# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 81.92 11.30 15.74 27.38 117.77 -164.92 -102.97 133.20 99.83 0.17 0.00 99.85 0.04 0.01 0.00 0.00 0.00 0.11 0.00 1 E E E 104.65 8.18 16.90 26.14 121.06 -158.61 -108.75 135.14 41.56 58.37 0.06 40.39 0.71 0.13 0.01 0.04 0.00 58.09 0.63 2 V E E 29.37 17.36 14.31 31.81 125.95 -169.17 -121.60 140.09 12.33 87.64 0.03 11.05 0.77 0.06 0.00 0.01 0.00 87.93 0.17 3 T E E 57.59 10.22 21.83 32.45 127.30 -167.26 -124.79 141.20 2.89 97.10 0.01 2.71 0.12 0.01 0.00 0.00 0.00 97.09 0.07 4 A E E 12.30 21.24 16.31 37.30 130.93 -173.76 -133.67 146.69 2.15 97.84 0.01 1.99 0.11 0.01 0.00 0.00 0.00 97.85 0.03 5 K E E 98.04 8.41 24.36 33.41 122.74 -157.27 -121.07 131.66 2.03 97.96 0.01 1.85 0.12 0.01 0.00 0.00 0.00 97.95 0.06 6 L E E 22.17 21.84 14.75 36.21 118.23 -164.10 -113.80 125.34 6.68 93.26 0.06 6.46 0.30 0.05 0.02 0.02 0.00 92.89 0.25 7 R E E 130.53 5.49 21.95 28.44 124.11 -166.46 -108.80 142.92 19.12 80.57 0.31 8.58 6.16 5.43 0.04 0.27 0.00 79.17 0.33 8 G E E 45.01 5.59 21.94 27.91 95.89 16.69 75.07 15.16 36.97 62.82 0.21 12.53 17.40 7.51 0.01 0.23 0.00 61.89 0.43 9 A E E 12.51 22.10 13.62 35.27 114.63 155.03 -79.28 133.74 37.58 62.07 0.35 33.84 3.11 0.45 0.10 0.25 0.00 60.28 1.97 10 A C E 64.94 6.70 25.22 32.26 111.11 -139.74 -88.93 120.31 50.55 49.22 0.22 42.72 6.59 0.61 0.09 0.16 0.00 45.60 4.23 11 I C C 14.12 23.53 13.53 36.71 129.58 169.43 -127.06 146.13 85.36 14.46 0.18 78.17 7.29 0.22 0.10 0.08 0.00 12.09 2.04 12 S C C 45.21 5.49 23.97 29.40 120.08 -113.98 -75.74 157.65 96.71 3.07 0.22 96.65 0.54 0.07 0.17 0.02 0.00 2.06 0.49 13 A H H 42.32 15.80 15.35 30.87 91.85 -112.65 -58.90 -37.67 1.66 0.00 98.33 0.25 0.19 0.98 98.21 0.37 0.00 0.00 0.00 14 Q H H 118.64 2.31 23.03 24.89 91.54 53.55 -63.46 -39.92 0.78 0.00 99.22 0.08 0.05 0.51 99.01 0.34 0.00 0.00 0.00 15 K H H 68.11 12.33 21.51 33.63 91.91 48.06 -66.61 -39.07 0.44 0.00 99.56 0.07 0.03 0.25 99.33 0.32 0.00 0.00 0.00 16 A H H 1.68 26.75 15.96 43.47 90.79 52.63 -62.74 -42.58 0.15 0.00 99.85 0.02 0.01 0.07 99.86 0.04 0.00 0.00 0.00 17 R H H 104.37 10.74 24.01 34.47 91.24 51.93 -62.67 -41.31 0.10 0.00 99.90 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 18 L H H 69.96 5.40 26.33 32.13 91.45 50.64 -63.66 -42.34 0.12 0.00 99.88 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 19 V H H 4.49 23.76 21.74 45.20 91.85 48.68 -64.15 -43.69 0.17 0.00 99.83 0.01 0.00 0.12 99.82 0.04 0.00 0.00 0.00 20 A H H 3.71 25.07 19.22 44.27 91.06 51.61 -62.63 -41.30 0.27 0.00 99.73 0.01 0.01 0.20 99.60 0.17 0.00 0.00 0.00 21 D H H 88.38 4.60 25.52 30.74 91.19 53.20 -64.84 -35.60 