#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k8t s THR 91 N 0.00 2.81 -0.12 12.58 2.01 -1.26 -4.98 115.64 126.67 3k8t s THR 91 Ca 0.00 0.71 -0.17 0.00 0.31 0.00 0.00 61.69 62.54 3k8t s THR 91 Cb 0.00 -3.41 -0.26 0.00 0.01 0.00 0.00 72.50 68.84 3k8t s THR 91 CO 0.00 0.09 0.53 0.50 -0.69 0.00 0.00 174.62 175.05 3k8t h LYS 92 N 2.69 0.20 -6.27 4.92 3.64 -1.99 -3.46 116.57 116.29 3k8t h LYS 92 Ca -0.49 -0.33 -0.56 0.00 -1.27 0.00 0.00 60.65 57.99 3k8t h LYS 92 Cb 1.24 0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 33.16 3k8t h LYS 92 CO 0.63 1.16 1.08 -1.14 -2.27 0.00 0.00 179.45 178.91 3k8t s GLN 93 N -2.44 3.92 0.23 1.90 0.74 -1.26 -4.90 119.66 117.84 3k8t s GLN 93 Ca -0.21 1.72 -0.10 0.00 0.05 0.00 0.00 55.36 56.82 3k8t s GLN 93 Cb 0.04 -3.99 0.34 0.00 1.10 0.00 0.00 33.01 30.50 3k8t s GLN 93 CO 0.74 -1.14 1.62 0.35 -0.55 0.00 0.00 175.29 176.31 3k8t h PHE 94 N 10.14 -0.26 -0.18 1.67 3.57 -1.89 0.08 116.94 130.08 3k8t h PHE 94 Ca -0.33 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.19 3k8t h PHE 94 Cb 1.15 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 40.10 3k8t h PHE 94 CO 0.89 -0.28 -0.04 0.66 -2.23 0.00 0.00 178.31 177.31 3k8t h SER 95 N 0.04 0.24 0.61 0.41 4.64 -1.90 0.97 113.55 118.55 3k8t h SER 95 Ca 0.36 -0.03 -0.19 0.00 -0.47 0.00 0.00 61.79 61.46 3k8t h SER 95 Cb 0.59 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 3k8t h SER 95 CO -0.70 0.32 -0.83 0.50 -0.87 0.00 0.00 176.83 175.25 3k8t h LYS 96 N 0.25 0.15 -0.36 4.77 1.63 -1.44 -1.76 116.57 119.82 3k8t h LYS 96 Ca 0.06 -0.16 -0.08 0.00 -0.85 0.00 0.00 60.65 59.62 3k8t h LYS 96 Cb 0.25 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 3k8t h LYS 96 CO 0.01 0.90 -0.07 0.28 -3.45 0.00 0.00 179.45 177.12 3k8t h VAL 97 N 0.09 1.28 -0.96 2.00 2.07 -0.09 -1.96 116.25 118.67 3k8t h VAL 97 Ca -0.03 -1.13 -0.00 0.00 0.82 0.00 0.00 66.70 66.36 3k8t h VAL 97 Cb 1.44 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 32.45 3k8t h VAL 97 CO 0.12 0.37 0.59 0.58 0.02 0.00 0.00 177.57 179.25 3k8t h VAL 98 N 0.47 1.26 0.05 2.57 2.07 -0.85 -2.01 116.25 119.81 3k8t h VAL 98 Ca 0.09 -0.56 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 3k8t h VAL 98 Cb 0.57 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 3k8t h VAL 98 CO 0.03 0.27 -0.02 -0.08 0.02 0.00 0.00 177.57 177.79 3k8t h GLU 99 N 1.32 -0.06 -0.86 1.57 4.57 -1.22 -0.19 114.58 119.71 3k8t h GLU 99 Ca 0.35 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.59 3k8t h GLU 99 Cb -0.07 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.48 3k8t h GLU 99 CO -0.07 -0.03 0.54 -0.44 -1.18 0.00 0.00 179.01 177.83 3k8t h ASP 100 N -0.07 0.85 -0.20 1.04 3.45 -1.16 -0.37 116.42 119.95 3k8t h ASP 100 Ca -0.01 0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.40 3k8t h ASP 100 Cb 0.06 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 38.66 3k8t h ASP 100 CO 0.01 0.55 -0.14 -0.07 -1.57 0.00 0.00 179.24 178.02 3k8t h LEU 101 N 0.99 0.48 -1.02 1.55 3.38 -1.21 -2.67 115.31 116.81 3k8t h LEU 101 Ca 0.37 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3k8t h LEU 101 Cb 0.15 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3k8t h LEU 101 CO -0.17 0.81 0.30 0.22 0.09 0.00 0.00 178.44 179.70 3k8t h TYR 102 N 0.14 1.01 -0.16 1.13 3.20 -0.74 -1.10 116.97 120.44 3k8t h TYR 102 Ca 0.04 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3k8t h TYR 102 Cb 0.65 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.61 3k8t h TYR 102 CO 0.07 0.75 0.00 0.54 -1.64 0.00 0.00 178.16 177.89 3k8t n ARG 103 N -4.31 1.66 -1.74 1.82 5.12 -0.17 -4.26 116.66 114.78 3k8t n ARG 103 Ca 0.06 -1.00 -0.42 0.00 -1.93 0.00 0.00 57.85 54.56 3k8t n ARG 103 Cb 0.16 -1.37 -0.02 0.00 -1.16 0.00 0.00 32.46 30.07 3k8t n ARG 103 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 3k8t n TYR 104 N 0.23 2.81 -5.04 -1.55 9.36 -1.01 -4.89 117.16 117.07 3k8t n TYR 104 Ca 0.15 0.27 -0.30 0.00 3.32 0.00 0.00 57.90 61.35 3k8t n TYR 104 Cb 0.30 -2.58 -0.17 0.00 -0.63 0.00 0.00 39.34 36.26 3k8t n TYR 104 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 3k8t s VAL 105 N -0.05 1.78 -0.55 2.97 1.01 -1.26 -0.83 120.40 123.47 3k8t s VAL 105 Ca 0.64 -0.87 -0.27 0.00 0.00 0.00 0.00 61.98 61.48 3k8t s VAL 105 Cb -0.51 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 3k8t s VAL 105 CO 0.49 0.50 1.85 0.21 0.00 0.00 0.00 175.10 178.15 3k8t s ASN 106 N 0.30 5.41 0.52 3.32 3.84 0.73 -4.86 114.94 124.19 3k8t s ASN 106 Ca -0.14 0.56 0.19 0.00 0.21 0.00 0.00 52.86 53.68 3k8t s ASN 106 Cb -0.16 -2.53 1.33 0.00 -0.55 0.00 0.00 41.25 39.34 3k8t s ASN 106 CO 0.06 -2.23 2.14 0.00 -2.79 0.00 0.00 177.10 174.28 3k8t h ALA 107 N 14.53 1.84 0.00 1.71 0.00 -1.95 0.81 119.26 136.21 3k8t h ALA 107 Ca -0.27 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 3k8t h ALA 107 Cb 1.16 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 3k8t h ALA 107 CO 1.18 0.04 -0.72 0.00 0.00 0.00 0.00 179.25 179.75 3k8t h ALA 108 N 1.96 0.78 0.00 0.00 0.00 -1.97 -3.30 119.26 116.73 3k8t h ALA 108 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 3k8t h ALA 108 Cb 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3k8t h ALA 108 CO 0.00 0.90 -0.90 -2.37 0.00 0.00 0.00 179.25 176.88 3k8t n THR 109 N -3.63 0.00 -1.13 0.00 5.66 -0.98 -5.01 114.28 109.20 3k8t n THR 109 Ca -0.01 -0.25 -0.04 0.00 -3.05 0.00 0.00 64.05 60.70 3k8t n THR 109 Cb 0.71 0.67 -0.02 0.00 -1.55 0.00 0.00 70.33 70.15 3k8t n THR 109 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3k8t n GLY 110 N 1.55 0.72 3.70 1.09 0.00 0.28 -5.02 105.19 107.50 3k8t n GLY 110 Ca 0.00 -0.62 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 3k8t n GLY 110 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k8t s LYS 111 N -2.04 4.21 0.16 1.61 2.20 -1.13 -4.86 119.74 119.89 3k8t s LYS 111 Ca 0.00 0.14 -0.32 0.00 -0.36 0.00 0.00 55.97 55.43 3k8t s LYS 111 Cb 0.00 -3.48 -0.10 0.00 -1.51 0.00 0.00 37.83 32.74 3k8t s LYS 111 CO 0.00 0.10 1.59 -2.14 -0.36 0.00 0.00 175.35 174.54 3k8t s PRO 112 N 0.89 4.20 -0.45 4.03 0.02 -1.26 -0.19 135.00 142.24 3k8t s PRO 112 Ca 0.17 2.39 0.09 0.00 0.02 0.00 0.00 61.00 63.67 3k8t s PRO 112 Cb -0.14 -3.18 0.30 0.00 0.02 0.00 0.00 34.50 31.50 3k8t s PRO 112 CO 0.06 -0.63 0.70 0.00 -0.33 0.00 0.00 177.00 176.80 3k8t n ALA 113 N 4.10 2.85 -1.77 -1.55 0.00 -0.01 -4.86 120.51 119.27 3k8t n ALA 113 Ca 0.14 -3.79 -0.41 0.00 0.00 0.00 0.00 53.44 49.38 3k8t n ALA 113 Cb 0.38 -0.86 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 3k8t n ALA 113 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3k8t s PRO 114 N -2.19 4.12 0.00 0.00 0.04 -1.23 -4.58 135.00 131.16 3k8t s PRO 114 Ca 0.40 2.56 0.12 0.00 0.04 0.00 0.00 61.00 64.12 3k8t s PRO 114 Cb 0.25 -3.00 0.30 0.00 0.04 0.00 0.00 34.50 32.09 3k8t s PRO 114 CO -0.09 -0.57 1.22 -1.33 0.04 0.00 0.00 177.00 176.27 3k8t n MET 115 N 1.26 2.53 -4.69 4.56 2.81 -0.43 -4.74 117.12 118.42 3k8t n MET 115 Ca 0.04 -1.97 -0.25 0.00 -1.81 0.00 0.00 57.70 53.71 3k8t n MET 115 Cb 0.38 -1.28 -0.14 0.00 -0.71 0.00 0.00 33.22 31.47 3k8t n MET 115 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3k8t s ILE 116 N -1.00 1.58 0.55 2.02 -1.09 -1.26 -4.47 121.20 117.53 3k8t s ILE 116 Ca 0.24 -1.08 -0.19 0.00 -2.23 0.00 0.00 60.65 57.38 3k8t s ILE 116 Cb 0.13 -1.36 -0.06 0.00 -1.58 0.00 0.00 42.46 39.59 3k8t s ILE 116 CO 0.17 0.25 1.11 -0.94 -1.23 0.00 0.00 174.94 174.30 3k8t s SER 117 N -0.98 5.77 0.25 3.58 1.04 -0.09 -4.40 113.70 118.86 3k8t s SER 117 Ca 0.07 2.11 -0.04 0.00 0.48 0.00 0.00 55.95 58.57 3k8t s SER 117 Cb -0.08 -2.57 0.50 0.00 0.10 0.00 0.00 66.02 63.96 3k8t s SER 117 CO 0.01 -1.18 1.66 0.44 0.98 0.00 0.00 173.24 175.14 3k8t h ASP 118 N 1.13 -0.14 0.44 7.02 3.45 -1.94 -1.67 116.42 124.71 3k8t h ASP 118 Ca -0.50 0.18 -0.02 0.00 0.43 0.00 0.00 57.03 57.12 3k8t h ASP 118 Cb 1.25 0.27 0.00 0.00 -0.56 0.00 0.00 39.33 40.30 3k8t h ASP 118 CO 0.57 -0.12 -0.21 -0.78 -1.57 0.00 0.00 179.24 177.13 3k8t h ASP 119 N 0.18 -0.50 -0.16 6.45 -0.00 -1.95 -2.26 116.42 118.19 3k8t h ASP 119 Ca 0.44 -0.01 -0.08 0.00 -0.00 0.00 0.00 57.03 57.38 3k8t h ASP 119 Cb 0.80 0.13 -0.02 0.00 -0.00 0.00 0.00 39.33 40.24 3k8t h ASP 119 CO -0.60 -0.32 -0.16 0.58 -0.00 0.00 0.00 179.24 178.74 3k8t h VAL 120 N -0.64 1.25 -0.20 2.25 2.07 -1.81 -2.57 116.25 116.59 3k8t h VAL 120 Ca -0.06 -1.12 0.02 0.00 0.82 0.00 0.00 66.70 66.36 3k8t h VAL 120 Cb 0.48 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 3k8t h VAL 120 CO 0.10 0.37 0.05 0.22 0.02 0.00 0.00 177.57 178.33 3k8t h TYR 121 N 0.50 0.09 -0.19 1.57 3.20 -1.25 -0.62 116.97 120.27 3k8t h TYR 121 Ca 0.09 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 3k8t h TYR 121 Cb 0.57 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 3k8t h TYR 121 CO 0.02 0.04 -0.05 -0.91 -1.64 0.00 0.00 178.16 175.62 3k8t h ASN 122 N 0.14 0.26 -0.08 -2.11 2.35 -1.22 -1.06 115.58 113.86 3k8t h ASN 122 Ca 0.09 -0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.75 3k8t h ASN 122 Cb 0.07 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 3k8t h ASN 122 CO -0.11 0.36 -0.14 0.40 -1.65 0.00 0.00 177.43 176.29 3k8t h ILE 123 N 0.28 1.39 -0.42 2.81 2.04 -1.06 -1.94 117.51 120.61 3k8t h ILE 123 Ca 0.06 -1.40 0.01 0.00 1.00 0.00 0.00 64.86 64.53 3k8t h ILE 123 Cb 0.27 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 3k8t h ILE 123 CO 0.01 0.39 0.27 0.58 0.00 0.00 0.00 178.15 179.41 3k8t h VAL 124 N -0.22 1.09 0.00 1.67 2.07 -0.81 -1.98 116.25 118.08 3k8t h VAL 124 Ca 0.01 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 3k8t h VAL 124 Cb 0.70 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 3k8t h VAL 124 CO 0.03 0.10 -0.30 0.24 0.02 0.00 0.00 177.57 177.66 3k8t h MET 125 N 0.55 0.00 0.00 1.57 2.86 -1.24 -0.95 114.93 117.72 3k8t h MET 125 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 3k8t h MET 125 Cb -0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.61 3k8t h MET 125 CO -0.04 0.30 -0.12 0.39 1.06 0.00 0.00 176.91 178.50 3k8t n GLU 126 N -3.96 0.18 -1.81 1.72 1.02 -0.73 -4.08 120.64 112.98 3k8t n GLU 126 Ca -0.02 0.13 0.02 0.00 -0.02 0.00 0.00 57.16 57.27 3k8t n GLU 126 Cb 0.37 -1.69 0.05 0.00 -0.02 0.00 0.00 31.44 30.15 3k8t n GLU 126 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3k8t n ASN 127 N -2.00 1.39 0.07 1.62 4.13 -0.80 -4.97 115.26 114.70 3k8t n ASN 127 Ca 0.06 -2.26 -0.04 0.00 1.68 0.00 0.00 54.58 54.02 3k8t n ASN 127 Cb 0.40 -0.37 0.16 0.00 -1.54 0.00 0.00 39.78 38.43 3k8t n ASN 127 CO 0.00 0.00 0.00 0.07 0.28 0.00 0.00 177.26 177.61 3k8t h LYS 128 N 1.50 0.31 0.11 3.52 2.10 -1.34 -1.66 116.57 121.11 3k8t h LYS 128 Ca -0.16 -0.17 -0.01 0.00 -2.00 0.00 0.00 60.65 58.31 3k8t h LYS 128 Cb 1.63 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.97 3k8t h LYS 128 CO 0.14 0.73 -0.06 -0.44 -2.00 0.00 0.00 179.45 177.83 3k8t h ASP 129 N 0.25 -0.13 -0.97 7.07 3.32 -1.93 0.60 116.42 124.63 3k8t h ASP 129 Ca 0.01 -0.22 0.05 0.00 0.02 0.00 0.00 57.03 56.89 3k8t h ASP 129 Cb 0.95 0.03 -0.06 0.00 0.22 0.00 0.00 39.33 40.47 3k8t h ASP 129 CO 0.08 0.16 0.63 0.50 -1.72 0.00 0.00 179.24 178.89 3k8t h LYS 130 N -0.43 1.13 0.07 3.56 3.64 -1.94 -2.07 116.57 120.53 3k8t h LYS 130 Ca -0.02 -0.07 -0.13 0.00 -1.27 0.00 0.00 60.65 59.17 3k8t h LYS 130 Cb 0.35 -0.26 0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3k8t h LYS 130 CO 0.03 0.75 -0.53 -0.07 -2.27 0.00 0.00 179.45 177.35 3k8t h LEU 131 N 1.17 0.36 -0.99 5.20 4.07 -1.30 -2.96 115.31 120.85 3k8t h LEU 131 Ca 0.40 -0.90 0.01 0.00 0.08 0.00 0.00 57.88 57.47 3k8t h LEU 131 Cb 0.10 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 41.68 3k8t h LEU 131 CO -0.14 1.22 0.65 0.78 -1.08 0.00 0.00 178.44 179.86 3k8t h ASN 132 N -0.45 1.15 0.76 -0.43 2.35 -0.74 -2.65 115.58 115.57 3k8t h ASN 132 Ca -0.09 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 3k8t h ASN 132 Cb 1.36 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 39.44 3k8t h ASN 132 CO 0.10 0.85 -0.26 -1.54 -1.65 0.00 0.00 177.43 174.92 3k8t n SER 133 N -4.37 0.29 0.10 5.81 3.41 -0.79 -3.60 113.62 114.46 3k8t n SER 133 Ca 0.12 0.13 -0.05 0.00 -0.26 0.00 0.00 58.87 58.81 3k8t n SER 133 Cb 0.02 -0.12 0.05 0.00 -0.26 0.00 0.00 64.21 63.90 3k8t n SER 133 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k8t h ALA 134 N 2.97 0.70 -2.46 7.33 0.00 -1.29 -3.45 119.26 123.06 3k8t h ALA 134 Ca 0.00 -0.69 -0.54 0.00 0.00 0.00 0.00 54.91 53.68 3k8t h ALA 134 Cb 0.51 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.20 3k8t h ALA 134 CO 0.00 0.93 0.76 0.42 0.00 0.00 0.00 179.25 181.36 3k8t s ILE 135 N -3.29 3.57 -0.65 0.00 1.01 -1.23 -4.97 121.20 115.63 3k8t s ILE 135 Ca -0.01 1.06 -0.13 0.00 0.00 0.00 0.00 60.65 61.56 3k8t s ILE 135 Cb 0.11 -3.68 0.17 0.00 0.01 0.00 0.00 42.46 39.07 3k8t s ILE 135 CO 0.79 0.04 0.58 -0.69 0.00 0.00 0.00 174.94 175.67 3k8t s VAL 136 N 1.72 5.14 -1.42 2.92 1.01 -1.26 -4.95 120.40 123.56 3k8t s VAL 136 Ca 0.64 -2.03 0.10 0.00 0.00 0.00 0.00 61.98 60.69 3k8t s VAL 136 Cb -0.34 -4.25 0.18 0.00 0.00 0.00 0.00 36.38 31.97 3k8t s VAL 136 CO 0.28 -0.92 1.23 -1.22 0.00 0.00 0.00 175.10 174.47 3k8t n TYR 137 N 4.56 0.00 1.00 5.22 4.02 -1.26 -1.99 117.16 128.72 3k8t n TYR 137 Ca -0.00 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.01 3k8t n TYR 137 Cb 0.43 -0.29 0.59 0.00 -0.02 0.00 0.00 39.34 40.05 3k8t n TYR 137 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3k8t n ASP 138 N -1.29 0.00 -0.10 7.72 10.43 -1.26 -3.45 116.55 128.60 3k8t n ASP 138 Ca 0.05 0.33 0.14 0.00 2.57 0.00 0.00 54.79 57.87 3k8t n ASP 138 Cb 0.08 -0.44 0.53 0.00 1.84 0.00 0.00 41.12 43.14 3k8t n ASP 138 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3k8t n ARG 139 N -1.44 0.52 0.02 -1.24 1.74 -0.84 -3.05 116.66 112.37 3k8t n ARG 139 Ca 0.08 -0.20 0.06 0.00 -0.77 0.00 0.00 57.85 57.02 3k8t n ARG 139 Cb 0.28 -1.50 0.28 0.00 -1.02 0.00 0.00 32.46 30.50 3k8t n ARG 139 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3k8t n ASP 140 N -1.06 0.08 -1.97 0.55 10.43 -1.22 -1.53 116.55 121.83 3k8t n ASP 140 Ca 0.12 0.52 -0.12 0.00 2.57 0.00 0.00 54.79 57.88 3k8t n ASP 140 Cb 0.30 -0.54 0.22 0.00 1.84 0.00 0.00 41.12 42.94 3k8t n ASP 140 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 3k8t n PHE 141 N -1.59 2.43 0.68 1.24 3.72 -1.17 -3.69 117.46 119.08 3k8t n PHE 141 Ca 0.03 -1.35 0.12 0.00 -0.05 0.00 0.00 57.45 56.19 3k8t n PHE 141 Cb 0.14 -0.74 0.16 0.00 -0.94 0.00 0.00 39.48 38.11 3k8t n PHE 141 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3k8t n GLN 142 N -0.47 0.22 -3.12 -1.08 1.13 -0.58 -4.97 117.38 108.50 3k8t n GLN 142 Ca 0.44 0.05 -0.19 0.00 -1.94 0.00 0.00 57.00 55.35 3k8t n GLN 142 Cb 1.39 -1.62 0.04 0.00 0.11 0.00 0.00 30.24 30.16 3k8t n GLN 142 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 3k8t s TYR 143 N -3.13 1.87 0.44 1.08 1.51 -1.24 -4.98 117.35 112.90 3k8t s TYR 143 Ca 0.07 -0.63 0.03 0.00 -1.01 0.00 0.00 57.07 55.52 3k8t s TYR 143 Cb 0.15 -2.23 -0.02 0.00 -0.11 0.00 0.00 41.96 39.74 3k8t s TYR 143 CO 0.73 -0.86 0.08 -1.54 -1.11 0.00 0.00 175.55 172.86 3k8t s SER 144 N -4.53 3.26 0.15 2.29 1.04 -1.26 -4.91 113.70 109.74 3k8t s SER 144 Ca 0.57 -1.66 -0.29 0.00 0.48 0.00 0.00 55.95 55.05 3k8t s SER 144 Cb -0.06 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 3k8t s SER 144 CO 0.36 -0.90 1.56 0.10 0.98 0.00 0.00 173.24 175.34 3k8t h TYR 145 N 1.64 -1.41 0.00 5.02 -0.00 -1.99 0.21 116.97 120.44 3k8t h TYR 145 Ca -0.38 0.07 0.00 0.00 0.00 0.00 0.00 58.73 58.42 3k8t h TYR 145 Cb 1.29 0.67 0.00 0.00 0.00 0.00 0.00 36.73 38.69 3k8t h TYR 145 CO 1.50 -0.46 0.00 0.27 -0.00 0.00 0.00 178.16 179.47 3k8t h PHE 146 N -0.35 0.00 0.15 0.10 -0.00 -1.95 -2.13 116.94 112.75 3k8t h PHE 146 Ca 0.12 0.00 -0.36 0.00 -0.00 0.00 0.00 57.97 57.73 3k8t h PHE 146 Cb 0.59 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.54 3k8t h PHE 146 CO -0.66 0.00 -1.88 0.78 -0.00 0.00 0.00 178.31 176.55 3k8t h GLY 147 N 4.21 0.36 0.53 6.09 0.00 -1.50 -2.61 103.07 110.15 3k8t h GLY 147 Ca 0.00 -0.91 -0.00 0.00 0.00 0.00 0.00 47.33 46.41 3k8t h GLY 147 CO 0.00 0.80 -0.04 -2.75 0.00 0.00 0.00 176.54 174.55 3k8t h PHE 148 N 0.08 -0.10 0.00 5.60 3.57 -0.66 -2.84 116.94 122.59 3k8t h PHE 148 Ca -0.38 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.11 3k8t h PHE 148 Cb 2.06 0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.84 3k8t h PHE 148 CO 0.09 0.34 0.00 1.63 -2.23 0.00 0.00 178.31 178.13 3k8t n LYS 149 N -4.92 0.04 -0.01 1.11 4.76 -0.80 -0.38 118.16 117.95 3k8t n LYS 149 Ca -0.09 0.33 -0.17 0.00 -2.87 0.00 0.00 58.31 55.51 3k8t n LYS 149 Cb 0.25 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 31.80 3k8t n LYS 149 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 3k8t h THR 150 N 0.00 1.64 -0.06 -0.18 2.02 -1.35 -3.26 112.91 111.71 3k8t h THR 150 Ca 0.00 -2.45 -0.02 0.00 0.77 0.00 0.00 66.41 64.71 3k8t h THR 150 Cb 0.08 3.28 -0.00 0.00 -1.74 0.00 0.00 68.15 69.77 3k8t h THR 150 CO 0.00 0.66 -0.04 -0.07 0.37 0.00 0.00 175.52 176.44 3k8t h LEU 151 N -0.67 0.15 -1.67 2.58 3.38 -0.72 -2.89 115.31 115.46 3k8t h LEU 151 Ca -0.08 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.51 3k8t h LEU 151 Cb 1.34 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 3k8t h LEU 151 CO 0.08 0.56 0.32 -0.08 0.09 0.00 0.00 178.44 179.41 3k8t h GLU 152 N -0.26 0.39 0.00 1.13 4.81 -0.91 0.18 114.58 119.91 3k8t h GLU 152 Ca 0.01 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.07 3k8t h GLU 152 Cb 0.51 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 3k8t h GLU 152 CO 0.01 0.26 -0.86 -0.09 -0.73 0.00 0.00 179.01 177.60 3k8t h ARG 153 N 0.40 0.00 0.00 1.92 9.65 -1.59 -3.43 114.38 121.34 3k8t h ARG 153 Ca 0.21 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.09 3k8t h ARG 153 Cb 0.31 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.89 3k8t h ARG 153 CO -0.05 0.56 0.00 -1.13 2.80 0.00 0.00 179.97 182.15 3k8t n SER 154 N -3.17 0.00 -0.06 -3.80 3.41 -1.10 -4.99 113.62 103.91 3k8t n SER 154 Ca -0.02 -1.00 -0.11 0.00 -0.26 0.00 0.00 58.87 57.49 3k8t n SER 154 Cb 0.82 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.72 3k8t n SER 154 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3k8t n TYR 155 N 0.00 0.00 -2.21 7.33 4.02 0.47 -4.97 117.16 121.80 3k8t n TYR 155 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 3k8t n TYR 155 Cb 0.25 -0.45 -0.02 0.00 -0.02 0.00 0.00 39.34 39.09 3k8t n TYR 155 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3k8t s LEU 156 N -6.13 4.23 0.40 7.72 1.43 -0.25 -4.72 118.68 121.36 3k8t s LEU 156 Ca -0.17 1.94 -0.27 0.00 -1.03 0.00 0.00 54.13 54.60 3k8t s LEU 156 Cb 0.05 -3.54 -0.10 0.00 0.03 0.00 0.00 46.19 42.63 3k8t s LEU 156 CO 0.25 -0.87 1.37 0.18 0.23 0.00 0.00 176.35 177.51 3k8t n LEU 157 N 6.97 4.33 -4.50 1.79 4.77 -1.26 -4.74 117.00 124.35 3k8t n LEU 157 Ca 0.16 1.17 -0.31 0.00 -0.03 0.00 0.00 56.01 57.00 3k8t n LEU 157 Cb 0.44 -1.55 -0.12 0.00 -2.33 0.00 0.00 43.42 39.86 3k8t n LEU 157 CO 0.60 -0.29 -0.46 -0.13 -1.33 0.00 0.00 177.39 175.77 3k8t s ARG 158 N -2.14 2.14 -0.20 3.23 0.52 -1.26 -0.55 118.95 120.69 3k8t s ARG 158 Ca 0.57 -0.96 -0.01 0.00 -0.52 0.00 0.00 55.73 54.82 3k8t s ARG 158 Cb -0.50 -2.25 0.01 0.00 0.52 0.00 0.00 34.95 32.72 3k8t s ARG 158 CO 0.61 0.54 -0.13 0.42 0.02 0.00 0.00 175.30 176.75 3k8t s ILE 159 N -0.99 2.61 -1.68 1.52 1.01 0.14 -4.75 121.20 119.06 3k8t s ILE 159 Ca 0.16 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.06 3k8t s ILE 159 Cb -0.11 -2.14 0.00 0.00 0.01 0.00 0.00 42.46 40.22 3k8t s ILE 159 CO 0.07 0.49 0.00 0.59 0.00 0.00 0.00 174.94 176.09 3k8t n ASN 160 N 4.68 -5.60 0.00 3.58 3.02 -1.26 -1.25 115.26 118.42 3k8t n ASN 160 Ca -0.20 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 3k8t n ASN 160 Cb 0.50 -4.68 0.00 0.00 -0.61 0.00 0.00 39.78 35.00 3k8t n ASN 160 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k8t n GLY 161 N -0.98 1.04 3.66 7.41 0.00 -1.26 -5.04 105.19 110.03 3k8t n GLY 161 Ca -0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 3k8t n GLY 161 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k8t s GLN 162 N -0.27 3.51 0.07 1.61 0.74 -0.38 -5.06 119.66 119.87 3k8t s GLN 162 Ca 0.00 -0.36 -0.34 0.00 0.05 0.00 0.00 55.36 54.71 3k8t s GLN 162 Cb 0.00 -3.02 -0.13 0.00 1.10 0.00 0.00 33.01 30.96 3k8t s GLN 162 CO 0.00 0.49 1.68 0.28 -0.55 0.00 0.00 175.29 177.19 3k8t n VAL 163 N 2.83 0.21 0.13 1.34 0.31 -1.26 0.25 118.33 122.14 3k8t n VAL 163 Ca -0.18 -0.04 0.07 0.00 -0.01 0.00 0.00 64.34 64.19 3k8t n VAL 163 Cb 0.53 -1.63 -0.11 0.00 -0.91 0.00 0.00 33.84 31.73 3k8t n VAL 163 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3k8t n ALA 164 N 4.53 2.81 -2.84 3.52 0.00 0.29 -4.75 120.51 124.08 3k8t n ALA 164 Ca 0.19 -0.36 -0.34 0.00 0.00 0.00 0.00 53.44 52.93 3k8t n ALA 164 Cb 0.28 -0.50 -0.10 0.00 0.00 0.00 0.00 19.45 19.13 3k8t n ALA 164 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3k8t s GLU 165 N -2.88 3.69 0.52 0.00 2.02 -1.13 -4.70 118.70 116.21 3k8t s GLU 165 Ca -0.03 -0.40 -0.17 0.00 0.02 0.00 0.00 54.97 54.39 3k8t s GLU 165 Cb 0.10 -3.04 -0.08 0.00 0.10 0.00 0.00 34.13 31.21 3k8t s GLU 165 CO 0.60 0.36 0.99 1.03 0.02 0.00 0.00 175.26 178.27 3k8t s ARG 166 N 0.09 3.89 0.29 1.61 0.52 -1.26 -4.81 118.95 119.28 3k8t s ARG 166 Ca 0.03 1.01 0.04 0.00 -0.52 0.00 0.00 55.73 56.28 3k8t s ARG 166 Cb -0.13 -2.13 0.67 0.00 0.52 0.00 0.00 34.95 33.89 3k8t s ARG 166 CO 0.02 -0.32 1.79 -1.35 0.02 0.00 0.00 175.30 175.45 3k8t h PRO 167 N 0.95 0.77 -0.17 3.54 0.11 -1.99 0.39 132.00 135.60 3k8t h PRO 167 Ca -0.47 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.53 3k8t h PRO 167 Cb 1.19 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3k8t h PRO 167 CO 0.61 0.51 -0.17 1.96 -0.21 0.00 0.00 178.00 180.70 3k8t h GLN 168 N 0.80 0.29 -0.10 1.05 1.08 -1.95 -1.58 115.11 114.70 3k8t h GLN 168 Ca 0.55 -0.08 -0.01 0.00 -1.45 0.00 0.00 58.65 57.65 3k8t h GLN 168 Cb 0.77 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.17 3k8t h GLN 168 CO -0.35 0.46 0.01 0.45 -0.95 0.00 0.00 178.83 178.44 3k8t h HIS 169 N 0.27 0.18 -0.47 2.96 