# 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 108.03 7.29 15.34 23.83 116.13 -159.00 -99.48 133.26 99.86 0.14 0.00 99.87 0.04 0.00 0.00 0.00 0.00 0.09 0.00 1 M C C 79.00 11.01 13.07 24.93 121.34 -163.31 -110.66 136.27 62.26 37.67 0.07 61.29 0.49 0.15 0.02 0.04 0.00 37.44 0.59 2 E E E 103.62 7.89 17.02 26.07 121.31 -159.71 -113.18 136.71 24.07 75.88 0.05 20.85 2.40 0.17 0.01 0.04 0.00 76.18 0.36 3 V E E 25.62 18.08 14.94 33.13 127.76 -169.73 -125.99 141.41 6.94 93.04 0.02 6.44 0.28 0.02 0.00 0.01 0.00 93.15 0.10 4 T E E 56.09 10.60 22.34 33.22 126.99 -167.71 -126.74 140.61 2.36 97.63 0.01 2.22 0.09 0.01 0.00 0.00 0.00 97.62 0.06 5 A E E 11.69 21.29 16.59 37.66 131.55 -173.56 -135.09 145.80 2.66 97.33 0.01 2.43 0.15 0.01 0.00 0.00 0.00 97.36 0.03 6 K E E 97.87 8.30 24.73 33.62 122.58 -156.48 -120.17 131.15 2.56 97.42 0.01 2.32 0.18 0.02 0.00 0.00 0.00 97.41 0.06 7 L E E 20.88 22.19 14.77 36.61 118.35 -161.41 -111.18 125.92 7.54 92.40 0.07 7.22 0.37 0.07 0.02 0.03 0.00 91.99 0.30 8 R E E 128.19 5.69 22.37 28.96 124.08 -168.43 -109.88 143.11 20.18 79.50 0.32 9.26 6.46 5.60 0.04 0.29 0.00 77.99 0.36 9 G E E 43.19 6.27 22.25 28.78 96.91 16.12 76.37 15.00 37.55 62.23 0.22 13.39 17.46 7.36 0.02 0.23 0.00 61.10 0.44 10 A E E 11.55 22.51 13.83 35.90 114.20 157.94 -79.73 133.41 37.09 62.60 0.31 33.39 3.10 0.41 0.09 0.23 0.00 60.73 2.06 11 A E E 64.56 6.67 25.42 32.44 109.40 -137.34 -87.13 118.63 49.79 50.01 0.21 42.41 6.30 0.55 0.08 0.15 0.00 46.16 4.35 12 I C C 13.70 23.62 13.64 36.91 129.65 167.17 -127.69 146.24 87.10 12.72 0.19 79.87 7.29 0.24 0.10 0.09 0.00 10.62 1.78 13 S C C 44.93 5.66 24.13 29.70 120.48 -113.58 -75.90 157.82 97.02 2.75 0.23 96.85 0.56 0.08 0.17 0.02 0.00 1.85 0.47 14 A H H 41.36 16.13 15.50 31.28 91.75 -112.45 -58.93 -37.62 1.91 0.00 98.08 0.28 0.22 1.16 97.92 0.42 0.00 0.00 0.00 15 Q H H 117.81 2.44 23.27 25.35 91.57 53.70 -63.59 -40.07 0.94 0.00 99.06 0.10 0.06 0.63 98.82 0.38 0.00 0.00 0.00 16 K H H 67.23 12.54 21.75 34.02 91.97 48.06 -66.53 -39.08 0.51 0.00 99.49 0.08 0.03 0.29 99.23 0.36 0.00 0.00 0.00 17 A H H 1.47 27.02 16.19 44.05 90.74 52.56 -62.69 -42.53 0.16 0.00 99.84 0.03 0.01 0.08 99.84 0.05 0.00 0.00 0.00 18 R H H 102.03 11.17 24.24 35.02 91.21 51.88 -62.76 -41.38 0.11 0.00 99.89 0.01 0.00 0.05 99.91 0.02 0.00 0.00 0.00 19 L H H 68.64 5.63 26.52 32.67 91.48 50.70 -63.67 -42.32 0.12 0.00 99.88 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 20 V H H 4.26 23.96 21.97 45.62 91.76 48.74 -64.11 -43.67 0.16 0.00 99.84 0.01 0.00 0.11 99.84 0.04 0.00 0.00 0.00 21 A H H 3.48 25.26 19.42 44.68 91.12 51.56 -62.59 -41.30 0.25 0.00 99.75 0.01 0.01 