A0A096M5C5_POEFO Loading...

SUN domain-containing protein

AlphaFold DB , UniProt , Accession A0A096M5C5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 188 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	42.8	Very low	235 Å²	235	109.8 Å²	109.8	100%	1.158	60%	0.604	S	S	*	*				0	115.8	0	-62.1	-178.7	-158.1	0	0	106.6	N3	M1-N3 PolarHBondContact O-N 3.47Å
2	A	35.2	Very low	42.5	Very low	59 Å²	59	109.3 Å²	109.3	49%	0.488	61%	0.614	S	S	.	*			trans	-72.8	119.8	175.7	0	0	0	0	0	108.3	F4	A2-F4 HydrophobicContact CB-CD2 4.35Å; A2-F4 HydrophobicContact CB-CE1 4.27Å; A2-F4 HydrophobicContact CB-CE2 3.72Å; A2-F4 HydrophobicContact CB-CZ 3.68Å; A2-F4 VanDerWaalsContact O-CD2 3.29Å; A2-F4 WeakPolarHBondContact O-CD2 2.82Å; A2-F4 PolarHBondContact O-N 3.27Å
3	N	46.5	Very low	43.2	Very low	157 Å²	157	104.3 Å²	104.3	84%	0.84	58%	0.584	S	S	*	*			trans	-78.6	96.5	173.2	-80.7	-24.4	0	0	0	107.9	M1	M1-N3 PolarHBondContact O-N 3.47Å
4	F	45.9	Very low	43	Very low	87 Å²	87	108.9 Å²	108.9	38%	0.382	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-76.3	133.6	175.8	-63.1	-78.3	0	0	0	110.5	A2 E115 T133 L135	A2-F4 HydrophobicContact CB-CD2 4.35Å; A2-F4 HydrophobicContact CB-CE1 4.27Å; A2-F4 HydrophobicContact CB-CE2 3.72Å; A2-F4 HydrophobicContact CB-CZ 3.68Å; A2-F4 VanDerWaalsContact O-CD2 3.29Å; A2-F4 WeakPolarHBondContact O-CD2 2.82Å; A2-F4 PolarHBondContact O-N 3.27Å; F4-E115 HydrophobicContact CE1-CG 3.88Å; F4-E115 WeakPolarHBondContact CE1-OE1 3.49Å; F4-E115 HydrophobicContact CZ-CG 4.39Å; F4-E115 WeakPolarHBondContact CZ-OE1 3.47Å; F4-T133 HydrophobicContact CD1-CG2 3.99Å; F4-T133 HydrophobicContact CE1-CG2 3.71Å; F4-L135 HydrophobicContact CD1-CB 4.49Å
5	A	53.1	Low	42.4	Very low	30 Å²	30	108.4 Å²	108.4	25%	0.248	61%	0.613	C	S	.	*	P	Polyproline II helix	trans	-75.5	139.9	173.6	0	0	0	0	0	110.9	T133 F134	A5-T133 PolarHBondContact N-O 3.26Å; A5-F134 HydrophobicContact CB-CD1 3.93Å; A5-F134 HydrophobicContact CB-CE1 3.64Å
6	L	44.3	Very low	42.7	Very low	156 Å²	156	106.3 Å²	106.3	82%	0.817	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-68.7	144.7	-175.2	-70.9	166.2	0	0	0	112.6
7	K	45.3	Very low	43.1	Very low	58 Å²	58	102.2 Å²	102.2	25%	0.252	57%	0.574	S	S	.	*	B	Isolated β-bridge	trans	-66.5	125.6	173.2	-174.3	173.5	-177.5	169.4	0	110	Q9 D137 Q144	K7-Q9 VanDerWaalsContact CE-NE2 3.3Å; K7-Q9 HydrophobicContact CG-CG 4.49Å; K7-D137 IonicContact NZ-OD2 3.73Å; K7-D137 PolarHBondContact NZ-OD2 2.93Å; K7-Q144 VanDerWaalsContact NZ-CD 3.3Å; K7-Q144 VanDerWaalsContact NZ-OE1 3.1Å
8	S	45.1	Very low	43.7	Very low	43 Å²	43	97.3 Å²	97.3	30%	0.301	55%	0.547	S	S	.	.			trans	-88.4	110.8	172.9	-178.3	0	0	0	0	109
9	Q	40.8	Very low	44.2	Very low	137 Å²	137	92.6 Å²	92.6	64%	0.64	52%	0.521	S	S	*	.			trans	-93.8	126.3	175.3	-67.3	-78	15.3	0	0	109.5	K7	K7-Q9 VanDerWaalsContact CE-NE2 3.3Å; K7-Q9 HydrophobicContact CG-CG 4.49Å
10	G	41.9	Very low	44.3	Very low	75 Å²	75	90.7 Å²	90.7	77%	0.773	51%	0.509	S	S	*	.			trans	91.5	49	156.5	0	0	0	0	0	118.5
11	K	40.3	Very low	44.4	Very low	171 Å²	171	95.7 Å²	95.7	74%	0.743	53%	0.526	S	S	*	.			trans	-127.2	128.9	157.1	-69.5	-177.7	-176.9	172.9	0	110.5	L13	K11-L13 WeakPolarHBondContact O-CG 3.4Å; K11-L13 PolarHBondContact O-N 2.92Å
12	S	40.1	Very low	45.7	Very low	104 Å²	104	88 Å²	88	73%	0.727	49%	0.492	S	S	*	.			trans	-57.5	98.7	167.5	153.9	0	0	0	0	108.9	L14	S12-L14 PolarHBondContact O-N 3.43Å
13	L	51	Low	47.6	Very low	44 Å²	44	87.8 Å²	87.8	23%	0.23	50%	0.495	C	S	.	.			trans	-86	20.8	-178.8	-75.8	163.5	0	0	0	113.2	K11 S15 F16 T145	K11-L13 WeakPolarHBondContact O-CG 3.4Å; K11-L13 PolarHBondContact O-N 2.92Å; L13-S15 PolarHBondContact O-N 3.44Å; L13-F16 PolarHBondContact O-N 3.5Å; L13-T145 HydrophobicContact CD1-CG2 3.56Å
14	L	39.9	Very low	49.4	Very low	168 Å²	168	81.4 Å²	81.4	88%	0.88	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-16.7	177.9	-86.2	159.9	0	0	0	113.4	S12	S12-L14 PolarHBondContact O-N 3.43Å
15	S	35.2	Very low	51.4	Low	102 Å²	102	84.1 Å²	84.1	71%	0.713	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	1.3	-175.2	-153.5	0	0	0	0	116.3	L13	L13-S15 PolarHBondContact O-N 3.44Å
16	F	46.4	Very low	53.1	Low	74 Å²	74	83.6 Å²	83.6	33%	0.325	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	4.1	-170.3	-70.6	-76.3	0	0	0	116.7	L13 V18 H181 G182 K183	L13-F16 PolarHBondContact O-N 3.5Å; F16-V18 PolarHBondContact O-N 2.8Å; F16-H181 HydrophobicContact CB-CB 4.35Å; F16-H181 WeakPolarHBondContact O-CA 3.38Å; F16-G182 PolarHBondContact O-N 3.34Å; F16-K183 HydrophobicContact CD1-CG 4.38Å; F16-K183 HydrophobicContact CE1-CG 4Å