3.86 -1.35 -1.92 115.15 118.68 3k8t h HIS 169 Ca 0.05 -0.03 0.09 0.00 -1.16 0.00 0.00 60.37 59.32 3k8t h HIS 169 Cb 0.47 -0.05 -0.10 0.00 1.06 0.00 0.00 27.41 28.79 3k8t h HIS 169 CO 0.01 0.41 -0.32 1.25 0.86 0.00 0.00 177.93 180.14 3k8t h LEU 170 N -0.09 -1.08 -1.17 2.43 7.12 -0.89 0.85 115.31 122.49 3k8t h LEU 170 Ca 0.03 0.20 -0.02 0.00 0.13 0.00 0.00 57.88 58.22 3k8t h LEU 170 Cb 0.33 0.52 -0.03 0.00 -0.53 0.00 0.00 40.66 40.95 3k8t h LEU 170 CO 0.00 -0.31 0.36 0.40 -0.13 0.00 0.00 178.44 178.76 3k8t h ILE 171 N -0.21 1.21 0.08 4.05 2.04 -1.18 0.42 117.51 123.91 3k8t h ILE 171 Ca 0.20 -0.53 -0.25 0.00 1.00 0.00 0.00 64.86 65.28 3k8t h ILE 171 Cb 0.54 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3k8t h ILE 171 CO -0.59 0.23 -1.12 -0.03 0.00 0.00 0.00 178.15 176.65 3k8t h MET 172 N 0.94 0.30 -0.52 2.37 4.05 -0.90 -0.79 114.93 120.39 3k8t h MET 172 Ca 0.24 -0.43 0.02 0.00 -0.28 0.00 0.00 59.70 59.25 3k8t h MET 172 Cb 0.04 0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 30.96 3k8t h MET 172 CO -0.04 1.16 0.33 -0.09 0.23 0.00 0.00 176.91 178.50 3k8t h ARG 173 N 0.12 0.64 -0.38 0.39 2.43 -0.39 -1.71 114.38 115.47 3k8t h ARG 173 Ca -0.11 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 58.93 3k8t h ARG 173 Cb 1.81 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 31.21 3k8t h ARG 173 CO 0.18 0.42 -0.12 0.28 -1.51 0.00 0.00 179.97 179.22 3k8t h VAL 174 N 0.65 1.28 -0.86 0.20 2.07 -0.80 0.43 116.25 119.22 3k8t h VAL 174 Ca 0.20 -1.22 0.07 0.00 0.82 0.00 0.00 66.70 66.57 3k8t h VAL 174 Cb -0.01 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 3k8t h VAL 174 CO -0.08 0.41 0.53 0.00 0.02 0.00 0.00 177.57 178.45 3k8t h ALA 175 N 0.82 1.20 -0.14 1.67 0.00 -1.03 0.31 119.26 122.09 3k8t h ALA 175 Ca 0.09 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.79 3k8t h ALA 175 Cb 0.65 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.23 3k8t h ALA 175 CO 0.04 0.26 -0.72 -0.07 0.00 0.00 0.00 179.25 178.76 3k8t h LEU 176 N 0.95 0.87 -1.64 0.00 4.07 -1.20 -1.41 115.31 116.95 3k8t h LEU 176 Ca 0.38 -0.64 -0.01 0.00 0.08 0.00 0.00 57.88 57.70 3k8t h LEU 176 Cb 0.21 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 3k8t h LEU 176 CO -0.19 1.37 0.10 1.23 -1.08 0.00 0.00 178.44 179.87 3k8t h GLY 177 N 0.44 0.36 0.75 0.83 0.00 -0.25 0.41 103.07 105.60 3k8t h GLY 177 Ca -0.05 -0.15 -0.22 0.00 0.00 0.00 0.00 47.33 46.91 3k8t h GLY 177 CO 0.15 0.15 -0.99 -2.22 0.00 0.00 0.00 176.54 173.63 3k8t h ILE 178 N 0.34 1.42 0.00 2.60 2.04 -0.88 -3.41 117.51 119.61 3k8t h ILE 178 Ca 0.09 -2.54 -0.04 0.00 1.00 0.00 0.00 64.86 63.36 3k8t h ILE 178 Cb 0.07 3.12 -0.01 0.00 -0.74 0.00 0.00 36.82 39.26 3k8t h ILE 178 CO -0.01 0.73 -2.01 1.41 0.00 0.00 0.00 178.15 178.27 3k8t n HIS 179 N -4.04 0.00 0.00 1.37 8.25 -0.54 -4.60 115.22 115.66 3k8t n HIS 179 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 3k8t n HIS 179 Cb 0.87 -0.54 0.00 0.00 1.12 0.00 0.00 29.99 31.45 3k8t n HIS 179 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k8t n GLY 180 N 1.36 3.19 0.10 -1.41 0.00 0.14 -2.69 105.19 105.88 3k8t n GLY 180 Ca -0.07 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 45.90 3k8t n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k8t n ARG 181 N 13.35 0.16 -2.68 1.61 5.12 -1.26 -4.41 116.66 128.55 3k8t n ARG 181 Ca 0.00 0.36 -0.43 0.00 -1.93 0.00 0.00 57.85 55.85 3k8t n ARG 181 Cb 0.00 -1.78 -0.01 0.00 -1.16 0.00 0.00 32.46 29.51 3k8t n ARG 181 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3k8t s ASP 182 N -3.99 6.78 0.37 0.55 3.68 -1.10 -4.81 116.67 118.15 3k8t s ASP 182 Ca 0.06 -2.27 0.09 0.00 2.13 0.00 0.00 52.55 52.55 3k8t s ASP 182 Cb 0.10 -2.52 0.73 0.00 -1.45 0.00 0.00 42.92 39.78 3k8t s ASP 182 CO 0.39 -1.16 1.89 0.40 0.13 0.00 0.00 175.17 176.82 3k8t h ILE 183 N 5.72 1.20 0.05 4.11 5.03 -1.88 -1.15 117.51 130.59 3k8t h ILE 183 Ca 0.33 -0.88 -0.00 0.00 -0.12 0.00 0.00 64.86 64.19 3k8t h ILE 183 Cb 0.92 1.27 0.00 0.00 -3.03 0.00 0.00 36.82 35.98 3k8t h ILE 183 CO 1.37 0.27 -0.02 -0.33 -0.68 0.00 0.00 178.15 178.76 3k8t h GLU 184 N 0.23 -0.06 -0.44 2.37 4.39 -1.96 0.26 114.58 119.36 3k8t h GLU 184 Ca 0.04 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.83 3k8t h GLU 184 Cb 0.43 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.02 3k8t h GLU 184 CO 0.03 0.28 -0.01 0.00 -1.16 0.00 0.00 179.01 178.14 3k8t h ALA 185 N 0.53 0.40 -0.62 3.43 0.00 -1.94 -0.26 119.26 120.79 3k8t h ALA 185 Ca -0.01 0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3k8t h ALA 185 Cb 0.37 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 3k8t h ALA 185 CO 0.01 -0.40 0.28 0.00 0.00 0.00 0.00 179.25 179.14 3k8t h ALA 186 N 1.40 0.82 -0.33 0.00 0.00 -0.84 -0.48 119.26 119.83 3k8t h ALA 186 Ca 0.22 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 3k8t h ALA 186 Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3k8t h ALA 186 CO -0.38 -0.11 -0.03 -0.07 0.00 0.00 0.00 179.25 178.66 3k8t h LEU 187 N 0.50 0.60 -0.74 0.00 4.07 0.25 -0.57 115.31 119.42 3k8t h LEU 187 Ca 0.30 -0.33 0.03 0.00 0.08 0.00 0.00 57.88 57.96 3k8t h LEU 187 Cb 0.31 -0.16 -0.04 0.00 1.08 0.00 0.00 40.66 41.84 3k8t h LEU 187 CO -0.26 0.79 0.47 -0.08 -1.08 0.00 0.00 178.44 178.28 3k8t h GLU 188 N 0.40 0.90 -0.23 1.13 4.81 -0.74 -0.81 114.58 120.04 3k8t h GLU 188 Ca 0.09 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 3k8t h GLU 188 Cb 0.49 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3k8t h GLU 188 CO 0.02 0.60 -0.10 1.15 -0.73 0.00 0.00 179.01 179.95 3k8t h THR 189 N 0.93 1.30 -0.68 0.32 2.02 -0.81 -1.70 112.91 114.29 3k8t h THR 189 Ca 0.29 -1.16 0.10 0.00 0.77 0.00 0.00 66.41 66.42 3k8t h THR 189 Cb -0.00 1.57 -0.08 0.00 -1.74 0.00 0.00 68.15 67.90 3k8t h THR 189 CO -0.10 0.36 0.29 0.22 0.37 0.00 0.00 175.52 176.65 3k8t h TYR 190 N 0.19 0.50 -0.07 3.16 3.20 -0.99 0.27 116.97 123.24 3k8t h TYR 190 Ca 0.05 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 3k8t h TYR 190 Cb 0.59 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 3k8t h TYR 190 CO 0.06 0.14 0.01 -0.91 -1.64 0.00 0.00 178.16 175.82 3k8t h ASN 191 N 0.48 0.11 -0.28 -2.11 2.35 -1.01 -0.14 115.58 114.99 3k8t h ASN 191 Ca 0.35 -0.25 -0.14 0.00 -0.55 0.00 0.00 56.30 55.70 3k8t h ASN 191 Cb 0.43 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 3k8t h ASN 191 CO -0.31 0.33 -0.33 -0.07 -1.65 0.00 0.00 177.43 175.39 3k8t h LEU 192 N -0.12 0.84 -0.38 1.61 3.38 -1.16 -1.93 115.31 117.56 3k8t h LEU 192 Ca 0.02 -0.36 -0.15 0.00 0.09 0.00 0.00 57.88 57.48 3k8t h LEU 192 Cb 0.27 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3k8t h LEU 192 CO 0.00 1.10 -0.34 0.24 0.09 0.00 0.00 178.44 179.53 3k8t h MET 193 N 0.67 0.90 -0.13 1.13 2.86 -0.98 -1.40 114.93 117.98 3k8t h MET 193 Ca 0.07 -0.46 -0.05 0.00 -2.06 0.00 0.00 59.70 57.19 3k8t h MET 193 Cb 0.88 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.54 3k8t h MET 193 CO 0.08 1.11 -0.16 0.66 1.06 0.00 0.00 176.91 179.66 3k8t h SER 194 N 0.71 0.20 -0.32 1.22 4.64 -0.92 -0.52 113.55 118.56 3k8t h SER 194 Ca 0.06 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3k8t h SER 194 Cb 0.93 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3k8t h SER 194 CO 0.09 0.39 0.00 0.18 -0.87 0.00 0.00 176.83 176.62 3k8t n LEU 195 N -4.25 1.83 -2.32 5.97 4.77 -0.73 -4.95 117.00 117.32 3k8t n LEU 195 Ca -0.01 -0.90 -0.16 0.00 -0.03 0.00 0.00 56.01 54.92 3k8t n LEU 195 Cb 0.29 -0.22 0.04 0.00 -2.33 0.00 0.00 43.42 41.20 3k8t n LEU 195 CO 0.38 0.45 0.07 0.29 -1.33 0.00 0.00 177.39 177.25 3k8t n LYS 196 N 0.49 -4.18 0.07 3.23 5.02 -0.20 -4.94 118.16 117.65 3k8t n LYS 196 Ca 0.12 0.60 -0.15 0.00 -2.02 0.00 0.00 58.31 56.86 3k8t n LYS 196 Cb 0.30 -4.86 -0.07 0.00 -0.02 0.00 0.00 35.03 30.37 3k8t n LYS 196 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 3k8t h TYR 197 N -1.31 0.67 -3.33 2.13 -1.99 -1.48 -3.43 116.97 108.23 3k8t h TYR 197 Ca -0.37 -0.39 -0.02 0.00 2.00 0.00 0.00 58.73 59.95 3k8t h TYR 197 Cb 1.25 -0.07 -0.06 0.00 2.00 0.00 0.00 36.73 39.86 3k8t h TYR 197 CO 0.35 1.23 0.08 -0.59 -0.00 0.00 0.00 178.16 179.23 3k8t s PHE 198 N -3.14 0.17 0.12 4.88 -0.71 -1.26 -0.61 117.98 117.43 3k8t s PHE 198 Ca -0.06 -0.61 -0.11 0.00 -1.04 0.00 0.00 56.93 55.11 3k8t s PHE 198 Cb 0.08 0.48 0.00 0.00 -1.21 0.00 0.00 43.02 42.37 3k8t s PHE 198 CO 0.88 -1.20 0.28 -0.08 -1.34 0.00 0.00 175.22 173.76 3k8t s THR 199 N -3.61 0.10 0.32 -4.49 -1.32 -0.09 -4.48 115.64 102.06 3k8t s THR 199 Ca 0.18 -1.11 0.04 0.00 -1.21 0.00 0.00 61.69 59.58 3k8t s THR 199 Cb -0.03 -1.48 -0.02 0.00 -1.51 0.00 0.00 72.50 69.46 3k8t s THR 199 CO 0.10 -0.45 0.47 -1.00 -2.21 0.00 0.00 174.62 171.53 3k8t s HIS 200 N -3.88 3.35 0.84 9.09 3.76 -1.26 -1.11 115.29 126.07 3k8t s HIS 200 Ca 0.09 0.06 -0.11 0.00 -0.15 0.00 0.00 55.06 54.94 3k8t s HIS 200 Cb 0.03 -1.85 0.09 0.00 1.11 0.00 0.00 32.58 31.97 3k8t s HIS 200 CO -0.07 0.15 1.09 0.00 -0.85 0.00 0.00 174.74 175.06 3k8t s ALA 201 N -2.19 1.89 0.24 -1.40 0.00 -0.62 -4.69 121.76 114.99 3k8t s ALA 201 Ca 0.40 0.06 -0.09 0.00 0.00 0.00 0.00 51.96 52.33 3k8t s ALA 201 Cb -0.09 -3.22 0.39 0.00 0.00 0.00 0.00 23.12 20.20 3k8t s ALA 201 CO 0.32 -2.06 1.63 0.77 0.00 0.00 0.00 175.76 176.42 3k8t h SER 202 N -1.34 -0.42 -0.89 0.00 0.02 -1.94 -0.79 113.55 108.20 3k8t h SER 202 Ca -0.47 0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.67 3k8t h SER 202 Cb 1.26 0.36 -0.04 0.00 0.14 0.00 0.00 62.40 64.12 3k8t h SER 202 CO 0.54 -0.19 0.52 -0.65 -1.14 0.00 0.00 176.83 175.91 3k8t h PRO 203 N 0.08 1.22 -0.07 3.45 0.11 -1.88 0.38 132.00 135.29 3k8t h PRO 203 Ca 0.39 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.38 3k8t h PRO 203 Cb 0.66 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 3k8t h PRO 203 CO -0.67 0.87 0.04 1.15 -0.21 0.00 0.00 178.00 179.18 3k8t h THR 204 N 1.24 1.04 -0.34 -1.15 2.02 -1.20 0.12 112.91 114.64 3k8t h THR 204 Ca 0.32 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.40 3k8t h THR 204 Cb -0.02 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 3k8t h THR 204 CO -0.06 0.03 0.22 -0.07 0.37 0.00 0.00 175.52 176.02 3k8t h LEU 205 N 0.07 0.40 -0.19 2.58 3.38 -0.91 0.66 115.31 121.31 3k8t h LEU 205 Ca 0.02 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.99 3k8t h LEU 205 Cb 0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3k8t h LEU 205 CO -0.00 0.30 0.05 -0.26 0.09 0.00 0.00 178.44 178.62 3k8t h PHE 206 N 0.45 0.08 0.00 1.13 0.05 -0.14 -3.40 116.94 115.12 3k8t h PHE 206 Ca 0.12 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.92 3k8t h PHE 206 Cb -0.03 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 37.91 3k8t h PHE 206 CO -0.05 0.03 -1.15 0.09 -0.18 0.00 0.00 178.31 177.06 3k8t n ASN 207 N -5.07 2.62 -4.70 2.17 3.02 0.41 -4.94 115.26 108.77 3k8t n ASN 207 Ca -0.03 -0.14 -0.44 0.00 -0.03 0.00 0.00 54.58 53.94 3k8t n ASN 207 Cb 0.08 1.28 -0.03 0.00 -0.61 0.00 0.00 39.78 40.51 3k8t n ASN 207 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k8t n ALA 208 N -1.65 1.83 -0.47 5.41 0.00 0.20 -1.84 120.51 123.98 3k8t n ALA 208 Ca -0.01 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 3k8t n ALA 208 Cb 0.19 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.26 3k8t n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k8t n GLY 209 N 2.59 1.22 3.95 0.00 0.00 -1.26 -4.50 105.19 107.19 3k8t n GLY 209 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 3k8t n GLY 209 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k8t s THR 210 N -3.16 4.00 0.23 2.61 -4.23 -0.77 -0.91 115.64 113.40 3k8t s THR 210 Ca 0.00 -1.10 -0.06 0.00 -1.18 0.00 0.00 61.69 59.35 3k8t s THR 210 Cb 0.00 -3.37 0.19 0.00 1.34 0.00 0.00 72.50 70.66 3k8t s THR 210 CO 0.00 -0.17 1.83 -0.65 -0.54 0.00 0.00 174.62 175.08 3k8t h PRO 211 N 1.01 0.80 -3.14 3.99 0.11 -1.81 -3.21 132.00 129.75 3k8t h PRO 211 Ca -0.46 -0.05 -0.65 0.00 0.11 0.00 0.00 66.00 64.96 3k8t h PRO 211 Cb 1.25 -0.18 -0.40 0.00 0.11 0.00 0.00 31.00 31.79 3k8t h PRO 211 CO 0.55 0.53 -0.41 1.63 -0.21 0.00 0.00 178.00 180.09 3k8t n LYS 212 N -4.71 2.13 -2.35 1.05 5.02 -1.26 -4.94 118.16 113.10 3k8t n LYS 212 Ca 0.11 -4.50 -0.40 0.00 -2.02 0.00 0.00 58.31 51.51 3k8t n LYS 212 Cb 0.20 -2.33 -0.03 0.00 -0.02 0.00 0.00 35.03 32.85 3k8t n LYS 212 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3k8t s PRO 213 N -1.48 2.99 -0.56 1.97 0.04 -1.21 -4.84 135.00 131.91 3k8t s PRO 213 Ca 0.26 0.01 -0.13 0.00 0.04 0.00 0.00 61.00 61.18 3k8t s PRO 213 Cb -0.05 -4.36 0.14 0.00 0.04 0.00 0.00 34.50 30.27 3k8t s PRO 213 CO -0.15 -2.41 0.49 -1.14 0.04 0.00 0.00 177.00 173.82 3k8t s GLN 214 N 6.21 2.90 0.00 4.56 -0.44 -1.26 0.61 119.66 132.24 3k8t s GLN 214 Ca 0.49 -1.85 0.17 0.00 -2.50 0.00 0.00 55.36 51.66 3k8t s GLN 214 Cb -0.09 -4.18 0.09 0.00 -1.64 0.00 0.00 33.01 27.18 3k8t s GLN 214 CO 0.15 -1.28 0.97 -1.33 0.50 0.00 0.00 175.29 174.30 3k8t n MET 215 N 4.92 1.47 -3.52 1.67 2.81 -1.26 -4.56 117.12 118.65 3k8t n MET 215 Ca -0.08 -1.26 -0.38 0.00 -1.81 0.00 0.00 57.70 54.17 3k8t n MET 215 Cb 0.41 -1.31 -0.06 0.00 -0.71 0.00 0.00 33.22 31.55 3k8t n MET 215 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 3k8t s SER 216 N -1.59 6.79 0.01 7.83 0.01 -1.26 -3.47 113.70 122.02 3k8t s SER 216 Ca 0.18 0.94 0.19 0.00 1.31 0.00 0.00 55.95 58.56 3k8t s SER 216 Cb 0.14 -2.24 -0.18 0.00 0.21 0.00 0.00 66.02 63.95 3k8t s SER 216 CO 0.28 0.32 0.65 -1.20 0.41 0.00 0.00 173.24 173.69 3k8t n SER 217 N 1.76 0.52 -4.05 2.44 7.64 -0.51 -4.55 113.62 116.87 3k8t n SER 217 Ca -0.14 0.22 -0.23 0.00 1.01 0.00 0.00 58.87 59.74 3k8t n SER 217 Cb 0.52 0.75 -0.16 0.00 -1.01 0.00 0.00 64.21 64.31 3k8t n SER 217 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k8t s PHE 219 N 0.24 1.51 -0.22 0.00 0.40 0.04 -1.38 117.98 118.58 3k8t s PHE 219 Ca -0.06 -0.52 0.01 0.00 -0.60 0.00 0.00 56.93 55.76 3k8t s PHE 219 Cb -0.11 -1.08 0.03 0.00 0.51 0.00 0.00 43.02 42.37 3k8t s PHE 219 CO 0.02 -0.24 -0.14 -0.51 0.70 0.00 0.00 175.22 175.04 3k8t s LEU 220 N 0.48 2.75 -0.13 -0.37 1.43 0.66 -0.65 118.68 122.84 3k8t s LEU 220 Ca -0.12 -0.89 -0.01 0.00 -1.03 0.00 0.00 54.13 52.08 3k8t s LEU 220 Cb -0.14 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 3k8t s LEU 220 CO 0.03 -0.08 -0.09 -0.69 0.23 0.00 0.00 176.35 175.75 3k8t s VAL 221 N 1.25 3.42 -0.15 -1.59 1.01 0.82 -1.37 120.40 123.80 3k8t s VAL 221 Ca 0.00 -0.54 -0.29 0.00 0.00 0.00 0.00 61.98 61.16 3k8t s VAL 221 Cb -0.16 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 33.76 3k8t s VAL 221 CO -0.09 0.52 1.00 0.00 0.00 0.00 0.00 175.10 176.53 3k8t s ALA 222 N 0.21 3.50 -0.06 5.51 0.00 -1.26 -1.69 121.76 127.97 3k8t s ALA 222 Ca -0.06 0.28 -0.35 0.00 0.00 0.00 0.00 51.96 51.83 3k8t s ALA 222 Cb -0.15 -3.44 -0.13 0.00 0.00 0.00 0.00 23.12 19.40 3k8t s ALA 222 CO 0.04 -0.74 1.74 -0.12 0.00 0.00 0.00 175.76 176.68 3k8t n MET 223 N 5.41 1.88 0.11 0.00 1.56 -1.00 -4.67 117.12 120.42 3k8t n MET 223 Ca 0.09 0.69 -0.03 0.00 -0.27 0.00 0.00 57.70 58.18 3k8t n MET 223 Cb 0.48 -2.47 0.19 0.00 2.15 0.00 0.00 33.22 33.57 3k8t n MET 223 CO 0.00 0.00 0.00 0.87 -0.73 0.00 0.00 175.97 176.11 3k8t h LYS 224 N 7.70 0.17 -1.38 2.12 1.57 -1.93 -3.46 116.57 121.37 3k8t h LYS 224 Ca -0.47 -0.10 0.16 0.00 -1.87 0.00 0.00 60.65 58.37 3k8t h LYS 224 Cb 1.28 0.01 -0.24 0.00 0.08 0.00 0.00 32.23 33.36 3k8t h LYS 224 CO 0.92 0.65 0.73 -2.00 -0.57 0.00 0.00 179.45 179.18 3k8t s GLU 225 N -3.91 0.37 -1.50 3.15 2.12 -1.26 -4.84 118.70 112.83 3k8t s GLU 225 Ca -0.03 0.06 -0.11 0.00 0.36 0.00 0.00 54.97 55.24 3k8t s GLU 225 Cb 0.13 0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.69 3k8t s GLU 225 CO 0.77 -0.12 2.52 -3.47 -0.54 0.00 0.00 175.26 174.42 3k8t n ASP 226 N 0.54 6.37 -3.72 -1.70 4.64 -1.26 -3.72 116.55 117.69 3k8t n ASP 226 Ca -0.05 -2.78 -0.10 0.00 -1.38 0.00 0.00 54.79 50.48 3k8t n ASP 226 Cb 0.58 -1.58 -0.05 0.00 -1.04 0.00 0.00 41.12 39.03 3k8t n ASP 226 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3k8t s SER 227 N 2.32 -0.11 0.19 1.67 1.04 -1.26 -4.93 113.70 112.62 3k8t s SER 227 Ca 0.56 -0.46 -0.13 0.00 0.48 0.00 0.00 55.95 56.41 3k8t s SER 227 Cb 0.16 0.43 0.20 0.00 0.10 0.00 0.00 66.02 66.91 3k8t s SER 227 CO -0.07 -0.82 1.71 0.40 0.98 0.00 0.00 173.24 175.44 3k8t h ILE 228 N 2.49 0.71 0.20 -1.02 1.08 -1.99 -1.08 117.51 117.91 3k8t h ILE 228 Ca -0.34 -0.08 0.01 0.00 -0.39 0.00 0.00 64.86 64.06 3k8t h ILE 228 Cb 1.24 0.45 -0.03 0.00 -3.07 0.00 0.00 36.82 35.41 3k8t h ILE 228 CO 0.50 0.04 -0.31 -0.08 -0.69 0.00 0.00 178.15 177.61 3k8t h GLU 229 N 0.24 -0.56 -0.48 2.37 4.81 -1.97 0.92 114.58 119.91 3k8t h GLU 229 Ca 0.26 0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.57 3k8t h GLU 229 Cb 0.35 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.81 3k8t h GLU 229 CO -0.33 -0.37 0.21 0.78 -0.73 0.00 0.00 179.01 178.56 3k8t h GLY 230 N -0.58 0.65 0.20 1.92 0.00 -1.76 0.16 103.07 103.67 3k8t h GLY 230 Ca 0.01 -0.13 0.10 0.00 0.00 0.00 0.00 47.33 47.31 3k8t h GLY 230 CO -0.13 0.07 0.08 -2.22 0.00 0.00 0.00 176.54 174.33 3k8t h ILE 231 N 0.42 0.64 0.00 2.60 2.04 -1.05 0.11 117.51 122.26 3k8t h ILE 231 Ca 0.22 -0.07 -0.18 0.00 1.00 0.00 0.00 64.86 65.83 3k8t h ILE 231 Cb 0.17 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 3k8t h ILE 231 CO -0.18 0.04 -0.91 1.88 0.00 0.00 0.00 178.15 178.97 3k8t h TYR 232 N 0.20 0.00 -0.54 1.37 -1.99 -0.51 -0.56 116.97 114.94 3k8t h TYR 232 Ca 0.28 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.92 3k8t h TYR 232 Cb 0.41 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.13 3k8t h TYR 232 CO -0.27 0.83 -0.02 -0.44 -0.00 0.00 0.00 178.16 178.26 3k8t h ASP 233 N 0.00 0.95 -0.37 3.88 3.45 -0.60 -1.73 116.42 122.00 3k8t h ASP 233 Ca -0.03 -0.32 -0.11 0.00 0.43 0.00 0.00 57.03 57.00 3k8t h ASP 233 Cb 1.66 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 40.16 3k8t h ASP 233 CO 0.10 1.04 -0.20 0.74 -1.57 0.00 0.00 179.24 179.35 3k8t h THR 234 N 0.84 1.28 -0.46 0.35 2.02 -0.72 -2.21 112.91 114.02 3k8t h THR 234 Ca 0.15 -1.34 0.05 0.00 0.77 0.00 0.00 66.41 66.04 3k8t h THR 234 Cb 0.56 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 68.27 3k8t h THR 234 CO 0.03 0.44 0.20 0.25 0.37 0.00 0.00 175.52 176.81 3k8t h LEU 235 N 0.59 0.25 -1.13 2.58 5.85 -1.07 0.20 115.31 122.58 3k8t h LEU 235 Ca 0.08 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 3k8t h LEU 235 Cb 0.76 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 3k8t h LEU 235 CO 0.06 0.18 0.48 0.50 -0.34 0.00 0.00 178.44 179.32 3k8t h LYS 236 N 0.40 1.07 -0.37 1.25 3.64 -1.22 -0.42 116.57 120.93 3k8t h LYS 236 Ca 0.21 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.37 3k8t h LYS 236 Cb 0.16 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3k8t h LYS 236 CO -0.18 0.75 -0.24 1.49 -2.27 0.00 0.00 179.45 179.01 3k8t h GLU 237 N 1.09 0.80 -0.79 1.90 4.81 -0.71 -1.56 114.58 120.12 3k8t h GLU 237 Ca 0.29 -0.38 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 3k8t h GLU 237 Cb -0.05 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 3k8t h GLU 237 CO -0.05 1.01 0.38 0.00 -0.73 0.00 0.00 179.01 179.62 3k8t h ALA 239 N 1.30 0.88 -0.17 0.00 0.00 -0.91 -1.07 119.26 119.29 3k8t h ALA 239 Ca 0.27 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 3k8t h ALA 239 Cb 0.10 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3k8t h ALA 239 CO -0.04 0.64 -0.26 -0.07 0.00 0.00 0.00 179.25 179.53 3k8t h LEU 240 N 0.85 0.52 -0.49 0.00 3.38 -0.96 -2.10 115.31 116.51 3k8t h LEU 240 Ca 0.14 -0.52 0.07 0.00 0.09 0.00 0.00 57.88 57.65 3k8t h LEU 240 Cb 0.61 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 3k8t h LEU 240 CO 0.04 0.94 0.17 0.40 0.09 0.00 0.00 178.44 180.08 3k8t h ILE 241 N 0.11 0.83 0.00 1.22 2.04 -1.27 -2.99 117.51 117.45 3k8t h ILE 241 Ca 0.02 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.76 3k8t h ILE 241 Cb 0.83 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 3k8t h ILE 241 CO 0.06 0.06 0.00 -0.24 0.00 0.00 0.00 178.15 178.03 3k8t n SER 242 N -5.01 0.00 0.15 1.72 2.88 -0.41 -1.98 113.62 110.98 3k8t n SER 242 Ca 0.05 0.45 0.02 0.00 -1.33 0.00 0.00 58.87 58.06 3k8t n SER 242 Cb 0.19 -0.48 0.19 0.00 -0.75 0.00 0.00 64.21 63.36 3k8t n SER 242 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 3k8t h LYS 243 N 0.00 0.00 -0.63 -1.46 3.64 -1.22 -3.05 116.57 113.85 3k8t h LYS 243 Ca 0.00 0.00 -0.46 0.00 -1.27 0.00 0.00 60.65 58.92 3k8t h LYS 243 Cb 0.33 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 31.80 3k8t h LYS 243 CO 0.00 0.52 -0.65 0.25 -2.27 0.00 0.00 179.45 177.30 3k8t n THR 244 N -3.50 2.54 -1.71 1.00 -2.24 -0.84 -2.40 114.28 107.14 3k8t n THR 244 Ca 0.00 -3.95 0.00 0.00 -2.27 0.00 0.00 64.05 57.83 3k8t n THR 244 Cb 0.63 -0.97 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 3k8t n THR 244 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k8t n ALA 245 N -0.80 -2.00 0.00 6.98 0.00 -1.22 -4.94 120.51 118.53 3k8t n ALA 245 Ca 0.41 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.32 3k8t n ALA 245 Cb 0.91 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.92 3k8t n ALA 245 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k8t n GLY 246 N -0.44 3.99 3.89 0.00 0.00 -1.26 -4.86 105.19 106.51 3k8t n GLY 246 Ca 0.00 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 3k8t n GLY 246 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k8t s GLY 247 N 0.00 1.60 -0.07 -0.02 0.00 -0.46 -4.73 107.32 103.64 3k8t s GLY 247 Ca 0.00 -0.34 0.04 0.00 0.00 0.00 0.00 44.72 44.42 3k8t s GLY 247 CO 0.00 -0.08 -0.21 -0.42 0.00 0.00 0.00 173.10 172.39 3k8t s ILE 248 N -3.08 1.79 -0.22 0.90 1.01 -1.23 -0.78 121.20 119.60 3k8t s ILE 248 Ca 0.54 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 60.23 3k8t s ILE 248 Cb -0.11 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 3k8t s ILE 248 CO 0.50 0.50 0.03 -0.83 0.00 0.00 0.00 174.94 175.14 3k8t s GLY 249 N 0.17 1.74 -0.15 6.18 0.00 0.17 -0.93 107.32 114.51 3k8t s GLY 249 Ca -0.11 -1.06 0.02 0.00 0.00 0.00 0.00 44.72 43.57 3k8t s GLY 249 CO 0.05 0.39 -0.21 -2.27 0.00 0.00 0.00 173.10 171.06 3k8t s LEU 250 N 1.31 2.18 -0.13 