1.79 0.00 98.21 0.04 0.04 1.78 96.97 1.17 0.00 0.00 0.00 22 L H H 64.99 10.72 23.11 33.94 91.41 54.73 -70.20 -26.26 6.86 0.00 93.14 0.06 0.11 7.56 90.85 1.41 0.00 0.00 0.00 23 I H H 2.67 26.16 15.00 42.19 95.75 47.46 -90.71 -13.90 31.79 0.05 68.15 1.10 1.40 29.08 66.28 2.04 0.03 0.02 0.05 24 R C T 103.71 13.65 17.09 30.95 112.49 115.36 -62.15 132.23 98.64 0.10 1.25 0.34 0.67 97.95 0.81 0.11 0.00 0.03 0.10 25 G C T 54.86 2.51 21.11 23.94 94.30 18.19 84.30 -2.82 99.83 0.01 0.16 0.15 0.90 98.83 0.08 0.03 0.00 0.00 0.00 26 K C S 63.28 13.18 15.68 29.48 123.47 123.74 -86.16 153.57 99.64 0.34 0.02 44.90 54.69 0.15 0.00 0.00 0.00 0.13 0.12 27 S E B 42.54 6.44 24.02 30.97 118.00 -105.33 -70.54 154.13 7.29 92.69 0.02 5.59 0.09 0.00 0.02 0.00 0.00 4.25 90.05 28 V H H 8.46 24.61 14.60 39.63 90.91 -111.37 -57.86 -39.42 0.60 0.00 99.40 0.06 0.04 0.42 99.02 0.46 0.00 0.00 0.00 29 A H H 55.57 7.65 22.86 30.88 91.46 53.97 -62.75 -41.01 0.21 0.00 99.79 0.01 0.01 0.16 99.44 0.38 0.00 0.00 0.00 30 H H H 101.39 3.90 25.41 29.05 91.74 47.80 -65.79 -40.06 0.12 0.00 99.88 0.01 0.00 0.08 99.49 0.41 0.00 0.00 0.00 31 A H H 2.66 23.90 17.13 41.45 91.42 51.24 -63.70 -43.32 0.17 0.00 99.83 0.02 0.01 0.09 99.70 0.18 0.00 0.00 0.00 32 L H H 26.01 19.28 20.16 38.66 91.38 51.15 -62.66 -41.80 0.38 0.00 99.62 0.02 0.01 0.27 99.29 0.40 0.00 0.00 0.00 33 N H H 96.04 2.54 25.76 27.42 91.56 51.08 -63.92 -40.90 1.30 0.00 98.70 0.05 0.04 1.17 97.28 1.46 0.00 0.00 0.00 34 I H H 42.92 12.34 21.25 34.02 91.79 49.93 -64.88 -41.10 2.57 0.00 97.43 0.11 0.10 2.22 94.03 3.54 0.00 0.00 0.00 35 L H H 3.50 25.95 14.37 40.68 91.48 52.01 -68.73 -31.47 8.25 0.03 91.72 0.81 0.57 6.41 82.52 9.65 0.01 0.01 0.01 36 N H H 87.55 9.49 19.45 29.44 91.51 68.53 -67.37 -20.87 47.08 0.11 52.81 2.15 1.73 42.95 45.76 7.26 0.02 0.05 0.09 37 F C T 137.49 3.63 19.89 23.70 94.42 56.81 -89.82 -4.53 68.09 0.16 31.74 4.34 5.03 58.35 25.21 6.83 0.01 0.07 0.15 38 S C S 24.90 17.42 9.68 26.45 119.46 95.92 -85.15 144.24 97.18 0.63 2.19 45.43 48.69 3.02 1.71 0.45 0.00 0.16 0.56 39 N C C 129.82 1.93 18.50 20.57 96.81 -144.22 -86.79 10.75 98.41 0.78 0.80 72.63 23.08 2.65 0.42 0.32 0.00 0.25 0.66 40 K C S 85.76 10.11 14.32 25.60 119.26 112.29 -83.09 147.47 80.71 0.82 18.47 24.32 51.44 3.32 19.44 0.62 0.01 0.14 0.72 41 K H H 125.83 4.63 21.43 27.07 93.40 -117.80 -61.88 -37.26 19.48 0.03 80.49 1.02 2.09 15.89 77.94 3.01 0.02 0.01 0.03 42 A H H 9.04 20.83 18.28 38.81 91.52 52.82 -65.12 -37.18 13.08 0.03 86.89 1.32 0.90 10.40 84.30 3.05 0.01 0.01 0.01 43 A H H 6.95 20.20 18.82 39.25 91.37 54.69 -62.71 -40.95 1.11 0.00 98.89 0.33 0.11 0.50 