17	C	50	Low	55	Low	37 Å²	37	77.1 Å²	77.1	25%	0.25	44%	0.436	C	S	.	.	B	Isolated β-bridge	trans	-77.4	96.4	-178.8	-160.7	0	0	0	0	111.4	C19 L20 H181	C17-C19 VanDerWaalsContact C-N 3.31Å; C17-L20 HydrophobicContact CB-CB 4.43Å; C17-L20 HydrophobicContact CB-CD1 4.16Å; C17-H181 WeakPolarHBondContact CA-ND1 3.33Å
18	V	53.9	Low	56.5	Low	14 Å²	14	79.6 Å²	79.6	9%	0.085	46%	0.46	C	S	.	.	S	Bend	trans	-74.3	-26.9	178.1	-179.2	0	0	0	0	111.4	F16 L20 T22 V89 V180 F184	F16-V18 PolarHBondContact O-N 2.8Å; V18-L20 VanDerWaalsContact C-N 3.33Å; V18-L20 PolarHBondContact O-N 3.26Å; V18-T22 PolarHBondContact O-OG1 3.44Å; V18-V89 HydrophobicContact CB-CG2 4.28Å; V18-V89 HydrophobicContact CG1-CG2 3.67Å; V18-V89 HydrophobicContact CG2-CG1 4.19Å; V18-V89 HydrophobicContact CG2-CG2 4.25Å; V18-V180 PolarHBondContact N-O 3.3Å; V18-F184 HydrophobicContact CG1-CD1 4.31Å; V18-F184 HydrophobicContact CG1-CE1 3.45Å; V18-F184 VanDerWaalsContact CG1-CE1 3.45Å; V18-F184 HydrophobicContact CG1-CZ 4.01Å; V18-F184 HydrophobicContact CG2-CE1 4.34Å
19	C	52.6	Low	57.9	Low	8 Å²	8	84.5 Å²	84.5	5%	0.054	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-24.9	-173.1	-167.3	0	0	0	0	113.9	C17 K21	C17-C19 VanDerWaalsContact C-N 3.31Å; C19-K21 PolarHBondContact O-N 2.91Å
20	L	46.5	Very low	59.5	Low	54 Å²	54	80.1 Å²	80.1	28%	0.283	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-21.4	-151.9	-117.7	167	0	0	0	115.9	C17 V18 G62	C17-L20 HydrophobicContact CB-CB 4.43Å; C17-L20 HydrophobicContact CB-CD1 4.16Å; V18-L20 VanDerWaalsContact C-N 3.33Å; V18-L20 PolarHBondContact O-N 3.26Å; L20-G62 WeakPolarHBondContact CD2-O 3.49Å
21	K	47.4	Very low	61	Low	197 Å²	197	78.2 Å²	78.2	86%	0.857	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.7	3.3	-178.8	-68.3	-166.4	178	-178.7	0	118.1	C19	C19-K21 PolarHBondContact O-N 2.91Å
22	T	59.1	Low	62.7	Low	73 Å²	73	71.2 Å²	71.2	45%	0.448	40%	0.4	S	S	.	.	S	Bend	trans	-109.1	24.2	-165.6	59.3	0	0	0	0	116.5	V18 S86	V18-T22 PolarHBondContact O-OG1 3.44Å; T22-S86 WeakPolarHBondContact O-CB 3.16Å; T22-S86 PolarHBondContact O-OG 3.02Å; T22-S86 PolarHBondContact OG1-OG 3.01Å
23	G	73.7	Confident	64.5	Low	54 Å²	54	70.2 Å²	70.2	56%	0.557	40%	0.398	S	S	*	.			trans	96.2	21.5	169.8	0	0	0	0	0	115.8
24	A	84.1	Confident	65.6	Low	23 Å²	23	70.3 Å²	70.3	19%	0.19	40%	0.4	C	S	.	.			trans	-63.6	144.7	165.5	0	0	0	0	0	110.7	A84	A24-A84 CarbonylContact C-O 3.48Å; A24-A84 WeakPolarHBondContact CA-O 3.18Å; A24-A84 WeakPolarHBondContact CB-O 3.39Å
25	K	89.1	Confident	67.2	Low	145 Å²	145	63.5 Å²	63.5	63%	0.63	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140	146.4	-176.7	-65.3	-176	-179.5	-178.7	0	111.3	I83 A84	K25-I83 CarbonylContact O-C 3.5Å; K25-I83 VanDerWaalsContact O-CA 3.29Å; K25-I83 WeakPolarHBondContact O-CA 3.42Å; K25-A84 PolarHBondContact N-O 3.41Å; K25-A84 PolarHBondContact O-N 3.04Å
26	V	87.8	Confident	68.5	Low	19 Å²	19	62.7 Å²	62.7	12%	0.115	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136	167.5	172	0	0	0	0	109.7	S28 P56 D57 L60 L81 I83	V26-S28 PolarHBondContact O-N 3.33Å; V26-P56 HydrophobicContact CG1-CB 4.25Å; V26-P56 HydrophobicContact CG2-CB 4.34Å; V26-D57 WeakPolarHBondContact CB-OD1 3.39Å; V26-D57 HydrophobicContact CG2-CB 4.36Å; V26-D57 WeakPolarHBondContact CG2-OD1 3.35Å; V26-L60 HydrophobicContact CG2-CD1 3.84Å; V26-L60 HydrophobicContact CG2-CG 4.48Å; V26-L81 HydrophobicContact CB-CD1 4.22Å; V26-L81 HydrophobicContact CG1-CD1 3.36Å; V26-L81 HydrophobicContact CG2-CD1 3.86Å; V26-L81 HydrophobicContact CG2-CD2 4.32Å; V26-L81 HydrophobicContact CG2-CG 4.47Å; V26-I83 HydrophobicContact CG2-CG2 4.27Å
27	L	85.3	Confident	69.3	Low	20 Å²	20	66.8 Å²	66.8	11%	0.105	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	109.3	169.4	-62.9	-174.8	0	0	0	108.7	Y29 M30 P31 A82 A84 Y158	L27-Y29 HydrophobicContact CB-CD1 4.36Å; L27-Y29 HydrophobicContact CB-CE1 4Å; L27-Y29 HydrophobicContact CD1-CE1 4.34Å; L27-Y29 HydrophobicContact CD2-CE1 4.4Å; L27-Y29 HydrophobicContact CG-CE1 4.49Å; L27-Y29 PolarHBondContact O-N 3.19Å; L27-M30 HydrophobicContact CB-CB 4.48Å; L27-M30 PolarHBondContact O-N 3.48Å; L27-P31 WeakPolarHBondContact O-CD 3.46Å; L27-A82 HydrophobicContact CB-CB 4.24Å; L27-A82 HydrophobicContact CD1-CB 3.78Å; L27-A82 HydrophobicContact CG-CB 4.22Å; L27-A82 PolarHBondContact N-O 3.1Å; L27-A84 HydrophobicContact CD2-CB 3.91Å; L27-Y158 HydrophobicContact CD1-CD1 3.9Å; L27-Y158 HydrophobicContact CD1-CE1 4.43Å; L27-Y158 HydrophobicContact CD2-CD1 4.23Å; L27-Y158 HydrophobicContact CD2-CE1 4.18Å