0.66 2.96 0.43 -0.13 118.68 125.95 3k8t s LEU 250 Ca 0.04 -0.58 -0.11 0.00 -0.22 0.00 0.00 54.13 53.26 3k8t s LEU 250 Cb -0.15 -1.47 -0.05 0.00 0.50 0.00 0.00 46.19 45.03 3k8t s LEU 250 CO 0.02 0.08 0.23 -1.38 -1.32 0.00 0.00 176.35 173.97 3k8t s HIS 251 N 0.85 3.54 -0.12 5.38 -3.43 -0.68 -0.53 115.29 120.29 3k8t s HIS 251 Ca -0.06 0.58 0.17 0.00 -0.80 0.00 0.00 55.06 54.95 3k8t s HIS 251 Cb -0.15 -2.17 0.41 0.00 -1.43 0.00 0.00 32.58 29.24 3k8t s HIS 251 CO -0.02 0.47 1.19 0.44 -2.00 0.00 0.00 174.74 174.82 3k8t n ILE 252 N 2.78 1.26 0.30 -5.38 -5.35 -0.61 -2.37 119.36 110.00 3k8t n ILE 252 Ca -0.16 -2.24 0.13 0.00 -0.27 0.00 0.00 62.75 60.21 3k8t n ILE 252 Cb 0.53 0.28 0.60 0.00 -1.74 0.00 0.00 39.64 39.30 3k8t n ILE 252 CO 0.00 0.00 0.00 0.45 -1.76 0.00 0.00 176.55 175.24 3k8t h HIS 253 N 0.95 0.00 -0.05 4.28 -0.00 -1.95 -2.94 115.15 115.44 3k8t h HIS 253 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.28 3k8t h HIS 253 Cb 1.37 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.78 3k8t h HIS 253 CO 0.49 0.00 0.00 0.27 -0.00 0.00 0.00 177.93 178.69 3k8t n ASN 254 N -2.40 1.63 -4.68 2.45 6.94 -1.26 -4.65 115.26 113.28 3k8t n ASN 254 Ca 0.00 -1.57 -0.40 0.00 -0.02 0.00 0.00 54.58 52.60 3k8t n ASN 254 Cb 0.16 -0.02 -0.05 0.00 -2.36 0.00 0.00 39.78 37.51 3k8t n ASN 254 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3k8t s ILE 255 N -1.95 5.03 0.50 1.53 -1.09 -1.11 -4.48 121.20 119.62 3k8t s ILE 255 Ca 0.36 1.27 -0.23 0.00 -2.23 0.00 0.00 60.65 59.83 3k8t s ILE 255 Cb 0.20 -3.97 -0.06 0.00 -1.58 0.00 0.00 42.46 37.05 3k8t s ILE 255 CO 0.32 0.16 1.29 0.00 -1.23 0.00 0.00 174.94 175.48 3k8t s ARG 256 N 1.54 3.44 0.74 2.79 1.70 -1.26 -4.63 118.95 123.26 3k8t s ARG 256 Ca 0.32 2.07 -0.05 0.00 -0.47 0.00 0.00 55.73 57.60 3k8t s ARG 256 Cb -0.16 -2.36 0.11 0.00 -0.57 0.00 0.00 34.95 31.97 3k8t s ARG 256 CO 0.12 -0.90 1.03 -1.54 -1.08 0.00 0.00 175.30 172.93 3k8t s SER 257 N -1.06 4.37 0.22 -2.89 1.04 -1.26 -4.53 113.70 109.59 3k8t s SER 257 Ca 0.67 0.00 -0.32 0.00 0.48 0.00 0.00 55.95 56.79 3k8t s SER 257 Cb -0.36 -0.46 -0.14 0.00 0.10 0.00 0.00 66.02 65.16 3k8t s SER 257 CO 0.44 -1.85 1.40 0.41 0.98 0.00 0.00 173.24 174.61 3k8t n THR 258 N -2.95 0.81 -0.08 2.02 -1.04 -1.26 -1.55 114.28 110.22 3k8t n THR 258 Ca 0.12 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 3k8t n THR 258 Cb 0.60 -1.39 0.00 0.00 -1.82 0.00 0.00 70.33 67.72 3k8t n THR 258 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3k8t n GLY 259 N 2.29 1.62 3.78 3.41 0.00 0.74 -4.91 105.19 112.12 3k8t n GLY 259 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 3k8t n GLY 259 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k8t s SER 260 N -3.15 5.53 0.26 1.61 0.01 -0.59 -4.63 113.70 112.74 3k8t s SER 260 Ca 0.00 2.08 -0.30 0.00 1.31 0.00 0.00 55.95 59.04 3k8t s SER 260 Cb 0.00 -2.57 -0.09 0.00 0.21 0.00 0.00 66.02 63.57 3k8t s SER 260 CO 0.00 -1.35 1.04 -0.47 0.41 0.00 0.00 173.24 172.87 3k8t s TYR 261 N -2.03 3.74 -0.25 2.43 6.04 -1.26 0.22 117.35 126.24 3k8t s TYR 261 Ca 0.70 1.78 -0.02 0.00 0.04 0.00 0.00 57.07 59.57 3k8t s TYR 261 Cb -0.22 -3.16 0.02 0.00 -1.04 0.00 0.00 41.96 37.56 3k8t s TYR 261 CO 0.32 -0.16 -0.05 0.42 -1.54 0.00 0.00 175.55 174.55 3k8t s ILE 262 N -1.11 3.00 0.20 3.14 1.01 -0.31 -4.81 121.20 122.32 3k8t s ILE 262 Ca 0.43 -0.96 0.10 0.00 0.00 0.00 0.00 60.65 60.22 3k8t s ILE 262 Cb -0.29 -2.52 -0.07 0.00 0.01 0.00 0.00 42.46 39.59 3k8t s ILE 262 CO 0.37 0.20 1.51 0.00 0.00 0.00 0.00 174.94 177.02 3k8t h ALA 263 N 8.04 0.77 -0.05 9.38 0.00 -1.96 -0.70 119.26 134.74 3k8t h ALA 263 Ca -0.33 -0.65 -0.14 0.00 0.00 0.00 0.00 54.91 53.79 3k8t h ALA 263 Cb 1.11 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3k8t h ALA 263 CO 0.58 0.90 -0.59 0.78 0.00 0.00 0.00 179.25 180.92 3k8t h GLY 264 N 2.29 0.17 -0.11 0.00 0.00 -1.97 -3.15 103.07 100.30 3k8t h GLY 264 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3k8t h GLY 264 CO 0.09 0.19 0.00 -1.30 0.00 0.00 0.00 176.54 175.52 3k8t n THR 265 N -3.87 0.47 -4.13 4.70 -2.24 -1.23 -5.01 114.28 102.98 3k8t n THR 265 Ca -0.02 -0.73 -0.30 0.00 -2.27 0.00 0.00 64.05 60.73 3k8t n THR 265 Cb 0.60 0.78 -0.05 0.00 -2.10 0.00 0.00 70.33 69.55 3k8t n THR 265 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3k8t n ASN 266 N -0.15 -0.16 0.00 3.42 4.05 -0.35 -4.93 115.26 117.14 3k8t n ASN 266 Ca 0.01 -1.16 0.00 0.00 0.45 0.00 0.00 54.58 53.88 3k8t n ASN 266 Cb 0.14 -2.26 0.00 0.00 1.23 0.00 0.00 39.78 38.89 3k8t n ASN 266 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3k8t n GLY 267 N -2.27 6.83 2.88 8.20 0.00 -0.74 -4.94 105.19 115.15 3k8t n GLY 267 Ca -0.30 -1.83 -0.18 0.00 0.00 0.00 0.00 46.02 43.71 3k8t n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k8t s THR 268 N 0.71 0.38 0.50 2.61 2.01 -1.26 -1.17 115.64 119.42 3k8t s THR 268 Ca 0.00 -0.07 -0.21 0.00 0.31 0.00 0.00 61.69 61.71 3k8t s THR 268 Cb 0.00 -0.41 -0.06 0.00 0.01 0.00 0.00 72.50 72.04 3k8t s THR 268 CO 0.00 0.17 1.17 -0.55 -0.69 0.00 0.00 174.62 174.72 3k8t s SER 269 N 0.70 5.91 0.00 3.53 0.15 0.13 -4.84 113.70 119.28 3k8t s SER 269 Ca -0.08 2.29 0.23 0.00 0.70 0.00 0.00 55.95 59.09 3k8t s SER 269 Cb -0.11 -2.60 0.51 0.00 -1.71 0.00 0.00 66.02 62.11 3k8t s SER 269 CO -0.00 -1.10 1.44 0.59 1.20 0.00 0.00 173.24 175.36 3k8t n ASN 270 N -0.86 2.87 0.00 5.45 5.03 -1.26 -0.19 115.26 126.30 3k8t n ASN 270 Ca 0.09 -1.91 0.00 0.00 0.87 0.00 0.00 54.58 53.64 3k8t n ASN 270 Cb 0.49 -0.18 0.00 0.00 -1.02 0.00 0.00 39.78 39.07 3k8t n ASN 270 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3k8t n GLY 271 N 1.38 -1.65 0.14 7.41 0.00 -1.26 -4.49 105.19 106.71 3k8t n GLY 271 Ca 0.18 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.67 3k8t n GLY 271 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k8t h LEU 272 N 0.00 0.27 -0.16 0.99 3.38 -1.92 -3.31 115.31 114.56 3k8t h LEU 272 Ca 0.00 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 3k8t h LEU 272 Cb 0.00 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 3k8t h LEU 272 CO 0.00 0.98 -0.10 0.40 0.09 0.00 0.00 178.44 179.82 3k8t h ILE 273 N 0.13 1.32 -0.92 1.22 1.08 -1.95 0.84 117.51 119.23 3k8t h ILE 273 Ca -0.04 -1.17 0.10 0.00 -0.39 0.00 0.00 64.86 63.36 3k8t h ILE 273 Cb 1.43 1.76 -0.07 0.00 -3.07 0.00 0.00 36.82 36.87 3k8t h ILE 273 CO 0.13 0.35 0.60 -0.65 -0.69 0.00 0.00 178.15 177.88 3k8t h PRO 274 N 0.00 0.91 -0.42 2.37 0.11 -1.79 -1.75 132.00 131.44 3k8t h PRO 274 Ca 0.03 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 3k8t h PRO 274 Cb 0.58 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 3k8t h PRO 274 CO 0.03 0.60 -0.12 1.98 -0.21 0.00 0.00 178.00 180.28 3k8t h MET 275 N 0.94 0.83 -0.95 1.05 4.05 -1.48 -2.37 114.93 116.99 3k8t h MET 275 Ca 0.43 -0.32 0.14 0.00 -0.28 0.00 0.00 59.70 59.66 3k8t h MET 275 Cb 0.39 -0.04 -0.09 0.00 -0.80 0.00 0.00 31.60 31.06 3k8t h MET 275 CO -0.19 0.95 0.57 0.82 0.23 0.00 0.00 176.91 179.29 3k8t h ILE 276 N 0.65 0.83 -0.33 1.77 1.08 -0.48 -1.92 117.51 119.10 3k8t h ILE 276 Ca 0.11 -0.29 -0.05 0.00 -0.39 0.00 0.00 64.86 64.24 3k8t h ILE 276 Cb 0.65 -0.08 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 3k8t h ILE 276 CO 0.04 0.15 -0.00 0.03 -0.69 0.00 0.00 178.15 177.69 3k8t h ARG 277 N 0.84 0.52 -0.24 2.37 3.08 -0.80 0.16 114.38 120.31 3k8t h ARG 277 Ca 0.50 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.43 3k8t h ARG 277 Cb 0.60 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 3k8t h ARG 277 CO -0.31 0.55 0.12 0.28 -1.07 0.00 0.00 179.97 179.53 3k8t h VAL 278 N 0.50 1.14 -0.37 2.04 2.07 -1.13 -1.72 116.25 118.77 3k8t h VAL 278 Ca 0.11 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.17 3k8t h VAL 278 Cb 0.32 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 3k8t h VAL 278 CO 0.01 0.14 -0.03 -0.26 0.02 0.00 0.00 177.57 177.44 3k8t h PHE 279 N 0.26 0.63 -0.24 1.57 0.04 -0.90 -2.10 116.94 116.20 3k8t h PHE 279 Ca 0.08 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 3k8t h PHE 279 Cb 0.11 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 3k8t h PHE 279 CO -0.02 0.63 0.10 -0.97 -0.60 0.00 0.00 178.31 177.45 3k8t h ASN 280 N 0.57 0.34 -0.94 2.17 -1.24 -0.45 -1.22 115.58 114.80 3k8t h ASN 280 Ca 0.11 -0.16 -0.00 0.00 0.71 0.00 0.00 56.30 56.96 3k8t h ASN 280 Cb 0.41 -0.09 -0.05 0.00 0.73 0.00 0.00 38.32 39.33 3k8t h ASN 280 CO 0.02 0.41 0.58 -1.13 -1.29 0.00 0.00 177.43 176.02 3k8t h ASN 281 N 0.24 1.13 -0.51 1.15 -0.73 -1.04 -2.25 115.58 113.58 3k8t h ASN 281 Ca 0.08 -0.06 -0.09 0.00 1.87 0.00 0.00 56.30 58.10 3k8t h ASN 281 Cb 0.18 -0.28 -0.02 0.00 0.27 0.00 0.00 38.32 38.46 3k8t h ASN 281 CO -0.01 0.86 -0.01 0.74 -0.37 0.00 0.00 177.43 178.64 3k8t h THR 282 N 1.30 1.26 -0.72 -3.57 2.02 -1.08 -0.77 112.91 111.36 3k8t h THR 282 Ca 0.34 -1.11 0.01 0.00 0.77 0.00 0.00 66.41 66.41 3k8t h THR 282 Cb -0.07 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.15 3k8t h THR 282 CO -0.07 0.40 0.47 0.00 0.37 0.00 0.00 175.52 176.70 3k8t h ALA 283 N 1.10 1.48 -0.11 6.16 0.00 -0.89 -1.49 119.26 125.52 3k8t h ALA 283 Ca 0.16 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 3k8t h ALA 283 Cb 0.53 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3k8t h ALA 283 CO 0.03 0.48 -0.42 0.00 0.00 0.00 0.00 179.25 179.34 3k8t h ARG 284 N 0.98 0.49 -0.06 0.00 3.08 -1.23 0.26 114.38 117.90 3k8t h ARG 284 Ca 0.26 -0.37 0.01 0.00 0.07 0.00 0.00 59.98 59.96 3k8t h ARG 284 Cb -0.11 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 3k8t h ARG 284 CO -0.06 1.00 -0.03 -0.92 -1.07 0.00 0.00 179.97 178.89 3k8t h TYR 285 N 0.08 -0.07 -3.56 3.04 3.20 -0.96 -3.40 116.97 115.30 3k8t h TYR 285 Ca -0.02 0.01 -0.63 0.00 3.14 0.00 0.00 58.73 61.23 3k8t h TYR 285 Cb 1.05 0.04 -0.13 0.00 1.54 0.00 0.00 36.73 39.23 3k8t h TYR 285 CO 0.11 -0.05 0.14 0.08 -1.64 0.00 0.00 178.16 176.80 3k8t s VAL 286 N -6.19 4.90 -0.60 1.81 1.01 -0.58 -4.96 120.40 115.79 3k8t s VAL 286 Ca -0.13 0.61 0.06 0.00 0.00 0.00 0.00 61.98 62.51 3k8t s VAL 286 Cb 0.07 -4.06 0.29 0.00 0.00 0.00 0.00 36.38 32.68 3k8t s VAL 286 CO 0.67 -0.29 0.82 -0.90 0.00 0.00 0.00 175.10 175.40 3k8t n ASP 287 N 6.01 3.87 -2.95 3.32 3.85 -1.26 -3.16 116.55 126.23 3k8t n ASP 287 Ca -0.01 -3.51 -0.20 0.00 -0.71 0.00 0.00 54.79 50.36 3k8t n ASP 287 Cb 0.49 -0.63 0.01 0.00 -1.35 0.00 0.00 41.12 39.64 3k8t n ASP 287 CO 0.00 0.00 0.00 1.67 -1.01 0.00 0.00 177.20 177.86 3k8t n GLN 288 N 0.43 -3.39 0.00 0.11 7.27 -1.15 -1.99 117.38 118.66 3k8t n GLN 288 Ca 0.30 0.68 0.00 0.00 0.07 0.00 0.00 57.00 58.05 3k8t n GLN 288 Cb 0.41 -5.40 0.00 0.00 2.41 0.00 0.00 30.24 27.66 3k8t n GLN 288 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3k8t n GLY 289 N -1.17 1.14 0.26 1.69 0.00 -1.01 -4.74 105.19 101.36 3k8t n GLY 289 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3k8t n GLY 289 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k8t n GLY 290 N -0.88 0.83 3.16 -0.02 0.00 -0.84 -5.14 105.19 102.29 3k8t n GLY 290 Ca 0.00 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 3k8t n GLY 290 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3k8t s PRO 294 N -1.73 0.91 0.60 1.61 0.02 -1.26 -5.04 135.00 130.12 3k8t s PRO 294 Ca 0.00 -0.84 -0.15 0.00 0.02 0.00 0.00 61.00 60.02 3k8t s PRO 294 Cb 0.00 -0.94 -0.03 0.00 0.02 0.00 0.00 34.50 33.55 3k8t s PRO 294 CO 0.00 0.22 1.06 0.20 -0.33 0.00 0.00 177.00 178.16 3k8t s GLY 295 N -1.37 2.11 -0.09 0.52 0.00 0.91 -4.83 107.32 104.57 3k8t s GLY 295 Ca 0.01 0.39 -0.01 0.00 0.00 0.00 0.00 44.72 45.11 3k8t s GLY 295 CO 0.02 0.71 -0.02 0.00 0.00 0.00 0.00 173.10 173.81 3k8t s ALA 296 N -2.47 0.94 0.01 3.20 0.00 -1.26 -4.77 121.76 117.41 3k8t s ALA 296 Ca 0.64 -0.31 0.09 0.00 0.00 0.00 0.00 51.96 52.37 3k8t s ALA 296 Cb -0.16 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 3k8t s ALA 296 CO 0.38 -0.50 -0.26 -0.06 0.00 0.00 0.00 175.76 175.33 3k8t s PHE 297 N 1.87 2.30 -0.08 0.00 2.99 -1.26 -3.47 117.98 120.34 3k8t s PHE 297 Ca 0.05 -0.43 -0.14 0.00 0.00 0.00 0.00 56.93 56.41 3k8t s PHE 297 Cb -0.13 -1.44 -0.05 0.00 0.00 0.00 0.00 43.02 41.41 3k8t s PHE 297 CO -0.06 0.03 0.36 0.00 -0.00 0.00 0.00 175.22 175.55 3k8t s ALA 298 N -0.70 3.65 -0.14 5.36 0.00 -0.10 -1.33 121.76 128.50 3k8t s ALA 298 Ca 0.11 -0.33 -0.03 0.00 0.00 0.00 0.00 51.96 51.70 3k8t s ALA 298 Cb -0.10 -2.38 -0.03 0.00 0.00 0.00 0.00 23.12 20.61 3k8t s ALA 298 CO 0.00 0.31 -0.02 -0.51 0.00 0.00 0.00 175.76 175.54 3k8t s LEU 299 N -0.35 3.37 -0.08 0.00 1.43 0.84 0.16 118.68 124.05 3k8t s LEU 299 Ca 0.21 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 3k8t s LEU 299 Cb -0.15 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 3k8t s LEU 299 CO 0.09 0.22 -0.07 -0.31 0.23 0.00 0.00 176.35 176.51 3k8t s TYR 300 N 0.05 2.92 -0.18 0.29 1.51 0.31 0.17 117.35 122.41 3k8t s TYR 300 Ca 0.01 -0.09 -0.11 0.00 -1.01 0.00 0.00 57.07 55.87 3k8t s TYR 300 Cb -0.13 -1.75 0.06 0.00 -0.11 0.00 0.00 41.96 40.03 3k8t s TYR 300 CO 0.02 0.23 0.45 -1.17 -1.11 0.00 0.00 175.55 173.98 3k8t s LEU 301 N -0.55 -0.15 0.35 -1.29 0.20 -0.96 -1.57 118.68 114.70 3k8t s LEU 301 Ca 0.08 0.98 -0.27 0.00 0.69 0.00 0.00 54.13 55.61 3k8t s LEU 301 Cb -0.12 1.52 -0.09 0.00 -0.43 0.00 0.00 46.19 47.07 3k8t s LEU 301 CO 0.02 -0.19 1.19 -1.61 -0.29 0.00 0.00 176.35 175.47 3k8t s GLU 302 N 1.25 4.29 0.00 1.98 2.02 -1.26 -1.59 118.70 125.40 3k8t s GLU 302 Ca -0.08 1.94 0.10 0.00 0.02 0.00 0.00 54.97 56.95 3k8t s GLU 302 Cb -0.07 -2.92 0.56 0.00 0.10 0.00 0.00 34.13 31.80 3k8t s GLU 302 CO -0.12 -0.14 1.37 -0.35 0.02 0.00 0.00 175.26 176.04 3k8t n PRO 303 N 0.57 1.05 0.09 0.39 -0.04 -1.26 -1.96 135.00 133.84 3k8t n PRO 303 Ca 0.02 -0.07 0.12 0.00 -0.04 0.00 0.00 63.50 63.53 3k8t n PRO 303 Cb 0.45 -1.16 0.25 0.00 -0.04 0.00 0.00 33.50 33.00 3k8t n PRO 303 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 3k8t h TRP 304 N 0.13 0.00 -3.26 0.54 5.08 -1.93 -3.48 115.95 113.04 3k8t h TRP 304 Ca 0.00 0.00 -0.56 0.00 1.08 0.00 0.00 58.89 59.41 3k8t h TRP 304 Cb 0.03 0.00 0.10 0.00 -3.00 0.00 0.00 29.16 26.29 3k8t h TRP 304 CO 0.01 0.00 0.70 1.58 -1.28 0.00 0.00 178.44 179.45 3k8t n HIS 305 N -2.28 2.57 0.33 0.12 -0.00 -0.83 -0.93 115.22 114.20 3k8t n HIS 305 Ca 0.04 0.41 0.15 0.00 0.46 0.00 0.00 57.72 58.78 3k8t n HIS 305 Cb 0.45 -2.50 0.60 0.00 -0.12 0.00 0.00 29.99 28.41 3k8t n HIS 305 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3k8t h ALA 306 N 3.71 1.00 -0.48 1.57 0.00 -1.54 -1.99 119.26 121.55 3k8t h ALA 306 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3k8t h ALA 306 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3k8t h ALA 306 CO 0.71 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.71 3k8t n ASP 307 N -2.74 4.03 0.23 0.00 8.00 -1.26 -4.65 116.55 120.16 3k8t n ASP 307 Ca 0.01 -2.46 0.06 0.00 0.71 0.00 0.00 54.79 53.11 3k8t n ASP 307 Cb 0.28 -0.55 0.54 0.00 -0.02 0.00 0.00 41.12 41.38 3k8t n ASP 307 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 3k8t h ILE 308 N 3.09 1.08 -0.02 0.53 6.09 -1.72 -1.86 117.51 124.71 3k8t h ILE 308 Ca 0.00 -0.47 -0.11 0.00 -1.37 0.00 0.00 64.86 62.91 3k8t h ILE 308 Cb 1.32 1.25 -0.01 0.00 0.47 0.00 0.00 36.82 39.85 3k8t h ILE 308 CO 0.25 0.13 -0.50 -0.26 -3.07 0.00 0.00 178.15 174.69 3k8t h PHE 309 N 0.00 0.05 0.15 2.19 -1.00 -1.85 -2.25 116.94 114.24 3k8t h PHE 309 Ca -0.00 -0.02 -0.34 0.00 2.81 0.00 0.00 57.97 60.42 3k8t h PHE 309 Cb 0.24 -0.01 -0.00 0.00 3.61 0.00 0.00 35.95 39.79 3k8t h PHE 309 CO 0.00 0.54 -1.77 -0.44 -1.61 0.00 0.00 178.31 175.03 3k8t h ASP 310 N 0.03 0.51 -0.32 2.17 3.32 -1.86 -3.36 116.42 116.92 3k8t h ASP 310 Ca -0.00 -0.83 0.07 0.00 0.02 0.00 0.00 57.03 56.29 3k8t h ASP 310 Cb 0.91 -0.17 -0.08 0.00 0.22 0.00 0.00 39.33 40.21 3k8t h ASP 310 CO 0.07 1.71 -0.23 0.15 -1.72 0.00 0.00 179.24 179.22 3k8t h PHE 311 N 0.09 -0.59 0.00 4.55 3.57 -0.97 -1.48 116.94 122.11 3k8t h PHE 311 Ca -0.34 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.20 3k8t h PHE 311 Cb 2.07 0.31 0.00 0.00 2.79 0.00 0.00 35.95 41.12 3k8t h PHE 311 CO 0.09 -0.30 0.03 0.44 -2.23 0.00 0.00 178.31 176.33 3k8t n ILE 312 N -5.38 1.01 0.13 1.41 -5.35 -0.88 -2.98 119.36 107.32 3k8t n ILE 312 Ca 0.00 0.74 0.09 0.00 -0.27 0.00 0.00 62.75 63.31 3k8t n ILE 312 Cb 0.29 -1.74 0.18 0.00 -1.74 0.00 0.00 39.64 36.63 3k8t n ILE 312 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3k8t n ASP 313 N -2.23 3.11 0.22 7.28 9.92 -0.56 -4.37 116.55 129.91 3k8t n ASP 313 Ca -0.01 -1.90 0.07 0.00 -0.53 0.00 0.00 54.79 52.41 3k8t n ASP 313 Cb 0.06 -0.23 0.50 0.00 -0.64 0.00 0.00 41.12 40.81 3k8t n ASP 313 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 3k8t h ILE 314 N 3.39 0.98 -0.15 0.53 6.09 -1.54 -0.60 117.51 126.21 3k8t h ILE 314 Ca 0.00 -0.93 0.00 0.00 -1.37 0.00 0.00 64.86 62.56 3k8t h ILE 314 Cb 0.83 1.53 0.00 0.00 0.47 0.00 0.00 36.82 39.65 3k8t h ILE 314 CO 0.00 0.25 0.00 0.54 -3.07 0.00 0.00 178.15 175.87 3k8t n ARG 315 N -3.95 1.94 -1.86 2.19 1.74 -1.26 -1.99 116.66 113.47 3k8t n ARG 315 Ca -0.02 -1.39 -0.38 0.00 -0.77 0.00 0.00 57.85 55.29 3k8t n ARG 315 Cb 0.33 -1.45 0.03 0.00 -1.02 0.00 0.00 32.46 30.36 3k8t n ARG 315 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3k8t s LYS 316 N -1.82 3.25 0.00 5.56 1.02 -0.24 -4.91 119.74 122.61 3k8t s LYS 316 Ca 0.34 2.17 0.25 0.00 0.02 0.00 0.00 55.97 58.75 3k8t s LYS 316 Cb 0.20 -2.29 0.43 0.00 -0.52 0.00 0.00 37.83 35.64 3k8t s LYS 316 CO 0.30 -1.08 1.36 -1.71 -0.92 0.00 0.00 175.35 173.29 3k8t n ASN 317 N -0.92 0.75 -1.01 2.83 4.05 -1.26 -4.91 115.26 114.79 3k8t n ASN 317 Ca 0.10 -0.55 0.00 0.00 0.45 0.00 0.00 54.58 54.57 3k8t n ASN 317 Cb 0.45 0.35 0.00 0.00 1.23 0.00 0.00 39.78 41.81 3k8t n ASN 317 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3k8t n HIS 318 N -1.25 0.00 -1.99 1.20 1.44 -1.26 -5.05 115.22 108.30 3k8t n HIS 318 Ca 0.07 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.36 3k8t n HIS 318 Cb 0.34 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.43 3k8t n HIS 318 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 3k8t s GLY 319 N -0.54 1.55 0.00 -1.39 0.00 -1.26 -4.62 107.32 101.06 3k8t s GLY 319 Ca 0.00 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.70 3k8t s GLY 319 CO 0.00 3.01 0.00 1.17 0.00 0.00 0.00 173.10 177.28 3k8t n LYS 320 N 6.88 0.00 0.00 2.90 3.00 -1.26 -5.05 118.16 124.63 3k8t n LYS 320 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 3k8t n LYS 320 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.45 3k8t n LYS 320 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 3k8t n GLU 321 N 0.00 0.00 -0.02 1.64 0.00 -1.26 -4.47 120.64 116.53 3k8t n GLU 321 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.29 3k8t n GLU 321 Cb 0.00 0.00 0.62 0.00 0.00 0.00 0.00 31.44 32.06 3k8t n GLU 321 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3k8t n GLU 322 N 0.00 1.38 -0.06 5.31 0.28 -1.26 -3.24 120.64 123.06 3k8t n GLU 322 Ca 0.00 -0.56 0.07 0.00 -0.16 0.00 0.00 57.16 56.50 3k8t n GLU 322 Cb 0.00 -1.44 0.09 0.00 1.43 0.00 0.00 31.44 31.52 3k8t n GLU 322 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 3k8t n ILE 323 N -0.29 0.27 -4.35 3.84 -0.00 -1.26 -4.80 119.36 112.78 3k8t n ILE 323 Ca 0.19 -0.64 -0.30 0.00 -0.00 0.00 0.00 62.75 62.01 3k8t n ILE 323 Cb 0.23 1.06 -0.11 0.00 -0.00 0.00 0.00 39.64 40.83 3k8t n ILE 323 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 3k8t s ARG 324 N -1.08 1.92 -0.46 0.38 1.81 -1.20 -4.72 118.95 115.60 3k8t s ARG 324 Ca 0.19 -1.10 0.04 0.00 -1.72 0.00 0.00 55.73 53.13 3k8t s ARG 324 Cb 0.12 -2.18 0.16 0.00 -0.45 0.00 0.00 34.95 32.61 3k8t s ARG 324 CO 0.17 0.50 0.35 0.00 -0.68 0.00 0.00 175.30 175.64 3k8t s ALA 325 N -1.12 1.85 -2.00 2.13 0.00 -0.84 -4.90 121.76 116.88 3k8t s ALA 325 Ca 0.18 -2.66 0.23 0.00 0.00 0.00 0.00 51.96 49.71 3k8t s ALA 325 Cb -0.11 -1.72 1.35 0.00 0.00 0.00 0.00 23.12 22.64 3k8t s ALA 325 CO 0.10 -2.02 1.81 0.54 0.00 0.00 0.00 175.76 176.20 3k8t n ARG 326 N 2.86 0.91 -0.34 0.00 1.74 -1.24 -2.22 116.66 118.37 3k8t n ARG 326 Ca 0.25 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.41 3k8t n ARG 326 Cb 0.43 -1.39 0.25 0.00 -1.02 0.00 0.00 32.46 30.74 3k8t n ARG 326 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3k8t n ASP 327 N -0.89 3.66 -4.44 0.55 8.00 -1.26 -4.98 116.55 117.19 3k8t n ASP 327 Ca 0.17 -2.17 -0.23 0.00 0.71 0.00 0.00 54.79 53.27 3k8t n ASP 327 Cb 0.08 -0.40 -0.10 0.00 -0.02 0.00 0.00 41.12 40.68 3k8t n ASP 327 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3k8t s LEU 328 N -1.31 2.58 -0.24 0.64 1.43 -0.94 -4.32 118.68 116.52 3k8t s LEU 328 Ca 0.38 -1.02 -0.01 0.00 -1.03 0.00 0.00 54.13 52.44 3k8t s LEU 328 Cb 0.22 -1.02 0.03 0.00 0.03 0.00 0.00 46.19 45.45 3k8t s LEU 328 CO 0.22 0.00 -0.08 -0.36 0.23 0.00 0.00 176.35 176.37 3k8t s PHE 329 N -2.58 3.04 0.21 0.29 0.08 -0.44 -4.73 117.98 113.85 3k8t s PHE 329 Ca 0.28 -1.58 -0.30 0.00 0.12 0.00 0.00 56.93 55.45 3k8t s PHE 329 Cb -0.04 -2.04 -0.08 0.00 -0.57 0.00 0.00 43.02 40.29 3k8t s PHE 329 CO 0.13 -0.74 0.97 -1.25 -0.10 0.00 0.00 175.22 174.24 3k8t s PRO 330 N 1.32 4.79 -0.03 0.24 0.04 -1.26 -0.11 135.00 139.97 3k8t s PRO 330 Ca 0.00 1.53 0.03 0.00 0.04 0.00 0.00 61.00 62.61 3k8t s PRO 330 Cb -0.16 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.09 3k8t s PRO 330 CO -0.05 0.40 -0.13 0.00 0.04 0.00 0.00 177.00 177.26 3k8t s ALA 331 N -0.89 1.16 0.04 8.56 0.00 0.13 -2.15 121.76 128.61 3k8t s ALA 331 Ca 0.43 -0.49 -0.20 0.00 0.00 0.00 0.00 51.96 51.71 3k8t s ALA 331 Cb -0.26 -0.41 -0.06 0.00 0.00 0.00 0.00 23.12 22.39 3k8t s ALA 331 CO 0.33 0.20 0.58 -0.51 0.00 0.00 0.00 175.76 176.35 3k8t s LEU 332 N 0.15 4.48 -0.75 0.00 1.43 -0.09 -2.26 118.68 121.64 3k8t s LEU 332 Ca -0.04 1.22 -0.05 0.00 -1.03 0.00 0.00 54.13 54.23 3k8t s LEU 332 Cb -0.10 -2.90 0.19 0.00 0.03 0.00 0.00 46.19 43.41 3k8t s LEU 332 CO 0.01 0.20 0.62 0.86 0.23 0.00 0.00 176.35 178.27 3k8t s TRP 333 N -0.72 3.62 -0.29 0.29 -0.00 -0.62 -2.11 118.94 119.11 3k8t s TRP 333 Ca 0.30 -2.65 -0.17 0.00 -0.00 0.00 0.00 56.10 53.58 3k8t s TRP 333 Cb -0.19 -3.36 -0.02 0.00 -0.00 0.00 0.00 33.47 29.90 3k8t s TRP 333 