# 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 V C C 17.20 21.66 17.66 38.81 119.23 -160.98 -104.41 133.24 99.66 0.34 0.01 99.61 0.12 0.02 0.00 0.00 0.00 0.22 0.02 1 R E E 97.70 9.08 22.89 32.21 122.99 -161.05 -114.49 135.27 22.43 77.41 0.15 21.31 0.78 0.12 0.11 0.07 0.00 63.72 13.89 2 V E E 15.84 21.71 14.36 35.63 115.11 -163.15 -115.17 116.72 10.13 89.44 0.43 5.82 2.44 0.84 0.31 0.25 0.00 69.95 20.38 3 G C T 28.14 13.18 16.43 29.58 97.58 -24.58 59.06 27.52 98.87 0.61 0.51 0.77 3.29 94.99 0.03 0.40 0.00 0.39 0.12 4 N C T 123.56 3.22 18.40 22.25 95.71 -41.77 63.57 9.48 99.48 0.18 0.34 0.81 3.81 94.88 0.02 0.33 0.00 0.12 0.03 5 V E E 41.74 14.48 12.02 27.21 120.29 115.27 -102.44 134.19 11.77 88.10 0.13 6.64 4.30 0.51 0.07 0.08 0.00 67.54 20.87 6 E E E 124.11 3.78 20.89 25.48 111.06 -132.77 -88.00 120.92 42.59 57.36 0.05 39.01 2.20 0.21 0.01 0.04 0.00 56.07 2.47 7 I C C 14.03 23.22 10.39 33.16 115.93 -158.20 -99.65 126.61 92.98 6.94 0.08 91.32 1.84 0.13 0.02 0.04 0.00 6.09 0.55 8 P C C 55.71 6.31 19.80 27.07 111.61 -113.20 -67.28 145.34 97.61 1.36 1.03 93.04 2.67 1.95 0.13 0.92 0.00 0.87 0.43 9 N C T 90.21 11.01 14.31 25.47 96.26 -121.46 -69.32 -14.43 95.84 0.80 3.36 6.27 24.27 65.13 0.34 3.16 0.00 0.46 0.36 10 N C T 109.91 4.22 18.16 23.06 97.79 55.34 -89.97 12.42 92.86 3.39 3.76 15.21 14.27 63.50 0.48 3.37 0.00 2.66 0.50 11 K C C 69.36 13.04 15.59 29.11 116.35 117.82 -82.90 138.48 80.60 18.38 1.02 63.40 16.66 0.95 0.47 0.61 0.00 14.82 3.09 12 R E B 102.04 11.07 22.16 32.96 114.82 -126.98 -85.25 134.05 18.26 81.03 0.70 17.04 0.62 0.12 0.73 0.13 0.00 29.47 51.89 13 V H H 6.58 25.41 16.77 41.96 101.28 -154.42 -81.94 -22.32 35.71 22.28 42.00 28.88 3.49 3.92 31.67 9.64 0.02 19.73 2.65 14 E H H 55.64 16.52 22.11 37.28 94.85 74.60 -67.62 -34.96 14.80 3.50 81.70 5.58 2.89 7.04 50.98 29.87 0.05 3.28 0.32 15 Y H H 84.36 10.62 24.84 35.26 94.24 55.23 -66.47 -37.03 5.73 0.48 93.79 1.34 0.91 3.50 52.51 41.18 0.01 0.51 0.04 16 S H H 11.04 19.54 21.39 40.51 92.22 57.42 -66.49 -33.13 4.14 0.11 95.75 0.94 0.49 2.41 49.95 46.10 0.00 0.10 0.01 17 L H G 3.77 25.90 18.00 44.09 92.05 60.08 -72.89 -23.06 5.75 0.08 94.17 0.76 0.56 3.80 38.40 56.40 0.00 0.06 0.01 18 