28	S	76.9	Confident	69.8	Low	109 Å²	109	66.3 Å²	66.3	76%	0.762	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.5	-24.8	-171.8	56.6	0	0	0	0	115.1	V26 P31	V26-S28 PolarHBondContact O-N 3.33Å; S28-P31 VanDerWaalsContact O-CD 3.31Å; S28-P31 WeakPolarHBondContact O-CD 3.43Å
29	Y	74.3	Confident	70.1	Confident	146 Å²	146	74.6 Å²	74.6	57%	0.573	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	-3.1	-178.7	62.8	-90.9	0	0	0	114.3	L27	L27-Y29 HydrophobicContact CB-CD1 4.36Å; L27-Y29 HydrophobicContact CB-CE1 4Å; L27-Y29 HydrophobicContact CD1-CE1 4.34Å; L27-Y29 HydrophobicContact CD2-CE1 4.4Å; L27-Y29 HydrophobicContact CG-CE1 4.49Å; L27-Y29 PolarHBondContact O-N 3.19Å
30	M	74.8	Confident	70.5	Confident	46 Å²	46	80.3 Å²	80.3	23%	0.227	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	28.2	-173.3	-155.7	176.1	-90	0	0	116.2	L27 H80 A82 W128	L27-M30 HydrophobicContact CB-CB 4.48Å; L27-M30 PolarHBondContact O-N 3.48Å; M30-H80 PolarHBondContact O-CD2 3.3Å; M30-H80 VanDerWaalsContact O-CD2 3.32Å; M30-A82 HydrophobicContact CB-CB 4.03Å; M30-A82 HydrophobicContact CG-CB 4.05Å; M30-A82 PolarHBondContact O-N 3.45Å; M30-A82 HydrophobicContact SD-CB 3.7Å; M30-W128 HydrophobicContact CE-CZ2 4.36Å; M30-W128 HydrophobicContact SD-CZ2 3.59Å; M30-W128 VanDerWaalsContact SD-CZ2 3.59Å
31	P	72.6	Confident	71	Confident	35 Å²	35	82.1 Å²	82.1	23%	0.227	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	144.3	157.8	34.2	-25.5	0	0	0	110.8	L27 S28 P56 H80 L81	L27-P31 WeakPolarHBondContact O-CD 3.46Å; S28-P31 VanDerWaalsContact O-CD 3.31Å; S28-P31 WeakPolarHBondContact O-CD 3.43Å; P31-P56 HydrophobicContact CB-CB 4.16Å; P31-P56 HydrophobicContact CB-CG 3.75Å; P31-P56 HydrophobicContact CG-CG 4.1Å; P31-H80 CarbonylContact C-O 3.56Å; P31-H80 WeakPolarHBondContact CA-O 3.43Å; P31-L81 HydrophobicContact CB-CD1 3.75Å
32	S	76.5	Confident	71.9	Confident	23 Å²	23	76.7 Å²	76.7	16%	0.161	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-60.4	147.8	162.1	-59.8	0	0	0	0	110.8	V34 G79 H80	S32-V34 PolarHBondContact O-N 2.84Å; S32-G79 VanDerWaalsContact OG-CA 3.29Å; S32-G79 WeakPolarHBondContact OG-CA 3.08Å; S32-H80 PolarHBondContact N-O 3.35Å; S32-H80 PolarHBondContact OG-CE1 3.37Å; S32-H80 PolarHBondContact OG-N 2.79Å; S32-H80 PolarHBondContact OG-ND1 3.26Å
33	A	76.8	Confident	72.2	Confident	83 Å²	83	78.9 Å²	78.9	69%	0.686	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-57.6	133	-173.7	0	0	0	0	0	111.5	H35	A33-H35 PolarHBondContact O-N 3.16Å
34	V	75.6	Confident	72	Confident	46 Å²	46	83.9 Å²	83.9	28%	0.279	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-62.6	133.5	176.1	179.6	0	0	0	0	109.5	S32 Q38 P56 G73	S32-V34 PolarHBondContact O-N 2.84Å; V34-Q38 HydrophobicContact CG1-CB 4.03Å; V34-Q38 HydrophobicContact CG1-CG 4.31Å; V34-P56 HydrophobicContact CG2-CG 4.09Å; V34-G73 CarbonylContact C-O 3.53Å; V34-G73 WeakPolarHBondContact CA-O 3.47Å
35	H	72.3	Confident	71.5	Confident	26 Å²	26	91.9 Å²	91.9	12%	0.12	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-61	135.1	-176	-179	-85.5	0	0	0	111.5	A33 K37 Q38 G73	A33-H35 PolarHBondContact O-N 3.16Å; H35-K37 VanDerWaalsContact C-N 3.31Å; H35-K37 PolarHBondContact ND1-N 2.9Å; H35-K37 PolarHBondContact O-N 2.79Å; H35-K37 VanDerWaalsContact O-N 3.13Å; H35-Q38 VanDerWaalsContact O-CB 3.28Å; H35-Q38 WeakPolarHBondContact O-CB 3.12Å; H35-Q38 PolarHBondContact O-N 3.45Å; H35-G73 PolarHBondContact N-O 3.16Å
36	P	63.1	Low	70.8	Confident	85 Å²	85	88.1 Å²	88.1	55%	0.552	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-56.7	-37.1	-170.3	-27.1	33.5	0	0	0	115.1	Q38 R39	P36-Q38 PolarHBondContact O-N 3.11Å; P36-Q38 VanDerWaalsContact O-N 3.16Å; P36-R39 WeakPolarHBondContact O-CB 3.38Å; P36-R39 PolarHBondContact O-N 2.93Å
37	K	63.4	Low	70.1	Confident	160 Å²	160	92.6 Å²	92.6	70%	0.696	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-68.8	-8.9	179.7	-66.8	-169.1	175.3	-163.4	0	114.7	H35 R39	H35-K37 VanDerWaalsContact C-N 3.31Å; H35-K37 PolarHBondContact ND1-N 2.9Å; H35-K37 PolarHBondContact O-N 2.79Å; H35-K37 VanDerWaalsContact O-N 3.13Å; K37-R39 VanDerWaalsContact C-N 3.26Å
38	Q	61	Low	69.6	Low	26 Å²	26	94.6 Å²	94.6	12%	0.121	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-81.6	-9.7	172.9	-164.4	152	31.6	0	0	112.4	V34 H35 P36 Q40 V54 C71	V34-Q38 HydrophobicContact CG1-CB 4.03Å; V34-Q38 HydrophobicContact CG1-CG 4.31Å; H35-Q38 VanDerWaalsContact O-CB 3.28Å; H35-Q38 WeakPolarHBondContact O-CB 3.12Å; H35-Q38 PolarHBondContact O-N 3.45Å; P36-Q38 PolarHBondContact O-N 3.11Å; P36-Q38 VanDerWaalsContact O-N 3.16Å; Q38-Q40 PolarHBondContact O-N 2.9Å; Q38-V54 HydrophobicContact CG-CB 3.83Å; Q38-V54 HydrophobicContact CG-CG2 3.92Å; Q38-V54 VanDerWaalsContact NE2-CB 3.32Å; Q38-C71 PolarHBondContact NE2-O 2.91Å