CO 0.18 -0.85 0.47 0.42 -0.00 0.00 0.00 176.95 177.17 3k8t s ILE 334 N -0.39 5.09 0.48 5.86 1.01 -0.47 -4.06 121.20 128.73 3k8t s ILE 334 Ca 0.20 0.62 -0.22 0.00 0.00 0.00 0.00 60.65 61.25 3k8t s ILE 334 Cb -0.15 -3.83 -0.07 0.00 0.01 0.00 0.00 42.46 38.43 3k8t s ILE 334 CO -0.07 0.02 1.15 -2.16 0.00 0.00 0.00 174.94 173.88 3k8t s PRO 335 N 2.26 3.65 0.51 2.79 0.04 -1.26 -1.33 135.00 141.65 3k8t s PRO 335 Ca 0.18 1.72 0.28 0.00 0.04 0.00 0.00 61.00 63.22 3k8t s PRO 335 Cb -0.16 -2.29 1.39 0.00 0.04 0.00 0.00 34.50 33.48 3k8t s PRO 335 CO 0.11 -0.63 1.89 -0.44 0.04 0.00 0.00 177.00 177.96 3k8t h ASP 336 N 1.80 0.10 -0.87 6.66 3.32 -1.97 -1.82 116.42 123.63 3k8t h ASP 336 Ca -0.50 0.01 0.05 0.00 0.02 0.00 0.00 57.03 56.62 3k8t h ASP 336 Cb 1.25 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.74 3k8t h ASP 336 CO 0.59 0.03 0.57 0.25 -1.72 0.00 0.00 179.24 178.97 3k8t h LEU 337 N 0.09 0.89 -0.19 1.55 6.46 -1.95 -0.87 115.31 121.29 3k8t h LEU 337 Ca 0.43 -0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 58.18 3k8t h LEU 337 Cb 1.56 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 41.28 3k8t h LEU 337 CO -0.05 0.59 0.09 0.15 -0.62 0.00 0.00 178.44 178.60 3k8t h PHE 338 N 1.03 0.28 -0.68 1.25 3.57 -1.71 -0.08 116.94 120.60 3k8t h PHE 338 Ca 0.36 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.79 3k8t h PHE 338 Cb 0.12 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 3k8t h PHE 338 CO -0.00 0.30 0.22 0.52 -2.23 0.00 0.00 178.31 177.12 3k8t h MET 339 N 0.17 1.03 0.37 1.11 2.86 -1.44 -1.42 114.93 117.61 3k8t h MET 339 Ca 0.07 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 3k8t h MET 339 Cb 0.13 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.64 3k8t h MET 339 CO -0.01 0.88 -0.18 0.87 1.06 0.00 0.00 176.91 179.53 3k8t h LYS 340 N 0.99 -0.48 -0.79 1.72 1.57 -0.91 -0.72 116.57 117.95 3k8t h LYS 340 Ca 0.22 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 59.13 3k8t h LYS 340 Cb 0.27 0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.62 3k8t h LYS 340 CO -0.01 -0.24 0.43 0.00 -0.57 0.00 0.00 179.45 179.05 3k8t h ARG 341 N -0.64 0.69 -0.00 3.15 2.47 -0.81 0.16 114.38 119.39 3k8t h ARG 341 Ca -0.05 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.63 3k8t h ARG 341 Cb 0.46 -0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.63 3k8t h ARG 341 CO 0.08 0.45 0.00 0.28 0.56 0.00 0.00 179.97 181.35 3k8t h VAL 342 N 0.71 1.04 -0.10 2.04 2.07 -1.18 0.13 116.25 120.95 3k8t h VAL 342 Ca 0.39 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.72 3k8t h VAL 342 Cb 0.39 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 3k8t h VAL 342 CO -0.27 0.03 -0.26 1.05 0.02 0.00 0.00 177.57 178.14 3k8t h GLU 343 N -0.05 0.18 0.00 1.57 4.11 -0.64 -1.74 114.58 118.01 3k8t h GLU 343 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.37 3k8t h GLU 343 Cb 0.05 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3k8t h GLU 343 CO -0.00 0.44 0.00 0.39 0.07 0.00 0.00 179.01 179.91 3k8t n GLU 344 N -4.17 0.11 -4.00 1.06 1.02 0.52 -4.92 120.64 110.26 3k8t n GLU 344 Ca -0.01 0.15 -0.31 0.00 -0.02 0.00 0.00 57.16 56.96 3k8t n GLU 344 Cb 0.36 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.29 3k8t n GLU 344 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3k8t n ASN 345 N -1.42 -4.09 -0.49 1.62 5.15 -0.65 -4.99 115.26 110.39 3k8t n ASN 345 Ca 0.06 -0.85 0.00 0.00 -0.60 0.00 0.00 54.58 53.19 3k8t n ASN 345 Cb 0.20 -3.54 0.00 0.00 -0.53 0.00 0.00 39.78 35.90 3k8t n ASN 345 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k8t n GLY 346 N -1.62 1.72 3.86 8.20 0.00 0.39 -4.91 105.19 112.84 3k8t n GLY 346 Ca 0.03 -1.80 -0.21 0.00 0.00 0.00 0.00 46.02 44.03 3k8t n GLY 346 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k8t s THR 347 N 2.65 4.02 -0.04 2.61 -4.23 -1.26 -1.47 115.64 117.92 3k8t s THR 347 Ca 0.00 -1.33 -0.05 0.00 -1.18 0.00 0.00 61.69 59.13 3k8t s THR 347 Cb 0.00 -3.32 0.01 0.00 1.34 0.00 0.00 72.50 70.53 3k8t s THR 347 CO 0.00 -0.25 0.14 0.86 -0.54 0.00 0.00 174.62 174.83 3k8t s TRP 348 N -2.21 -0.11 -0.09 3.99 -0.11 -0.28 -4.53 118.94 115.59 3k8t s TRP 348 Ca 0.38 0.26 0.01 0.00 1.22 0.00 0.00 56.10 57.97 3k8t s TRP 348 Cb -0.07 0.03 -0.02 0.00 -1.50 0.00 0.00 33.47 31.91 3k8t s TRP 348 CO 0.26 -0.12 -0.12 0.99 -4.62 0.00 0.00 176.95 173.34 3k8t s THR 349 N -0.26 3.19 -0.19 5.86 2.01 -1.26 -0.08 115.64 124.90 3k8t s THR 349 Ca -0.03 -0.64 -0.10 0.00 0.31 0.00 0.00 61.69 61.22 3k8t s THR 349 Cb -0.03 -2.30 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 3k8t s THR 349 CO 0.00 0.56 0.13 -0.76 -0.69 0.00 0.00 174.62 173.86 3k8t s LEU 350 N -0.20 4.23 0.17 4.42 1.43 0.17 -4.64 118.68 124.26 3k8t s LEU 350 Ca 0.01 0.26 0.10 0.00 -1.03 0.00 0.00 54.13 53.47 3k8t s LEU 350 Cb -0.13 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 3k8t s LEU 350 CO 0.03 0.21 -0.21 -0.36 0.23 0.00 0.00 176.35 176.25 3k8t s PHE 351 N 0.20 2.02 0.10 0.29 0.40 -0.11 -0.57 117.98 120.31 3k8t s PHE 351 Ca 0.09 -0.42 -0.23 0.00 -0.60 0.00 0.00 56.93 55.77 3k8t s PHE 351 Cb -0.11 -1.01 -0.07 0.00 0.51 0.00 0.00 43.02 42.34 3k8t s PHE 351 CO -0.01 0.40 0.71 0.45 0.70 0.00 0.00 175.22 177.46 3k8t s SER 352 N -2.63 7.24 0.53 1.36 0.15 -1.26 -1.35 113.70 117.74 3k8t s SER 352 Ca 0.17 1.47 0.27 0.00 0.70 0.00 0.00 55.95 58.57 3k8t s SER 352 Cb -0.07 -2.45 1.41 0.00 -1.71 0.00 0.00 66.02 63.20 3k8t s SER 352 CO 0.08 0.17 1.95 1.55 1.20 0.00 0.00 173.24 178.19 3k8t h PRO 353 N 4.80 0.02 0.00 5.44 0.13 -1.82 -1.26 132.00 139.31 3k8t h PRO 353 Ca -0.47 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 3k8t h PRO 353 Cb 1.21 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3k8t h PRO 353 CO 0.67 0.01 -0.31 1.79 -0.23 0.00 0.00 178.00 179.93 3k8t h THR 354 N 0.02 0.85 0.00 1.56 1.35 -1.92 -2.26 112.91 112.52 3k8t h THR 354 Ca 0.32 -1.24 -0.18 0.00 -0.55 0.00 0.00 66.41 64.76 3k8t h THR 354 Cb 1.25 1.75 -0.03 0.00 -1.73 0.00 0.00 68.15 69.40 3k8t h THR 354 CO -0.01 0.30 -1.19 0.28 -0.25 0.00 0.00 175.52 174.66 3k8t h SER 355 N 0.00 0.00 -2.07 5.36 0.02 -1.59 -3.41 113.55 111.86 3k8t h SER 355 Ca -0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.37 3k8t h SER 355 Cb 0.73 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.87 3k8t h SER 355 CO 0.04 0.69 -0.93 0.00 -1.14 0.00 0.00 176.83 175.49 3k8t n ALA 356 N -2.37 3.00 -1.74 3.77 0.00 -0.81 -4.91 120.51 117.44 3k8t n ALA 356 Ca -0.07 -3.87 -0.42 0.00 0.00 0.00 0.00 53.44 49.08 3k8t n ALA 356 Cb 0.86 -0.84 -0.00 0.00 0.00 0.00 0.00 19.45 19.47 3k8t n ALA 356 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3k8t n PRO 357 N 1.21 2.44 -0.44 0.00 -0.02 -0.86 -4.01 135.00 133.32 3k8t n PRO 357 Ca 0.24 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.58 3k8t n PRO 357 Cb 0.49 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 3k8t n PRO 357 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k8t n GLY 358 N 0.71 0.75 0.35 -1.23 0.00 -1.26 -4.95 105.19 99.55 3k8t n GLY 358 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 3k8t n GLY 358 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k8t h LEU 359 N 0.00 1.04 -0.07 0.99 4.07 -1.93 -2.34 115.31 117.07 3k8t h LEU 359 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.94 3k8t h LEU 359 Cb 0.00 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.49 3k8t h LEU 359 CO 0.00 0.73 -0.17 -1.54 -1.08 0.00 0.00 178.44 176.39 3k8t n SER 360 N -4.46 0.28 -1.41 -0.43 3.41 -1.26 -3.00 113.62 106.74 3k8t n SER 360 Ca 0.11 -0.06 0.08 0.00 -0.26 0.00 0.00 58.87 58.74 3k8t n SER 360 Cb 0.05 -0.16 0.33 0.00 -0.26 0.00 0.00 64.21 64.17 3k8t n SER 360 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3k8t n ASP 361 N -1.32 4.80 -4.05 4.04 2.03 -0.89 -4.82 116.55 116.34 3k8t n ASP 361 Ca 0.09 -2.89 -0.11 0.00 0.52 0.00 0.00 54.79 52.41 3k8t n ASP 361 Cb 0.31 -0.60 -0.08 0.00 -0.72 0.00 0.00 41.12 40.03 3k8t n ASP 361 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3k8t s TYR 363 N -4.03 0.76 0.00 0.00 -0.85 -1.26 -4.73 117.35 107.23 3k8t s TYR 363 Ca 0.32 -1.05 0.00 0.00 -0.52 0.00 0.00 57.07 55.82 3k8t s TYR 363 Cb 0.03 -0.07 0.00 0.00 0.38 0.00 0.00 41.96 42.30 3k8t s TYR 363 CO 0.12 -0.95 0.00 0.41 -1.52 0.00 0.00 175.55 173.61 3k8t n GLY 364 N -0.41 3.31 0.21 5.49 0.00 -1.26 -2.44 105.19 110.10 3k8t n GLY 364 Ca 0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 3k8t n GLY 364 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3k8t h ASP 365 N 2.05 0.59 -0.72 1.61 3.45 -2.00 -0.67 116.42 120.74 3k8t h ASP 365 Ca 0.00 -0.30 -0.03 0.00 0.43 0.00 0.00 57.03 57.13 3k8t h ASP 365 Cb 0.00 -0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 38.57 3k8t h ASP 365 CO 0.00 1.00 0.32 -0.08 -1.57 0.00 0.00 179.24 178.91 3k8t h GLU 366 N 0.42 1.04 -0.03 3.56 4.81 -1.97 0.11 114.58 122.52 3k8t h GLU 366 Ca 0.02 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.09 3k8t h GLU 366 Cb 1.04 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 3k8t h GLU 366 CO 0.10 0.83 -0.01 0.35 -0.73 0.00 0.00 179.01 179.55 3k8t h PHE 367 N 1.01 -0.02 -0.83 0.92 3.04 -1.20 -1.71 116.94 118.15 3k8t h PHE 367 Ca 0.24 0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.22 3k8t h PHE 367 Cb 0.15 0.01 -0.05 0.00 2.56 0.00 0.00 35.95 38.63 3k8t h PHE 367 CO 0.01 -0.02 0.54 0.93 -2.02 0.00 0.00 178.31 177.76 3k8t h GLU 368 N -0.00 1.06 -0.25 1.11 5.08 -0.44 0.12 114.58 121.25 3k8t h GLU 368 Ca 0.02 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3k8t h GLU 368 Cb 0.03 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 3k8t h GLU 368 CO -0.04 0.70 0.11 0.00 -1.00 0.00 0.00 179.01 178.78 3k8t h ALA 369 N 1.32 0.33 -0.48 3.43 0.00 -0.75 -1.77 119.26 121.34 3k8t h ALA 369 Ca 0.32 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3k8t h ALA 369 Cb -0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3k8t h ALA 369 CO -0.09 -0.08 0.08 1.25 0.00 0.00 0.00 179.25 180.41 3k8t h LEU 370 N 0.26 0.76 -0.36 0.00 5.85 -0.89 -1.96 115.31 118.97 3k8t h LEU 370 Ca 0.09 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 3k8t h LEU 370 Cb 0.17 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 3k8t h LEU 370 CO -0.01 0.82 0.13 0.22 -0.34 0.00 0.00 178.44 179.26 3k8t h TYR 371 N 0.66 0.56 -0.56 1.25 3.20 -0.77 -1.84 116.97 119.48 3k8t h TYR 371 Ca 0.15 -0.05 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 3k8t h TYR 371 Cb 0.38 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 3k8t h TYR 371 CO 0.03 0.53 0.16 1.15 -1.64 0.00 0.00 178.16 178.38 3k8t h THR 372 N 0.43 1.24 0.12 1.81 2.02 -1.30 -0.77 112.91 116.47 3k8t h THR 372 Ca 0.12 -0.83 0.02 0.00 0.77 0.00 0.00 66.41 66.48 3k8t h THR 372 Cb 0.22 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 3k8t h THR 372 CO -0.01 0.31 -0.28 -0.09 0.37 0.00 0.00 175.52 175.82 3k8t h ARG 373 N 0.78 -0.48 -0.78 6.66 2.43 -1.24 -0.60 114.38 121.14 3k8t h ARG 373 Ca 0.18 0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.49 3k8t h ARG 373 Cb 0.31 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 3k8t h ARG 373 CO -0.00 -0.32 0.51 1.88 -1.51 0.00 0.00 179.97 180.53 3k8t h TYR 374 N -0.50 0.72 -0.00 2.20 0.99 -1.18 0.18 116.97 119.37 3k8t h TYR 374 Ca 0.03 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.78 3k8t h TYR 374 Cb 0.53 -0.23 -0.00 0.00 1.00 0.00 0.00 36.73 38.03 3k8t h TYR 374 CO -0.26 0.32 0.00 1.49 -0.00 0.00 0.00 178.16 179.72 3k8t h GLU 375 N 0.66 0.01 0.00 4.88 4.81 -0.72 -2.88 114.58 121.34 3k8t h GLU 375 Ca 0.37 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.54 3k8t h GLU 375 Cb 0.54 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3k8t h GLU 375 CO -0.14 0.03 -0.26 0.87 -0.73 0.00 0.00 179.01 178.78 3k8t h LYS 376 N -0.02 0.00 -0.03 1.92 1.57 0.07 -2.63 116.57 117.43 3k8t h LYS 376 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k8t h LYS 376 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3k8t h LYS 376 CO -0.00 0.26 0.00 0.39 -0.57 0.00 0.00 179.45 179.53 3k8t n GLU 377 N -4.01 1.15 -2.55 3.15 1.02 -0.06 -4.90 120.64 114.43 3k8t n GLU 377 Ca -0.02 -0.22 -0.15 0.00 -0.02 0.00 0.00 57.16 56.75 3k8t n GLU 377 Cb 0.33 -1.30 0.01 0.00 -0.02 0.00 0.00 31.44 30.46 3k8t n GLU 377 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k8t n GLY 378 N 0.85 -0.17 0.09 0.62 0.00 -0.99 -4.90 105.19 100.68 3k8t n GLY 378 Ca 0.14 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 46.07 3k8t n GLY 378 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k8t n ARG 379 N -2.71 0.41 0.00 1.61 1.74 -1.12 -4.97 116.66 111.61 3k8t n ARG 379 Ca -0.12 -0.19 0.00 0.00 -0.77 0.00 0.00 57.85 56.77 3k8t n ARG 379 Cb 0.60 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 3k8t n ARG 379 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k8t n GLY 380 N 1.39 5.01 3.15 -0.13 0.00 -1.26 -4.73 105.19 108.62 3k8t n GLY 380 Ca 0.10 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.47 3k8t n GLY 380 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k8t s LYS 381 N 1.15 2.97 0.04 1.61 2.20 0.26 -4.93 119.74 123.04 3k8t s LYS 381 Ca 0.00 -0.86 -0.18 0.00 -0.36 0.00 0.00 55.97 54.58 3k8t s LYS 381 Cb 0.00 -2.69 -0.06 0.00 -1.51 0.00 0.00 37.83 33.56 3k8t s LYS 381 CO 0.00 -0.25 0.51 0.99 -0.36 0.00 0.00 175.35 176.24 3k8t s THR 382 N 1.30 4.86 0.34 3.43 2.01 -1.26 -0.66 115.64 125.67 3k8t s THR 382 Ca 0.04 1.08 0.07 0.00 0.31 0.00 0.00 61.69 63.18 3k8t s THR 382 Cb -0.14 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 3k8t s THR 382 CO -0.10 0.55 0.26 2.30 -0.69 0.00 0.00 174.62 176.94 3k8t n ILE 383 N 1.88 0.00 -2.60 1.82 -5.35 0.88 -4.98 119.36 111.00 3k8t n ILE 383 Ca -0.11 -2.40 -0.42 0.00 -0.27 0.00 0.00 62.75 59.55 3k8t n ILE 383 Cb 0.51 1.15 -0.03 0.00 -1.74 0.00 0.00 39.64 39.54 3k8t n ILE 383 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 3k8t s LYS 384 N -3.36 4.38 0.24 6.28 1.02 -1.26 -1.13 119.74 125.90 3k8t s LYS 384 Ca 0.37 1.50 -0.06 0.00 0.02 0.00 0.00 55.97 57.80 3k8t s LYS 384 Cb 0.02 -3.57 0.43 0.00 -0.52 0.00 0.00 37.83 34.19 3k8t s LYS 384 CO 0.26 -0.41 1.69 0.00 -0.92 0.00 0.00 175.35 175.98 3k8t h ALA 385 N 7.30 0.91 0.00 5.17 0.00 -1.49 0.57 119.26 131.72 3k8t h ALA 385 Ca -0.31 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3k8t h ALA 385 Cb 1.14 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3k8t h ALA 385 CO 0.88 -0.32 0.00 1.96 0.00 0.00 0.00 179.25 181.77 3k8t h GLN 386 N 0.28 0.00 -0.28 0.00 4.20 -1.87 -1.31 115.11 116.13 3k8t h GLN 386 Ca 0.40 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 59.07 3k8t h GLN 386 Cb 0.66 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 3k8t h GLN 386 CO -0.48 0.00 0.03 -0.22 -0.67 0.00 0.00 178.83 177.48 3k8t h LYS 387 N 0.00 0.48 0.11 1.46 3.64 -1.26 -0.67 116.57 120.34 3k8t h LYS 387 Ca 0.00 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.23 3k8t h LYS 387 Cb 0.27 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3k8t h LYS 387 CO 0.00 0.61 -0.05 1.25 -2.27 0.00 0.00 179.45 178.99 3k8t h LEU 388 N 0.29 -0.13 -0.77 5.20 6.46 -1.27 -2.96 115.31 122.14 3k8t h LEU 388 Ca 0.08 -0.09 0.17 0.00 -0.12 0.00 0.00 57.88 57.92 3k8t h LEU 388 Cb 0.38 0.03 -0.11 0.00 -0.73 0.00 0.00 40.66 40.22 3k8t h LEU 388 CO 0.01 0.01 0.21 -0.25 -0.62 0.00 0.00 178.44 177.80 3k8t h TRP 389 N -0.26 0.34 -0.84 1.25 2.91 -1.26 -0.07 115.95 118.02 3k8t h TRP 389 Ca -0.02 0.04 -0.02 0.00 1.13 0.00 0.00 58.89 60.02 3k8t h TRP 389 Cb 0.21 -0.03 -0.04 0.00 -0.51 0.00 0.00 29.16 28.79 3k8t h TRP 389 CO -0.04 -0.08 0.43 -0.92 -1.03 0.00 0.00 178.44 176.80 3k8t h TYR 390 N 0.29 1.18 -0.26 2.65 3.20 -1.05 -1.91 116.97 121.07 3k8t h TYR 390 Ca 0.44 -0.04 -0.14 0.00 3.14 0.00 0.00 58.73 62.13 3k8t h TYR 390 Cb 0.78 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 3k8t h TYR 390 CO -0.25 0.84 -0.42 0.77 -1.64 0.00 0.00 178.16 177.46 3k8t h SER 391 N 1.18 0.68 0.08 -2.11 0.02 -0.91 -2.11 113.55 110.38 3k8t h SER 391 Ca 0.29 -0.31 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3k8t h SER 391 Cb 0.08 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 3k8t h SER 391 CO -0.04 1.01 -0.10 0.40 -1.14 0.00 0.00 176.83 176.96 3k8t h ILE 392 N 0.52 0.77 -0.43 3.27 1.08 -0.38 -1.83 117.51 120.51 3k8t h ILE 392 Ca 0.04 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.47 3k8t h ILE 392 Cb 0.94 0.77 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 3k8t h ILE 392 CO 0.08 0.00 0.08 -0.07 -0.69 0.00 0.00 178.15 177.56 3k8t h LEU 393 N -0.21 0.60 -0.71 1.44 3.38 -1.32 -1.32 115.31 117.16 3k8t h LEU 393 Ca 0.01 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 3k8t h LEU 393 Cb 0.21 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3k8t h LEU 393 CO -0.04 0.61 -0.11 -0.08 0.09 0.00 0.00 178.44 178.91 3k8t h GLU 394 N 0.62 0.88 -0.01 1.13 4.81 -1.24 -1.09 114.58 119.69 3k8t h GLU 394 Ca 0.14 -0.31 -0.15 0.00 -0.13 0.00 0.00 59.36 58.91 3k8t h GLU 394 Cb 0.27 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3k8t h GLU 394 CO 0.00 0.95 -0.70 0.00 -0.73 0.00 0.00 179.01 178.53 3k8t h ALA 395 N 1.08 0.82 -0.05 2.92 0.00 -0.64 -2.11 119.26 121.28 3k8t h ALA 395 Ca 0.13 -0.63 -0.21 0.00 0.00 0.00 0.00 54.91 54.20 3k8t h ALA 395 Cb 0.63 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3k8t h ALA 395 CO 0.04 0.85 -0.84 1.96 0.00 0.00 0.00 179.25 181.26 3k8t h GLN 396 N 0.03 0.49 -0.57 0.00 4.20 -0.66 -0.14 115.11 118.47 3k8t h GLN 396 Ca -0.01 -0.45 -0.08 0.00 0.06 0.00 0.00 58.65 58.16 3k8t h GLN 396 Cb 1.24 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 29.11 3k8t h GLN 396 CO 0.10 1.09 0.03 1.15 -0.67 0.00 0.00 178.83 180.53 3k8t h THR 397 N 0.31 1.26 0.19 -0.54 2.02 -1.10 -0.29 112.91 114.76 3k8t h THR 397 Ca -0.06 -1.06 -0.31 0.00 0.77 0.00 0.00 66.41 65.75 3k8t h THR 397 Cb 1.45 0.79 0.02 0.00 -1.74 0.00 0.00 68.15 68.67 3k8t h THR 397 CO 0.15 0.38 -1.48 -0.33 0.37 0.00 0.00 175.52 174.62 3k8t h GLU 398 N 0.89 0.40 0.00 6.66 5.08 -1.36 -3.42 114.58 122.83 3k8t h GLU 398 Ca 0.17 -0.69 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 3k8t h GLU 398 Cb 0.48 0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.99 3k8t h GLU 398 CO 0.02 1.33 -0.71 0.25 -1.00 0.00 0.00 179.01 178.90 3k8t n THR 399 N -3.77 0.00 -0.41 1.13 -2.24 -0.07 -5.00 114.28 103.93 3k8t n THR 399 Ca -0.21 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 3k8t n THR 399 Cb 1.02 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 3k8t n THR 399 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k8t n GLY 400 N 1.58 1.30 3.17 3.38 0.00 -0.12 -4.98 105.19 109.52 3k8t n GLY 400 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 3k8t n GLY 400 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k8t s THR 401 N -3.08 0.26 0.57 2.61 -4.23 -1.25 -2.15 115.64 108.38 3k8t s THR 401 Ca 0.00 -1.92 -0.18 0.00 -1.18 0.00 0.00 61.69 58.41 3k8t s THR 401 Cb 0.00 -2.01 -0.05 0.00 1.34 0.00 0.00 72.50 71.78 3k8t s THR 401 CO 0.00 -0.52 1.11 -2.16 -0.54 0.00 0.00 174.62 172.51 3k8t s PRO 402 N -4.00 3.26 0.91 3.99 0.04 -1.26 -2.04 135.00 135.89 3k8t s PRO 402 Ca 0.22 1.52 -0.10 0.00 0.04 0.00 0.00 61.00 62.68 3k8t s PRO 402 Cb 0.07 -2.00 0.14 0.00 0.04 0.00 0.00 34.50 32.75 3k8t s PRO 402 CO 0.01 -0.91 1.14 -0.06 0.04 0.00 0.00 177.00 177.23 3k8t s PHE 403 N -1.96 1.66 -0.18 0.56 2.99 -0.92 -4.81 117.98 115.32 3k8t s PHE 403 Ca 0.70 1.79 -0.00 0.00 0.00 0.00 0.00 56.93 59.42 3k8t s PHE 403 Cb -0.22 -3.33 0.04 0.00 0.00 0.00 0.00 43.02 39.51 3k8t s PHE 403 CO 0.30 -2.77 -0.06 0.08 -0.00 0.00 0.00 175.22 172.78 3k8t s VAL 404 N -2.66 1.22 -0.03 -0.44 1.01 0.11 -0.91 120.40 118.69 3k8t s VAL 404 Ca 0.66 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.95 3k8t s VAL 404 Cb -0.22 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 3k8t s VAL 404 CO 0.58 0.10 -0.18 -0.69 0.00 0.00 0.00 175.10 174.91 3k8t s VAL 405 N 1.58 1.49 -0.38 2.92 1.01 -0.90 -0.82 120.40 125.31 3k8t s VAL 405 Ca -0.00 -0.77 -0.18 0.00 0.00 0.00 0.00 61.98 61.02 3k8t s VAL 405 Cb -0.16 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 34.97 3k8t s VAL 405 CO -0.08 0.42 0.53 -0.31 0.00 0.00 0.00 175.10 175.67 3k8t s TYR 406 N -0.15 3.15 0.11 5.22 1.51 0.13 -1.36 117.35 125.97 3k8t s TYR 406 Ca 0.00 0.05 -0.21 0.00 -1.01 0.00 0.00 57.07 55.90 3k8t s TYR 406 Cb -0.10 -3.00 -0.09 0.00 -0.11 0.00 0.00 41.96 38.65 3k8t s TYR 406 CO 0.01 -0.63 1.75 -0.22 -1.11 0.00 0.00 175.55 175.35 3k8t h LYS 407 N 8.58 0.11 -0.30 -0.62 3.64 -1.49 -1.14 116.57 125.35 3k8t h LYS 407 Ca -0.27 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 58.93 3k8t h LYS 407 Cb 1.12 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.91 3k8t h LYS 407 CO 0.80 0.07 -0.51 -0.44 -2.27 0.00 0.00 179.45 177.11 3k8t h ASP 408 N 0.11 0.93 -0.64 4.20 3.32 -1.94 -1.66 116.42 120.75 3k8t h ASP 408 Ca 0.05 -0.48 0.07 0.00 0.02 0.00 0.00 57.03 56.69 3k8t h ASP 408 Cb 0.02 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.24 3k8t h ASP 408 CO -0.04 1.27 0.32 0.00 -1.72 0.00 0.00 179.24 179.07 3k8t h ALA 409 N 0.76 0.85 -0.41 3.45 0.00 -1.87 0.19 119.26 122.23 3k8t h ALA 409 Ca 0.03 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3k8t h ALA 409 Cb 1.10 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3k8t h ALA 409 CO 0.11 -0.04 -0.03 0.00 0.00 0.00 0.00 179.25 179.29 3k8t h ASN 411 N 0.57 0.90 0.28 0.00 2.35 -1.17 -3.17 115.58 115.32 3k8t h ASN 411 Ca 0.11 -0.78 -0.08 0.00 -0.55 0.00 0.00 56.30 55.01 3k8t h ASN 411 Cb 0.53 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3k8t h ASN 411 CO 0.03 1.58 -0.33 0.03 -1.65 0.00 0.00 177.43 177.08 3k8t h ARG 412 N 0.33 0.09 -0.75 0.81 3.08 -0.67 -3.25 114.38 114.02 3k8t h ARG 412 Ca -0.16 -0.03 -0.53 0.00 0.07 0.00 0.00 59.98 59.33 3k8t h ARG 412 Cb 1.82 -0.01 -0.35 0.00 0.08 0.00 0.00 29.97 31.52 3k8t h ARG 412 CO 0.22 0.41 -0.30 1.63 -1.07 0.00 0.00 179.97 180.87 3k8t n LYS 413 N -4.12 3.13 -4.67 0.04 5.02 -0.94 -5.00 118.16 111.61 3k8t n LYS 413 Ca -0.02 -3.82 -0.33 0.00 -2.02 0.00 0.00 58.31 52.12 3k8t n LYS 413 Cb 0.39 -2.21 -0.13 0.00 -0.02 0.00 0.00 35.03 33.06 3k8t n LYS 413 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k8t s SER 414 N -3.02 4.37 0.29 4.39 0.15 -1.20 -4.92 113.70 113.76 3k8t s SER 414 Ca 0.54 -0.17 0.25 0.00 0.70 0.00 0.00 55.95 57.26 3k8t s SER 414 Cb 0.43 -1.37 1.03 0.00 -1.71 0.00 0.00 66.02 64.41 3k8t s SER 414 CO 0.02 0.26 1.74 -1.13 1.20 0.00 0.00 173.24 175.33 3k8t h ASN 415 N 6.00 0.00 -0.20 5.45 -1.24 -1.85 -2.61 115.58 121.12 3k8t h ASN 415 Ca -0.38 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.63 3k8t h ASN 415 Cb 1.18 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.23 3k8t h ASN 415 CO 0.55 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.69 3k8t n GLN 416 N -2.32 1.59 0.33 6.67 6.02 -1.26 -4.36 117.38 124.04 3k8t n GLN 416 Ca 0.02 -0.90 0.22 0.00 -0.01 0.00 0.00 57.00 56.32 3k8t n GLN 416 Cb 0.23 -1.28 1.12 0.00 1.02 0.00 0.00 30.24 31.32 3k8t n GLN 416 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 3k8t h LYS 417 N 1.62 0.00 0.00 -1.09 2.10 -1.72 0.11 116.57 117.59 3k8t h LYS 417 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3k8t h LYS 417 Cb 0.