASP 203 CO 0.33 0.16 2.18 0.07 -0.00 0.00 0.00 175.17 177.91 1s4v h LYS 204 N 6.76 0.00 0.00 8.23 2.10 -1.89 -2.01 116.57 129.77 1s4v h LYS 204 Ca -0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 1s4v h LYS 204 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1s4v h LYS 204 CO 0.69 0.02 0.00 0.93 -2.00 0.00 0.00 179.45 179.09 1s4v h GLU 205 N 0.00 0.00 0.00 0.07 3.07 -1.94 -3.33 114.58 112.45 1s4v h GLU 205 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1s4v h GLU 205 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1s4v h GLU 205 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 1s4v n GLY 206 N -0.01 -0.93 3.70 -3.84 0.00 -0.76 -1.04 105.19 102.31 1s4v n GLY 206 Ca 0.01 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 43.98 1s4v n GLY 206 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1s4v s LEU 207 N -2.97 4.37 -1.59 0.99 2.96 -1.26 -1.29 118.68 119.90 1s4v s LEU 207 Ca 0.00 2.58 0.00 0.00 -0.22 0.00 0.00 54.13 56.49 1s4v s LEU 207 Cb 0.00 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.12 1s4v s LEU 207 CO 0.00 -0.91 0.00 0.00 -1.32 0.00 0.00 176.35 174.12 1s4v n GLY 209 N -0.41 0.67 0.35 0.00 0.00 -0.41 -0.78 105.19 104.61 1s4v n GLY 209 Ca -0.15 -0.80 0.17 0.00 0.00 0.00 0.00 46.02 45.25 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 0.16 -0.03 -0.61 2.10 -1.37 -0.83 117.51 116.93 1s4v h ILE 210 Ca -0.08 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.86 1s4v h ILE 210 Cb 0.26 0.69 0.00 0.00 -1.09 0.00 0.00 36.82 36.68 1s4v h ILE 210 CO 0.11 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.18 1s4v n ALA 211 N -2.08 2.51 0.04 0.18 0.00 -0.20 -4.47 120.51 116.48 1s4v n ALA 211 Ca 0.01 -0.59 -0.14 0.00 0.00 0.00 0.00 53.44 52.73 1s4v n ALA 211 Cb 0.44 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 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 3.67 0.54 -1.84 0.00 2.86 -1.20 -1.34 114.93 117.62 1s4v h MET 212 Ca 0.00 -0.50 -0.53 0.00 -2.06 0.00 0.00 59.70 56.62 1s4v h MET 212 Cb 0.78 0.12 -0.37 0.00 0.06 0.00 0.00 31.60 32.19 1s4v h MET 212 CO 0.00 1.13 -1.07 0.39 1.06 0.00 0.00 176.91 178.42 1s4v n GLU 213 N -3.83 0.74 -3.95 1.72 1.02 -1.26 -4.65 120.64 110.43 1s4v n GLU 213 Ca -0.07 -3.12 -0.36 0.00 -0.02 0.00 0.00 57.16 53.59 1s4v n GLU 213 Cb 0.78 -1.27 -0.07 0.00 -0.02 0.00 0.00 31.44 30.86 1s4v n GLU 213 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s4v s ALA 214 N -1.15 3.76 0.17 0.62 0.00 -1.26 -3.37 121.76 120.54 1s4v s ALA 214 Ca 0.35 -0.67 -0.13 0.00 0.00 0.00 0.00 51.96 51.51 1s4v s ALA 214 Cb 0.19 -1.91 0.01 0.00 0.00 0.00 0.00 23.12 21.41 