39	R	59.3	Low	69.3	Low	189 Å²	189	93.3 Å²	93.3	71%	0.713	49%	0.487	S	S	*	.	S	Bend	trans	-83.8	104.6	163.1	-64	-179.4	174.7	179.4	-1.5	108	P36 K37	P36-R39 WeakPolarHBondContact O-CB 3.38Å; P36-R39 PolarHBondContact O-N 2.93Å; K37-R39 VanDerWaalsContact C-N 3.26Å
40	Q	61.2	Low	68.8	Low	128 Å²	128	93.6 Å²	93.6	60%	0.598	49%	0.494	S	S	*	.			trans	-98.5	134.1	177.5	-65	-171	5.4	0	0	110.5	Q38 M51	Q38-Q40 PolarHBondContact O-N 2.9Å; Q40-M51 HydrophobicContact CB-CB 4.12Å; Q40-M51 HydrophobicContact CB-CG 4.34Å; Q40-M51 WeakPolarHBondContact O-CB 3.43Å; Q40-M51 PolarHBondContact O-N 2.88Å
41	T	57.9	Low	68.2	Low	91 Å²	91	96 Å²	96	56%	0.558	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.6	167.6	41.8	0	0	0	0	108.1	L49	T41-L49 CarbonylContact C-O 3.58Å; T41-L49 WeakPolarHBondContact CA-O 3.34Å
42	L	65.2	Low	67.5	Low	84 Å²	84	100 Å²	100	44%	0.44	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	119.7	173.8	-171	74.6	0	0	0	108.2	W44 L49 M51	L42-W44 HydrophobicContact CD2-CE3 3.97Å; L42-W44 PolarHBondContact O-N 3.05Å; L42-L49 HydrophobicContact CB-CB 4.39Å; L42-L49 PolarHBondContact N-O 3.35Å; L42-L49 PolarHBondContact O-N 2.81Å; L42-M51 HydrophobicContact CB-CG 4.41Å
43	N	64.8	Low	66.9	Low	119 Å²	119	101.4 Å²	101.4	64%	0.636	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	102.6	172.8	-172.9	8.5	0	0	0	109.4	G46 I47	N43-G46 VanDerWaalsContact OD1-CA 3.29Å; N43-G46 WeakPolarHBondContact OD1-CA 3.49Å; N43-G46 PolarHBondContact OD1-N 2.77Å; N43-G46 VanDerWaalsContact OD1-N 3.08Å; N43-I47 PolarHBondContact OD1-N 2.87Å
44	W	69.5	Low	67	Low	158 Å²	158	99.3 Å²	99.3	60%	0.598	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	100	176.7	-168.2	-68.9	0	0	0	108.1	L42 G46 I47 L49	L42-W44 HydrophobicContact CD2-CE3 3.97Å; L42-W44 PolarHBondContact O-N 3.05Å; W44-G46 PolarHBondContact O-N 2.9Å; W44-I47 PolarHBondContact N-O 3.28Å; W44-I47 PolarHBondContact O-N 2.79Å; W44-I47 VanDerWaalsContact O-N 3.16Å; W44-L49 HydrophobicContact CB-CD1 4.04Å
45	F	73.6	Confident	67.4	Low	191 Å²	191	100.5 Å²	100.5	84%	0.838	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	44.1	176.4	-63.1	-106.7	0	0	0	114.2	I47	F45-I47 VanDerWaalsContact C-N 3.33Å
46	G	74.9	Confident	68.2	Low	67 Å²	67	99.9 Å²	99.9	69%	0.691	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	-2.8	177.8	0	0	0	0	0	114.6	N43 W44	N43-G46 VanDerWaalsContact OD1-CA 3.29Å; N43-G46 WeakPolarHBondContact OD1-CA 3.49Å; N43-G46 PolarHBondContact OD1-N 2.77Å; N43-G46 VanDerWaalsContact OD1-N 3.08Å; W44-G46 PolarHBondContact O-N 2.9Å
47	I	72.5	Confident	69.3	Low	113 Å²	113	99.2 Å²	99.2	58%	0.579	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.6	172.2	-57.3	173.5	0	0	0	108.7	N43 W44 F45 L49	N43-I47 PolarHBondContact OD1-N 2.87Å; W44-I47 PolarHBondContact N-O 3.28Å; W44-I47 PolarHBondContact O-N 2.79Å; W44-I47 VanDerWaalsContact O-N 3.16Å; F45-I47 VanDerWaalsContact C-N 3.33Å; I47-L49 HydrophobicContact CG2-CD2 4.03Å; I47-L49 HydrophobicContact CG2-CG 4.41Å; I47-L49 PolarHBondContact O-N 3.37Å
48	A	76.3	Confident	70.5	Confident	61 Å²	61	91.9 Å²	91.9	50%	0.504	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	94.5	173.8	0	0	0	0	0	110.6	H50	A48-H50 PolarHBondContact O-N 2.92Å; A48-H50 PolarHBondContact O-ND1 2.76Å
49	L	69	Low	72	Confident	83 Å²	83	90.6 Å²	90.6	44%	0.435	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.4	171.3	-62.4	177	0	0	0	109.2	T41 L42 W44 I47 M51	T41-L49 CarbonylContact C-O 3.58Å; T41-L49 WeakPolarHBondContact CA-O 3.34Å; L42-L49 HydrophobicContact CB-CB 4.39Å; L42-L49 PolarHBondContact N-O 3.35Å; L42-L49 PolarHBondContact O-N 2.81Å; W44-L49 HydrophobicContact CB-CD1 4.04Å; I47-L49 HydrophobicContact CG2-CD2 4.03Å; I47-L49 HydrophobicContact CG2-CG 4.41Å; I47-L49 PolarHBondContact O-N 3.37Å; L49-M51 PolarHBondContact O-N 2.97Å
50	H	64.4	Low	73.4	Confident	152 Å²	152	82.5 Å²	82.5	70%	0.704	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	112.4	174.3	-70.5	68.3	0	0	0	108.6	A48	A48-H50 PolarHBondContact O-N 2.92Å; A48-H50 PolarHBondContact O-ND1 2.76Å
51	M	61.8	Low	74.5	Confident	95 Å²	95	81.4 Å²	81.4	47%	0.468	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-70.5	144.4	174.1	-65.8	-67.2	-82.4	0	0	109	Q40 L42 L49 S53	Q40-M51 HydrophobicContact CB-CB 4.12Å; Q40-M51 HydrophobicContact CB-CG 4.34Å; Q40-M51 WeakPolarHBondContact O-CB 3.43Å; Q40-M51 PolarHBondContact O-N 2.88Å; L42-M51 HydrophobicContact CB-CG 4.41Å; L49-M51 PolarHBondContact O-N 2.97Å; M51-S53 PolarHBondContact O-N 2.86Å; M51-S53 VanDerWaalsContact O-N 3.1Å