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 3k8t h LYS 417 CO 0.00 0.00 0.00 0.27 -2.00 0.00 0.00 179.45 177.72 3k8t n ASN 418 N -3.12 0.06 0.06 7.07 6.94 -1.26 -3.26 115.26 121.75 3k8t n ASN 418 Ca -0.02 0.51 -0.11 0.00 -0.02 0.00 0.00 54.58 54.94 3k8t n ASN 418 Cb 0.11 -0.53 -0.13 0.00 -2.36 0.00 0.00 39.78 36.87 3k8t n ASN 418 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 3k8t h LEU 419 N 0.00 0.18 0.00 -4.53 3.38 -1.11 -3.51 115.31 109.73 3k8t h LEU 419 Ca 0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3k8t h LEU 419 Cb 0.33 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3k8t h LEU 419 CO 0.00 1.18 0.00 0.61 0.09 0.00 0.00 178.44 180.32 3k8t n GLY 420 N 1.48 0.52 3.69 0.83 0.00 -1.20 -5.08 105.19 105.43 3k8t n GLY 420 Ca -0.07 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 3k8t n GLY 420 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k8t s VAL 421 N -2.46 4.83 0.04 1.61 1.01 -1.26 -4.61 120.40 119.56 3k8t s VAL 421 Ca 0.00 1.92 -0.30 0.00 0.00 0.00 0.00 61.98 63.60 3k8t s VAL 421 Cb 0.00 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 3k8t s VAL 421 CO 0.00 0.04 1.05 -0.63 0.00 0.00 0.00 175.10 175.56 3k8t s ILE 422 N 1.89 4.51 -0.24 2.22 1.01 -1.26 -4.74 121.20 124.58 3k8t s ILE 422 Ca 0.46 1.85 0.02 0.00 0.00 0.00 0.00 60.65 62.98 3k8t s ILE 422 Cb -0.18 -4.19 0.00 0.00 0.01 0.00 0.00 42.46 38.11 3k8t s ILE 422 CO 0.17 0.17 0.40 0.29 0.00 0.00 0.00 174.94 175.98 3k8t n LYS 423 N 3.67 1.94 -3.78 2.79 5.02 -1.26 -4.89 118.16 121.65 3k8t n LYS 423 Ca 0.06 -0.41 -0.09 0.00 -2.02 0.00 0.00 58.31 55.85 3k8t n LYS 423 Cb 0.49 -0.88 -0.04 0.00 -0.02 0.00 0.00 35.03 34.58 3k8t n LYS 423 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3k8t s SER 424 N -0.59 -0.25 0.00 4.39 1.04 -1.26 -4.82 113.70 112.21 3k8t s SER 424 Ca 0.02 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.91 3k8t s SER 424 Cb 0.02 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.74 3k8t s SER 424 CO 0.06 -1.11 0.00 -0.24 0.98 0.00 0.00 173.24 172.93 3k8t n SER 425 N -0.37 0.00 -2.20 7.02 2.88 -1.26 -4.31 113.62 115.38 3k8t n SER 425 Ca -0.08 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.37 3k8t n SER 425 Cb 0.62 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.05 3k8t n SER 425 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3k8t n ASN 426 N 0.00 0.60 -0.32 -3.46 6.94 -1.25 -4.60 115.26 113.18 3k8t n ASN 426 Ca 0.00 -1.83 0.07 0.00 -0.02 0.00 0.00 54.58 52.80 3k8t n ASN 426 Cb 0.00 0.47 0.27 0.00 -2.36 0.00 0.00 39.78 38.17 3k8t n ASN 426 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3k8t h LEU 427 N 0.00 0.86 -2.88 -4.53 5.85 -1.88 -2.89 115.31 109.83 3k8t h LEU 427 Ca -0.11 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.64 3k8t h LEU 427 Cb 0.46 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.34 3k8t h LEU 427 CO 0.17 0.49 0.00 0.00 -0.34 0.00 0.00 178.44 178.76 3k8t n GLU 430 N -2.79 3.01 -2.97 0.00 0.00 -1.26 -3.99 120.64 112.64 3k8t n GLU 430 Ca -0.10 -0.00 -0.40 0.00 0.00 0.00 0.00 57.16 56.66 3k8t n GLU 430 Cb 0.59 -1.03 -0.04 0.00 0.00 0.00 0.00 31.44 30.96 3k8t n GLU 430 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 3k8t s ILE 431 N -2.04 5.00 -0.30 3.84 -1.09 -1.26 -0.29 121.20 125.06 3k8t s ILE 431 Ca -0.01 1.56 0.00 0.00 -2.23 0.00 0.00 60.65 59.98 3k8t s ILE 431 Cb 0.00 -4.10 0.09 0.00 -1.58 0.00 0.00 42.46 36.88 3k8t s ILE 431 CO 0.05 0.21 0.07 0.68 -1.23 0.00 0.00 174.94 174.71 3k8t s VAL 432 N 1.03 1.17 0.02 2.92 -7.23 -1.26 -3.79 120.40 113.26 3k8t s VAL 432 Ca 0.40 -1.49 -0.00 0.00 -1.81 0.00 0.00 61.98 59.07 3k8t s VAL 432 Cb -0.18 -1.82 -0.02 0.00 0.56 0.00 0.00 36.38 34.92 3k8t s VAL 432 CO 0.19 -0.57 -0.03 -1.61 -0.31 0.00 0.00 175.10 172.77 3k8t s GLU 433 N 1.48 0.29 0.25 4.82 2.02 -1.26 -4.85 118.70 121.45 3k8t s GLU 433 Ca 0.08 -0.57 -0.30 0.00 0.02 0.00 0.00 54.97 54.20 3k8t s GLU 433 Cb -0.18 0.10 -0.09 0.00 0.10 0.00 0.00 34.13 34.06 3k8t s GLU 433 CO -0.19 -0.05 1.09 -0.47 0.02 0.00 0.00 175.26 175.67 3k8t s TYR 434 N -1.35 3.61 0.05 1.61 5.04 -1.26 -4.70 117.35 120.34 3k8t s TYR 434 Ca -0.15 1.69 -0.00 0.00 -2.44 0.00 0.00 57.07 56.17 3k8t s TYR 434 Cb -0.09 -3.27 -0.03 0.00 0.35 0.00 0.00 41.96 38.92 3k8t s TYR 434 CO -0.01 -0.51 -0.04 -1.54 -1.34 0.00 0.00 175.55 172.11 3k8t s SER 435 N -0.72 0.55 0.28 4.32 1.04 -1.26 -4.24 113.70 113.66 3k8t s SER 435 Ca 0.45 -0.84 -0.20 0.00 0.48 0.00 0.00 55.95 55.85 3k8t s SER 435 Cb -0.31 0.15 0.02 0.00 0.10 0.00 0.00 66.02 65.97 3k8t s SER 435 CO 0.39 -0.47 0.69 0.00 0.98 0.00 0.00 173.24 174.82 3k8t s ALA 436 N -3.06 -1.05 0.49 5.32 0.00 0.63 -4.83 121.76 119.26 3k8t s ALA 436 Ca 0.01 -0.41 0.26 0.00 0.00 0.00 0.00 51.96 51.82 3k8t s ALA 436 Cb 0.02 0.88 1.34 0.00 0.00 0.00 0.00 23.12 25.35 3k8t s ALA 436 CO -0.06 -1.01 1.88 -1.35 0.00 0.00 0.00 175.76 175.22 3k8t h PRO 437 N 2.04 0.14 -0.02 0.00 0.11 -1.88 -0.13 132.00 132.26 3k8t h PRO 437 Ca -0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3k8t h PRO 437 Cb 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3k8t h PRO 437 CO 0.25 0.09 0.00 -0.40 -0.21 0.00 0.00 178.00 177.74 3k8t n ASP 438 N -4.37 2.59 -3.76 -2.05 3.85 -1.26 -4.87 116.55 106.68 3k8t n ASP 438 Ca 0.18 -1.79 -0.28 0.00 -0.71 0.00 0.00 54.79 52.19 3k8t n ASP 438 Cb 0.85 -0.00 -0.16 0.00 -1.35 0.00 0.00 41.12 40.46 3k8t n ASP 438 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 3k8t s GLU 439 N -1.59 0.77 -0.33 0.11 2.02 -0.06 -4.52 118.70 115.10 3k8t s GLU 439 Ca 0.22 -0.48 -0.12 0.00 0.02 0.00 0.00 54.97 54.62 3k8t s GLU 439 Cb 0.16 -2.15 -0.02 0.00 0.10 0.00 0.00 34.13 32.23 3k8t s GLU 439 CO 0.24 -0.63 0.21 0.99 0.02 0.00 0.00 175.26 176.09 3k8t s THR 440 N 1.81 5.04 0.25 3.63 2.01 -0.98 -0.27 115.64 127.13 3k8t s THR 440 Ca -0.01 -0.27 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 3k8t s THR 440 Cb -0.17 -3.57 -0.09 0.00 0.01 0.00 0.00 72.50 68.67 3k8t s THR 440 CO -0.08 0.03 1.26 0.00 -0.69 0.00 0.00 174.62 175.14 3k8t s ALA 441 N 1.69 3.49 0.13 7.40 0.00 -0.47 -4.02 121.76 129.97 3k8t s ALA 441 Ca 0.06 1.10 0.10 0.00 0.00 0.00 0.00 51.96 53.21 3k8t s ALA 441 Cb -0.17 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 3k8t s ALA 441 CO 0.09 -0.48 -0.25 0.08 0.00 0.00 0.00 175.76 175.20 3k8t s VAL 442 N -0.46 2.08 0.02 0.00 1.01 -1.26 -0.25 120.40 121.54 3k8t s VAL 442 Ca 0.52 -1.71 -0.01 0.00 0.00 0.00 0.00 61.98 60.78 3k8t s VAL 442 Cb -0.36 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 3k8t s VAL 442 CO 0.42 0.02 -0.01 0.00 0.00 0.00 0.00 175.10 175.54 3k8t s ASN 444 N -1.36 4.53 0.09 0.00 0.01 -1.26 -1.42 114.94 115.53 3k8t s ASN 444 Ca -0.15 -0.17 0.07 0.00 -0.71 0.00 0.00 52.86 51.91 3k8t s ASN 444 Cb -0.09 -1.60 -0.03 0.00 0.41 0.00 0.00 41.25 39.93 3k8t s ASN 444 CO -0.01 0.21 -0.19 -0.76 -1.51 0.00 0.00 177.10 174.84 3k8t s LEU 445 N 0.12 2.28 0.03 0.60 1.43 -1.26 -1.79 118.68 120.10 3k8t s LEU 445 Ca -0.03 -0.66 -0.24 0.00 -1.03 0.00 0.00 54.13 52.17 3k8t s LEU 445 Cb -0.14 -0.81 0.06 0.00 0.03 0.00 0.00 46.19 45.32 3k8t s LEU 445 CO 0.03 0.04 0.56 0.00 0.23 0.00 0.00 176.35 177.22 3k8t s ALA 446 N -1.15 -1.46 -0.05 4.21 0.00 -1.05 -1.58 121.76 120.67 3k8t s ALA 446 Ca 0.05 0.77 0.04 0.00 0.00 0.00 0.00 51.96 52.81 3k8t s ALA 446 Cb -0.10 0.33 -0.00 0.00 0.00 0.00 0.00 23.12 23.35 3k8t s ALA 446 CO 0.04 -0.49 -0.17 -1.54 0.00 0.00 0.00 175.76 173.59 3k8t s SER 447 N -1.83 2.23 0.07 0.00 1.04 -0.27 -0.82 113.70 114.12 3k8t s SER 447 Ca -0.06 -0.37 -0.30 0.00 0.48 0.00 0.00 55.95 55.69 3k8t s SER 447 Cb -0.01 -0.74 -0.05 0.00 0.10 0.00 0.00 66.02 65.32 3k8t s SER 447 CO 0.00 0.14 1.08 -0.69 0.98 0.00 0.00 173.24 174.75 3k8t s VAL 448 N 0.17 4.30 -0.80 5.02 1.01 -0.47 -0.92 120.40 128.72 3k8t s VAL 448 Ca -0.07 1.75 -0.24 0.00 0.00 0.00 0.00 61.98 63.41 3k8t s VAL 448 Cb -0.13 -4.12 0.05 0.00 0.00 0.00 0.00 36.38 32.19 3k8t s VAL 448 CO 0.03 0.19 1.23 0.00 0.00 0.00 0.00 175.10 176.55 3k8t s ALA 449 N 0.63 2.88 0.39 5.51 0.00 0.22 -1.14 121.76 130.25 3k8t s ALA 449 Ca 0.53 -1.79 0.08 0.00 0.00 0.00 0.00 51.96 50.79 3k8t s ALA 449 Cb -0.26 -4.20 0.81 0.00 0.00 0.00 0.00 23.12 19.46 3k8t s ALA 449 CO 0.30 -3.21 1.97 -0.07 0.00 0.00 0.00 175.76 174.74 3k8t h LEU 450 N 12.36 0.33 -2.51 0.00 3.38 -1.38 -1.66 115.31 125.84 3k8t h LEU 450 Ca -0.14 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 3k8t h LEU 450 Cb 1.04 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 3k8t h LEU 450 CO 1.27 0.38 -0.01 -0.65 0.09 0.00 0.00 178.44 179.52 3k8t h PRO 451 N 0.36 0.00 0.00 1.13 0.11 -1.79 -3.13 132.00 128.67 3k8t h PRO 451 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3k8t h PRO 451 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 3k8t h PRO 451 CO 0.00 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 177.80 3k8t h ALA 452 N 1.99 1.00 -0.36 -0.75 0.00 -1.60 -2.42 119.26 117.13 3k8t h ALA 452 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k8t h ALA 452 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3k8t h ALA 452 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 3k8t n PHE 453 N -2.39 0.46 -2.38 0.00 3.01 -1.18 -4.91 117.46 110.07 3k8t n PHE 453 Ca -0.01 -0.24 -0.41 0.00 1.01 0.00 0.00 57.45 57.80 3k8t n PHE 453 Cb 0.08 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.52 3k8t n PHE 453 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3k8t s ILE 454 N -1.49 3.65 -0.26 4.37 1.01 -0.91 0.15 121.20 127.70 3k8t s ILE 454 Ca 0.37 1.35 -0.01 0.00 0.00 0.00 0.00 60.65 62.35 3k8t s ILE 454 Cb 0.22 -3.86 0.08 0.00 0.01 0.00 0.00 42.46 38.91 3k8t s ILE 454 CO 0.31 0.20 0.06 -1.61 0.00 0.00 0.00 174.94 173.90 3k8t s GLU 455 N -0.01 0.75 0.00 2.79 2.02 0.80 -4.92 118.70 120.13 3k8t s GLU 455 Ca 0.54 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.71 3k8t s GLU 455 Cb -0.32 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 31.86 3k8t s GLU 455 CO 0.35 -0.84 0.00 0.36 0.02 0.00 0.00 175.26 175.15 3k8t n LYS 461 N 4.92 0.00 -3.98 1.61 2.85 -1.26 -1.24 118.16 121.06 3k8t n LYS 461 Ca -0.05 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.89 3k8t n LYS 461 Cb 0.44 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.77 3k8t n LYS 461 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 3k8t s THR 462 N 0.00 5.06 -0.00 0.58 -1.32 -1.26 -5.11 115.64 113.59 3k8t s THR 462 Ca 0.00 -0.44 0.00 0.00 -1.21 0.00 0.00 61.69 60.05 3k8t s THR 462 Cb 0.00 -3.41 -0.04 0.00 -1.51 0.00 0.00 72.50 67.55 3k8t s THR 462 CO 0.00 0.22 0.05 -0.44 -2.21 0.00 0.00 174.62 172.24 3k8t s SER 463 N -2.20 5.45 0.26 8.08 0.01 -1.26 -5.12 113.70 118.92 3k8t s SER 463 Ca 0.29 0.08 0.02 0.00 1.31 0.00 0.00 55.95 57.66 3k8t s SER 463 Cb -0.13 -1.51 -0.05 0.00 0.21 0.00 0.00 66.02 64.54 3k8t s SER 463 CO 0.22 0.27 0.06 0.42 0.41 0.00 0.00 173.24 174.62 3k8t s THR 464 N -1.15 0.83 -0.21 1.44 -4.23 -0.37 -4.98 115.64 106.96 3k8t s THR 464 Ca 0.22 -2.01 -0.03 0.00 -1.18 0.00 0.00 61.69 58.69 3k8t s THR 464 Cb -0.12 -2.58 -0.01 0.00 1.34 0.00 0.00 72.50 71.13 3k8t s THR 464 CO 0.12 -0.10 -0.05 -0.47 -0.54 0.00 0.00 174.62 173.58 3k8t s TYR 465 N -3.56 2.94 -1.14 3.99 5.04 -1.26 -0.14 117.35 123.22 3k8t s TYR 465 Ca 0.35 -0.95 -0.18 0.00 -2.44 0.00 0.00 57.07 53.84 3k8t s TYR 465 Cb 0.07 -2.08 0.10 0.00 0.35 0.00 0.00 41.96 40.40 3k8t s TYR 465 CO 0.12 -0.54 1.48 1.21 -1.34 0.00 0.00 175.55 176.49 3k8t s ASN 466 N 1.40 6.77 0.39 4.32 3.84 0.12 -4.83 114.94 126.96 3k8t s ASN 466 Ca 0.05 -2.26 0.06 0.00 0.21 0.00 0.00 52.86 50.92 3k8t s ASN 466 Cb -0.14 -2.50 0.79 0.00 -0.55 0.00 0.00 41.25 38.85 3k8t s ASN 466 CO -0.03 -1.13 2.02 -0.26 -2.79 0.00 0.00 177.10 174.90 3k8t h PHE 467 N 8.25 0.54 -0.49 0.43 -1.00 -1.97 -2.24 116.94 120.46 3k8t h PHE 467 Ca 0.30 -0.00 -0.04 0.00 2.81 0.00 0.00 57.97 61.04 3k8t h PHE 467 Cb 0.93 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 40.29 3k8t h PHE 467 CO 1.27 0.38 0.14 0.87 -1.61 0.00 0.00 178.31 179.36 3k8t h LYS 468 N 0.57 0.72 -0.19 1.51 6.56 -1.99 0.73 116.57 124.47 3k8t h LYS 468 Ca 0.15 -0.13 -0.18 0.00 -1.06 0.00 0.00 60.65 59.43 3k8t h LYS 468 Cb 0.01 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 31.55 3k8t h LYS 468 CO -0.03 0.64 -0.62 0.87 -2.06 0.00 0.00 179.45 178.25 3k8t h LYS 469 N 0.71 0.66 0.09 3.15 1.79 -1.87 -2.26 116.57 118.84 3k8t h LYS 469 Ca 0.16 -0.46 -0.00 0.00 -2.18 0.00 0.00 60.65 58.17 3k8t h LYS 469 Cb 0.23 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 3k8t h LYS 469 CO -0.01 1.08 -0.04 1.25 -1.08 0.00 0.00 179.45 180.65 3k8t h LEU 470 N 0.49 -0.10 -0.33 2.94 5.85 -0.99 0.00 115.31 123.17 3k8t h LEU 470 Ca -0.01 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.71 3k8t h LEU 470 Cb 1.20 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.20 3k8t h LEU 470 CO 0.12 -0.01 -0.03 -0.74 -0.34 0.00 0.00 178.44 177.44 3k8t h HIS 471 N -0.19 -0.08 -0.35 1.25 2.76 -0.88 0.67 115.15 118.33 3k8t h HIS 471 Ca -0.01 0.03 0.05 0.00 -2.20 0.00 0.00 60.37 58.23 3k8t h HIS 471 Cb 0.15 0.09 -0.04 0.00 1.55 0.00 0.00 27.41 29.16 3k8t h HIS 471 CO -0.05 -0.09 0.10 1.49 -1.30 0.00 0.00 177.93 178.08 3k8t h GLU 472 N 0.05 0.23 -0.34 5.26 4.81 -1.29 -2.06 114.58 121.25 3k8t h GLU 472 Ca 0.16 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 3k8t h GLU 472 Cb 0.23 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3k8t h GLU 472 CO -0.30 0.15 -0.00 0.82 -0.73 0.00 0.00 179.01 178.95 3k8t h ILE 473 N 0.24 1.26 -0.95 2.32 5.03 -0.64 -2.56 117.51 122.21 3k8t h ILE 473 Ca 0.16 -0.97 0.15 0.00 -0.12 0.00 0.00 64.86 64.08 3k8t h ILE 473 Cb 0.16 1.22 -0.08 0.00 -3.03 0.00 0.00 36.82 35.09 3k8t h ILE 473 CO -0.19 0.32 0.60 0.00 -0.68 0.00 0.00 178.15 178.20 3k8t h ALA 474 N 0.85 1.74 -0.44 1.87 0.00 -0.60 -0.41 119.26 122.27 3k8t h ALA 474 Ca 0.10 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 3k8t h ALA 474 Cb 0.46 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3k8t h ALA 474 CO 0.02 -0.02 -0.28 0.87 0.00 0.00 0.00 179.25 179.84 3k8t h LYS 475 N 0.77 0.95 0.03 0.00 1.57 -1.20 -1.09 116.57 117.60 3k8t h LYS 475 Ca 0.49 -0.44 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 3k8t h LYS 475 Cb 0.73 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.98 3k8t h LYS 475 CO -0.26 1.10 -0.23 0.28 -0.57 0.00 0.00 179.45 179.77 3k8t h VAL 476 N 0.81 0.46 -0.92 0.50 2.07 -0.83 -1.51 116.25 116.84 3k8t h VAL 476 Ca 0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 3k8t h VAL 476 Cb 0.86 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 3k8t h VAL 476 CO 0.08 0.00 0.57 0.58 0.02 0.00 0.00 177.57 178.82 3k8t h VAL 477 N -0.38 1.25 -0.26 2.57 2.07 -1.06 -1.94 116.25 118.50 3k8t h VAL 477 Ca 0.05 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 67.09 3k8t h VAL 477 Cb 0.45 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.11 3k8t h VAL 477 CO -0.19 0.26 0.02 0.74 0.02 0.00 0.00 177.57 178.41 3k8t h THR 478 N 1.27 0.84 -0.62 2.57 2.02 -0.93 -1.30 112.91 116.75 3k8t h THR 478 Ca 0.33 -0.04 -0.07 0.00 0.77 0.00 0.00 66.41 67.41 3k8t h THR 478 Cb -0.08 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 3k8t h THR 478 CO -0.07 0.02 0.13 0.03 0.37 0.00 0.00 175.52 176.00 3k8t h ARG 479 N 0.11 0.99 -0.34 6.66 3.08 -0.84 -2.29 114.38 121.75 3k8t h ARG 479 Ca 0.12 -0.23 0.06 0.00 0.07 0.00 0.00 59.98 60.00 3k8t h ARG 479 Cb 0.15 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.01 3k8t h ARG 479 CO -0.19 0.90 -0.00 -0.91 -1.07 0.00 0.00 179.97 178.69 3k8t h ASN 480 N 0.94 -0.14 0.38 7.04 4.21 -1.17 -2.23 115.58 124.60 3k8t h ASN 480 Ca 0.20 0.08 -0.10 0.00 1.21 0.00 0.00 56.30 57.69 3k8t h ASN 480 Cb 0.37 0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.69 3k8t h ASN 480 CO 0.00 -0.04 -0.44 -0.07 -1.29 0.00 0.00 177.43 175.60 3k8t h LEU 481 N 0.09 0.08 -0.75 1.61 3.38 -0.81 -0.83 115.31 118.08 3k8t h LEU 481 Ca 0.16 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 3k8t h LEU 481 Cb 0.22 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3k8t h LEU 481 CO -0.28 0.51 0.04 0.78 0.09 0.00 0.00 178.44 179.58 3k8t h ASN 482 N 0.06 0.96 -0.57 -0.43 2.35 -1.30 -2.68 115.58 113.98 3k8t h ASN 482 Ca 0.00 -0.24 -0.11 0.00 -0.55 0.00 0.00 56.30 55.40 3k8t h ASN 482 Cb 0.80 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 3k8t h ASN 482 CO 0.06 0.99 -0.07 0.03 -1.65 0.00 0.00 177.43 176.79 3k8t h ARG 483 N 0.93 1.05 -0.96 0.81 3.08 -0.94 -2.77 114.38 115.57 3k8t h ARG 483 Ca 0.18 -0.37 0.13 0.00 0.07 0.00 0.00 59.98 59.98 3k8t h ARG 483 Cb 0.48 -0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.38 3k8t h ARG 483 CO 0.02 1.07 0.61 0.28 -1.07 0.00 0.00 179.97 180.88 3k8t h VAL 484 N 0.93 0.90 -0.73 2.04 2.07 -0.93 -1.92 116.25 118.62 3k8t h VAL 484 Ca 0.15 -0.31 0.11 0.00 0.82 0.00 0.00 66.70 67.47 3k8t h VAL 484 Cb 0.64 -0.08 -0.08 0.00 -1.52 0.00 0.00 31.29 30.26 3k8t h VAL 484 CO 0.04 0.16 0.34 0.40 0.02 0.00 0.00 177.57 178.54 3k8t h ILE 485 N 0.90 0.79 0.00 4.57 2.04 -1.18 -0.94 117.51 123.69 3k8t h ILE 485 Ca 0.48 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 66.07 3k8t h ILE 485 Cb 0.55 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3k8t h ILE 485 CO -0.24 0.10 -0.51 0.44 0.00 0.00 0.00 178.15 177.94 3k8t h ASP 486 N 0.56 0.00 -0.00 1.72 3.45 -1.40 -3.27 116.42 117.47 3k8t h ASP 486 Ca 0.37 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.83 3k8t h ASP 486 Cb 0.46 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 3k8t h ASP 486 CO -0.31 0.33 -0.16 0.54 -1.57 0.00 0.00 179.24 178.07 3k8t n ARG 487 N -3.11 1.80 -2.33 3.56 1.74 -0.87 -4.98 116.66 112.48 3k8t n ARG 487 Ca 0.01 -1.43 -0.38 0.00 -0.77 0.00 0.00 57.85 55.28 3k8t n ARG 487 Cb 0.68 -1.47 -0.02 0.00 -1.02 0.00 0.00 32.46 30.62 3k8t n ARG 487 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3k8t s ASN 488 N -2.18 6.61 -0.30 0.55 2.47 -0.40 -4.81 114.94 116.86 3k8t s ASN 488 Ca 0.26 2.31 -0.19 0.00 0.42 0.00 0.00 52.86 55.66 3k8t s ASN 488 Cb 0.19 -2.61 -0.01 0.00 -1.45 0.00 0.00 41.25 37.37 3k8t s ASN 488 CO 0.40 -0.61 0.59 -0.47 -3.72 0.00 0.00 177.10 173.29 3k8t s TYR 489 N -1.42 3.22 -0.18 0.43 5.04 0.20 -4.98 117.35 119.66 3k8t s TYR 489 Ca 0.56 0.53 -0.19 0.00 -2.44 0.00 0.00 57.07 55.53 3k8t s TYR 489 Cb -0.30 -2.93 -0.03 0.00 0.35 0.00 0.00 41.96 39.05 3k8t s TYR 489 CO 0.38 -0.45 0.53 0.71 -1.34 0.00 0.00 175.55 175.39 3k8t s TYR 490 N 2.51 3.40 0.18 4.97 2.02 -1.26 -4.34 117.35 124.84 3k8t s TYR 490 Ca 0.23 0.82 0.25 0.00 -0.37 0.00 0.00 57.07 58.01 3k8t s TYR 490 Cb -0.15 -2.68 1.04 0.00 -0.40 0.00 0.00 41.96 39.77 3k8t s TYR 490 CO 0.11 -0.07 1.88 -1.00 -1.57 0.00 0.00 175.55 174.90 3k8t h PRO 491 N 7.34 0.00 -3.86 -1.71 0.13 -1.95 -3.44 132.00 128.51 3k8t h PRO 491 Ca -0.35 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.62 3k8t h PRO 491 Cb 1.16 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.08 3k8t h PRO 491 CO 0.75 0.20 -0.65 0.14 -0.23 0.00 0.00 178.00 178.21 3k8t s VAL 492 N -3.74 0.10 0.53 1.56 -7.23 -1.26 -4.77 120.40 105.59 3k8t s VAL 492 Ca -0.00 -0.83 0.21 0.00 -1.81 0.00 0.00 61.98 59.54 3k8t s VAL 492 Cb 0.11 -0.30 0.29 0.00 0.56 0.00 0.00 36.38 37.04 3k8t s VAL 492 CO 0.62 -0.46 2.17 -0.08 -0.31 0.00 0.00 175.10 177.04 3k8t h GLU 493 N 4.59 0.00 -0.03 4.82 4.57 -1.99 -2.30 114.58 124.25 3k8t h GLU 493 Ca -0.32 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 57.83 3k8t h GLU 493 Cb 1.21 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 3k8t h GLU 493 CO 0.41 0.02 -0.16 0.93 -1.18 0.00 0.00 179.01 179.03 3k8t h GLU 494 N 0.00 0.04 0.17 1.92 3.07 -1.93 -2.36 114.58 115.49 3k8t h GLU 494 Ca -0.00 -0.01 -0.31 0.00 -0.50 0.00 0.00 59.36 58.54 3k8t h GLU 494 Cb 0.04 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 27.95 3k8t h GLU 494 CO 0.00 0.20 -1.44 0.00 -1.40 0.00 0.00 179.01 176.37 3k8t h ALA 495 N 1.80 0.07 -0.33 3.43 0.00 -1.55 -2.39 119.26 120.29 3k8t h ALA 495 Ca 0.01 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 53.96 3k8t h ALA 495 Cb 0.30 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3k8t h ALA 495 CO 0.02 0.94 0.22 -0.09 0.00 0.00 0.00 179.25 180.34 3k8t h ARG 496 N 0.10 0.43 -0.23 0.00 2.43 -1.54 -2.11 114.38 113.46 3k8t h ARG 496 Ca -0.22 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 58.92 3k8t h ARG 496 Cb 2.06 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 31.50 3k8t h ARG 496 CO 0.21 0.29 0.13 -0.22 -1.51 0.00 0.00 179.97 178.87 3k8t h LYS 497 N 0.45 0.32 0.38 0.20 3.64 -1.46 0.34 116.57 120.44 3k8t h LYS 497 Ca 0.12 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 3k8t h LYS 497 Cb -0.05 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 3k8t h LYS 497 CO -0.03 0.29 -0.50 1.03 -2.27 0.00 0.00 179.45 177.97 3k8t h SER 498 N 0.27 -1.41 -0.34 4.20 0.87 -1.48 -2.77 113.55 112.90 3k8t h SER 498 Ca 0.08 0.12 -0.09 0.00 -1.23 0.00 0.00 61.79 60.67 3k8t h SER 498 Cb 0.05 0.48 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 3k8t h SER 498 CO -0.01 -0.62 -0.11 -1.13 -0.53 0.00 0.00 176.83 174.43 3k8t h ASN 499 N -0.90 0.76 0.35 