0.19 99.66 0.14 0.00 0.00 0.00 22 D H H 86.65 4.92 25.68 31.25 91.27 52.99 -64.85 -35.75 1.55 0.00 98.45 0.04 0.04 1.52 97.50 0.91 0.00 0.00 0.00 23 L H H 63.71 10.88 23.26 34.24 91.57 54.17 -70.29 -26.58 5.88 0.00 94.12 0.06 0.10 6.42 92.23 1.20 0.00 0.00 0.00 24 I H H 2.70 26.16 15.26 42.39 95.55 48.03 -90.05 -14.90 28.58 0.04 71.38 0.93 1.24 26.37 69.54 1.84 0.02 0.01 0.04 25 R C T 102.86 13.83 17.16 31.13 112.34 114.50 -62.18 131.92 98.05 0.08 1.86 0.28 0.59 97.59 1.29 0.14 0.00 0.02 0.08 26 G C T 54.75 2.57 21.17 24.08 94.25 17.95 84.36 -2.46 99.72 0.01 0.26 0.14 0.79 98.87 0.16 0.04 0.00 0.00 0.00 27 K C S 62.89 13.27 15.60 29.48 123.40 123.84 -86.14 153.68 99.67 0.31 0.02 43.41 56.17 0.17 0.01 0.01 0.00 0.11 0.12 28 S E B 43.35 6.24 24.03 30.75 117.78 -105.36 -70.40 154.11 7.86 92.12 0.02 6.01 0.10 0.00 0.02 0.00 0.00 4.07 89.80 29 V H H 9.13 24.45 14.53 39.33 90.93 -111.60 -57.76 -39.61 0.55 0.00 99.45 0.05 0.04 0.38 99.12 0.41 0.00 0.00 0.00 30 A H H 56.16 7.39 22.88 30.69 91.48 53.72 -62.77 -40.96 0.20 0.00 99.80 0.01 0.01 0.15 99.49 0.34 0.00 0.00 0.00 31 H H H 101.14 3.93 25.34 29.02 91.77 47.75 -65.81 -40.05 0.11 0.00 99.89 0.01 0.00 0.07 99.55 0.36 0.00 0.00 0.00 32 A H H 2.60 23.96 17.02 41.42 91.39 51.26 -63.66 -43.29 0.15 0.00 99.85 0.02 0.00 0.08 99.73 0.16 0.00 0.00 0.00 33 L H H 27.02 19.06 20.21 38.50 91.38 51.22 -62.68 -41.69 0.35 0.00 99.65 0.02 0.01 0.25 99.33 0.38 0.00 0.00 0.00 34 N H H 95.88 2.46 25.81 27.29 91.57 51.02 -63.86 -40.97 1.23 0.00 98.77 0.04 0.03 1.12 97.44 1.37 0.00 0.00 0.00 35 I H H 42.04 12.38 21.15 33.99 91.80 49.95 -64.88 -41.15 2.26 0.00 97.74 0.10 0.09 1.93 94.29 3.59 0.00 0.00 0.00 36 L H H 3.60 25.90 14.22 40.47 91.35 52.26 -68.03 -32.18 6.97 0.02 93.00 0.65 0.45 5.43 83.34 10.10 0.01 0.01 0.01 37 N H H 89.59 8.91 19.51 29.08 91.32 65.68 -67.23 -21.52 43.60 0.08 56.32 1.60 1.45 40.61 48.81 7.41 0.02 0.04 0.07 38 F C T 138.80 3.39 19.91 23.40 94.56 55.12 -90.27 -5.00 65.82 0.13 34.05 3.52 4.46 57.40 27.68 6.74 0.01 0.06 0.12 39 S C C 23.78 17.86 9.35 26.41 119.47 96.71 -84.42 144.16 97.51 0.66 1.83 50.85 44.05 2.57 1.42 0.37 0.00 0.16 0.59 40 N C C 131.93 1.66 18.65 20.17 96.40 -145.78 -87.40 8.02 98.73 0.66 0.62 70.07 26.34 2.30 0.31 0.24 0.00 0.21 0.54 41 K C S 83.76 10.65 14.02 25.76 117.65 109.40 -82.55 144.01 86.20 0.94 12.85 31.05 51.18 2.70 13.47 0.60 0.00 0.16 0.84 42 K H H 125.81 4.63 21.42 27.13 93.12 -123.41 -62.06 -37.21 20.43 0.04 79.53 1.23 2.20 16.42 76.00 4.08 0.03 0.01 0.03 43 A H H 9.56 20.64 18.43 38.76 91.47 54.20 -65.26 -36.39 14.16 0.03 85.80 1.53 0.96 11.16 82.17 4.14 0.01 0.01 0.02 44 A H H 6.65 20.52 