1s4v s ALA 214 CO -0.12 0.57 0.38 -1.54 0.00 0.00 0.00 175.76 175.06 1s4v s SER 215 N -0.88 -0.09 0.12 0.00 1.04 -0.07 -0.53 113.70 113.28 1s4v s SER 215 Ca 0.14 -0.67 -0.14 0.00 0.48 0.00 0.00 55.95 55.75 1s4v s SER 215 Cb -0.12 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.52 1s4v s SER 215 CO 0.03 -0.95 0.35 -0.72 0.98 0.00 0.00 173.24 172.93 1s4v s TYR 216 N -3.92 -0.10 0.50 5.02 -0.85 -0.47 -1.06 117.35 116.46 1s4v s TYR 216 Ca 0.13 -0.24 -0.09 0.00 -0.52 0.00 0.00 57.07 56.34 1s4v s TYR 216 Cb 0.02 0.18 -0.05 0.00 0.38 0.00 0.00 41.96 42.48 1s4v s TYR 216 CO -0.02 -0.66 0.86 -1.25 -1.52 0.00 0.00 175.55 172.95 1s4v s PRO 217 N -3.82 3.64 -0.09 -3.49 0.04 -1.26 -1.56 135.00 128.45 1s4v s PRO 217 Ca 0.04 0.46 0.01 0.00 0.04 0.00 0.00 61.00 61.55 1s4v s PRO 217 Cb 0.03 -2.28 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 1s4v s PRO 217 CO -0.11 -0.27 -0.13 0.42 0.04 0.00 0.00 177.00 176.95 1s4v s ILE 218 N -2.76 3.09 -0.27 0.56 1.01 -0.20 -4.89 121.20 117.74 1s4v s ILE 218 Ca 0.51 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 60.48 1s4v s ILE 218 Cb -0.10 -2.26 0.15 0.00 0.01 0.00 0.00 42.46 40.25 1s4v s ILE 218 CO 0.43 0.55 0.38 -0.75 0.00 0.00 0.00 174.94 175.56 1s4v s LYS 219 N -0.14 0.38 -0.13 2.79 2.20 -1.26 0.10 119.74 123.67 1s4v s LYS 219 Ca -0.01 0.27 -0.13 0.00 -0.36 0.00 0.00 55.97 55.75 1s4v s LYS 219 Cb -0.14 -0.42 -0.25 0.00 -1.51 0.00 0.00 37.83 35.52 1s4v s LYS 219 CO 0.03 -0.87 0.39 0.87 -0.36 0.00 0.00 175.35 175.42 1s4v h LYS 220 N 8.18 0.20 -7.14 4.03 1.57 -1.98 -3.48 116.57 117.95 1s4v h LYS 220 Ca -0.14 -0.34 -0.48 0.00 -1.87 0.00 0.00 60.65 57.82 1s4v h LYS 220 Cb 1.13 0.13 0.04 0.00 0.08 0.00 0.00 32.23 33.61 1s4v h LYS 220 CO 0.28 1.16 0.38 0.45 -0.57 0.00 0.00 179.45 181.15 1s4v s SER 221 N -7.01 6.18 -0.11 0.86 0.15 -1.26 -4.97 113.70 107.55 1s4v s SER 221 Ca -0.23 1.81 0.11 0.00 0.70 0.00 0.00 55.95 58.34 1s4v s SER 221 Cb 0.06 -2.54 0.50 0.00 -1.71 0.00 0.00 66.02 62.33 1s4v s SER 221 CO 0.73 -0.89 1.33 -1.20 1.20 0.00 0.00 173.24 174.41 1s4v n SER 222 N -1.50 3.63 -4.37 5.45 7.64 -1.26 -4.93 113.62 118.28 1s4v n SER 222 Ca 0.08 -2.42 -0.24 0.00 1.01 0.00 0.00 58.87 57.30 1s4v n SER 222 Cb 0.53 -0.53 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 1s4v n SER 222 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1s4v s ASN 223 N -0.66 2.71 0.00 6.43 4.22 -1.26 -4.43 114.94 121.95 1s4v s ASN 223 Ca 0.35 -1.50 0.00 0.00 -2.14 0.00 0.00 52.86 49.56 1s4v s ASN 223 Cb 0.24 0.16 0.00 0.00 1.28 0.00 0.00 41.25 42.93 1s4v s ASN 223 CO 0.14 -0.73 0.17 0.59 -2.04 0.00 0.00 177.10 175.23