6.23 -1.24 -1.32 -1.51 115.58 117.95 3k8t h ASN 499 Ca -0.04 -0.23 -0.07 0.00 0.71 0.00 0.00 56.30 56.66 3k8t h ASN 499 Cb 0.82 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.65 3k8t h ASN 499 CO -0.13 0.90 -0.35 0.24 -1.29 0.00 0.00 177.43 176.80 3k8t h MET 500 N 0.70 0.00 0.00 6.67 2.86 -0.99 -0.23 114.93 123.94 3k8t h MET 500 Ca 0.12 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.66 3k8t h MET 500 Cb 0.59 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.26 3k8t h MET 500 CO 0.04 0.35 -0.37 0.00 1.06 0.00 0.00 176.91 177.98 3k8t h ARG 501 N 0.00 0.25 0.00 1.72 3.08 -1.00 -3.41 114.38 115.02 3k8t h ARG 501 Ca -0.00 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.77 3k8t h ARG 501 Cb 0.62 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.75 3k8t h ARG 501 CO 0.05 0.99 -0.98 0.72 -1.07 0.00 0.00 179.97 179.67 3k8t n HIS 502 N -4.40 0.00 -3.93 3.04 8.25 -0.78 -1.94 115.22 115.46 3k8t n HIS 502 Ca -0.10 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.09 3k8t n HIS 502 Cb 0.57 -0.10 -0.00 0.00 1.12 0.00 0.00 29.99 31.58 3k8t n HIS 502 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3k8t n ARG 503 N -1.54 -4.06 -1.38 -0.41 1.74 -0.10 -1.62 116.66 109.29 3k8t n ARG 503 Ca -0.00 0.49 -0.30 0.00 -0.77 0.00 0.00 57.85 57.26 3k8t n ARG 503 Cb 0.14 -4.94 0.11 0.00 -1.02 0.00 0.00 32.46 26.76 3k8t n ARG 503 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3k8t s PRO 504 N -6.48 1.78 0.07 5.56 0.04 -1.26 -3.57 135.00 131.13 3k8t s PRO 504 Ca 0.23 0.77 -0.07 0.00 0.04 0.00 0.00 61.00 61.97 3k8t s PRO 504 Cb -0.12 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 3k8t s PRO 504 CO 0.87 -1.87 0.15 -1.50 0.04 0.00 0.00 177.00 174.68 3k8t s ILE 505 N -3.03 0.15 -0.35 0.56 1.10 0.11 -4.64 121.20 115.10 3k8t s ILE 505 Ca 0.62 -1.25 -0.01 0.00 -0.51 0.00 0.00 60.65 59.50 3k8t s ILE 505 Cb -0.16 -1.31 0.12 0.00 0.15 0.00 0.00 42.46 41.26 3k8t s ILE 505 CO 0.56 -0.69 0.17 0.00 -2.11 0.00 0.00 174.94 172.86 3k8t s ALA 506 N -3.68 1.26 0.34 1.50 0.00 -0.74 -3.29 121.76 117.15 3k8t s ALA 506 Ca 0.04 -1.80 -0.26 0.00 0.00 0.00 0.00 51.96 49.94 3k8t s ALA 506 Cb 0.05 -1.62 -0.10 0.00 0.00 0.00 0.00 23.12 21.45 3k8t s ALA 506 CO -0.10 -1.89 0.98 -0.51 0.00 0.00 0.00 175.76 174.24 3k8t s LEU 507 N 1.28 4.29 0.00 0.00 1.02 0.27 -2.54 118.68 123.01 3k8t s LEU 507 Ca 0.14 1.92 0.00 0.00 0.02 0.00 0.00 54.13 56.21 3k8t s LEU 507 Cb -0.20 -4.04 0.00 0.00 0.02 0.00 0.00 46.19 41.96 3k8t s LEU 507 CO -0.14 -0.19 0.00 0.61 0.02 0.00 0.00 176.35 176.65 3k8t n GLY 508 N 0.52 4.94 3.35 -3.19 0.00 -0.00 -1.45 105.19 109.36 3k8t n GLY 508 Ca 0.03 -1.16 -0.10 0.00 0.00 0.00 0.00 46.02 44.79 3k8t n GLY 508 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k8t s VAL 509 N -0.32 0.06 0.18 1.61 -7.23 -1.26 -1.36 120.40 112.07 3k8t s VAL 509 Ca 0.00 -1.39 -0.06 0.00 -1.81 0.00 0.00 61.98 58.72 3k8t s VAL 509 Cb 0.00 -1.87 -0.02 0.00 0.56 0.00 0.00 36.38 35.04 3k8t s VAL 509 CO 0.00 -0.27 0.22 0.00 -0.31 0.00 0.00 175.10 174.75 3k8t s GLN 510 N -3.97 1.18 -1.19 4.82 -2.07 -0.29 -3.76 119.66 114.38 3k8t s GLN 510 Ca 0.18 -1.36 -0.02 0.00 -1.82 0.00 0.00 55.36 52.34 3k8t s GLN 510 Cb 0.03 0.33 0.00 0.00 -1.09 0.00 0.00 33.01 32.29 3k8t s GLN 510 CO 0.01 -0.41 0.21 0.41 -1.32 0.00 0.00 175.29 174.19 3k8t n GLY 511 N -0.23 -0.21 0.14 2.60 0.00 -0.59 -1.15 105.19 105.75 3k8t n GLY 511 Ca -0.04 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.67 3k8t n GLY 511 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3k8t h LEU 512 N -0.48 -0.26 -0.92 0.99 6.46 -1.73 -1.32 115.31 118.04 3k8t h LEU 512 Ca -0.36 0.04 0.02 0.00 -0.12 0.00 0.00 57.88 57.45 3k8t h LEU 512 Cb 1.26 0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 41.25 3k8t h LEU 512 CO 0.41 -0.14 0.61 0.00 -0.62 0.00 0.00 178.44 178.70 3k8t h ALA 513 N 0.79 1.18 -0.18 1.25 0.00 -1.81 -1.74 119.26 118.75 3k8t h ALA 513 Ca 0.03 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3k8t h ALA 513 Cb 0.20 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3k8t h ALA 513 CO -0.08 0.54 -0.03 -0.44 0.00 0.00 0.00 179.25 179.24 3k8t h ASP 514 N 1.22 -0.13 -0.17 0.00 3.32 -1.90 -1.56 116.42 117.21 3k8t h ASP 514 Ca 0.34 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.49 3k8t h ASP 514 Cb -0.10 0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.48 3k8t h ASP 514 CO -0.09 -0.04 -0.23 0.74 -1.72 0.00 0.00 179.24 177.90 3k8t h THR 515 N 0.02 0.43 -0.41 0.35 2.02 -0.54 0.14 112.91 114.93 3k8t h THR 515 Ca 0.09 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.32 3k8t h THR 515 Cb 0.12 0.43 -0.05 0.00 -1.74 0.00 0.00 68.15 66.91 3k8t h THR 515 CO -0.17 0.00 0.11 -0.26 0.37 0.00 0.00 175.52 175.57 3k8t h PHE 516 N -0.27 0.19 -0.47 3.16 0.04 -1.20 -0.17 116.94 118.22 3k8t h PHE 516 Ca 0.11 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.86 3k8t h PHE 516 Cb 0.44 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.55 3k8t h PHE 516 CO -0.35 0.05 0.13 0.52 -0.60 0.00 0.00 178.31 178.06 3k8t h MET 517 N 0.25 0.74 -0.98 1.51 2.86 -0.48 0.22 114.93 119.05 3k8t h MET 517 Ca 0.19 -0.17 0.11 0.00 -2.06 0.00 0.00 59.70 57.77 3k8t h MET 517 Cb 0.21 -0.10 -0.08 0.00 0.06 0.00 0.00 31.60 31.69 3k8t h MET 517 CO -0.23 0.72 0.62 -0.07 1.06 0.00 0.00 176.91 179.01 3k8t h LEU 518 N 0.63 0.91 -1.02 1.22 -0.00 -0.36 -1.98 115.31 114.72 3k8t h LEU 518 Ca 0.15 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 3k8t h LEU 518 Cb 0.30 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 40.81 3k8t h LEU 518 CO -0.00 0.51 0.00 0.18 -0.00 0.00 0.00 178.44 179.13 3k8t n LEU 519 N -4.57 1.58 -0.96 1.67 4.77 -0.11 -4.95 117.00 114.43 3k8t n LEU 519 Ca 0.17 -0.53 -0.10 0.00 -0.03 0.00 0.00 56.01 55.52 3k8t n LEU 519 Cb 0.32 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 3k8t n LEU 519 CO 0.29 0.26 -0.11 0.54 -1.33 0.00 0.00 177.39 177.04 3k8t n ARG 520 N 0.24 -0.75 -3.68 3.23 5.12 0.64 -5.01 116.66 116.44 3k8t n ARG 520 Ca 0.19 0.66 -0.37 0.00 -1.93 0.00 0.00 57.85 56.40 3k8t n ARG 520 Cb 0.37 -4.66 -0.11 0.00 -1.16 0.00 0.00 32.46 26.90 3k8t n ARG 520 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3k8t s LEU 521 N -2.59 3.95 0.69 0.55 1.43 -0.51 -4.99 118.68 117.21 3k8t s LEU 521 Ca 0.00 0.02 -0.16 0.00 -1.03 0.00 0.00 54.13 52.95 3k8t s LEU 521 Cb 0.00 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 3k8t s LEU 521 CO 0.00 0.02 0.80 -2.65 0.23 0.00 0.00 176.35 174.75 3k8t n PRO 522 N 4.59 0.50 -0.20 1.29 -0.02 -1.26 -4.34 135.00 135.56 3k8t n PRO 522 Ca -0.15 0.22 -0.06 0.00 -2.02 0.00 0.00 63.50 61.49 3k8t n PRO 522 Cb 0.52 -2.06 0.09 0.00 -0.02 0.00 0.00 33.50 32.03 3k8t n PRO 522 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3k8t h PHE 523 N -0.15 1.07 -0.28 6.00 3.04 -1.83 -2.83 116.94 121.96 3k8t h PHE 523 Ca -0.47 -0.13 0.00 0.00 3.98 0.00 0.00 57.97 61.35 3k8t h PHE 523 Cb 1.35 -0.30 0.00 0.00 2.56 0.00 0.00 35.95 39.56 3k8t h PHE 523 CO 0.37 0.89 0.00 -0.40 -2.02 0.00 0.00 178.31 177.16 3k8t n ASP 524 N -4.23 2.47 -4.88 0.41 5.68 -1.26 -4.58 116.55 110.16 3k8t n ASP 524 Ca 0.04 -2.23 -0.30 0.00 -0.50 0.00 0.00 54.79 51.81 3k8t n ASP 524 Cb 0.27 -0.42 -0.04 0.00 -1.14 0.00 0.00 41.12 39.79 3k8t n ASP 524 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3k8t s SER 525 N -0.62 6.52 0.38 -1.12 1.04 -1.07 -4.94 113.70 113.89 3k8t s SER 525 Ca 0.23 0.97 0.10 0.00 0.48 0.00 0.00 55.95 57.73 3k8t s SER 525 Cb 0.15 -2.25 0.86 0.00 0.10 0.00 0.00 66.02 64.88 3k8t s SER 525 CO 0.10 -0.28 1.91 -0.08 0.98 0.00 0.00 173.24 175.88 3k8t h GLU 526 N 1.62 0.61 -0.55 4.02 4.57 -1.93 -0.78 114.58 122.14 3k8t h GLU 526 Ca -0.47 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 57.57 3k8t h GLU 526 Cb 1.19 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.62 3k8t h GLU 526 CO 0.65 0.40 -0.03 0.93 -1.18 0.00 0.00 179.01 179.78 3k8t h GLU 527 N 0.63 1.00 -0.37 1.92 3.07 -1.93 -1.32 114.58 117.58 3k8t h GLU 527 Ca 0.38 -0.33 -0.16 0.00 -0.50 0.00 0.00 59.36 58.75 3k8t h GLU 527 Cb 0.61 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 3k8t h GLU 527 CO -0.15 1.01 -0.38 0.00 -1.40 0.00 0.00 179.01 178.10 3k8t h ALA 528 N 0.95 0.54 -0.42 3.43 0.00 -1.63 -1.23 119.26 120.90 3k8t h ALA 528 Ca 0.15 -0.45 0.08 0.00 0.00 0.00 0.00 54.91 54.69 3k8t h ALA 528 Cb 0.58 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 3k8t h ALA 528 CO 0.03 0.64 -0.00 -0.09 0.00 0.00 0.00 179.25 179.83 3k8t h ARG 529 N 0.71 0.10 -0.48 0.00 2.43 -0.99 -1.06 114.38 115.10 3k8t h ARG 529 Ca 0.06 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 3k8t h ARG 529 Cb 0.97 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 3k8t h ARG 529 CO 0.09 0.07 -0.05 1.25 -1.51 0.00 0.00 179.97 179.82 3k8t h LEU 530 N 0.10 0.87 -0.70 3.80 6.46 -1.17 -2.75 115.31 121.92 3k8t h LEU 530 Ca 0.21 -0.33 -0.08 0.00 -0.12 0.00 0.00 57.88 57.56 3k8t h LEU 530 Cb 0.30 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 39.97 3k8t h LEU 530 CO -0.35 0.99 0.14 0.25 -0.62 0.00 0.00 178.44 178.85 3k8t h LEU 531 N 0.73 1.08 -0.21 2.25 5.85 -1.04 -1.09 115.31 122.88 3k8t h LEU 531 Ca 0.13 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.65 3k8t h LEU 531 Cb 0.57 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 3k8t h LEU 531 CO 0.03 1.05 -0.06 -1.13 -0.34 0.00 0.00 178.44 178.00 3k8t h ASN 532 N 1.07 -0.21 -0.38 1.25 -1.24 -1.17 0.49 115.58 115.39 3k8t h ASN 532 Ca 0.22 0.07 -0.02 0.00 0.71 0.00 0.00 56.30 57.28 3k8t h ASN 532 Cb 0.41 0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.58 3k8t h ASN 532 CO 0.01 -0.08 0.18 0.40 -1.29 0.00 0.00 177.43 176.65 3k8t h ILE 533 N -0.01 1.17 0.00 2.57 2.04 -1.18 -2.73 117.51 119.37 3k8t h ILE 533 Ca 0.10 -0.51 -0.15 0.00 1.00 0.00 0.00 64.86 65.31 3k8t h ILE 533 Cb 0.17 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3k8t h ILE 533 CO -0.23 0.19 -0.69 0.06 0.00 0.00 0.00 178.15 177.48 3k8t h GLN 534 N 0.48 0.00 0.12 2.37 3.07 -1.05 -0.63 115.11 119.47 3k8t h GLN 534 Ca 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.87 3k8t h GLN 534 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.69 3k8t h GLN 534 CO -0.02 0.69 -0.06 0.82 0.09 0.00 0.00 178.83 180.36 3k8t h ILE 535 N 0.00 0.99 -0.09 1.86 2.04 -0.86 -1.85 117.51 119.60 3k8t h ILE 535 Ca -0.01 -0.40 -0.11 0.00 1.00 0.00 0.00 64.86 65.34 3k8t h ILE 535 Cb 1.29 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 3k8t h ILE 535 CO 0.09 0.10 -0.45 -0.26 0.00 0.00 0.00 178.15 177.62 3k8t h PHE 536 N -0.34 0.26 -0.50 1.37 0.04 -1.43 -1.49 116.94 114.84 3k8t h PHE 536 Ca -0.02 -0.08 -0.03 0.00 2.80 0.00 0.00 57.97 60.64 3k8t h PHE 536 Cb 0.28 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 3k8t h PHE 536 CO -0.01 0.64 0.18 1.49 -0.60 0.00 0.00 178.31 180.01 3k8t h GLU 537 N 0.18 0.76 -0.35 1.51 4.81 -1.10 -1.75 114.58 118.65 3k8t h GLU 537 Ca 0.01 -0.15 -0.12 0.00 -0.13 0.00 0.00 59.36 58.97 3k8t h GLU 537 Cb 0.88 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 3k8t h GLU 537 CO 0.07 0.69 -0.27 0.00 -0.73 0.00 0.00 179.01 178.78 3k8t h THR 538 N 0.68 1.28 -0.47 0.32 1.03 -0.93 -1.60 112.91 113.21 3k8t h THR 538 Ca 0.17 -1.38 -0.08 0.00 -0.01 0.00 0.00 66.41 65.11 3k8t h THR 538 Cb 0.23 1.29 -0.02 0.00 -1.07 0.00 0.00 68.15 68.58 3k8t h THR 538 CO -0.01 0.45 0.00 0.40 -0.01 0.00 0.00 175.52 176.36 3k8t h ILE 539 N 0.62 1.26 -0.35 0.00 2.04 -1.15 -0.07 117.51 119.86 3k8t h ILE 539 Ca 0.08 -1.06 -0.13 0.00 1.00 0.00 0.00 64.86 64.75 3k8t h ILE 539 Cb 0.77 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 3k8t h ILE 539 CO 0.06 0.37 -0.28 0.22 0.00 0.00 0.00 178.15 178.52 3k8t h TYR 540 N 0.69 0.96 -0.20 1.37 3.20 -1.27 0.07 116.97 121.78 3k8t h TYR 540 Ca 0.13 -0.27 0.00 0.00 3.14 0.00 0.00 58.73 61.73 3k8t h TYR 540 Cb 0.50 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 3k8t h TYR 540 CO 0.04 1.05 0.13 1.25 -1.64 0.00 0.00 178.16 178.99 3k8t h HIS 541 N 0.60 0.26 -0.18 -3.82 2.76 -1.20 -1.76 115.15 111.80 3k8t h HIS 541 Ca 0.06 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.24 3k8t h HIS 541 Cb 0.86 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.72 3k8t h HIS 541 CO 0.06 0.17 0.11 0.00 -1.30 0.00 0.00 177.93 176.98 3k8t h ALA 542 N 1.07 0.23 -0.66 5.26 0.00 -0.87 0.31 119.26 124.60 3k8t h ALA 542 Ca 0.07 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3k8t h ALA 542 Cb -0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3k8t h ALA 542 CO -0.02 -0.26 0.40 0.66 0.00 0.00 0.00 179.25 180.04 3k8t h SER 543 N 0.22 0.65 -0.03 0.00 4.64 -0.84 0.09 113.55 118.29 3k8t h SER 543 Ca 0.07 0.01 -0.20 0.00 -0.47 0.00 0.00 61.79 61.19 3k8t h SER 543 Cb 0.02 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 3k8t h SER 543 CO -0.01 0.45 -0.70 0.24 -0.87 0.00 0.00 176.83 175.94 3k8t h MET 544 N 0.78 0.66 -0.33 4.77 2.86 -1.06 -0.37 114.93 122.25 3k8t h MET 544 Ca 0.27 -0.50 -0.02 0.00 -2.06 0.00 0.00 59.70 57.38 3k8t h MET 544 Cb 0.05 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 3k8t h MET 544 CO -0.12 1.12 0.11 1.49 1.06 0.00 0.00 176.91 180.57 3k8t h GLU 545 N 0.47 0.51 -0.53 1.72 4.81 -0.55 0.36 114.58 121.37 3k8t h GLU 545 Ca -0.03 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.02 3k8t h GLU 545 Cb 1.30 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.58 3k8t h GLU 545 CO 0.14 0.54 0.04 0.00 -0.73 0.00 0.00 179.01 178.99 3k8t h ALA 546 N 0.95 1.07 -0.11 2.92 0.00 -0.83 -0.87 119.26 122.40 3k8t h ALA 546 Ca 0.11 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 3k8t h ALA 546 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3k8t h ALA 546 CO -0.00 0.59 -0.44 1.03 0.00 0.00 0.00 179.25 180.43 3k8t h SER 547 N 0.81 0.26 -0.17 0.00 0.87 -0.74 -1.37 113.55 113.21 3k8t h SER 547 Ca 0.16 -0.12 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 3k8t h SER 547 Cb 0.43 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.31 3k8t h SER 547 CO 0.02 0.67 -0.15 0.00 -0.53 0.00 0.00 176.83 176.84 3k8t h GLU 549 N 0.06 0.38 -0.86 0.00 5.08 -0.93 -0.18 114.58 118.13 3k8t h GLU 549 Ca 0.03 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3k8t h GLU 549 Cb 0.68 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 3k8t h GLU 549 CO 0.04 0.25 0.44 -0.07 -1.00 0.00 0.00 179.01 178.67 3k8t h LEU 550 N 0.39 1.10 -1.04 1.33 3.38 -0.99 -2.43 115.31 117.05 3k8t h LEU 550 Ca 0.38 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 3k8t h LEU 550 Cb 0.56 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3k8t h LEU 550 CO -0.40 0.90 -0.17 0.00 0.09 0.00 0.00 178.44 178.87 3k8t h ALA 551 N 1.27 1.19 0.00 1.53 0.00 0.32 0.20 119.26 123.77 3k8t h ALA 551 Ca 0.30 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 3k8t h ALA 551 Cb 0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3k8t h ALA 551 CO -0.04 0.52 -0.43 1.96 0.00 0.00 0.00 179.25 181.26 3k8t h GLN 552 N 0.44 0.00 0.00 0.00 4.20 -0.69 -0.55 115.11 118.51 3k8t h GLN 552 Ca 0.08 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 3k8t h GLN 552 Cb 0.56 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 3k8t h GLN 552 CO 0.04 0.43 -0.06 0.87 -0.67 0.00 0.00 178.83 179.44 3k8t h LYS 553 N 0.00 0.00 -0.02 1.46 1.57 -1.03 -3.41 116.57 115.14 3k8t h LYS 553 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k8t h LYS 553 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 3k8t h LYS 553 CO 0.06 0.15 -0.11 -0.25 -0.57 0.00 0.00 179.45 178.73 3k8t n ASP 554 N -4.74 2.07 0.00 0.86 10.43 0.66 -5.10 116.55 120.74 3k8t n ASP 554 Ca -0.02 -1.54 0.00 0.00 2.57 0.00 0.00 54.79 55.80 3k8t n ASP 554 Cb 0.10 0.16 0.00 0.00 1.84 0.00 0.00 41.12 43.21 3k8t n ASP 554 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3k8t n GLY 555 N 0.97 1.54 3.71 0.44 0.00 -0.21 -5.00 105.19 106.64 3k8t n GLY 555 Ca 0.08 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 3k8t n GLY 555 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3k8t s PRO 556 N -3.77 1.29 0.97 1.61 0.02 -1.26 -4.39 135.00 129.49 3k8t s PRO 556 Ca 0.00 0.97 -0.11 0.00 0.02 0.00 0.00 61.00 61.88 3k8t s PRO 556 Cb 0.00 -1.80 0.18 0.00 0.02 0.00 0.00 34.50 32.90 3k8t s PRO 556 CO 0.00 -2.26 1.11 1.52 -0.33 0.00 0.00 177.00 177.04 3k8t s TYR 557 N -2.87 1.61 0.38 6.54 -0.85 -0.87 -4.87 117.35 116.43 3k8t s TYR 557 Ca 0.64 1.61 0.11 0.00 -0.52 0.00 0.00 57.07 58.90 3k8t s TYR 557 Cb -0.19 -3.26 0.77 0.00 0.38 0.00 0.00 41.96 39.66 3k8t s TYR 557 CO 0.57 -3.03 1.88 0.93 -1.52 0.00 0.00 175.55 174.38 3k8t h GLU 558 N -2.03 0.15 -0.55 -3.49 5.08 -1.67 -2.56 114.58 109.50 3k8t h GLU 558 Ca -0.48 -0.04 -0.23 0.00 -1.00 0.00 0.00 59.36 57.61 3k8t h GLU 558 Cb 1.28 -0.02 -0.13 0.00 0.50 0.00 0.00 28.75 30.38 3k8t h GLU 558 CO 0.45 0.37 0.16 -2.37 -1.00 0.00 0.00 179.01 176.62 3k8t n THR 559 N -4.22 2.72 -0.10 1.13 5.66 -1.24 -4.62 114.28 113.62 3k8t n THR 559 Ca -0.01 -2.20 -0.08 0.00 -3.05 0.00 0.00 64.05 58.71 3k8t n THR 559 Cb 0.32 -0.35 0.08 0.00 -1.55 0.00 0.00 70.33 68.83 3k8t n THR 559 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 3k8t h PHE 560 N 1.48 0.92 -2.62 1.09 3.04 -1.80 -3.41 116.94 115.65 3k8t h PHE 560 Ca 0.28 -0.21 -0.53 0.00 3.98 0.00 0.00 57.97 61.49 3k8t h PHE 560 Cb 2.02 -0.22 0.03 0.00 2.56 0.00 0.00 35.95 40.34 3k8t h PHE 560 CO 1.11 0.95 1.05 -0.65 -2.02 0.00 0.00 178.31 178.74 3k8t s GLN 561 N -4.64 4.17 0.00 1.11 -0.21 -1.26 -1.44 119.66 117.39 3k8t s GLN 561 Ca -0.10 2.47 0.00 0.00 0.02 0.00 0.00 55.36 57.76 3k8t s GLN 561 Cb 0.13 -3.54 0.00 0.00 1.00 0.00 0.00 33.01 30.59 3k8t s GLN 561 CO 0.84 -0.78 0.00 0.41 -2.12 0.00 0.00 175.29 173.64 3k8t n GLY 562 N 4.09 1.08 3.78 3.09 0.00 -1.26 -5.07 105.19 110.91 3k8t n GLY 562 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3k8t n GLY 562 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k8t s SER 563 N -2.89 5.45 0.33 1.61 1.04 -0.52 -4.73 113.70 114.00 3k8t s SER 563 Ca 0.00 1.98 0.11 0.00 0.48 0.00 0.00 55.95 58.52 3k8t s SER 563 Cb 0.00 -2.55 0.91 0.00 0.10 0.00 0.00 66.02 64.48 3k8t s SER 563 CO 0.00 -1.40 1.75 -0.65 0.98 0.00 0.00 173.24 173.92 3k8t h PRO 564 N 0.41 0.56 -0.14 4.02 0.11 -1.84 -1.26 132.00 133.86 3k8t h PRO 564 Ca -0.47 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.51 3k8t h PRO 564 Cb 1.24 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3k8t h PRO 564 CO 0.56 0.37 -0.33 0.00 -0.21 0.00 0.00 178.00 178.39 3k8t h ALA 565 N 1.69 1.20 0.00 -0.75 0.00 -1.85 -0.07 119.26 119.49 3k8t h ALA 565 Ca 0.62 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 3k8t h ALA 565 Cb 1.23 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3k8t h ALA 565 CO -0.42 0.53 -0.00 0.66 0.00 0.00 0.00 179.25 180.02 3k8t h SER 566 N 0.24 0.00 -0.43 0.00 4.64 -1.44 -2.24 113.55 114.32 3k8t h SER 566 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3k8t h SER 566 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3k8t h SER 566 CO 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.02 3k8t n GLN 567 N -3.12 2.49 -0.73 4.77 1.13 -0.66 -4.75 117.38 116.51 3k8t n GLN 567 Ca -0.02 -2.18 0.00 0.00 -1.94 0.00 0.00 57.00 52.86 3k8t n GLN 567 Cb 0.12 -1.40 0.00 0.00 0.11 0.00 0.00 30.24 29.07 3k8t n GLN 567 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k8t n GLY 568 N 1.07 0.58 3.37 1.08 0.00 -0.84 -5.01 105.19 105.43 3k8t n GLY 568 Ca 0.16 -0.51 -0.45 0.00 0.00 0.00 0.00 46.02 45.23 3k8t n GLY 568 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k8t s ILE 569 N -2.00 5.10 0.74 -0.61 1.01 -0.13 -4.98 121.20 120.33 3k8t s ILE 569 Ca 0.00 -1.10 -0.01 0.00 0.00 0.00 0.00 60.65 59.54 3k8t s ILE 569 Cb 0.00 -4.28 0.13 0.00 0.01 0.00 0.00 42.46 38.32 3k8t s ILE 569 CO 0.00 -0.80 1.01 -0.76 0.00 0.00 0.00 174.94 174.40 3k8t s LEU 570 N 1.96 2.96 0.07 2.97 1.43 -1.26 -2.90 118.68 123.90 3k8t s LEU 570 Ca 0.07 -0.37 -0.23 0.00 -1.03 0.00 0.00 54.13 52.56 3k8t s LEU 570 Cb -0.25 -1.93 -0.15 0.00 0.03 0.00 0.00 46.19 43.89 3k8t s LEU 570 CO 0.06 -1.93 1.61 -0.61 0.23 0.00 0.00 176.35 175.72 3k8t h GLN 571 N -0.59 0.06 0.00 1.70 5.75 -1.97 -2.28 115.11 117.79 3k8t h GLN 571 Ca -0.36 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.12 3k8t h GLN 571 Cb 1.26 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.80 3k8t h GLN 571 CO 0.39 0.18 -0.06 0.27 -2.65 0.00 0.00 178.83 176.97 3k8t h PHE 572 N -0.07 0.00 -0.42 3.99 -0.00 -1.57 -1.07 116.94 117.80 3k8t h PHE 572 Ca 0.01 0.00 -0.07 0.00 -0.00 0.00 0.00 57.97 57.91 3k8t h PHE 572 Cb 0.14 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 36.07 3k8t h PHE 572 CO -0.03 0.06 -0.04 -0.44 -0.00 0.00 0.00 178.31 177.86 3k8t h ASP 573 N 0.00 0.68 0.98 -0.68 3.45 -1.56 -1.46 116.42 117.83 3k8t h ASP 573 Ca -0.00 -0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.29 3k8t h ASP 573 Cb 0.17 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 38.76 3k8t h ASP 573 CO 0.01 0.77 0.00 0.24 -1.57 0.00 0.00 179.24 178.69 3k8t h MET 574 N 0.66 0.00 -0.29 3.56 2.86 -1.06 -0.14 114.93 120.51 3k8t h MET 574 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3k8t h MET 574 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 3k8t h MET 574 CO 0.02 0.00 0.00 0.91 1.06 0.00 0.00 176.91 178.90 3k8t n TRP 575 N -2.31 0.37 -3.63 -0.22 7.02 -1.04 -4.87 117.44 112.76 3k8t n TRP 575 Ca 0.03 -0.19 -0.24 0.00 -1.02 0.00 0.00 57.50 56.09 3k8t n TRP 575 Cb 0.30 0.00 0.07 0.00 -2.42 0.00 0.00 31.31 29.25 3k8t n TRP 575 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 3k8t n ASP 576 N 1.09 -4.95 -4.16 -0.99 8.00 -0.06 -5.01 116.55 110.46 3k8t n ASP 576 Ca 0.18 -0.62 -0.18 0.00 0.71 0.00 0.00 54.79 54.88 3k8t n ASP 576 Cb 0.51 -4.79 -0.12 0.00 -0.02 0.00 0.00 41.12 36.70 3k8t n ASP 576 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3k8t s GLN 577 N -6.17 0.81 0.34 -1.24 -0.21 -0.58 -5.03 119.66 107.58 3k8t s GLN 577 Ca 0.45 -0.92 -0.26 0.00 0.02 0.00 0.00 55.36 54.65 3k8t s GLN 577 Cb -0.21 -0.80 -0.10 0.00 1.00 0.00 0.00 33.01 32.90 3k8t s GLN 577 CO 0.75 0.18 0.99 0.15 -2.12 0.00 0.00 175.29 175.25 3k8t s LYS 578 N -1.67 4.48 0.83 2.91 1.02 -1.26 -4.08 119.74 121.97 3k8t s LYS 578 Ca -0.02 1.45 -0.11 0.00 