Q H G 76.12 13.18 21.94 34.77 91.30 69.05 -68.69 -21.14 27.29 0.23 72.48 1.39 1.77 22.70 21.60 52.22 0.06 0.13 0.13 19 Y H G 97.45 11.23 22.77 34.22 93.49 59.64 -86.26 -7.04 48.35 0.60 51.05 3.03 5.17 39.52 8.94 42.58 0.05 0.34 0.38 20 I C S 10.40 23.92 15.30 39.42 116.76 94.51 -91.25 132.66 88.34 10.43 1.23 10.07 76.30 1.06 0.75 0.18 0.02 1.73 9.89 21 H C T 83.43 11.96 22.83 34.41 108.95 -99.05 -65.92 128.62 98.52 0.57 0.91 0.43 7.75 90.75 0.20 0.38 0.00 0.22 0.27 22 G C T 36.19 8.63 22.28 31.36 96.21 12.34 84.81 -3.68 99.61 0.07 0.32 0.66 8.32 90.73 0.06 0.17 0.00 0.04 0.02 23 I C C 9.86 23.88 12.32 36.24 116.48 112.40 -102.94 124.38 88.15 11.47 0.38 64.95 19.15 0.64 0.28 0.10 0.00 1.83 13.04 24 G C C 27.65 5.93 23.67 29.53 128.13 -163.71 -98.22 170.99 99.52 0.31 0.17 98.36 1.13 0.09 0.14 0.01 0.00 0.08 0.19 25 R H H 121.37 12.28 15.97 28.17 92.24 -96.58 -60.01 -38.08 2.35 0.00 97.65 0.24 0.28 1.55 97.65 0.28 0.00 0.00 0.00 26 S H H 72.33 1.97 22.55 23.19 91.95 51.93 -64.25 -41.13 2.19 0.00 97.81 0.20 0.17 1.62 97.58 0.43 0.00 0.00 0.00 27 R H H 73.00 12.01 20.20 32.29 92.04 48.43 -66.31 -40.32 0.48 0.00 99.52 0.08 0.04 0.28 99.34 0.26 0.00 0.00 0.00 28 A H H 2.41 25.23 14.65 40.34 91.07 51.63 -62.53 -43.30 0.11 0.00 99.89 0.02 0.01 0.05 99.90 0.03 0.00 0.00 0.00 29 R H H 114.54 8.69 22.66 31.68 91.20 51.20 -63.19 -41.04 0.07 0.00 99.93 0.01 0.00 0.03 99.95 0.01 0.00 0.00 0.00 30 Q H H 90.69 3.60 24.85 27.92 91.60 50.54 -64.26 -42.27 0.07 0.00 99.93 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 31 I H H 6.94 20.54 19.09 40.14 91.37 48.88 -63.90 -43.98 0.11 0.00 99.89 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 32 L H H 9.49 21.60 16.97 38.58 91.42 49.98 -63.87 -42.26 0.34 0.00 99.66 0.03 0.02 0.21 99.64 0.10 0.00 0.00 0.00 33 C H H 75.96 3.82 20.66 24.69 91.91 50.06 -64.60 -40.39 1.54 0.00 98.46 0.05 0.04 1.37 98.17 0.36 0.00 0.00 0.00 34 D H H 86.64 5.27 19.04 25.19 91.42 51.44 -67.13 -29.79 7.10 0.00 92.89 0.10 0.18 7.18 92.12 0.40 0.01 0.00 0.00 35 L C T 25.34 18.29 13.02 31.36 96.21 46.80 -92.40 2.04 82.04 0.05 17.91 0.70 3.16 76.92 18.22 0.91 0.00 0.02 0.07 36 T C T 108.64 1.97 21.46 23.19 94.15 -120.95 59.09 39.23 99.58 