97.94 1.12 0.00 0.00 0.00 44 V H H 69.50 5.54 26.90 32.84 91.54 51.40 -63.64 -41.87 0.24 0.00 99.76 0.05 0.02 0.12 99.63 0.19 0.00 0.00 0.00 45 L H H 25.09 15.13 24.34 39.47 91.42 50.25 -64.27 -42.71 0.11 0.00 99.89 0.02 0.00 0.07 99.85 0.07 0.00 0.00 0.00 46 V H H 0.94 27.95 21.53 50.01 91.11 49.54 -63.71 -43.54 0.05 0.00 99.95 0.01 0.00 0.03 99.95 0.02 0.00 0.00 0.00 47 K H H 65.51 15.93 25.23 39.77 91.16 51.13 -62.24 -42.38 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 48 K H H 102.57 4.38 28.63 33.53 91.48 49.88 -64.13 -41.44 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 49 A H H 5.46 20.80 22.88 43.56 91.41 49.84 -63.83 -43.60 0.06 0.00 99.94 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 50 L H H 2.88 26.36 21.99 48.23 91.23 48.93 -63.67 -43.00 0.10 0.00 99.90 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 51 E H H 94.35 7.37 27.25 35.27 91.56 49.93 -63.92 -41.79 0.15 0.00 99.85 0.01 0.00 0.10 99.87 0.02 0.00 0.00 0.00 52 S H H 40.38 7.05 26.52 34.45 91.63 49.68 -64.50 -41.84 0.34 0.00 99.65 0.03 0.02 0.24 99.68 0.04 0.00 0.00 0.00 53 A H H 3.46 23.20 20.66 43.90 91.67 50.05 -64.15 -42.82 0.47 0.00 99.53 0.06 0.03 0.31 99.51 0.09 0.00 0.00 0.00 54 I H H 29.38 17.67 22.44 39.43 91.49 49.61 -63.14 -42.72 0.52 0.00 99.48 0.07 0.04 0.34 99.39 0.17 0.00 0.00 0.00 55 A H H 52.70 3.28 25.46 28.11 91.34 50.26 -63.10 -42.36 1.33 0.00 98.67 0.14 0.07 0.95 98.47 0.37 0.00 0.00 0.00 56 N H H 52.12 9.00 21.71 31.46 92.19 48.84 -66.09 -39.01 4.12 0.01 95.87 0.32 0.26 3.33 95.11 0.97 0.00 0.00 0.00 57 A H H 7.39 20.27 13.50 34.07 91.93 52.53 -65.03 -39.98 7.08 0.04 92.88 1.00 0.72 5.12 90.25 2.87 0.01 0.02 0.02 58 E H H 108.74 5.95 17.96 24.88 92.70 52.82 -66.21 -37.39 19.34 0.12 80.53 2.02 1.54 15.54 77.99 2.76 0.03 0.06 0.06 59 H H H 141.88 1.81 17.26 18.75 94.16 48.25 -76.37 -23.10 39.35 0.24 60.41 3.43 5.08 30.52 58.45 2.22 0.07 0.09 0.15 60 N C C 77.64 8.29 11.64 21.04 101.75 52.91 -94.95 11.90 80.77 0.96 18.27 30.61 25.10 24.82 16.10 2.29 0.01 0.30 0.77 61 N C T 113.82 3.86 13.51 18.56 99.85 -79.20 -65.72 18.07 94.93 0.36 4.71 12.05 17.81 65.18 1.50 3.03 0.00 0.18 0.25 62 S C T 89.65 2.42 16.15 18.95 96.09 -104.09 62.64 22.75 97.86 0.16 1.98 19.44 20.86 57.42 0.26 1.84 0.00 0.09 0.08 63 L C C 41.07 15.90 9.65 25.44 119.57 143.19 -89.54 144.85 98.11 1.20 0.69 70.99 25.96 0.94 0.17 0.56 0.00 0.36 1.01 64 D C C 82.39 3.77 21.87 25.40 106.72 -121.88 -84.41 112.94 99.27 0.48 0.25 98.56 0.71 0.21 0.05 0.11 0.00 0.20 0.17 65 V H G 33.20 21.25 11.18 31.61 93.52 -163.21 -65.65 -25.79 12.76 0.31 86.94 2.36 1.42 6.92 0.71 88.35 0.00 0.22 0.02 66 