0.02 0.00 0.00 55.97 57.30 3k8t s LYS 578 Cb -0.10 -2.79 0.09 0.00 -0.52 0.00 0.00 37.83 34.51 3k8t s LYS 578 CO 0.02 0.16 1.09 -1.25 -0.92 0.00 0.00 175.35 174.45 3k8t s PRO 579 N -2.07 1.78 0.40 -1.68 0.04 -1.26 -4.94 135.00 127.27 3k8t s PRO 579 Ca 0.51 0.75 0.14 0.00 0.04 0.00 0.00 61.00 62.44 3k8t s PRO 579 Cb -0.22 -1.87 0.83 0.00 0.04 0.00 0.00 34.50 33.28 3k8t s PRO 579 CO 0.27 -1.86 1.88 -0.92 0.04 0.00 0.00 177.00 176.42 3k8t h TYR 580 N -1.27 0.00 0.00 0.56 5.03 -1.96 -3.47 116.97 115.86 3k8t h TYR 580 Ca -0.48 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.83 3k8t h TYR 580 Cb 1.27 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.55 3k8t h TYR 580 CO 0.46 0.31 0.00 0.41 -1.32 0.00 0.00 178.16 178.01 3k8t n GLY 581 N -0.63 0.76 0.21 1.82 0.00 -1.26 -4.95 105.19 101.13 3k8t n GLY 581 Ca -0.02 -0.65 0.06 0.00 0.00 0.00 0.00 46.02 45.41 3k8t n GLY 581 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3k8t h MET 582 N 0.00 0.00 -6.43 1.61 4.05 -1.97 -3.44 114.93 108.74 3k8t h MET 582 Ca 0.00 0.00 -0.62 0.00 -0.28 0.00 0.00 59.70 58.80 3k8t h MET 582 Cb 0.30 0.00 -0.15 0.00 -0.80 0.00 0.00 31.60 30.95 3k8t h MET 582 CO 0.00 0.30 -0.74 -1.58 0.23 0.00 0.00 176.91 175.12 3k8t s TRP 583 N -4.11 2.51 -0.75 1.39 0.52 -1.26 -5.09 118.94 112.16 3k8t s TRP 583 Ca -0.02 -0.27 -0.27 0.00 0.02 0.00 0.00 56.10 55.56 3k8t s TRP 583 Cb 0.14 -1.20 0.03 0.00 -1.15 0.00 0.00 33.47 31.28 3k8t s TRP 583 CO 0.68 0.55 1.30 0.34 0.02 0.00 0.00 176.95 179.84 3k8t s ASP 584 N -2.97 6.17 0.31 2.95 -1.08 -1.26 -4.87 116.67 115.91 3k8t s ASP 584 Ca 0.25 -0.49 0.16 0.00 -0.52 0.00 0.00 52.55 51.95 3k8t s ASP 584 Cb -0.08 -2.56 0.17 0.00 -1.46 0.00 0.00 42.92 39.00 3k8t s ASP 584 CO 0.14 -1.83 1.50 -0.50 0.52 0.00 0.00 175.17 175.00 3k8t h TRP 585 N 10.09 0.00 -0.17 -5.34 4.06 -1.98 -3.26 115.95 119.35 3k8t h TRP 585 Ca -0.25 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.57 3k8t h TRP 585 Cb 1.05 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.21 3k8t h TRP 585 CO 1.14 0.45 -0.39 -0.44 -3.56 0.00 0.00 178.44 175.64 3k8t h ASP 586 N 0.00 0.64 -0.51 -3.49 3.45 -1.99 -0.86 116.42 113.65 3k8t h ASP 586 Ca -0.00 -0.56 -0.03 0.00 0.43 0.00 0.00 57.03 56.86 3k8t h ASP 586 Cb 1.29 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.86 3k8t h ASP 586 CO 0.06 1.08 0.19 0.74 -1.57 0.00 0.00 179.24 179.74 3k8t h THR 587 N 0.22 1.22 0.04 0.35 2.02 -2.00 0.47 112.91 115.24 3k8t h THR 587 Ca 0.00 -0.71 0.02 0.00 0.77 0.00 0.00 66.41 66.50 3k8t h THR 587 Cb 0.99 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 3k8t h THR 587 CO 0.08 0.26 -0.16 0.25 0.37 0.00 0.00 175.52 176.32 3k8t h LEU 588 N 0.69 -0.47 -0.58 2.58 5.85 -1.57 -1.66 115.31 120.16 3k8t h LEU 588 Ca 0.17 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.97 3k8t h LEU 588 Cb 0.22 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 3k8t h LEU 588 CO -0.01 -0.23 0.36 -0.09 -0.34 0.00 0.00 178.44 178.13 3k8t h ARG 589 N -0.29 0.71 -0.18 1.25 2.43 -1.01 -0.23 114.38 117.05 3k8t h ARG 589 Ca 0.04 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 3k8t h ARG 589 Cb 0.34 -0.16 -0.07 0.00 -0.42 0.00 0.00 29.97 29.66 3k8t h ARG 589 CO -0.13 0.47 -0.28 -0.22 -1.51 0.00 0.00 179.97 178.30 3k8t h LYS 590 N 0.73 -0.31 -0.74 0.20 3.64 -0.62 -1.31 116.57 118.16 3k8t h LYS 590 Ca 0.23 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 3k8t h LYS 590 Cb -0.02 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 3k8t h LYS 590 CO -0.08 -0.21 0.37 -0.44 -2.27 0.00 0.00 179.45 176.83 3k8t h ASP 591 N -0.32 0.94 -0.53 4.20 3.32 -0.86 -2.32 116.42 120.85 3k8t h ASP 591 Ca 0.12 -0.10 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 3k8t h ASP 591 Cb 0.50 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 3k8t h ASP 591 CO -0.37 0.79 0.04 0.40 -1.72 0.00 0.00 179.24 178.38 3k8t h ILE 592 N 1.05 1.25 -0.05 0.35 2.04 -0.57 0.84 117.51 122.41 3k8t h ILE 592 Ca 0.26 -1.04 -0.18 0.00 1.00 0.00 0.00 64.86 64.90 3k8t h ILE 592 Cb 0.08 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 3k8t h ILE 592 CO -0.04 0.38 -0.76 0.24 0.00 0.00 0.00 178.15 177.97 3k8t h MET 593 N 0.88 0.34 -0.10 2.37 2.86 -1.04 0.19 114.93 120.43 3k8t h MET 593 Ca 0.17 -0.29 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 3k8t h MET 593 Cb 0.46 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.19 3k8t h MET 593 CO 0.02 0.95 -0.27 -0.22 1.06 0.00 0.00 176.91 178.45 3k8t h LYS 594 N 0.22 0.36 0.00 1.72 1.63 -1.26 -3.41 116.57 115.84 3k8t h LYS 594 Ca -0.03 -0.25 0.00 0.00 -0.85 0.00 0.00 60.65 59.51 3k8t h LYS 594 Cb 1.34 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 33.01 3k8t h LYS 594 CO 0.13 0.87 -0.22 0.72 -3.45 0.00 0.00 179.45 177.50 3k8t n HIS 595 N -4.45 0.00 0.00 1.91 8.25 0.27 -5.11 115.22 116.09 3k8t n HIS 595 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 3k8t n HIS 595 Cb 0.46 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 3k8t n HIS 595 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k8t n GLY 596 N 1.12 -0.50 3.34 -1.41 0.00 0.68 -4.42 105.19 104.00 3k8t n GLY 596 Ca 0.01 -1.80 -0.21 0.00 0.00 0.00 0.00 46.02 44.02 3k8t n GLY 596 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k8t s VAL 597 N -1.07 1.80 -0.39 1.61 -7.23 -1.26 -4.41 120.40 109.44 3k8t s VAL 597 Ca 0.00 -2.00 0.23 0.00 -1.81 0.00 0.00 61.98 58.40 3k8t s VAL 597 Cb 0.00 -1.90 0.22 0.00 0.56 0.00 0.00 36.38 35.26 3k8t s VAL 597 CO 0.00 -0.40 1.42 -0.09 -0.31 0.00 0.00 175.10 175.73 3k8t h ARG 598 N 3.05 0.00 -4.89 4.82 9.65 -1.66 -2.32 114.38 123.03 3k8t h ARG 598 Ca -0.41 0.00 -0.57 0.00 -1.10 0.00 0.00 59.98 57.90 3k8t h ARG 598 Cb 1.21 0.00 -0.33 0.00 -1.39 0.00 0.00 29.97 29.46 3k8t h ARG 598 CO 0.54 0.00 -0.84 -0.80 2.80 0.00 0.00 179.97 181.67 3k8t s ASN 599 N -5.79 2.20 0.40 -3.80 -0.87 -1.26 -3.91 114.94 101.92 3k8t s ASN 599 Ca 0.05 -0.38 0.10 0.00 -1.57 0.00 0.00 52.86 51.06 3k8t s ASN 599 Cb 0.07 -0.95 0.84 0.00 -0.02 0.00 0.00 41.25 41.20 3k8t s ASN 599 CO 0.71 0.09 1.95 0.77 -2.57 0.00 0.00 177.10 178.04 3k8t h SER 600 N 6.78 0.21 -5.02 -1.22 4.64 -1.36 -3.44 113.55 114.13 3k8t h SER 600 Ca -0.28 -0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 60.89 3k8t h SER 600 Cb 1.20 -0.05 -0.19 0.00 -0.31 0.00 0.00 62.40 63.05 3k8t h SER 600 CO 0.47 0.33 -0.32 -0.76 -0.87 0.00 0.00 176.83 175.68 3k8t s LEU 601 N -8.83 1.07 0.00 5.97 1.43 -1.26 -4.72 118.68 112.34 3k8t s LEU 601 Ca -0.05 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 3k8t s LEU 601 Cb 0.16 1.14 0.00 0.00 0.03 0.00 0.00 46.19 47.52 3k8t s LEU 601 CO 0.72 -0.51 0.00 0.35 0.23 0.00 0.00 176.35 177.15 3k8t n THR 602 N 0.98 0.00 -4.00 5.49 -2.24 -1.21 -0.72 114.28 112.60 3k8t n THR 602 Ca -0.20 -0.09 -0.25 0.00 -2.27 0.00 0.00 64.05 61.24 3k8t n THR 602 Cb 0.57 0.72 -0.17 0.00 -2.10 0.00 0.00 70.33 69.35 3k8t n THR 602 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3k8t s MET 603 N -0.35 1.31 -0.47 -0.78 -1.94 -1.24 -0.56 119.30 115.27 3k8t s MET 603 Ca 0.00 -0.19 0.06 0.00 -1.71 0.00 0.00 55.69 53.85 3k8t s MET 603 Cb 0.00 -1.38 0.18 0.00 2.01 0.00 0.00 34.83 35.65 3k8t s MET 603 CO 0.00 -0.22 0.58 0.00 -0.01 0.00 0.00 175.02 175.37 3k8t s ALA 604 N 1.54 -0.85 -0.14 3.03 0.00 -0.53 -2.17 121.76 122.64 3k8t s ALA 604 Ca 0.01 -1.12 -0.35 0.00 0.00 0.00 0.00 51.96 50.50 3k8t s ALA 604 Cb -0.13 -2.31 -0.12 0.00 0.00 0.00 0.00 23.12 20.56 3k8t s ALA 604 CO -0.05 -2.14 1.90 -2.30 0.00 0.00 0.00 175.76 173.17 3k8t n PRO 605 N 3.01 1.94 -3.17 0.00 -0.02 -1.23 -4.60 135.00 130.93 3k8t n PRO 605 Ca 0.22 0.70 -0.19 0.00 -2.02 0.00 0.00 63.50 62.20 3k8t n PRO 605 Cb 0.53 -2.58 0.01 0.00 -0.02 0.00 0.00 33.50 31.45 3k8t n PRO 605 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k8t s MET 606 N 4.28 2.62 0.48 -0.52 0.23 -1.26 -3.04 119.30 122.09 3k8t s MET 606 Ca 0.95 -1.43 0.18 0.00 -1.03 0.00 0.00 55.69 54.36 3k8t s MET 606 Cb -0.75 -2.63 1.19 0.00 -1.53 0.00 0.00 34.83 31.12 3k8t s MET 606 CO 0.53 -0.41 2.06 -1.35 -2.03 0.00 0.00 175.02 173.82 3k8t h PRO 607 N 0.61 0.00 -6.10 3.16 0.11 -1.89 -3.42 132.00 124.47 3k8t h PRO 607 Ca -0.38 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.27 3k8t h PRO 607 Cb 1.28 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 3k8t h PRO 607 CO 0.47 0.12 -0.72 0.25 -0.21 0.00 0.00 178.00 177.91 3k8t n THR 608 N -4.23 -1.59 0.26 -1.15 -2.24 -1.26 -3.72 114.28 100.35 3k8t n THR 608 Ca -0.03 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.87 3k8t n THR 608 Cb 0.20 -2.43 0.72 0.00 -2.10 0.00 0.00 70.33 66.72 3k8t n THR 608 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k8t h ALA 609 N 0.96 1.52 0.00 6.98 0.00 -2.00 -2.91 119.26 123.82 3k8t h ALA 609 Ca -0.55 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.25 3k8t h ALA 609 Cb 1.36 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3k8t h ALA 609 CO 0.66 0.11 -1.15 0.43 0.00 0.00 0.00 179.25 179.30 3k8t n SER 610 N -3.95 4.46 0.01 0.00 7.64 -1.26 -4.63 113.62 115.88 3k8t n SER 610 Ca -0.02 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.79 3k8t n SER 610 Cb 0.18 0.60 0.12 0.00 -1.01 0.00 0.00 64.21 64.10 3k8t n SER 610 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 3k8t h THR 611 N 0.00 1.31 -0.83 0.44 1.35 -1.94 -2.75 112.91 110.48 3k8t h THR 611 Ca -0.05 -1.59 -0.01 0.00 -0.55 0.00 0.00 66.41 64.20 3k8t h THR 611 Cb 1.04 1.61 -0.04 0.00 -1.73 0.00 0.00 68.15 69.03 3k8t h THR 611 CO 0.00 0.50 0.49 0.77 -0.25 0.00 0.00 175.52 177.03 3k8t h SER 612 N 0.41 1.01 -0.71 5.36 4.64 -1.81 -2.32 113.55 120.13 3k8t h SER 612 Ca 0.03 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 3k8t h SER 612 Cb 0.91 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.71 3k8t h SER 612 CO 0.08 0.78 0.41 1.56 -0.87 0.00 0.00 176.83 178.79 3k8t h GLN 613 N 1.15 0.98 0.14 4.77 4.20 -1.69 0.57 115.11 125.24 3k8t h GLN 613 Ca 0.30 -0.10 0.01 0.00 0.06 0.00 0.00 58.65 58.92 3k8t h GLN 613 Cb -0.03 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 27.53 3k8t h GLN 613 CO -0.05 0.72 -0.23 0.82 -0.67 0.00 0.00 178.83 179.41 3k8t h ILE 614 N 0.97 0.50 0.00 2.54 2.04 -1.24 -2.84 117.51 119.48 3k8t h ILE 614 Ca 0.25 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.11 3k8t h ILE 614 Cb 0.01 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 3k8t h ILE 614 CO -0.04 0.00 0.00 -0.07 0.00 0.00 0.00 178.15 178.04 3k8t h LEU 615 N -0.44 0.00 -0.03 1.44 3.38 -0.87 -3.43 115.31 115.36 3k8t h LEU 615 Ca 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3k8t h LEU 615 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3k8t h LEU 615 CO -0.11 0.00 -0.00 0.61 0.09 0.00 0.00 178.44 179.03 3k8t n GLY 616 N 0.37 0.39 3.63 0.83 0.00 0.19 -4.97 105.19 105.63 3k8t n GLY 616 Ca 0.03 -0.88 -0.25 0.00 0.00 0.00 0.00 46.02 44.92 3k8t n GLY 616 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k8t s TYR 617 N -2.04 2.53 0.68 1.61 4.12 -0.44 -5.02 117.35 118.79 3k8t s TYR 617 Ca 0.00 -0.50 -0.12 0.00 0.02 0.00 0.00 57.07 56.47 3k8t s TYR 617 Cb -0.00 -1.58 0.00 0.00 -1.52 0.00 0.00 41.96 38.86 3k8t s TYR 617 CO 0.00 0.45 1.06 1.21 0.02 0.00 0.00 175.55 178.29 3k8t s ASN 618 N -3.73 5.42 0.27 2.29 3.84 -1.26 -4.29 114.94 117.47 3k8t s ASN 618 Ca 0.35 1.68 -0.29 0.00 0.21 0.00 0.00 52.86 54.82 3k8t s ASN 618 Cb 0.02 -2.51 -0.09 0.00 -0.55 0.00 0.00 41.25 38.12 3k8t s ASN 618 CO 0.19 -1.42 1.01 -1.83 -2.79 0.00 0.00 177.10 172.26 3k8t s GLU 619 N -4.78 4.72 0.00 0.43 -1.05 -1.26 -1.54 118.70 115.21 3k8t s GLU 619 Ca 0.60 1.60 0.00 0.00 -0.15 0.00 0.00 54.97 57.02 3k8t s GLU 619 Cb -0.15 -3.17 0.00 0.00 -0.44 0.00 0.00 34.13 30.37 3k8t s GLU 619 CO 0.50 0.35 0.00 0.00 0.95 0.00 0.00 175.26 177.06 3k8t n PHE 621 N 4.06 0.00 -3.95 0.00 1.16 -1.26 -2.40 117.46 115.06 3k8t n PHE 621 Ca 0.00 -0.78 -0.27 0.00 -1.87 0.00 0.00 57.45 54.53 3k8t n PHE 621 Cb 0.00 -0.13 -0.03 0.00 -1.61 0.00 0.00 39.48 37.70 3k8t n PHE 621 CO 0.00 0.00 0.00 -1.83 -1.87 0.00 0.00 176.76 173.06 3k8t s GLU 622 N -2.14 3.39 1.27 3.97 -1.05 -1.15 -4.88 118.70 118.12 3k8t s GLU 622 Ca 0.25 -0.60 -0.17 0.00 -0.15 0.00 0.00 54.97 54.30 3k8t s GLU 622 Cb 0.22 -2.95 0.32 0.00 -0.44 0.00 0.00 34.13 31.29 3k8t s GLU 622 CO 0.01 0.53 0.99 -2.14 0.95 0.00 0.00 175.26 175.60 3k8t s PRO 623 N -3.14 -1.77 0.53 -4.83 0.02 -1.26 -4.19 135.00 120.36 3k8t s PRO 623 Ca 0.34 0.51 -0.19 0.00 0.02 0.00 0.00 61.00 61.69 3k8t s PRO 623 Cb -0.11 -1.48 -0.06 0.00 0.02 0.00 0.00 34.50 32.86 3k8t s PRO 623 CO 0.28 -4.20 1.06 0.14 -0.33 0.00 0.00 177.00 173.94 3k8t s VAL 624 N -2.41 3.70 -0.13 3.83 -7.23 -1.26 -4.79 120.40 112.11 3k8t s VAL 624 Ca 0.69 0.97 0.17 0.00 -1.81 0.00 0.00 61.98 62.00 3k8t s VAL 624 Cb -0.20 -3.40 -0.23 0.00 0.56 0.00 0.00 36.38 33.11 3k8t s VAL 624 CO 0.62 -0.31 0.41 0.35 -0.31 0.00 0.00 175.10 175.85 3k8t n THR 625 N -1.36 1.17 -3.81 5.32 -2.24 -1.26 -0.65 114.28 111.45 3k8t n THR 625 Ca 0.09 -0.76 -0.12 0.00 -2.27 0.00 0.00 64.05 61.00 3k8t n THR 625 Cb 0.52 -0.55 -0.09 0.00 -2.10 0.00 0.00 70.33 68.12 3k8t n THR 625 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3k8t s SER 626 N -5.51 -0.07 0.00 3.42 0.15 -1.26 -4.47 113.70 105.96 3k8t s SER 626 Ca -0.07 -0.16 0.21 0.00 0.70 0.00 0.00 55.95 56.63 3k8t s SER 626 Cb 0.08 0.29 0.68 0.00 -1.71 0.00 0.00 66.02 65.36 3k8t s SER 626 CO 0.84 -0.50 1.51 0.59 1.20 0.00 0.00 173.24 176.88 3k8t n ASN 627 N 1.00 1.94 -3.67 5.45 3.02 -0.08 -4.77 115.26 118.15 3k8t n ASN 627 Ca -0.20 -1.76 -0.17 0.00 -0.03 0.00 0.00 54.58 52.41 3k8t n ASN 627 Cb 0.57 -0.13 -0.16 0.00 -0.61 0.00 0.00 39.78 39.45 3k8t n ASN 627 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 3k8t s MET 628 N -1.74 0.00 -0.45 3.52 1.75 -1.26 -0.04 119.30 121.08 3k8t s MET 628 Ca 0.33 0.50 0.05 0.00 -1.25 0.00 0.00 55.69 55.32 3k8t s MET 628 Cb 0.18 -0.33 0.42 0.00 2.84 0.00 0.00 34.83 37.94 3k8t s MET 628 CO 0.27 -0.31 1.16 0.66 -0.65 0.00 0.00 175.02 176.15 3k8t n TYR 629 N 5.26 3.37 -1.10 4.11 0.53 -1.26 -4.79 117.16 123.28 3k8t n TYR 629 Ca -0.05 -3.04 -0.25 0.00 -1.02 0.00 0.00 57.90 53.53 3k8t n TYR 629 Cb 0.50 -0.14 -0.09 0.00 -1.03 0.00 0.00 39.34 38.58 3k8t n TYR 629 CO 0.00 0.00 0.00 0.94 -1.02 0.00 0.00 176.86 176.78 3k8t n GLN 639 N -0.49 2.78 -4.12 -0.72 0.00 -1.26 -4.69 117.38 108.87 3k8t n GLN 639 Ca 0.40 -1.58 -0.15 0.00 -0.00 0.00 0.00 57.00 55.67 3k8t n GLN 639 Cb 0.66 -2.40 -0.14 0.00 0.00 0.00 0.00 30.24 28.35 3k8t n GLN 639 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3k8t s VAL 640 N 1.79 0.40 -0.06 1.69 1.01 -1.26 -5.16 120.40 118.81 3k8t s VAL 640 Ca 0.65 -0.36 -0.16 0.00 0.00 0.00 0.00 61.98 62.11 3k8t s VAL 640 Cb 0.23 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 36.19 3k8t s VAL 640 CO -0.03 0.02 0.42 0.54 0.00 0.00 0.00 175.10 176.04 3k8t s VAL 641 N -0.34 5.11 0.00 2.92 0.11 -1.26 -4.36 120.40 122.58 3k8t s VAL 641 Ca -0.00 0.84 0.00 0.00 -2.93 0.00 0.00 61.98 59.89 3k8t s VAL 641 Cb -0.03 -3.74 0.00 0.00 -1.53 0.00 0.00 36.38 31.08 3k8t s VAL 641 CO -0.00 0.48 0.00 -3.20 -3.33 0.00 0.00 175.10 169.05 3k8t n ASN 642 N 2.61 0.00 0.01 3.54 2.85 0.94 -4.75 115.26 120.47 3k8t n ASN 642 Ca -0.11 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.40 3k8t n ASN 642 Cb 0.52 0.00 0.43 0.00 1.24 0.00 0.00 39.78 41.97 3k8t n ASN 642 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3k8t h PRO 643 N 0.00 0.51 0.02 1.20 0.13 -1.95 -1.44 132.00 130.48 3k8t h PRO 643 Ca 0.00 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 65.04 3k8t h PRO 643 Cb 0.00 -0.12 0.01 0.00 0.13 0.00 0.00 31.00 31.02 3k8t h PRO 643 CO 0.00 0.34 -0.26 1.88 -0.23 0.00 0.00 178.00 179.73 3k8t h TYR 644 N 0.53 0.22 -0.15 1.56 -1.99 -1.99 -2.83 116.97 112.31 3k8t h TYR 644 Ca 0.14 -0.13 0.03 0.00 2.00 0.00 0.00 58.73 60.77 3k8t h TYR 644 Cb -0.06 -0.02 -0.03 0.00 2.00 0.00 0.00 36.73 38.62 3k8t h TYR 644 CO 0.00 1.00 -0.05 1.25 -0.00 0.00 0.00 178.16 180.35 3k8t h LEU 645 N -0.62 -0.18 -0.54 3.88 5.85 -1.90 -2.74 115.31 119.07 3k8t h LEU 645 Ca -0.04 0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.84 3k8t h LEU 645 Cb 1.08 0.11 -0.09 0.00 0.37 0.00 0.00 40.66 42.13 3k8t h LEU 645 CO 0.05 -0.07 -0.03 0.25 -0.34 0.00 0.00 178.44 178.30 3k8t h LEU 646 N -0.03 -0.30 -1.12 2.25 5.85 -1.32 -0.32 115.31 120.33 3k8t h LEU 646 Ca 0.08 0.14 0.05 0.00 0.84 0.00 0.00 57.88 58.98 3k8t h LEU 646 Cb 0.14 0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 3k8t h LEU 646 CO -0.17 -0.11 0.60 -0.09 -0.34 0.00 0.00 178.44 178.33 3k8t h ARG 647 N 0.08 1.07 -0.00 1.25 9.65 -1.25 -2.18 114.38 123.01 3k8t h ARG 647 Ca 0.27 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 59.08 3k8t h ARG 647 Cb 0.42 -0.24 0.00 0.00 -1.39 0.00 0.00 29.97 28.76 3k8t h ARG 647 CO -0.48 0.71 -0.01 -0.44 2.80 0.00 0.00 179.97 182.56 3k8t h ASP 648 N 1.11 0.01 -0.51 -3.80 3.32 -0.96 -1.12 116.42 114.46 3k8t h ASP 648 Ca 0.38 -0.63 0.08 0.00 0.02 0.00 0.00 57.03 56.87 3k8t h ASP 648 Cb 0.09 -0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.57 3k8t h ASP 648 CO -0.13 0.64 0.15 -0.07 -1.72 0.00 0.00 179.24 178.11 3k8t h LEU 649 N -0.63 0.11 -0.05 1.55 3.38 -0.98 -0.61 115.31 118.08 3k8t h LEU 649 Ca -0.00 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3k8t h LEU 649 Cb 0.64 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 3k8t h LEU 649 CO 0.00 0.08 0.00 0.58 0.09 0.00 0.00 178.44 179.20 3k8t h VAL 650 N 0.31 0.97 -0.12 1.22 2.07 -1.45 -2.62 116.25 116.63 3k8t h VAL 650 Ca 0.25 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.80 3k8t h VAL 650 Cb 0.31 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3k8t h VAL 650 CO -0.29 0.00 0.15 0.44 0.02 0.00 0.00 177.57 177.90 3k8t h ASP 651 N 0.02 0.00 0.01 0.57 3.32 -0.04 -1.38 116.42 118.93 3k8t h ASP 651 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3k8t h ASP 651 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3k8t h ASP 651 CO -0.04 0.00 -0.28 0.18 -1.72 0.00 0.00 179.24 177.38 3k8t n LEU 652 N -3.67 2.13 -1.31 1.55 4.77 -0.35 -4.97 117.00 115.15 3k8t n LEU 652 Ca 0.00 -0.74 -0.13 0.00 -0.03 0.00 0.00 56.01 55.11 3k8t n LEU 652 Cb 0.26 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.30 3k8t n LEU 652 CO 0.26 0.38 -0.15 0.61 -1.33 0.00 0.00 177.39 177.15 3k8t n GLY 653 N 1.37 0.48 0.25 -0.72 0.00 -0.52 -4.88 105.19 101.17 3k8t n GLY 653 Ca 0.12 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.83 3k8t n GLY 653 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3k8t n ILE 654 N -3.43 0.00 -2.38 -0.61 -5.35 -1.08 -4.92 119.36 101.58 3k8t n ILE 654 Ca -0.15 -0.39 -0.41 0.00 -0.27 0.00 0.00 62.75 61.53 3k8t n ILE 654 Cb 0.54 1.13 -0.03 0.00 -1.74 0.00 0.00 39.64 39.55 3k8t n ILE 654 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 3k8t s TRP 655 N -1.43 2.26 0.29 4.28 -0.11 -1.13 -4.74 118.94 118.36 3k8t s TRP 655 Ca 0.09 0.47 0.04 0.00 1.22 0.00 0.00 56.10 57.92 3k8t s TRP 655 Cb 0.09 -4.39 -0.01 0.00 -1.50 0.00 0.00 33.47 27.66 3k8t s TRP 655 CO 0.27 -2.00 0.30 -0.40 -4.62 0.00 0.00 176.95 170.50 3k8t n ASP 656 N 9.66 -0.79 0.08 5.86 5.68 -1.26 -4.93 116.55 130.86 3k8t n ASP 656 Ca 0.13 -2.80 -0.13 0.00 -0.50 0.00 0.00 54.79 51.49 3k8t n ASP 656 Cb 0.49 1.67 -0.08 0.00 -1.14 0.00 0.00 41.12 42.07 3k8t n ASP 656 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3k8t h GLU 657 N 0.00 -0.14 0.00 0.11 4.57 -1.99 0.16 114.58 117.29 3k8t h GLU 657 Ca -0.21 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.98 3k8t h GLU 657 Cb 1.02 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 3k8t h GLU 657 CO 0.30 -0.01 0.00 0.41 -1.18 0.00 0.00 179.01 178.53 3k8t n GLY 658 N -0.92 -0.07 0.03 1.92 0.00 -1.26 -0.57 105.19 104.32 3k8t n GLY 658 Ca -0.08 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.92 3k8t n GLY 658 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3k8t n MET 659 N -1.06 2.82 -0.34 1.61 0.00 -0.68 -4.55 117.12 114.93 3k8t n MET 659 Ca 0.00 -0.01 0.05 0.00 -0.00 0.00 0.00 57.70 57.74 3k8t n MET 659 Cb 0.00 -1.14 0.22 0.00 0.00 0.00 0.00 33.22 32.30 3k8t n MET 659 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 3k8t h LYS 660 N 0.00 1.03 -0.33 2.12 3.64 0.18 -3.19 116.57 120.02 3k8t h LYS 660 Ca -0.14 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.13 3k8t h LYS 660 Cb 1.24 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 3k8t h LYS 660 CO 0.01 0.68 0.00 0.37 -2.27 0.00 0.00 179.45 178.24 3k8t h GLN 661 N 1.06 0.59 -1.07 1.90 4.15 -1.55 -2.83 115.11 117.36 3k8t h GLN 661 Ca 0.43 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 59.67 3k8t h GLN 661 Cb 0.28 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.91 3k8t h GLN 661 CO -0.18 0.71 0.00 0.98 -1.93 0.00 0.00 178.83 178.41 3k8t n TYR 662 N -4.53 0.00 0.00 3.99 4.19 -1.20 0.02 117.16 119.62 3k8t n TYR 662 Ca -0.02 -0.15 0.00 0.00 3.31 0.00 0.00 57.90 61.04 3k8t n TYR 662 Cb 0.27 -0.12 0.00 0.00 0.49 0.00 0.00 39.34 39.97 3k8t n TYR 662 CO 0.00 0.00 0.00 -0.11 0.91 0.00 0.00 176.86 177.66 3k8t n LEU 663 N 0.53 1.02 0.31 2.98 7.94 -1.08 -4.24 117.00 124.46 3k8t n LEU 663 Ca 0.00 0.00 -0.17 0.00 -1.11 0.00 0.00 56.01 54.73 3k8t n LEU 663 Cb 0.20 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.07 3k8t n LEU 663 CO 0.00 0.09 0.64 0.16 -1.11 0.00 0.00 177.39 177.17 3k8t h ILE 664 N 0.00 0.44 0.00 1.96 3.07 -1.20 -1.58 117.51 120.20 3k8t h ILE 664 Ca 0.00 -0.10 -0.02 0.00 1.55 0.00 0.00 64.86 66.29 3k8t h ILE 664 Cb 0.55 0.48 -0.00 0.00 -0.27 0.00 0.00 36.82 37.58 3k8t h ILE 664 CO 0.00 0.02 -0.11 0.71 -1.05 0.00 0.00 178.15 177.71 3k8t h THR 665 N -0.81 0.35 -0.31 0.16 1.35 -0.70 -3.31 112.91 109.63 3k8t h THR 665 Ca -0.08 -0.70 -0.18 0.00 -0.55 0.00 0.00 66.41 64.90 3k8t h THR 665 Cb 0.60 1.52 -0.12 0.00 -1.73 0.00 0.00 68.15 68.43 3k8t h THR 665 CO 0.13 0.11 -0.26 0.00 -0.25 0.00 0.00 175.52 175.25 3k8t n GLN 666 N -3.34 1.97 -1.10 4.72 1.13 -1.21 -4.93 117.38 114.61 3k8t n GLN 666 Ca -0.00 -3.34 -0.04 0.00 -1.94 0.00 0.00 57.00 51.68 3k8t n GLN 666 Cb 0.32 -1.82 -0.02 0.00 0.11 0.00 0.00 30.24 28.83 3k8t n GLN 666 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3k8t n ASN 