0.01 0.40 3.84 1.76 94.13 0.17 0.09 0.00 0.01 0.01 37 L C C 18.93 21.76 9.81 30.64 112.72 152.11 -99.59 117.93 98.82 0.34 0.84 96.81 1.47 0.82 0.25 0.32 0.00 0.12 0.22 38 E C C 120.85 4.18 20.34 25.18 113.36 -146.30 -86.08 135.18 98.68 0.38 0.95 82.84 6.29 9.65 0.22 0.61 0.00 0.21 0.17 39 N C C 93.73 9.39 18.08 27.68 98.87 1.49 -80.60 45.14 97.90 1.11 0.99 67.24 16.53 14.05 0.20 0.88 0.00 0.75 0.34 40 K C C 72.92 11.35 17.20 29.26 123.81 131.30 -103.02 145.95 83.06 15.90 1.04 71.49 10.14 1.09 0.41 0.66 0.00 11.16 5.06 41 L C C 51.64 9.31 21.58 31.75 116.24 -112.90 -78.62 146.26 54.80 43.97 1.23 49.69 2.67 0.40 0.72 0.52 0.00 13.50 32.50 42 T H G 11.49 24.00 12.99 36.88 91.75 -116.07 -59.67 -35.59 15.33 0.45 84.22 4.33 2.12 7.30 1.62 84.24 0.00 0.36 0.04 43 K H G 122.10 6.89 19.60 27.55 90.90 63.67 -67.99 -19.12 14.65 0.24 85.11 1.34 1.71 10.21 1.12 85.43 0.00 0.16 0.03 44 E H G 120.70 3.63 20.87 24.81 94.61 56.57 -91.71 -1.97 15.45 0.24 84.31 2.44 2.39 8.80 1.26 84.93 0.00 0.14 0.04 45 L C C 13.69 23.30 7.67 29.33 118.04 106.91 -78.14 140.72 98.20 0.63 1.18 64.41 33.37 0.40 0.76 0.27 0.00 0.13 0.66 46 S C C 53.89 2.74 20.56 22.42 123.17 -126.22 -81.60 166.24 98.73 0.41 0.87 97.90 0.74 0.12 0.81 0.05 0.00 0.09 0.30 47 E H H 130.13 5.01 13.96 21.00 91.01 -99.89 -58.43 -38.23 0.88 0.00 99.11 0.13 0.13 0.50 98.99 0.26 0.00 0.00 0.00 48 D H H 107.25 1.24 18.67 18.55 91.62 52.71 -64.51 -39.95 0.39 0.00 99.61 0.04 0.03 0.26 99.37 0.30 0.00 0.00 0.00 49 E H H 48.29 13.00 16.28 29.92 91.98 48.72 -65.89 -40.36 0.15 0.00 99.85 0.02 0.01 0.09 99.62 0.26 0.00 0.00 0.00 50 L H H 16.93 19.49 14.76 34.35 91.40 51.50 -62.66 -42.84 0.06 0.00 99.94 0.01 0.00 0.03 99.91 0.05 0.00 0.00 0.00 51 L H H 77.57 3.68 22.01 25.56 91.24 50.75 -63.42 -41.20 0.10 0.00 99.90 0.01 0.00 0.06 99.89 0.03 0.00 0.00 0.00 52 Q H H 83.58 4.56 22.41 27.02 91.61 50.48 -64.31 -41.92 0.19 0.00 99.81 0.01 0.01 0.13 99.81 0.03 0.00 0.00 0.00 53 V H H 4.89 23.07 16.50 39.89 91.77 49.91 -63.99 -42.70 0.20 0.00 99.80 0.03 0.01 0.13 99.80 0.04 0.00 0.00 0.00 54 R H H 85.16 14.13 19.82 33.26 91.63 52.40 -62.16 -41.43 0.17 0.00 99.83 0.02 0.01 0.11 99.79 0.08 0.00 0.00 0.00 55 D H H 88.62 1.90 23.14 23.15 