52	P	58.3	Low	75.7	Confident	119 Å²	119	77.4 Å²	77.4	77%	0.773	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-57.2	121.6	175.6	20.5	-28.6	0	0	0	109.2
53	S	65	Low	76.4	Confident	54 Å²	54	75.3 Å²	75.3	38%	0.378	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-66	135.4	175.4	54.5	0	0	0	0	109.5	M51 T55	M51-S53 PolarHBondContact O-N 2.86Å; M51-S53 VanDerWaalsContact O-N 3.1Å; S53-T55 PolarHBondContact O-N 3.06Å
54	V	77.3	Confident	77	Confident	39 Å²	39	75.7 Å²	75.7	24%	0.236	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-62.6	122.6	174.7	-175.1	0	0	0	0	109.2	Q38 V58 C71	Q38-V54 HydrophobicContact CG-CB 3.83Å; Q38-V54 HydrophobicContact CG-CG2 3.92Å; Q38-V54 VanDerWaalsContact NE2-CB 3.32Å; V54-V58 HydrophobicContact CG1-CB 3.65Å; V54-V58 HydrophobicContact CG1-CG1 3.61Å; V54-V58 HydrophobicContact CG1-CG2 3.83Å; V54-C71 WeakPolarHBondContact CG1-O 3.37Å
55	T	84.8	Confident	77.7	Confident	70 Å²	70	78.2 Å²	78.2	43%	0.429	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-89.1	158.4	176.3	66.5	0	0	0	0	110.6	S53 D57 V58	S53-T55 PolarHBondContact O-N 3.06Å; T55-D57 PolarHBondContact O-N 3.26Å; T55-D57 PolarHBondContact OG1-OD2 2.8Å; T55-V58 WeakPolarHBondContact O-CB 3.29Å; T55-V58 VanDerWaalsContact O-CG1 3.25Å; T55-V58 WeakPolarHBondContact O-CG1 3.32Å; T55-V58 PolarHBondContact O-N 3.02Å; T55-V58 VanDerWaalsContact O-N 3.08Å
56	P	88.1	Confident	78.5	Confident	14 Å²	14	69.8 Å²	69.8	9%	0.091	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-57.4	-23.2	178.6	-23.8	33.4	0	0	0	114.2	V26 P31 V34 V58 V59 W72 L81	V26-P56 HydrophobicContact CG1-CB 4.25Å; V26-P56 HydrophobicContact CG2-CB 4.34Å; P31-P56 HydrophobicContact CB-CB 4.16Å; P31-P56 HydrophobicContact CB-CG 3.75Å; P31-P56 HydrophobicContact CG-CG 4.1Å; V34-P56 HydrophobicContact CG2-CG 4.09Å; P56-V58 PolarHBondContact O-N 3.16Å; P56-V59 WeakPolarHBondContact O-CG2 3.42Å; P56-V59 PolarHBondContact O-N 2.88Å; P56-W72 HydrophobicContact CB-CD2 4.31Å; P56-W72 HydrophobicContact CB-CG 4.02Å; P56-W72 HydrophobicContact CG-CG 4.43Å; P56-L81 HydrophobicContact CB-CD1 3.69Å
57	D	88.2	Confident	79.2	Confident	70 Å²	70	72.1 Å²	72.1	37%	0.374	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-57.9	-18.1	175.9	-52.4	-85	0	0	0	113.7	V26 T55 V59 L60	V26-D57 WeakPolarHBondContact CB-OD1 3.39Å; V26-D57 HydrophobicContact CG2-CB 4.36Å; V26-D57 WeakPolarHBondContact CG2-OD1 3.35Å; T55-D57 PolarHBondContact O-N 3.26Å; T55-D57 PolarHBondContact OG1-OD2 2.8Å; D57-V59 PolarHBondContact O-N 2.85Å; D57-V59 VanDerWaalsContact O-N 3.1Å; D57-L60 PolarHBondContact O-N 3.4Å
58	V	88.2	Confident	80	Confident	6 Å²	6	70.2 Å²	70.2	4%	0.036	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-52.9	-30	174.9	73.9	0	0	0	0	113.1	V54 T55 P56 L60 Q61 R63 E70 W72	V54-V58 HydrophobicContact CG1-CB 3.65Å; V54-V58 HydrophobicContact CG1-CG1 3.61Å; V54-V58 HydrophobicContact CG1-CG2 3.83Å; T55-V58 WeakPolarHBondContact O-CB 3.29Å; T55-V58 VanDerWaalsContact O-CG1 3.25Å; T55-V58 WeakPolarHBondContact O-CG1 3.32Å; T55-V58 PolarHBondContact O-N 3.02Å; T55-V58 VanDerWaalsContact O-N 3.08Å; P56-V58 PolarHBondContact O-N 3.16Å; V58-L60 VanDerWaalsContact C-N 3.27Å; V58-L60 PolarHBondContact O-N 3.01Å; V58-Q61 WeakPolarHBondContact O-CG 3.38Å; V58-R63 VanDerWaalsContact CG2-NH1 3.28Å; V58-R63 PolarHBondContact O-NH1 3.08Å; V58-E70 HydrophobicContact CG2-CB 4.47Å; V58-E70 VanDerWaalsContact CG2-O 3.28Å; V58-E70 WeakPolarHBondContact CG2-O 3.49Å; V58-W72 HydrophobicContact CG1-CB 3.77Å
59	V	91.3	Very high	80.4	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-74.1	-17.6	-178.9	-49.4	0	0	0	0	113.1	P56 D57 W72 L81 V175 D177 F178	P56-V59 WeakPolarHBondContact O-CG2 3.42Å; P56-V59 PolarHBondContact O-N 2.88Å; D57-V59 PolarHBondContact O-N 2.85Å; D57-V59 VanDerWaalsContact O-N 3.1Å; V59-W72 HydrophobicContact CG1-CB 3.55Å; V59-W72 HydrophobicContact CG1-CE3 4.32Å; V59-W72 HydrophobicContact CG1-CG 4.47Å; V59-L81 HydrophobicContact CG2-CD2 3.41Å; V59-L81 VanDerWaalsContact CG2-CD2 3.41Å; V59-V175 HydrophobicContact CB-CG1 4.36Å; V59-V175 HydrophobicContact CG1-CB 4.01Å; V59-V175 HydrophobicContact CG1-CG1 3.87Å; V59-V175 WeakPolarHBondContact CG1-O 3.27Å; V59-D177 CarbonylContact O-C 3.52Å; V59-D177 WeakPolarHBondContact O-CA 3.28Å; V59-F178 HydrophobicContact CB-CB 4.44Å; V59-F178 HydrophobicContact CG2-CB 4.28Å; V59-F178 PolarHBondContact O-N 2.87Å