667 N -1.08 -3.69 -1.13 1.08 2.85 -1.22 -2.69 115.26 109.38 3k8t n ASN 667 Ca 0.31 0.09 -0.11 0.00 -0.11 0.00 0.00 54.58 54.76 3k8t n ASN 667 Cb 0.91 -1.50 -0.02 0.00 1.24 0.00 0.00 39.78 40.41 3k8t n ASN 667 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3k8t n GLY 668 N -2.20 0.37 3.63 8.20 0.00 -0.60 -4.71 105.19 109.87 3k8t n GLY 668 Ca -0.04 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.19 3k8t n GLY 668 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3k8t s SER 669 N -2.63 4.94 0.00 1.61 0.15 -1.10 -0.91 113.70 115.77 3k8t s SER 669 Ca 0.00 0.05 0.21 0.00 0.70 0.00 0.00 55.95 56.91 3k8t s SER 669 Cb 0.00 -1.35 0.18 0.00 -1.71 0.00 0.00 66.02 63.14 3k8t s SER 669 CO 0.00 0.36 1.17 2.30 1.20 0.00 0.00 173.24 178.27 3k8t n ILE 670 N 2.26 0.05 -1.24 6.45 -5.35 -1.26 -4.75 119.36 115.51 3k8t n ILE 670 Ca -0.18 -0.52 -0.32 0.00 -0.27 0.00 0.00 62.75 61.45 3k8t n ILE 670 Cb 0.53 1.39 0.10 0.00 -1.74 0.00 0.00 39.64 39.93 3k8t n ILE 670 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3k8t s GLN 671 N -1.70 2.00 0.00 6.28 -1.52 -1.26 -3.06 119.66 120.40 3k8t s GLN 671 Ca 0.25 1.44 0.00 0.00 -1.95 0.00 0.00 55.36 55.11 3k8t s GLN 671 Cb 0.18 -1.85 0.00 0.00 -0.22 0.00 0.00 33.01 31.12 3k8t s GLN 671 CO 0.26 -1.88 0.00 0.41 -0.25 0.00 0.00 175.29 173.84 3k8t n GLY 672 N -0.34 1.44 3.64 3.09 0.00 -1.26 -4.93 105.19 106.83 3k8t n GLY 672 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 3k8t n GLY 672 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k8t s LEU 673 N 0.00 3.97 0.26 0.99 0.20 -1.17 -4.92 118.68 118.01 3k8t s LEU 673 Ca 0.00 1.34 -0.04 0.00 0.69 0.00 0.00 54.13 56.12 3k8t s LEU 673 Cb 0.00 -3.54 0.52 0.00 -0.43 0.00 0.00 46.19 42.74 3k8t s LEU 673 CO 0.00 -0.97 1.65 -0.65 -0.29 0.00 0.00 176.35 176.10 3k8t h PRO 674 N 8.86 0.18 -0.83 0.98 0.11 -1.91 -3.15 132.00 136.25 3k8t h PRO 674 Ca -0.26 -0.01 -0.59 0.00 0.11 0.00 0.00 66.00 65.26 3k8t h PRO 674 Cb 1.10 -0.04 -0.39 0.00 0.11 0.00 0.00 31.00 31.77 3k8t h PRO 674 CO 1.01 0.12 -0.35 -1.71 -0.21 0.00 0.00 178.00 176.86 3k8t n ASN 675 N -5.25 5.70 -4.31 -2.05 2.85 -1.26 -4.93 115.26 106.02 3k8t n ASN 675 Ca 0.16 -3.76 -0.32 0.00 -0.11 0.00 0.00 54.58 50.55 3k8t n ASN 675 Cb 0.53 -0.52 -0.16 0.00 1.24 0.00 0.00 39.78 40.87 3k8t n ASN 675 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3k8t s VAL 676 N -4.67 2.33 0.52 3.44 1.01 -1.19 -4.96 120.40 116.87 3k8t s VAL 676 Ca 0.55 -0.96 -0.23 0.00 0.00 0.00 0.00 61.98 61.34 3k8t s VAL 676 Cb 0.44 -1.88 -0.06 0.00 0.00 0.00 0.00 36.38 34.88 3k8t s VAL 676 CO 0.02 0.57 1.38 -2.84 0.00 0.00 0.00 175.10 174.22 3k8t s PRO 677 N -0.12 3.30 0.48 2.72 0.02 -1.26 -4.89 135.00 135.26 3k8t s PRO 677 Ca -0.04 2.28 0.14 0.00 0.02 0.00 0.00 61.00 63.40 3k8t s PRO 677 Cb -0.14 -2.37 1.14 0.00 0.02 0.00 0.00 34.50 33.15 3k8t s PRO 677 CO 0.04 -1.07 2.09 0.37 -0.33 0.00 0.00 177.00 178.10 3k8t h GLN 678 N 1.71 0.19 -0.31 5.54 5.75 -1.99 -2.60 115.11 123.40 3k8t h GLN 678 Ca -0.51 -0.01 -0.09 0.00 -0.15 0.00 0.00 58.65 57.89 3k8t h GLN 678 Cb 1.29 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.78 3k8t h GLN 678 CO 0.58 0.13 -0.20 1.05 -2.65 0.00 0.00 178.83 177.75 3k8t h GLU 679 N 0.20 0.58 -0.15 1.69 -0.00 -2.00 -1.54 114.58 113.36 3k8t h GLU 679 Ca 0.10 -0.21 -0.02 0.00 -0.00 0.00 0.00 59.36 59.23 3k8t h GLU 679 Cb 0.14 -0.04 -0.01 0.00 -0.00 0.00 0.00 28.75 28.84 3k8t h GLU 679 CO -0.02 0.74 0.01 -0.07 -0.00 0.00 0.00 179.01 179.68 3k8t h LEU 680 N 0.52 0.25 -0.50 3.06 3.38 -1.85 -2.40 115.31 117.77 3k8t h LEU 680 Ca 0.08 -0.29 0.10 0.00 0.09 0.00 0.00 57.88 57.86 3k8t h LEU 680 Cb 0.63 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.23 3k8t h LEU 680 CO 0.04 0.48 0.03 0.11 0.09 0.00 0.00 178.44 179.19 3k8t h LYS 681 N 0.01 0.14 -0.67 1.13 1.57 -1.29 0.16 116.57 117.63 3k8t h LYS 681 Ca 0.04 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 3k8t h LYS 681 Cb 0.35 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 3k8t h LYS 681 CO 0.01 0.09 0.16 -0.44 -0.57 0.00 0.00 179.45 178.70 3k8t h ASP 682 N 0.14 1.01 -0.02 0.86 3.32 -1.27 -3.15 116.42 117.31 3k8t h ASP 682 Ca 0.26 -0.24 -0.16 0.00 0.02 0.00 0.00 57.03 56.90 3k8t h ASP 682 Cb 0.38 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 3k8t h ASP 682 CO -0.40 0.99 -0.55 0.25 -1.72 0.00 0.00 179.24 177.81 3k8t h LEU 683 N 1.00 0.68 -4.24 1.55 5.85 -0.82 -3.28 115.31 116.04 3k8t h LEU 683 Ca 0.21 -0.36 -0.66 0.00 0.84 0.00 0.00 57.88 57.90 3k8t h LEU 683 Cb 0.37 -0.19 -0.33 0.00 0.37 0.00 0.00 40.66 40.88 3k8t h LEU 683 CO 0.00 1.09 0.37 -1.22 -0.34 0.00 0.00 178.44 178.34 3k8t n TYR 684 N -3.97 3.09 -2.36 1.25 4.02 0.50 -4.66 117.16 115.04 3k8t n TYR 684 Ca -0.03 -2.70 -0.39 0.00 -0.01 0.00 0.00 57.90 54.76 3k8t n TYR 684 Cb 0.61 -0.99 -0.03 0.00 -0.02 0.00 0.00 39.34 38.90 3k8t n TYR 684 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3k8t s LYS 685 N -3.81 4.37 0.50 -0.72 1.02 -1.20 -4.61 119.74 115.29 3k8t s LYS 685 Ca 0.57 1.87 -0.02 0.00 0.02 0.00 0.00 55.97 58.40 3k8t s LYS 685 Cb 0.46 -2.96 -0.00 0.00 -0.52 0.00 0.00 37.83 34.81 3k8t s LYS 685 CO -0.12 -0.05 0.76 0.99 -0.92 0.00 0.00 175.35 176.01 3k8t s THR 686 N -1.28 4.03 0.37 2.17 2.01 -1.26 -4.58 115.64 117.11 3k8t s THR 686 Ca 0.50 -0.25 0.17 0.00 0.31 0.00 0.00 61.69 62.42 3k8t s THR 686 Cb -0.32 -3.53 0.15 0.00 0.01 0.00 0.00 72.50 68.81 3k8t s THR 686 CO 0.41 -0.45 1.90 1.62 -0.69 0.00 0.00 174.62 177.42 3k8t h VAL 687 N 0.20 1.06 0.00 3.82 3.04 -1.11 -0.19 116.25 123.07 3k8t h VAL 687 Ca -0.46 -1.02 0.00 0.00 -1.01 0.00 0.00 66.70 64.21 3k8t h VAL 687 Cb 1.25 1.57 0.00 0.00 -2.01 0.00 0.00 31.29 32.10 3k8t h VAL 687 CO 0.59 0.28 0.00 0.79 -1.01 0.00 0.00 177.57 178.22 3k8t n TRP 688 N -3.99 0.00 0.24 3.17 7.02 -1.26 -3.04 117.44 119.58 3k8t n TRP 688 Ca -0.02 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.51 3k8t n TRP 688 Cb 0.35 -0.39 0.06 0.00 -2.42 0.00 0.00 31.31 28.91 3k8t n TRP 688 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 3k8t n GLU 689 N -1.39 0.95 -4.59 -0.99 1.02 -0.10 -4.83 120.64 110.72 3k8t n GLU 689 Ca 0.05 -1.28 -0.34 0.00 -0.02 0.00 0.00 57.16 55.58 3k8t n GLU 689 Cb 0.13 -1.19 -0.12 0.00 -0.02 0.00 0.00 31.44 30.25 3k8t n GLU 689 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3k8t s ILE 690 N -0.82 3.63 0.33 -3.67 1.01 -1.12 -4.85 121.20 115.71 3k8t s ILE 690 Ca 0.13 -0.48 -0.29 0.00 0.00 0.00 0.00 60.65 60.01 3k8t s ILE 690 Cb 0.08 -2.53 -0.10 0.00 0.01 0.00 0.00 42.46 39.92 3k8t s ILE 690 CO 0.12 0.55 1.38 -0.94 0.00 0.00 0.00 174.94 176.05 3k8t s SER 691 N -0.21 6.63 0.36 3.58 1.04 -1.26 -4.87 113.70 118.97 3k8t s SER 691 Ca 0.03 2.79 0.27 0.00 0.48 0.00 0.00 55.95 59.51 3k8t s SER 691 Cb -0.13 -2.65 0.91 0.00 0.10 0.00 0.00 66.02 64.25 3k8t s SER 691 CO 0.03 -0.65 1.78 1.56 0.98 0.00 0.00 173.24 176.93 3k8t h GLN 692 N 3.52 0.00 -0.52 4.02 1.08 -1.92 -2.00 115.11 119.29 3k8t h GLN 692 Ca -0.49 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 56.59 3k8t h GLN 692 Cb 1.23 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.64 3k8t h GLN 692 CO 0.67 0.00 -0.13 0.87 -0.95 0.00 0.00 178.83 179.29 3k8t h LYS 693 N 0.00 1.01 -0.50 1.46 1.79 -1.98 0.55 116.57 118.90 3k8t h LYS 693 Ca 0.00 -0.39 -0.02 0.00 -2.18 0.00 0.00 60.65 58.06 3k8t h LYS 693 Cb 0.63 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.20 3k8t h LYS 693 CO 0.00 1.07 0.23 1.15 -1.08 0.00 0.00 179.45 180.82 3k8t h THR 694 N 0.88 1.20 -0.15 -0.16 2.02 -1.81 0.44 112.91 115.33 3k8t h THR 694 Ca 0.13 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.74 3k8t h THR 694 Cb 0.70 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 3k8t h THR 694 CO 0.05 0.23 0.05 0.40 0.37 0.00 0.00 175.52 176.62 3k8t h ILE 695 N 0.67 0.97 -0.78 3.11 1.08 -1.06 -0.89 117.51 120.60 3k8t h ILE 695 Ca 0.17 -0.04 -0.03 0.00 -0.39 0.00 0.00 64.86 64.57 3k8t h ILE 695 Cb 0.15 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 34.69 3k8t h ILE 695 CO -0.02 0.02 0.37 0.40 -0.69 0.00 0.00 178.15 178.23 3k8t h ILE 696 N 0.13 1.25 -0.30 -0.67 1.08 0.33 -1.23 117.51 118.09 3k8t h ILE 696 Ca 0.06 -0.72 -0.01 0.00 -0.39 0.00 0.00 64.86 63.81 3k8t h ILE 696 Cb 0.04 0.27 -0.01 0.00 -3.07 0.00 0.00 36.82 34.05 3k8t h ILE 696 CO -0.07 0.30 0.15 0.78 -0.69 0.00 0.00 178.15 178.62 3k8t h ASN 697 N 1.11 0.39 -0.03 1.72 2.35 0.29 -0.07 115.58 121.35 3k8t h ASN 697 Ca 0.27 -0.12 -0.10 0.00 -0.55 0.00 0.00 56.30 55.79 3k8t h ASN 697 Cb 0.14 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 3k8t h ASN 697 CO -0.03 0.40 -0.29 0.24 -1.65 0.00 0.00 177.43 176.10 3k8t h MET 698 N 0.35 0.47 -0.52 0.81 2.86 -1.09 0.05 114.93 117.86 3k8t h MET 698 Ca 0.10 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.52 3k8t h MET 698 Cb 0.11 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 3k8t h MET 698 CO -0.01 0.72 0.19 0.00 1.06 0.00 0.00 176.91 178.87 3k8t h ALA 699 N 1.27 0.68 -0.52 6.32 0.00 -0.89 -1.16 119.26 124.96 3k8t h ALA 699 Ca 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3k8t h ALA 699 Cb 0.73 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3k8t h ALA 699 CO 0.06 0.31 0.26 0.00 0.00 0.00 0.00 179.25 179.87 3k8t h ALA 700 N 1.04 0.67 -0.01 0.00 0.00 -0.65 -1.32 119.26 119.00 3k8t h ALA 700 Ca 0.17 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.99 3k8t h ALA 700 Cb 0.22 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3k8t h ALA 700 CO -0.01 0.22 -0.12 -0.44 0.00 0.00 0.00 179.25 178.90 3k8t h ASP 701 N 0.69 -0.34 0.50 0.00 3.32 -0.78 -2.75 116.42 117.07 3k8t h ASP 701 Ca 0.18 0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.21 3k8t h ASP 701 Cb 0.10 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 3k8t h ASP 701 CO -0.02 -0.17 -0.32 0.08 -1.72 0.00 0.00 179.24 177.09 3k8t h ARG 702 N -0.20 0.00 0.00 3.56 0.11 -1.14 -3.21 114.38 113.51 3k8t h ARG 702 Ca 0.04 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.12 3k8t h ARG 702 Cb 0.25 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.33 3k8t h ARG 702 CO -0.12 0.32 -0.00 0.77 0.10 0.00 0.00 179.97 181.04 3k8t h SER 703 N 0.00 0.00 0.83 0.08 0.02 -0.92 -1.28 113.55 112.29 3k8t h SER 703 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3k8t h SER 703 Cb 0.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.20 3k8t h SER 703 CO 0.04 0.00 0.00 -0.37 -1.14 0.00 0.00 176.83 175.36 3k8t h VAL 704 N 0.00 0.00 -0.25 2.27 -1.51 -1.64 -2.14 116.25 112.98 3k8t h VAL 704 Ca -0.00 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 3k8t h VAL 704 Cb 0.15 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 3k8t h VAL 704 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.12 3k8t n TYR 705 N -2.33 0.55 -3.98 5.19 4.02 -0.48 -1.42 117.16 118.71 3k8t n TYR 705 Ca 0.02 -0.68 -0.31 0.00 -0.01 0.00 0.00 57.90 56.93 3k8t n TYR 705 Cb 0.26 -0.15 -0.14 0.00 -0.02 0.00 0.00 39.34 39.29 3k8t n TYR 705 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3k8t s ILE 706 N -1.83 2.47 0.07 -0.72 1.01 -0.80 -4.67 121.20 116.73 3k8t s ILE 706 Ca 0.28 -2.81 -0.02 0.00 0.00 0.00 0.00 60.65 58.11 3k8t s ILE 706 Cb 0.20 -2.77 0.11 0.00 0.01 0.00 0.00 42.46 40.01 3k8t s ILE 706 CO 0.10 -0.70 0.37 0.47 0.00 0.00 0.00 174.94 175.19 3k8t n ASP 707 N 3.71 -0.08 0.00 3.58 8.00 -1.26 -4.64 116.55 125.86 3k8t n ASP 707 Ca 0.04 0.41 0.00 0.00 0.71 0.00 0.00 54.79 55.95 3k8t n ASP 707 Cb 0.37 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 3k8t n ASP 707 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k8t n GLN 708 N -4.37 0.00 -1.28 -1.24 6.02 -0.92 -4.60 117.38 110.99 3k8t n GLN 708 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 3k8t n GLN 708 Cb 0.12 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.38 3k8t n GLN 708 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3k8t n SER 709 N 0.00 0.55 -3.81 1.08 2.88 0.60 -4.87 113.62 110.04 3k8t n SER 709 Ca 0.00 -0.64 -0.12 0.00 -1.33 0.00 0.00 58.87 56.78 3k8t n SER 709 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 3k8t n SER 709 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 3k8t s HIS 710 N -1.27 -0.15 -1.16 0.66 -3.43 -1.26 -3.55 115.29 105.13 3k8t s HIS 710 Ca 0.00 0.33 -0.22 0.00 -0.80 0.00 0.00 55.06 54.37 3k8t s HIS 710 Cb 0.00 0.05 -0.07 0.00 -1.43 0.00 0.00 32.58 31.12 3k8t s HIS 710 CO 0.00 -0.22 1.91 0.43 -2.00 0.00 0.00 174.74 174.86 3k8t n SER 711 N 2.22 3.28 -4.49 7.38 7.64 -1.17 -4.68 113.62 123.81 3k8t n SER 711 Ca -0.17 -2.73 -0.43 0.00 1.01 0.00 0.00 58.87 56.55 3k8t n SER 711 Cb 0.57 -1.67 -0.03 0.00 -1.01 0.00 0.00 64.21 62.07 3k8t n SER 711 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3k8t s LEU 712 N 8.90 4.50 0.55 -3.43 0.20 -1.26 -4.86 118.68 123.27 3k8t s LEU 712 Ca 0.65 -1.77 -0.21 0.00 0.69 0.00 0.00 54.13 53.49 3k8t s LEU 712 Cb 0.02 -2.46 -0.05 0.00 -0.43 0.00 0.00 46.19 43.28 3k8t s LEU 712 CO 0.12 -1.24 1.29 0.20 -0.29 0.00 0.00 176.35 176.43 3k8t s ASN 713 N 4.06 5.37 0.01 3.68 0.02 -1.26 -1.80 114.94 125.02 3k8t s ASN 713 Ca 0.36 2.60 0.07 0.00 -1.02 0.00 0.00 52.86 54.87 3k8t s ASN 713 Cb -0.04 -2.62 -0.03 0.00 0.02 0.00 0.00 41.25 38.58 3k8t s ASN 713 CO -0.08 -1.49 -0.22 -0.76 0.02 0.00 0.00 177.10 174.57 3k8t s LEU 714 N -3.59 2.34 -0.27 0.60 1.02 0.04 -4.91 118.68 113.91 3k8t s LEU 714 Ca 0.72 -0.45 0.01 0.00 0.02 0.00 0.00 54.13 54.43 3k8t s LEU 714 Cb -0.36 -1.40 0.08 0.00 0.02 0.00 0.00 46.19 44.52 3k8t s LEU 714 CO 0.42 0.29 0.02 -0.36 0.02 0.00 0.00 176.35 176.74 3k8t s PHE 715 N -0.77 2.35 -0.18 0.29 0.40 -1.26 -0.94 117.98 117.87 3k8t s PHE 715 Ca 0.12 -1.91 -0.02 0.00 -0.60 0.00 0.00 56.93 54.52 3k8t s PHE 715 Cb -0.10 -1.83 -0.00 0.00 0.51 0.00 0.00 43.02 41.60 3k8t s PHE 715 CO 0.02 -0.82 -0.11 -0.51 0.70 0.00 0.00 175.22 174.50 3k8t s LEU 716 N 1.40 2.65 -0.10 -0.37 1.43 -0.59 -4.82 118.68 118.29 3k8t s LEU 716 Ca 0.02 -0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 52.56 3k8t s LEU 716 Cb -0.18 -1.64 -0.10 0.00 0.03 0.00 0.00 46.19 44.29 3k8t s LEU 716 CO -0.12 0.04 0.40 -0.09 0.23 0.00 0.00 176.35 176.81 3k8t h ARG 717 N 7.66 -0.07 -2.68 1.70 2.43 -1.88 -2.95 114.38 118.59 3k8t h ARG 717 Ca -0.38 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.15 3k8t h ARG 717 Cb 1.17 0.02 -0.40 0.00 -0.42 0.00 0.00 29.97 30.34 3k8t h ARG 717 CO 0.60 0.30 -0.36 0.00 -1.51 0.00 0.00 179.97 178.99 3k8t n ALA 718 N -2.69 3.97 -2.68 2.80 0.00 -1.26 -3.46 120.51 117.19 3k8t n ALA 718 Ca -0.05 -4.69 -0.43 0.00 0.00 0.00 0.00 53.44 48.28 3k8t n ALA 718 Cb 0.19 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.41 3k8t n ALA 718 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3k8t s PRO 719 N -2.08 4.38 0.23 0.00 0.04 -1.26 -5.01 135.00 131.30 3k8t s PRO 719 Ca 0.33 1.36 0.11 0.00 0.04 0.00 0.00 61.00 62.84 3k8t s PRO 719 Cb 0.05 -3.56 -0.05 0.00 0.04 0.00 0.00 34.50 30.98 3k8t s PRO 719 CO -0.06 -0.38 -0.20 0.95 0.04 0.00 0.00 177.00 177.35 3k8t s THR 720 N 2.26 2.25 0.36 1.26 -4.23 -1.26 -5.04 115.64 111.24 3k8t s THR 720 Ca 0.47 -2.20 0.04 0.00 -1.18 0.00 0.00 61.69 58.82 3k8t s THR 720 Cb -0.17 -2.15 0.28 0.00 1.34 0.00 0.00 72.50 71.80 3k8t s THR 720 CO 0.15 -0.33 1.98 0.24 -0.54 0.00 0.00 174.62 176.12 3k8t h MET 721 N 2.72 0.77 -0.26 3.99 2.86 -1.96 -2.14 114.93 120.93 3k8t h MET 721 Ca -0.42 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.11 3k8t h MET 721 Cb 1.23 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 3k8t h MET 721 CO 0.55 0.51 -0.09 0.78 1.06 0.00 0.00 176.91 179.73 3k8t h GLY 722 N 0.80 0.55 1.01 8.32 0.00 -1.99 -1.82 103.07 109.93 3k8t h GLY 722 Ca 0.28 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 3k8t h GLY 722 CO -0.08 0.43 0.40 1.70 0.00 0.00 0.00 176.54 178.99 3k8t h LYS 723 N 0.25 1.05 -0.38 4.80 1.63 -1.87 -2.40 116.57 119.64 3k8t h LYS 723 Ca 0.06 -0.13 -0.10 0.00 -0.85 0.00 0.00 60.65 59.64 3k8t h LYS 723 Cb 0.57 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.99 3k8t h LYS 723 CO 0.03 0.78 -0.14 1.25 -3.45 0.00 0.00 179.45 177.92 3k8t h LEU 724 N 1.03 0.78 -0.50 5.20 6.46 -1.37 -2.38 115.31 124.54 3k8t h LEU 724 Ca 0.26 -0.39 0.07 0.00 -0.12 0.00 0.00 57.88 57.71 3k8t h LEU 724 Cb 0.04 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 39.70 3k8t h LEU 724 CO -0.04 0.99 0.15 0.74 -0.62 0.00 0.00 178.44 179.66 3k8t h THR 725 N 0.56 0.79 -0.83 1.05 2.02 -1.20 -1.67 112.91 113.64 3k8t h THR 725 Ca 0.09 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 3k8t h THR 725 Cb 0.68 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 3k8t h THR 725 CO 0.05 0.06 0.48 0.77 0.37 0.00 0.00 175.52 177.24 3k8t h SER 726 N 0.31 1.01 -0.08 4.18 4.64 -1.04 -0.70 113.55 121.87 3k8t h SER 726 Ca 0.24 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3k8t h SER 726 Cb 0.28 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3k8t h SER 726 CO -0.27 0.79 0.04 0.24 -0.87 0.00 0.00 176.83 176.76 3k8t h MET 727 N 1.14 0.11 -0.37 4.77 2.07 -1.20 0.61 114.93 122.06 3k8t h MET 727 Ca 0.29 -0.01 0.02 0.00 -2.07 0.00 0.00 59.70 57.93 3k8t h MET 727 Cb -0.01 -0.02 -0.03 0.00 -1.87 0.00 0.00 31.60 29.67 3k8t h MET 727 CO -0.05 0.17 0.21 0.45 1.07 0.00 0.00 176.91 178.77 3k8t h HIS 728 N 0.02 0.40 -0.23 -0.22 3.86 -0.99 -2.53 115.15 115.45 3k8t h HIS 728 Ca 0.03 0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.10 3k8t h HIS 728 Cb 0.10 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 3k8t h HIS 728 CO -0.04 0.23 -0.46 0.74 0.86 0.00 0.00 177.93 179.26 3k8t h PHE 729 N 0.43 0.73 -0.21 2.45 -1.00 -0.85 -0.60 116.94 117.90 3k8t h PHE 729 Ca 0.15 -0.23 0.03 0.00 2.81 0.00 0.00 57.97 60.72 3k8t h PHE 729 Cb 0.01 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.40 3k8t h PHE 729 CO -0.08 0.95 0.05 -0.92 -1.61 0.00 0.00 178.31 176.70 3k8t h TYR 730 N 0.48 0.09 0.02 -0.55 3.20 0.34 -0.78 116.97 119.77 3k8t h TYR 730 Ca 0.03 0.01 -0.23 0.00 3.14 0.00 0.00 58.73 61.68 3k8t h TYR 730 Cb 0.98 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.25 3k8t h TYR 730 CO 0.04 0.03 -0.98 0.78 -1.64 0.00 0.00 178.16 176.40 3k8t h GLY 731 N 0.14 0.41 0.13 1.82 0.00 -1.32 -1.12 103.07 103.14 3k8t h GLY 731 Ca 0.09 -0.76 0.04 0.00 0.00 0.00 0.00 47.33 46.70 3k8t h GLY 731 CO -0.11 0.67 -0.36 -0.25 0.00 0.00 0.00 176.54 176.49 3k8t h TRP 732 N 0.20 -1.01 0.00 5.60 7.01 -1.06 -0.72 115.95 125.96 3k8t h TRP 732 Ca -0.08 0.04 -0.06 0.00 2.11 0.00 0.00 58.89 60.90 3k8t h TRP 732 Cb 1.63 0.46 -0.01 0.00 -2.10 0.00 0.00 29.16 29.14 3k8t h TRP 732 CO 0.06 -0.44 -0.28 0.87 -2.79 0.00 0.00 178.44 175.86 3k8t h LYS 733 N -0.46 0.00 0.00 2.65 1.57 -1.09 -1.24 116.57 118.00 3k8t h LYS 733 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3k8t h LYS 733 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 3k8t h LYS 733 CO -0.35 0.28 0.00 1.63 -0.57 0.00 0.00 179.45 180.44 3k8t n LYS 734 N -3.66 0.15 -0.49 3.15 4.76 -0.43 -4.87 118.16 116.77 3k8t n LYS 734 Ca -0.01 0.52 0.00 0.00 -2.87 0.00 0.00 58.31 55.95 3k8t n LYS 734 Cb 0.39 -1.88 0.00 0.00 -1.84 0.00 0.00 35.03 31.71 3k8t n LYS 734 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3k8t n GLY 735 N -0.65 0.72 3.77 0.72 0.00 -0.47 -4.98 105.19 104.30 3k8t n GLY 735 Ca 0.00 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 3k8t n GLY 735 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k8t s LEU 736 N 0.00 4.16 -0.10 0.99 1.43 -0.34 -4.94 118.68 119.88 3k8t s LEU 736 Ca 0.00 2.87 -0.01 0.00 -1.03 0.00 0.00 54.13 55.95 3k8t s LEU 736 Cb 0.00 -3.90 -0.00 0.00 0.03 0.00 0.00 46.19 42.32 3k8t s LEU 736 CO 0.00 -1.06 -0.03 0.11 0.23 0.00 0.00 176.35 175.60 3k8t h LYS 737 N 2.48 0.00 -5.20 1.70 1.57 -1.88 -3.42 116.57 111.82 3k8t h LYS 737 Ca -0.51 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.62 3k8t h LYS 737 Cb 1.26 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 33.41 3k8t h LYS 737 CO 0.62 0.00 0.32 0.99 -0.57 0.00 0.00 179.45 180.81 3k8t s THR 738 N -1.64 4.59 0.22 -0.16 2.01 -1.26 0.19 115.64 119.58 3k8t s THR 738 Ca -0.02 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 61.57 3k8t s THR 738 Cb 0.00 -4.52 -0.07 0.00 0.01 0.00 0.00 72.50 67.92 3k8t s THR 738 CO 0.03 -1.17 1.51 1.23 -0.69 0.00 0.00 174.62 175.54 3k8t h GLY 739 N 10.56 0.23 -5.04 4.40 0.00 -1.22 -3.44 103.07 108.55 3k8t h GLY 739 Ca -0.28 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 3k8t h GLY 739 CO 1.10 0.29 0.04 -0.29 0.00 0.00 0.00 176.54 177.67 3k8t s MET 740 N -3.60 0.74 0.00 4.80 1.75 -0.60 -4.95 119.30 117.44 3k8t s MET 740 Ca -0.03 1.07 0.00 0.00 -1.25 0.00 0.00 55.69 55.48 3k8t s MET 740 Cb 0.11 0.26 0.00 0.00 2.84 0.00 0.00 34.83 38.04 3k8t s MET 740 CO 0.80 -0.12 0.00 0.98 -0.65 0.00 0.00 175.02 176.03 3k8t n TYR 741 N 3.51 0.00 -2.67 4.11 9.36 -0.74 0.04 117.16 130.77 3k8t n TYR 741 Ca -0.17 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.72 3k8t n TYR 741 Cb 0.57 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 39.22 3k8t n TYR 741 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 3k8t s TYR 742 N 2.47 3.34 -0.31 2.98 2.02 -1.26 -4.43 117.35 122.16 3k8t s TYR 742 Ca 0.00 1.56 -0.12 0.00 -0.37 0.00 0.00 57.07 58.14 3k8t s TYR 742 Cb 0.00 -2.84 -0.03 0.00 -0.40 0.00 0.00 41.96 38.69 3k8t s TYR 742 CO 0.00 -0.22 0.22 -1.17 -1.57 0.00 0.00 175.55 172.81 3k8t s LEU 743 N -3.49 4.26 -0.13 -1.29 0.20 -0.91 -0.78 118.68 116.54 3k8t s LEU 743 Ca 0.61 -0.19 -0.04 0.00 0.69 0.00 0.00 54.13 55.20 3k8t s LEU 743 Cb -0.10 -2.15 -0.04 0.00 -0.43 0.00 0.00 46.19 43.48 3k8t s LEU 743 CO 0.19 -0.15 0.03 -0.13 -0.29 0.00 0.00 176.35 176.01 3k8t s ARG 744 N 1.76 3.44 0.43 1.98 1.81 -0.12 -4.23 118.95 124.03 3k8t s ARG 744 Ca 0.07 -0.36 0.03 0.00 -1.72 0.00 0.00 55.73 53.75 3k8t s ARG 744 Cb -0.17 -2.99 -0.02 0.00 -0.45 0.00 0.00 34.95 31.32 3k8t s ARG 744 CO 0.11 0.52 0.10 -0.08 -0.68 0.00 0.00 175.30 175.27 3k8t s THR 745 N -0.36 0.74 0.00 0.02 -1.32 -1.26 -1.55 115.64 111.91 3k8t s THR 745 Ca 0.08 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.56 3k8t s THR 745 Cb -0.12 -2.31 0.00 0.00 -1.51 0.00 0.00 72.50 68.56 3k8t s THR 745 CO 0.02 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.43