18.79 39.52 91.40 55.09 -62.79 -40.26 1.44 0.00 98.55 0.47 0.14 0.66 96.89 1.84 0.00 0.00 0.00 45 V H H 69.34 5.71 26.88 33.04 91.58 51.70 -63.48 -41.98 0.28 0.00 99.72 0.06 0.02 0.14 99.52 0.27 0.00 0.00 0.00 46 L H H 25.64 14.97 24.44 39.44 91.42 50.35 -64.21 -42.78 0.12 0.00 99.87 0.02 0.01 0.07 99.81 0.09 0.00 0.00 0.00 47 V H H 0.96 27.91 21.56 49.97 91.08 49.49 -63.85 -43.42 0.05 0.00 99.95 0.01 0.00 0.03 99.94 0.02 0.00 0.00 0.00 48 K H H 64.95 16.08 25.17 39.80 91.17 51.23 -62.20 -42.42 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 49 K H H 103.10 4.34 28.60 33.46 91.50 49.93 -64.18 -41.49 0.04 0.00 99.96 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 50 A H H 5.87 20.58 22.91 43.35 91.44 49.83 -63.81 -43.54 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 51 L H H 2.85 26.42 21.86 48.19 91.24 48.98 -63.74 -43.00 0.10 0.00 99.90 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 52 E H H 94.30 7.45 27.17 35.26 91.54 49.95 -63.88 -41.90 0.16 0.00 99.84 0.01 0.00 0.09 99.87 0.02 0.00 0.00 0.00 53 S H H 41.18 6.86 26.59 34.30 91.70 49.64 -64.60 -41.79 0.32 0.00 99.68 0.03 0.01 0.22 99.70 0.04 0.00 0.00 0.00 54 A H H 3.58 23.05 20.76 43.83 91.68 50.04 -64.20 -42.80 0.43 0.00 99.57 0.05 0.02 0.28 99.56 0.07 0.00 0.00 0.00 55 I H H 28.12 17.85 22.40 39.59 91.48 49.72 -63.12 -42.76 0.43 0.00 99.57 0.06 0.03 0.27 99.51 0.13 0.00 0.00 0.00 56 A H H 52.24 3.32 25.50 28.25 91.32 50.18 -63.06 -42.50 1.00 0.00 98.99 0.10 0.05 0.69 98.86 0.29 0.00 0.00 0.00 57 N H H 52.52 8.82 21.92 31.48 92.15 48.69 -65.86 -39.29 3.00 0.01 97.00 0.22 0.18 2.39 96.39 0.80 0.00 0.00 0.00 58 A H H 7.08 20.22 13.63 34.22 91.93 52.06 -65.09 -40.37 5.37 0.03 94.60 0.65 0.52 3.97 92.53 2.31 0.01 0.01 0.01 59 E H H 106.14 6.24 17.88 25.07 92.60 52.71 -66.01 -37.25 17.37 0.10 82.52 1.55 1.28 14.40 80.33 2.32 0.03 0.05 0.05 60 H H H 142.28 1.74 17.35 18.71 94.21 48.83 -77.02 -23.01 38.41 0.21 61.38 2.83 4.45 30.67 59.86 1.92 0.07 0.07 0.13 61 N C S 76.35 8.53 11.42 21.03 102.02 55.96 -93.53 12.37 82.63 1.05 16.32 28.92 30.98 22.14 14.71 2.04 0.02 0.31 0.89 62 N C T 117.33 3.23 13.72 18.06 100.30 -95.61 -68.32 17.57 95.20 0.30 4.50 7.80 16.32 71.24 1.26 3.01 0.00 0.15 0.22 63 S C T 89.26 2.52 15.99 18.96 96.31 -101.37 62.16 22.59 98.02 0.13 1.85 15.07 18.00 64.79 0.22 1.78 0.00 0.07 0.06 64 L C C 40.47 16.09 9.56 25.47 119.65 143.95 -91.03 144.58 98.00 1.33 0.67 72.81 24.03 0.91 0.16 0.56 0.00 0.41 1.11 65 D C C 82.20 3.84 21.76 25.43 106.76 -123.55 -85.58 111.90 99.22 0.54 0.24 98.50 0.71 0.21 0.04 0.12 0.00 0.23 0.19 66 V H G 33.75 21.13 11.21 31.51 93.74 -164.50 -66.59 -23.33 14.04 0.43 