60	L	89.4	Confident	81.4	Confident	19 Å²	19	68.1 Å²	68.1	10%	0.099	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-96.3	2.1	-176.5	-55.3	-179.1	0	0	0	113.3	V26 D57 V58 G62 I83	V26-L60 HydrophobicContact CG2-CD1 3.84Å; V26-L60 HydrophobicContact CG2-CG 4.48Å; D57-L60 PolarHBondContact O-N 3.4Å; V58-L60 VanDerWaalsContact C-N 3.27Å; V58-L60 PolarHBondContact O-N 3.01Å; L60-G62 PolarHBondContact O-N 3.1Å; L60-I83 HydrophobicContact CD1-CB 4.35Å; L60-I83 HydrophobicContact CD1-CG2 3.84Å; L60-I83 HydrophobicContact CD2-CD1 3.93Å; L60-I83 HydrophobicContact CD2-CG2 3.94Å; L60-I83 HydrophobicContact CG-CG2 4.38Å
61	Q	84.9	Confident	82.7	Confident	104 Å²	104	61.2 Å²	61.2	49%	0.486	34%	0.335	S	S	.	.	S	Bend	trans	-71.8	-14.6	-178.1	-60.9	-169.8	19.3	0	0	113.3	V58 R63	V58-Q61 WeakPolarHBondContact O-CG 3.38Å; Q61-R63 VanDerWaalsContact C-N 3.3Å; Q61-R63 HydrophobicContact CB-CG 4.07Å; Q61-R63 PolarHBondContact O-N 3.2Å
62	G	81.7	Confident	84.2	Confident	8 Å²	8	56.7 Å²	56.7	8%	0.082	31%	0.313	C	S	.	.			trans	53.6	43	177.9	0	0	0	0	0	114	L20 L60 D177 R179	L20-G62 WeakPolarHBondContact CD2-O 3.49Å; L60-G62 PolarHBondContact O-N 3.1Å; G62-D177 VanDerWaalsContact CA-OD2 3.27Å; G62-D177 WeakPolarHBondContact CA-OD2 3.49Å; G62-R179 PolarHBondContact O-NH2 3.01Å
63	R	81.4	Confident	85.9	Confident	40 Å²	40	51.1 Å²	51.1	15%	0.151	28%	0.277	C	S	.	.			trans	-63.2	138.7	-177	-63.4	179.1	177.3	95.1	-15.1	110.6	V58 Q61 L66 E70 D177 R179	V58-R63 VanDerWaalsContact CG2-NH1 3.28Å; V58-R63 PolarHBondContact O-NH1 3.08Å; Q61-R63 VanDerWaalsContact C-N 3.3Å; Q61-R63 HydrophobicContact CB-CG 4.07Å; Q61-R63 PolarHBondContact O-N 3.2Å; R63-L66 HydrophobicContact CB-CD2 4.19Å; R63-E70 WeakPolarHBondContact CD-OE2 3.05Å; R63-E70 IonicContact CZ-OE1 3.44Å; R63-E70 IonicContact CZ-OE2 2.8Å; R63-E70 IonicContact NE-OE1 3.97Å; R63-E70 PolarHBondContact NE-OE1 2.91Å; R63-E70 IonicContact NE-OE2 3.39Å; R63-E70 PolarHBondContact NE-OE2 2.9Å; R63-E70 VanDerWaalsContact NH2-CD 3.27Å; R63-E70 IonicContact NH2-OE1 3.26Å; R63-E70 PolarHBondContact NH2-OE1 2.88Å; R63-E70 IonicContact NH2-OE2 3.06Å; R63-D177 PolarHBondContact N-OD2 3.19Å; R63-D177 VanDerWaalsContact N-OD2 3.16Å; R63-R179 PolarHBondContact O-NH2 3.25Å
64	T	76.5	Confident	87.2	Confident	127 Å²	127	48.6 Å²	48.6	78%	0.779	26%	0.26	S	S	*	.	S	Bend	trans	-81.1	-22.8	171.9	52.9	0	0	0	0	112.3
65	R	84.3	Confident	87.9	Confident	210 Å²	210	53.3 Å²	53.3	79%	0.792	28%	0.279	S	S	*	.	S	Bend	trans	-122.3	118.3	175.3	-63.8	-176.8	-179.3	-163.3	-0.4	108.6
66	L	89.5	Confident	88.4	Confident	15 Å²	15	51.1 Å²	51.1	8%	0.079	27%	0.271	C	S	.	.			trans	-88	126.9	177.9	-53.8	-179.6	0	0	0	108.7	R63 H98 L99 L143 Y176 D177	R63-L66 HydrophobicContact CB-CD2 4.19Å; L66-H98 WeakPolarHBondContact CD1-O 3.36Å; L66-L99 HydrophobicContact CB-CD1 4.26Å; L66-L99 VanDerWaalsContact O-CD1 3.27Å; L66-L99 WeakPolarHBondContact O-CD1 3.43Å; L66-L143 HydrophobicContact CD1-CD2 4.37Å; L66-Y176 HydrophobicContact CB-CD1 4.3Å; L66-D177 HydrophobicContact CD2-CB 4.24Å
67	Q	90.1	Very high	88.8	Confident	115 Å²	115	52.6 Å²	52.6	54%	0.537	28%	0.281	S	S	.	.			trans	-110.3	145.8	179.4	-57.5	-166.7	-41.8	0	0	111.6	G69 E70 Y176	Q67-G69 PolarHBondContact O-N 3.06Å; Q67-E70 HydrophobicContact CB-CG 4.14Å; Q67-E70 WeakPolarHBondContact CB-OE2 3.36Å; Q67-E70 WeakPolarHBondContact O-CB 3.27Å; Q67-E70 PolarHBondContact O-N 3.01Å; Q67-Y176 VanDerWaalsContact O-CE1 3.24Å; Q67-Y176 WeakPolarHBondContact O-CE1 3.4Å
68	P	89.9	Confident	89.2	Confident	74 Å²	74	55.9 Å²	55.9	48%	0.481	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	134.1	177.3	-23	31.8	0	0	0	112.5	E70 L99 L103	P68-E70 VanDerWaalsContact C-N 3.32Å; P68-E70 PolarHBondContact O-N 3.23Å; P68-L99 HydrophobicContact CB-CD2 4.21Å; P68-L99 HydrophobicContact CG-CD1 4.3Å; P68-L99 HydrophobicContact CG-CD2 4Å; P68-L103 WeakPolarHBondContact CG-O 3.43Å
69	G	84.8	Confident	89.6	Confident	47 Å²	47	55.8 Å²	55.8	49%	0.485	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-12.4	177.9	0	0	0	0	0	115	Q67 C71	Q67-G69 PolarHBondContact O-N 3.06Å; G69-C71 PolarHBondContact O-N 2.8Å