D H G 104.70 3.70 19.60 24.34 91.20 66.20 -70.84 -16.38 12.77 0.31 86.92 0.69 1.20 9.10 0.53 88.22 0.00 0.25 0.01 67 D H G 83.56 5.20 20.31 26.26 96.18 52.58 -97.74 2.39 12.92 0.50 86.57 1.74 1.77 7.37 0.51 88.18 0.00 0.41 0.02 68 L C C 9.09 25.02 10.99 35.81 118.91 106.49 -86.65 138.27 61.85 38.03 0.13 55.68 4.81 0.19 0.02 0.10 0.00 38.82 0.37 69 K E E 89.13 6.81 26.86 34.31 125.60 -166.69 -123.85 139.63 2.17 97.82 0.01 2.06 0.09 0.00 0.00 0.00 0.00 97.64 0.19 70 V E E 19.29 23.30 15.16 38.44 110.55 -125.43 -84.01 122.06 0.39 99.61 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.60 0.02 71 S E E 46.37 7.51 22.47 30.88 100.88 175.71 -94.39 -34.46 1.75 98.25 0.00 1.12 0.38 0.01 0.00 0.00 0.00 98.48 0.01 72 T E E 50.92 7.66 24.56 33.13 137.82 1.69 -151.61 148.04 0.72 99.28 0.00 0.49 0.08 0.00 0.00 0.00 0.00 99.42 0.00 73 I E E 21.70 23.92 15.20 38.70 124.14 -165.59 -127.44 129.52 0.36 99.64 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.00 74 Y E E 81.09 8.25 25.93 34.70 127.73 -173.33 -129.21 141.22 0.23 99.77 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.00 75 V E E 29.49 21.32 15.28 35.93 122.31 -161.03 -115.90 130.10 1.50 98.50 0.00 1.35 0.04 0.00 0.00 0.00 0.00 98.57 0.03 76 D E E 59.23 8.57 20.72 29.89 122.87 -168.16 -112.92 137.45 11.56 88.42 0.02 9.75 1.16 0.07 0.00 0.01 0.00 88.75 0.25 77 E E E 104.53 9.90 16.50 26.99 115.10 -131.63 -91.85 132.76 30.80 69.09 0.11 26.59 3.28 0.33 0.02 0.09 0.00 69.01 0.68 78 G C E 25.57 10.96 13.40 25.15 128.38 -155.31 -106.02 -178.74 50.43 49.35 0.22 36.40 12.13 1.29 0.03 0.21 0.00 49.34 0.60 79 M E E 123.26 3.44 16.72 21.10 116.41 -67.55 -85.85 139.97 38.49 61.22 0.29 30.36 6.77 0.87 0.06 0.23 0.00 61.02 0.69 80 S E E 54.69 10.78 10.91 22.46 125.23 -152.62 -114.70 145.35 17.94 81.86 0.21 15.89 1.84 0.29 0.07 0.13 0.00 80.90 0.88 81 L E E 90.81 5.91 12.79 20.54 120.63 -152.67 -111.92 134.91 9.86 90.01 0.13 8.70 0.97 0.16 0.05 0.06 0.00 89.57 0.48 82 K E E 127.44 5.28 11.89 19.23 119.05 -147.61 -103.55 134.28 7.60 92.33 0.07 6.88 0.46 0.07 0.02 0.03 0.00 92.24 0.28 83 R E E 129.66 5.03 11.72 18.66 121.64 -164.17 -113.38 140.46 10.14 89.78 0.08 9.38 0.49 0.07 0.03 0.03 0.00 89.63 0.37 84 I E E 102.31 5.31 9.65 17.01 117.08 -139.94 -99.39 130.59 19.84 80.03 0.13 18.92 0.79 0.11 0.06 0.06 0.00 78.46 1.60 85 M E E 110.28 3.59 10.72 16.23 119.15 -165.94 -111.69 133.96 49.11 50.57 0.32 46.13 1.93 0.28 0.13 0.17 0.00 50.40 0.97 86 P C C 94.61 3.35 8.73 14.11 112.91 -113.18 -71.02 142.47 55.45 36.95 7.60 42.64 8.14 4.86 2.24 5.21 0.01 35.14 1.76 87 R C C 163.00 2.32 8.09 12.19 110.87 -158.12 -99.23 114.20 