85.53 3.13 1.62 7.07 0.68 87.15 0.00 0.32 0.02 67 D H G 105.17 3.57 19.68 24.26 91.11 66.39 -70.92 -16.37 13.80 0.46 85.73 0.91 1.44 9.49 0.50 87.25 0.00 0.39 0.02 68 D H G 81.30 5.56 20.20 26.56 96.33 52.90 -97.38 3.00 13.89 0.74 85.37 2.25 2.03 7.46 0.50 87.10 0.00 0.63 0.03 69 L C C 9.61 24.97 11.08 35.87 118.70 108.17 -85.39 137.98 59.02 40.84 0.13 53.03 4.65 0.19 0.02 0.11 0.00 41.63 0.37 70 K E E 89.02 6.82 26.73 34.16 126.29 -169.06 -125.33 140.45 2.22 97.77 0.01 2.08 0.09 0.00 0.00 0.00 0.00 97.64 0.17 71 V E E 21.75 22.76 15.28 37.96 110.38 -124.69 -82.79 121.56 0.39 99.61 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.01 72 S E E 46.58 7.56 22.17 30.64 100.84 175.76 -94.39 -34.47 1.59 98.41 0.00 1.01 0.35 0.01 0.00 0.00 0.00 98.62 0.01 73 T E E 52.26 7.53 24.29 32.70 137.67 2.01 -151.61 147.65 0.53 99.47 0.00 0.36 0.05 0.00 0.00 0.00 0.00 99.58 0.00 74 I E E 24.14 23.55 14.96 38.01 124.28 -166.92 -128.27 129.41 0.26 99.74 0.00 0.22 0.01 0.00 0.00 0.00 0.00 99.77 0.00 75 Y E E 84.38 7.84 25.71 34.05 126.20 -173.52 -127.80 137.58 0.19 99.81 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.00 76 V E E 30.15 21.33 14.75 35.37 122.68 -163.25 -116.95 130.19 1.69 98.31 0.00 1.52 0.05 0.00 0.00 0.00 0.00 98.39 0.03 77 D E E 61.35 7.91 20.93 29.39 124.49 -170.75 -117.84 141.49 12.91 87.07 0.02 10.79 1.42 0.09 0.00 0.01 0.00 87.43 0.25 78 E E E 106.37 9.65 16.23 26.57 115.05 -120.18 -88.32 134.46 31.63 68.26 0.11 27.38 3.30 0.34 0.02 0.09 0.00 68.11 0.76 79 G C E 25.14 11.48 12.63 24.81 128.13 -155.53 -105.79 175.45 53.40 46.35 0.25 40.16 11.22 1.28 0.04 0.23 0.00 46.36 0.71 80 M E E 125.57 3.20 16.47 20.54 115.97 -75.97 -83.09 141.18 43.44 56.24 0.33 32.30 9.72 1.21 0.06 0.29 0.00 55.64 0.77 81 S E E 58.29 9.77 10.90 21.66 123.87 -146.77 -111.99 143.77 21.20 78.53 0.27 18.31 2.54 0.42 0.08 0.18 0.00 77.55 0.91 82 L E E 92.31 5.84 12.07 19.82 120.59 -154.93 -112.00 135.55 11.24 88.62 0.15 9.83 1.18 0.20 0.05 0.07 0.00 88.06 0.60 83 K E E 130.46 4.80 11.54 18.47 118.79 -147.17 -104.36 133.59 8.58 91.36 0.07 7.77 0.53 0.08 0.02 0.03 0.00 91.25 0.32 84 R E E 132.23 4.74 11.33 18.02 121.88 -164.84 -113.39 140.61 11.14 88.79 0.07 10.29 0.52 0.07 0.02 0.03 0.00 88.70 0.36 85 I E E 105.61 4.96 9.40 16.43 116.70 -141.28 -99.25 130.55 19.01 80.87 0.11 18.05 0.77 0.11 0.05 0.06 0.00 79.44 1.52 86 M E E 111.76 3.40 10.57 15.90 119.81 -165.89 -112.47 134.81 40.65 59.14 0.20 37.96 1.73 0.22 0.08 0.11 0.00 58.96 0.95 87 P C E 96.37 3.13 8.79 13.94 113.20 -110.37 -70.41 141.69 49.79 46.56 3.65 41.32 5.72 2.65 1.14 2.45 0.00 44.81 1.89 88 R C C 160.74 2.45 7.95 12.22 111.25 -161.87 -99.61 124.75 69.14 19.77 11.09 46.09 15.42 7.97 2.70 8.53 0.01 17.06 2.22 89 A C S 86.96 1.24 7.42 9.70 120.28 -28.14 -114.70 141.34 56.01 20.64 23.35 17.90 21.89 20.18 3.02 18.53 0.22 13.90 4.37 90 K C T 183.83 0.37 8.85 8.43 99.48 -14.86 24.72 47.96 75.73 1.72 22.55 7.70 19.04 48.17 1.74 21.48 0.01 1.01 0.86 91 G C T 66.29 0.59 8.82 9.32 98.09 -35.46 81.46 0.68 84.87 1.54 13.59 8.14 26.25 50.11 1.01 12.95 0.00 0.91 0.63 92 R C C 152.39 1.92 8.46 12.07 120.12 102.54 -106.48 146.25 62.01 31.75 6.24 30.82 21.43 11.61 1.23 4.92 0.06 23.27 6.67 93 A C C 69.79 4.83 8.09 14.87 118.48 -138.48 -100.34 141.56 57.52 39.72 2.76 42.31 10.82 5.06 0.67 2.29 0.01 36.00 2.84 94 D C E 84.03 4.71 11.15 17.71 121.95 -161.90 -111.54 141.84 52.25 46.83 0.92 38.76 10.43 2.65 0.17 0.74 0.00 46.53 0.71 95 R E E 141.82 5.12 11.46 18.60 116.29 -131.87 -94.10 133.72 27.87 71.92 0.20 24.16 2.45 0.37 0.06 0.11 0.00 72.42 0.42 96 I E E 79.16 7.91 11.85 21.51 121.55 -164.95 -114.75 135.85 5.57 94.40 0.03 5.19 0.30 0.04 0.01 0.01 0.00 94.12 0.33 97 T E E 71.22 7.38 13.34 22.50 118.91 -153.61 -107.23 131.83 3.90 96.08 0.02 3.63 0.18 0.02 0.01 0.01 0.00 95.85 0.31 98 K E E 98.13 8.75 15.00 25.03 125.17 -169.78 -118.38 140.15 15.48 84.49 0.03 13.71 1.06 0.07 0.01 0.02 0.00 84.82 0.31 99 R E E 105.24 10.39 16.21 27.31 118.92 -140.17 -102.60 135.00 27.48 72.48 0.04 24.87 1.79 0.14 0.01 0.03 0.00 72.69 0.47 100 T E E 44.90 12.05 18.94 31.48 127.33 -165.92 -119.69 147.77 27.97 71.99 0.04 26.70 0.99 0.09 0.01 0.03 0.00 71.19 0.99 101 C E E 12.51 20.18 16.45 36.72 125.89 -154.19 -120.26 142.15 19.47 80.50 0.02 18.20 0.91 0.06 0.01 0.02 0.00 80.11 0.70 102 H E E 65.13 10.16 24.28 34.84 119.42 -152.00 -110.77 130.50 10.41 89.58 0.01 9.05 0.92 0.04 0.00 0.01 0.00 89.79 0.19 103 I E E 7.68 24.13 17.47 41.93 122.48 -165.75 -117.33 132.25 3.44 96.55 0.00 3.24 0.12 0.01 0.00 0.00 0.00 96.58 0.06 104 T E E 32.18 10.07 26.24 37.36 120.44 -164.07 -114.15 130.45 0.85 99.15 0.00 0.78 0.03 0.00 0.00 0.00 0.00 99.18 0.01 105 V E E 4.67 25.10 18.18 43.89 121.35 -166.08 -115.06 130.40 0.28 99.72 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.73 0.00 106 K E E 67.79 9.54 26.78 36.80 120.66 -165.75 -114.21 131.30 0.19 99.81 0.00 0.18 0.00 0.00 0.00 0.00 0.00 99.81 0.00 107 V E E 11.19 23.05 16.59 39.62 121.33 -163.15 -113.03 133.02 1.35 98.65 0.00 1.28 0.03 0.00 0.00 0.00 0.00 98.64 0.05 108 G E E 21.96 8.95 21.42 31.00 133.12 174.58 -129.58 165.21 19.51 80.47 0.02 18.65 0.40 0.05 0.00 0.01 0.00 80.48 0.42 109 V C C 68.58 11.59 17.17 28.87 114.39 -97.72 -88.88 133.86 99.09 0.91 0.00 99.22 0.06 0.01 0.00 0.00 0.00 0.71 0.01