70	E	89.3	Confident	89.8	Confident	53 Å²	53	59 Å²	59	25%	0.248	31%	0.31	C	S	.	.			trans	-87.1	37.5	175.9	-59.1	-164.8	113	0	0	113.4	V58 R63 Q67 P68	V58-E70 HydrophobicContact CG2-CB 4.47Å; V58-E70 VanDerWaalsContact CG2-O 3.28Å; V58-E70 WeakPolarHBondContact CG2-O 3.49Å; R63-E70 WeakPolarHBondContact CD-OE2 3.05Å; R63-E70 IonicContact CZ-OE1 3.44Å; R63-E70 IonicContact CZ-OE2 2.8Å; R63-E70 IonicContact NE-OE1 3.97Å; R63-E70 PolarHBondContact NE-OE1 2.91Å; R63-E70 IonicContact NE-OE2 3.39Å; R63-E70 PolarHBondContact NE-OE2 2.9Å; R63-E70 VanDerWaalsContact NH2-CD 3.27Å; R63-E70 IonicContact NH2-OE1 3.26Å; R63-E70 PolarHBondContact NH2-OE1 2.88Å; R63-E70 IonicContact NH2-OE2 3.06Å; Q67-E70 HydrophobicContact CB-CG 4.14Å; Q67-E70 WeakPolarHBondContact CB-OE2 3.36Å; Q67-E70 WeakPolarHBondContact O-CB 3.27Å; Q67-E70 PolarHBondContact O-N 3.01Å; P68-E70 VanDerWaalsContact C-N 3.32Å; P68-E70 PolarHBondContact O-N 3.23Å
71	C	92.1	Very high	90.1	Very high	6 Å²	6	58.2 Å²	58.2	4%	0.041	31%	0.306	C	S	.	.	S	Bend	trans	-107.5	156.8	175.8	51.1	0	0	0	0	112.2	Q38 V54 G69 G73 C174 V175 Y176	Q38-C71 PolarHBondContact NE2-O 2.91Å; V54-C71 WeakPolarHBondContact CG1-O 3.37Å; G69-C71 PolarHBondContact O-N 2.8Å; C71-G73 PolarHBondContact O-N 3.44Å; C71-C174 HydrophobicContact CB-CB 3.63Å; C71-C174 WeakPolarHBondContact CB-SG 3.28Å; C71-C174 WeakPolarHBondContact SG-CB 3.33Å; C71-C174 CovalentContact SG-SG 2.06Å; C71-C174 PolarHBondContact SG-SG 2.93Å; C71-V175 CarbonylContact C-O 3.57Å; C71-V175 VanDerWaalsContact CA-O 3.26Å; C71-V175 WeakPolarHBondContact CA-O 3.34Å; C71-V175 VanDerWaalsContact CB-O 3.3Å; C71-V175 WeakPolarHBondContact CB-O 3.35Å; C71-Y176 HydrophobicContact CB-CD1 3.88Å; C71-Y176 HydrophobicContact CB-CD2 3.68Å; C71-Y176 HydrophobicContact CB-CE1 3.77Å; C71-Y176 HydrophobicContact CB-CE2 3.59Å; C71-Y176 HydrophobicContact CB-CG 3.84Å
72	W	93.4	Very high	90.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	109.4	158.4	167.2	50.9	0	0	0	108.1	P56 V58 V59 F74 H80 L81 I163 C174 V175	P56-W72 HydrophobicContact CB-CD2 4.31Å; P56-W72 HydrophobicContact CB-CG 4.02Å; P56-W72 HydrophobicContact CG-CG 4.43Å; V58-W72 HydrophobicContact CG1-CB 3.77Å; V59-W72 HydrophobicContact CG1-CB 3.55Å; V59-W72 HydrophobicContact CG1-CE3 4.32Å; V59-W72 HydrophobicContact CG1-CG 4.47Å; W72-F74 HydrophobicContact CD2-CD1 4.12Å; W72-F74 AromaticContact CE2-CD1 3.86Å; W72-F74 HydrophobicContact CE3-CD1 4.09Å; W72-F74 HydrophobicContact CE3-CE1 4.28Å; W72-F74 AromaticContact CH2-CD1 3.54Å; W72-F74 HydrophobicContact CH2-CD1 3.54Å; W72-F74 AromaticContact CH2-CE1 3.8Å; W72-F74 HydrophobicContact CH2-CE1 3.8Å; W72-F74 HydrophobicContact CH2-CG 4.36Å; W72-F74 HydrophobicContact CZ2-CB 4.16Å; W72-F74 AromaticContact CZ2-CD1 3.6Å; W72-F74 HydrophobicContact CZ2-CD1 3.6Å; W72-F74 HydrophobicContact CZ2-CE1 4.33Å; W72-F74 HydrophobicContact CZ2-CG 4.15Å; W72-F74 AromaticContact CZ3-CD1 3.81Å; W72-F74 HydrophobicContact CZ3-CD1 3.81Å; W72-F74 AromaticContact CZ3-CE1 3.78Å; W72-F74 HydrophobicContact CZ3-CE1 3.78Å; W72-H80 VanDerWaalsContact CH2-O 3.26Å; W72-H80 WeakPolarHBondContact CH2-O 3.35Å; W72-L81 HydrophobicContact CE3-CB 4.43Å; W72-L81 HydrophobicContact CE3-CD2 4.4Å; W72-L81 HydrophobicContact CH2-CB 3.85Å; W72-L81 HydrophobicContact CZ3-CB 3.77Å; W72-L81 HydrophobicContact CZ3-CD2 4.49Å; W72-I163 HydrophobicContact CZ3-CD1 4.42Å; W72-C174 WeakPolarHBondContact O-CA 3.45Å; W72-V175 HydrophobicContact CE3-CB 3.99Å; W72-V175 HydrophobicContact CE3-CG2 3.84Å; W72-V175 HydrophobicContact CZ3-CG2 4.02Å; W72-V175 PolarHBondContact N-O 3.13Å; W72-V175 PolarHBondContact O-N 3.25Å
73	G	93.1	Very high	91	Very high	2 Å²	2	53 Å²	53	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.1	175.8	0	0	0	0	0	111.7	V34 H35 C71 T173 C174	V34-G73 CarbonylContact C-O 3.53Å; V34-G73 WeakPolarHBondContact CA-O 3.47Å; H35-G73 PolarHBondContact N-O 3.16Å; C71-G73 PolarHBondContact O-N 3.44Å; G73-T173 VanDerWaalsContact CA-O 3.28Å; G73-T173 WeakPolarHBondContact CA-O 3.46Å; G73-C174 VanDerWaalsContact CA-SG 3.56Å
74	F	93.3	Very high	91.6	Very high	1 Å²	1	52 Å²	52	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	156.2	173.5	59.5	-94.6	0	0	0	111.1	W72 Q78 I163 H172 T173 V175	W72-F74 HydrophobicContact CD2-CD1 4.12Å; W72-F74 AromaticContact CE2-CD1 3.86Å; W72-F74 HydrophobicContact CE3-CD1 4.09Å; W72-F74 HydrophobicContact CE3-CE1 4.28Å; W72-F74 AromaticContact CH2-CD1 3.54Å; W72-F74 HydrophobicContact CH2-CD1 3.54Å; W72-F74 AromaticContact CH2-CE1 3.8Å; W72-F74 HydrophobicContact CH2-CE1 3.8Å; W72-F74 HydrophobicContact CH2-CG 4.36Å; W72-F74 HydrophobicContact CZ2-CB 4.16Å; W72-F74 AromaticContact CZ2-CD1 3.6Å; W72-F74 HydrophobicContact CZ2-CD1 3.6Å; W72-F74 HydrophobicContact CZ2-CE1 4.33Å; W72-F74 HydrophobicContact CZ2-CG 4.15Å; W72-F74 AromaticContact CZ3-CD1 3.81Å; W72-F74 HydrophobicContact CZ3-CD1 3.81Å; W72-F74 AromaticContact