91.96 50.11 -65.28 -40.79 0.63 0.00 99.37 0.06 0.03 0.47 99.18 0.26 0.00 0.00 0.00 56 E H H 50.34 10.72 18.63 30.32 92.29 49.38 -65.86 -40.70 1.74 0.00 98.25 0.13 0.09 1.38 97.88 0.53 0.00 0.00 0.00 57 V H H 10.66 22.36 12.59 34.52 92.03 51.51 -66.79 -36.21 7.83 0.03 92.14 1.39 0.71 5.26 90.59 2.03 0.01 0.01 0.01 58 T H H 83.57 5.95 17.20 24.30 91.76 58.18 -69.55 -23.82 41.23 0.08 58.69 3.85 1.94 34.08 56.24 3.79 0.01 0.03 0.06 59 K C T 147.91 1.64 18.35 19.29 94.84 52.79 -83.55 -15.23 62.53 0.12 37.35 5.21 4.21 51.11 35.63 3.69 0.01 0.05 0.08 60 Y C C 68.54 15.09 11.42 26.33 117.43 76.13 -99.61 132.62 83.22 1.96 14.82 41.16 30.65 10.99 12.43 2.96 0.02 0.82 0.99 61 M C C 115.68 5.33 18.20 24.71 111.65 -136.97 -88.31 120.09 84.59 10.90 4.52 79.17 3.07 2.44 3.51 1.05 0.00 6.52 4.23 62 I C C 39.92 17.93 11.34 28.68 116.94 -171.14 -104.70 131.75 77.31 14.84 7.84 69.53 4.57 2.52 7.00 1.56 0.00 8.40 6.42 63 E C H 117.24 6.03 16.93 23.85 107.80 -108.39 -71.38 123.95 51.74 4.54 43.72 14.30 9.75 27.96 30.42 12.64 0.49 2.86 1.59 64 G C T 41.21 5.07 17.23 23.07 109.46 21.50 78.74 -76.51 55.45 1.35 43.20 8.81 11.48 34.75 30.75 12.50 0.23 0.69 0.80 65 D H H 67.41 6.79 17.58 25.25 102.00 46.76 -82.31 38.00 46.25 1.26 52.50 30.99 5.54 10.06 41.69 10.47 0.01 0.65 0.58 66 L H H 27.75 19.37 13.44 32.27 93.59 86.02 -64.25 -39.37 7.16 0.08 92.76 3.23 1.07 2.90 90.50 2.22 0.00 0.04 0.02 67 R H H 118.85 8.97 18.79 28.32 91.94 53.79 -63.38 -40.88 2.90 0.04 97.06 0.95 0.35 1.50 95.49 1.67 0.00 0.02 0.01 68 R H H 139.76 2.43 21.77 23.56 92.08 49.59 -65.63 -40.97 1.62 0.02 98.36 0.56 0.18 0.82 97.31 1.12 0.00 0.01 0.00 69 F H H 68.42 11.50 19.80 31.63 92.33 49.61 -65.29 -41.69 0.57 0.00 99.43 0.17 0.05 0.27 99.26 0.24 0.00 0.00 0.00 70 N H H 22.46 19.29 17.96 36.77 91.78 49.90 -63.69 -41.96 0.40 0.00 99.60 0.09 0.02 0.22 99.55 0.12 0.00 0.00 0.00 71 A H H 42.88 7.16 22.02 29.85 91.58 51.10 -63.64 -41.92 0.33 0.00 99.67 0.04 0.02 0.20 99.65 0.09 0.00 0.00 0.00 72 I H H 70.56 4.41 23.81 28.20 91.54 49.99 -64.30 -41.95 0.21 0.00 99.79 0.02 0.01 0.13 99.79 0.05 0.00 0.00 0.00 73 A H H 9.81 17.90 19.61 37.89 91.60 50.40 -63.91 -42.33 0.31 0.00 99.69 0.02 0.01 0.22 99.71 0.04 0.00 