66.98 17.31 15.71 39.59 18.23 10.10 3.78 11.65 0.03 14.36 2.25 88 A C S 85.76 1.39 7.35 9.93 120.20 -31.84 -116.15 141.48 56.49 17.79 25.72 19.89 21.40 18.94 3.83 19.62 0.25 12.13 3.94 89 K C T 182.45 0.42 8.84 8.65 99.89 -12.48 3.73 49.37 74.29 2.08 23.63 8.70 19.56 45.81 2.24 21.42 0.01 1.20 1.05 90 G C T 66.18 0.60 8.92 9.42 98.42 -33.66 81.42 0.76 84.01 1.56 14.43 8.01 24.74 50.97 1.19 13.49 0.01 0.92 0.66 91 R C C 153.00 1.97 8.50 12.15 119.91 101.08 -104.23 144.56 63.44 28.36 8.19 29.77 21.59 14.00 1.59 6.40 0.09 20.05 6.51 92 A C C 69.98 4.76 8.20 14.90 118.31 -139.79 -99.03 140.92 60.79 35.33 3.88 42.42 12.49 6.59 0.92 3.27 0.01 31.01 3.29 93 D C C 84.84 4.76 11.08 17.66 121.30 -161.10 -109.76 141.82 57.55 41.06 1.39 41.84 11.70 3.64 0.24 1.16 0.00 40.58 0.83 94 R E E 141.08 5.05 11.63 18.67 116.12 -129.78 -94.67 134.15 35.17 64.52 0.30 30.43 3.27 0.55 0.08 0.18 0.00 64.97 0.51 95 I E E 79.15 8.28 11.72 21.64 121.04 -163.73 -112.49 134.78 7.53 92.43 0.04 7.05 0.41 0.05 0.02 0.02 0.00 91.97 0.48 96 T E E 70.77 7.28 13.55 22.59 119.72 -155.95 -107.87 132.78 4.27 95.71 0.02 4.02 0.20 0.02 0.01 0.01 0.00 95.34 0.41 97 K E E 98.97 9.02 14.84 25.08 124.11 -167.89 -117.59 139.52 15.72 84.25 0.03 14.21 0.85 0.06 0.01 0.01 0.00 84.55 0.31 98 R E E 102.85 10.52 16.21 27.45 119.76 -140.92 -100.11 135.28 27.97 71.99 0.04 25.87 1.34 0.11 0.01 0.03 0.00 72.20 0.45 99 T E E 46.17 11.83 19.03 31.37 126.43 -161.54 -117.79 145.70 28.24 71.72 0.04 27.02 0.90 0.08 0.01 0.02 0.00 71.20 0.78 100 C E E 12.10 20.13 16.44 36.73 126.87 -156.67 -122.09 143.65 16.97 83.01 0.02 15.88 0.76 0.06 0.00 0.01 0.00 82.74 0.54 101 H E E 64.05 10.16 24.23 34.86 119.90 -151.67 -111.08 130.86 7.93 92.06 0.01 6.88 0.69 0.04 0.00 0.01 0.00 92.24 0.14 102 I E E 7.49 24.01 17.67 42.03 122.33 -165.85 -117.24 131.79 2.54 97.46 0.00 2.36 0.09 0.00 0.00 0.00 0.00 97.50 0.04 103 T E E 30.91 10.25 26.21 37.54 120.55 -164.51 -113.94 130.20 0.85 99.15 0.00 0.77 0.03 0.00 0.00 0.00 0.00 99.19 0.01 104 V E E 4.47 25.15 18.36 44.12 121.58 -165.90 -115.01 130.48 0.33 99.67 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.69 0.00 105 K E E 67.30 9.65 26.81 36.94 121.13 -165.92 -115.40 131.84 0.25 99.75 0.00 0.24 0.00 0.00 0.00 0.00 0.00 99.75 0.01 106 V E E 10.78 23.09 16.76 39.85 121.09 -162.29 -112.30 132.24 1.48 98.52 0.00 1.42 0.03 0.00 0.00 0.00 0.00 98.49 0.05 107 G E E 21.53 9.15 21.45 31.24 132.69 -169.03 -128.58 164.99 16.59 83.39 0.02 16.00 0.32 0.05 0.00 0.01 0.00 83.19 0.42 108 V C C 64.98 12.21 17.14 29.43 116.26 -106.92 -95.49 134.22 98.76 1.23 0.00 98.92 0.05 0.00 0.00 0.00 0.00 1.01 0.02