0.00 0.00 74 I H H 24.41 17.99 19.65 37.34 91.73 50.40 -63.52 -42.11 0.14 0.00 99.86 0.01 0.00 0.09 99.87 0.02 0.00 0.00 0.00 75 R H H 133.11 2.64 24.69 26.55 91.56 50.55 -63.59 -41.74 0.12 0.00 99.88 0.01 0.00 0.07 99.88 0.03 0.00 0.00 0.00 76 R H H 87.70 7.98 21.64 30.14 91.79 49.22 -64.84 -41.17 0.28 0.00 99.72 0.02 0.01 0.20 99.70 0.06 0.00 0.00 0.00 77 L H H 8.52 21.48 14.07 35.83 91.37 50.89 -63.63 -41.89 0.47 0.00 99.53 0.04 0.03 0.32 99.37 0.24 0.00 0.00 0.00 78 K H H 104.31 8.27 18.28 27.25 91.97 50.87 -63.78 -40.60 1.29 0.00 98.70 0.11 0.07 0.98 98.34 0.50 0.00 0.00 0.00 79 E H H 132.14 1.99 19.91 21.45 91.31 51.93 -65.72 -34.30 5.42 0.00 94.58 0.16 0.22 4.93 94.28 0.40 0.00 0.00 0.00 80 I C T 53.49 11.59 14.90 27.65 95.04 46.92 -90.20 -1.45 55.02 0.05 44.92 0.93 2.95 49.14 46.21 0.70 0.02 0.01 0.05 81 Q C T 125.32 4.38 20.42 25.81 94.23 -120.75 60.11 37.73 99.28 0.04 0.68 14.20 3.81 81.41 0.44 0.11 0.00 0.02 0.02 82 C C C 16.82 18.72 14.37 33.24 122.49 153.02 -90.58 157.75 96.93 1.01 2.05 86.83 9.08 0.60 1.96 0.23 0.00 0.21 1.09 83 Y H H 90.55 10.88 23.18 34.88 92.04 -111.27 -61.76 -37.32 7.22 0.02 92.75 0.79 1.22 5.26 91.93 0.76 0.01 0.01 0.01 84 R H H 54.55 16.97 22.28 38.24 91.96 53.45 -64.56 -39.96 3.06 0.01 96.93 0.21 0.23 2.60 96.31 0.64 0.00 0.00 0.00 85 G H H 5.01 17.28 19.14 37.32 91.68 51.71 -63.51 -42.52 1.78 0.01 98.21 0.28 0.16 1.16 97.53 0.86 0.00 0.00 0.00 86 V H H 41.24 8.97 22.71 32.67 91.62 50.09 -64.63 -42.50 1.00 0.01 99.00 0.18 0.11 0.57 98.76 0.36 0.00 0.00 0.00 87 R H H 51.42 10.99 19.79 31.87 92.11 50.01 -64.44 -42.45 0.86 0.01 99.14 0.14 0.08 0.53 98.84 0.39 0.00 0.00 0.00 88 H H H 42.30 16.08 16.21 32.22 92.31 50.29 -64.77 -41.76 1.00 0.01 98.99 0.11 0.06 0.71 98.17 0.94 0.00 0.00 0.00 89 I H H 82.04 10.95 17.68 28.90 91.57 51.21 -66.78 -31.14 4.61 0.01 95.38 0.13 0.17 4.33 94.35 1.00 0.01 0.00 0.00 90 Q C T 104.44 4.81 17.57 23.18 92.89 50.28 -89.13 0.15 59.58 0.02 40.41 0.23 0.74 59.94 37.83 1.23 0.01 0.00 0.02 91 G C T 50.22 3.66 18.09 22.52 96.07 -104.05 85.68 10.26 99.77 0.00 0.22 0.93 0.92 98.01 0.11 0.02 0.00 0.00 0.00 92 L C C 48.06 12.18 12.95 26.47 117.13 142.80 -86.76 137.61 99.79 0.19 0.02 91.71 8.03 0.06 0.01 0.01 0.00 0.05 0.14 93 P C C 64.96 6.92 20.17 27.71 112.45 -105.32 -65.90 144.35 99.00 0.86 0.14 95.44 3.18 0.35 0.04 0.07 0.00 0.27 0.66 94 C C C 29.17 19.49 12.77 31.15 119.67 -159.86 -112.60 140.00 86.02 12.96 1.02 75.02 7.65 1.40 0.41 0.54 0.00 2.56 12.42 95 R C T 131.04 7.57 18.04 26.21 106.42 -105.69 -71.51 113.91 89.96 4.28 5.76 17.34 32.19 40.75 1.77 3.66 0.01 2.08 2.20 96 G C T 44.20 6.86 15.48 23.14 98.16 -8.95 80.92 -0.38 90.34 1.73 7.94 14.27 31.85 44.74 2.21 5.10 0.01 0.81 1.01 97 Q C C 91.73 8.04 13.59 22.71 107.13 108.44 -87.39 28.64 82.64 2.51 14.85 35.86 30.28 16.92 6.89 7.13 0.02 0.95 1.95 98 R C C 147.64 4.52 15.33 21.07 103.06 20.49 -87.40 39.28 80.32 3.14 16.54 49.59 17.49 13.27 10.61 5.58 0.01 1.29 2.16 99 T C C 56.77 10.07 12.46 23.42 105.82 121.57 -78.73 -24.37 62.56 2.64 34.80 36.53 15.05 11.72 26.20 7.82 0.03 1.18 1.47 100 K C H 134.40 4.71 15.37 21.27 96.11 41.01 -71.28 -25.73 55.48 1.35 43.16 21.31 16.13 18.85 34.52 7.80 0.06 0.66 0.68 101 N C H 92.69 4.81 16.26 21.82 98.75 52.37 -84.25 -12.15 54.84 1.30 43.86 24.07 14.70 17.31 35.09 7.48 0.06 0.56 0.73 102 N C H 56.50 9.82 14.25 25.24 99.87 73.36 -81.82 -13.06 50.24 1.37 48.39 30.88 10.21 10.43 40.67 6.50 0.02 0.58 0.72 103 C H H 46.56 11.56 13.58 25.86 96.72 65.99 -68.83 -31.56 39.95 1.20 58.85 23.25 7.54 10.59 47.98 9.49 0.02 0.60 0.53 104 R H H 132.13 4.48 16.99 22.23 93.81 62.83 -68.53 -32.72 37.45 1.48 61.07 18.94 7.69 12.38 49.33 10.24 0.04 0.80 0.58 105 T H H 65.34 5.82 14.91 22.00 95.60 54.88 -76.58 -27.99 39.58 1.99 58.44 20.20 8.48 12.67 47.29 9.43 0.06 1.08 0.79 106 L C H 68.04 10.84 11.17 22.56 98.07 62.86 -76.33 -23.99 50.25 1.80 47.96 27.26 11.99 12.51 40.02 6.50 0.04 0.83 0.86 107 K C C 129.24 4.51 12.03 18.01 99.54 67.80 -77.66 -13.97 63.28 1.60 35.12 32.79 14.05 16.98 29.81 4.78 0.02 0.66 0.90 108 R C C 166.25 2.38 10.25 14.05 103.47 69.46 -81.97 22.22 81.36 0.84 17.79 33.80 24.84 22.98 13.50 3.98 0.00 0.33 0.56 109 G C C 56.26 2.58 10.24 14.43 105.02 -62.60 41.45 22.10 93.72 0.49 5.79 73.01 3.52 17.94 3.33 1.65 0.00 0.24 0.30 110 K C C 147.98 3.03 11.33 16.06 108.03 -108.03 -87.12 87.50 99.88 0.08 0.05 99.64 0.16 0.12 0.02 0.01 0.00 0.03 0.02