CZ3-CE1 3.78Å; W72-F74 HydrophobicContact CZ3-CE1 3.78Å; F74-Q78 WeakPolarHBondContact CD2-O 3.35Å; F74-Q78 WeakPolarHBondContact CE2-O 3.32Å; F74-I163 HydrophobicContact CE1-CD1 3.57Å; F74-I163 HydrophobicContact CZ-CB 4.01Å; F74-I163 HydrophobicContact CZ-CD1 3.6Å; F74-I163 HydrophobicContact CZ-CG1 4.41Å; F74-I163 HydrophobicContact CZ-CG2 4.08Å; F74-H172 WeakPolarHBondContact O-CA 3.35Å; F74-H172 WeakPolarHBondContact O-CB 3.36Å; F74-T173 HydrophobicContact CE1-CG2 3.99Å; F74-T173 HydrophobicContact CE2-CG2 4.19Å; F74-T173 HydrophobicContact CZ-CG2 3.55Å; F74-T173 PolarHBondContact N-O 3.12Å; F74-T173 PolarHBondContact O-N 2.79Å; F74-V175 HydrophobicContact CE1-CG2 4.1Å
75	E	92.8	Very high	92.2	Very high	138 Å²	138	46.2 Å²	46.2	65%	0.645	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	140.8	-176.9	-172.7	170.8	-179.3	0	0	112.6
76	G	94.3	Very high	92.4	Very high	25 Å²	25	37.5 Å²	37.5	26%	0.258	22%	0.215	S	C	.	.	S	Bend	trans	73.7	-157.9	-179.6	0	0	0	0	0	114.3	K171 H172 T173	G76-K171 PolarHBondContact N-O 2.83Å; G76-H172 CarbonylContact O-C 3.1Å; G76-H172 VanDerWaalsContact O-CA 3.3Å; G76-H172 WeakPolarHBondContact O-CA 3.5Å; G76-T173 PolarHBondContact O-N 3.25Å; G76-T173 VanDerWaalsContact O-N 3.13Å; G76-T173 PolarHBondContact O-OG1 3.35Å
77	S	96.8	Very high	92.3	Very high	44 Å²	44	40.9 Å²	40.9	31%	0.308	23%	0.23	S	C	.	.	S	Bend	trans	-108.1	-3.7	-176.3	59.5	0	0	0	0	113.9	S165 T173	S77-S165 CarbonylContact O-C 3.48Å; S77-S165 WeakPolarHBondContact O-CA 3.38Å; S77-S165 PolarHBondContact O-N 2.92Å; S77-T173 WeakPolarHBondContact CA-OG1 3.3Å
78	Q	97	Very high	92.3	Very high	140 Å²	140	39.6 Å²	39.6	65%	0.654	22%	0.22	S	C	*	.			trans	-124.2	135.5	-177.2	-68.3	174.8	22.2	0	0	110.1	F74 I163 S164	F74-Q78 WeakPolarHBondContact CD2-O 3.35Å; F74-Q78 WeakPolarHBondContact CE2-O 3.32Å; Q78-I163 VanDerWaalsContact CA-O 3.27Å; Q78-I163 WeakPolarHBondContact CA-O 3.38Å; Q78-S164 VanDerWaalsContact CG-O 3.26Å; Q78-S164 WeakPolarHBondContact CG-O 3.41Å
79	G	95.6	Very high	92.2	Very high	4 Å²	4	36 Å²	36	4%	0.041	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	160	-178.7	0	0	0	0	0	111.4	S32 I163	S32-G79 VanDerWaalsContact OG-CA 3.29Å; S32-G79 WeakPolarHBondContact OG-CA 3.08Å; G79-I163 PolarHBondContact N-O 3.33Å; G79-I163 VanDerWaalsContact N-O 3.09Å; G79-I163 WeakPolarHBondContact O-CA 3.11Å; G79-I163 WeakPolarHBondContact O-CB 3.43Å; G79-I163 PolarHBondContact O-N 2.79Å
80	H	96.2	Very high	92.5	Very high	68 Å²	68	36 Å²	36	32%	0.315	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	155.5	-175.1	57.2	-88.5	0	0	0	111.2	M30 P31 S32 W72 L161	M30-H80 PolarHBondContact O-CD2 3.3Å; M30-H80 VanDerWaalsContact O-CD2 3.32Å; P31-H80 CarbonylContact C-O 3.56Å; P31-H80 WeakPolarHBondContact CA-O 3.43Å; S32-H80 PolarHBondContact N-O 3.35Å; S32-H80 PolarHBondContact OG-CE1 3.37Å; S32-H80 PolarHBondContact OG-N 2.79Å; S32-H80 PolarHBondContact OG-ND1 3.26Å; W72-H80 VanDerWaalsContact CH2-O 3.26Å; W72-H80 WeakPolarHBondContact CH2-O 3.35Å; H80-L161 CarbonylContact C-O 3.54Å; H80-L161 VanDerWaalsContact CA-O 3.22Å; H80-L161 WeakPolarHBondContact CA-O 3.36Å
81	L	94.3	Very high	92.5	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	130.3	176.2	177.6	69.8	0	0	0	108.4	V26 P31 P56 V59 W72 I83 K160 L161	V26-L81 HydrophobicContact CB-CD1 4.22Å; V26-L81 HydrophobicContact CG1-CD1 3.36Å; V26-L81 HydrophobicContact CG2-CD1 3.86Å; V26-L81 HydrophobicContact CG2-CD2 4.32Å; V26-L81 HydrophobicContact CG2-CG 4.47Å; P31-L81 HydrophobicContact CB-CD1 3.75Å; P56-L81 HydrophobicContact CB-CD1 3.69Å; V59-L81 HydrophobicContact CG2-CD2 3.41Å; V59-L81 VanDerWaalsContact CG2-CD2 3.41Å; W72-L81 HydrophobicContact CE3-CB 4.43Å; W72-L81 HydrophobicContact CE3-CD2 4.4Å; W72-L81 HydrophobicContact CH2-CB 3.85Å; W72-L81 HydrophobicContact CZ3-CB 3.77Å; W72-L81 HydrophobicContact CZ3-CD2 4.49Å; L81-I83 HydrophobicContact CD2-CG2 4.21Å; L81-I83 HydrophobicContact CG-CG2 4.19Å; L81-K160 CarbonylContact O-C 3.53Å; L81-K160 WeakPolarHBondContact O-CA 3.1Å; L81-L161 PolarHBondContact N-O 2.87Å; L81-L161 PolarHBondContact O-N 2.97Å
82	A	94.3	Very high	92.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	142	169.5	0	0	0	0	0	111.3	L27 M30 W128 I159 K160	L27-A82 HydrophobicContact CB-CB 4.24Å; L27-A82 HydrophobicContact CD1-CB 3.78Å; L27-A82 HydrophobicContact CG-CB 4.22Å; L27-A82 PolarHBondContact N-O 3.1Å; M30-A82 HydrophobicContact CB-CB 4.03Å; M30-A82 HydrophobicContact CG-CB 4.05Å; M30-A82 PolarHBondContact O-N 3.45Å; M30-A82 HydrophobicContact SD-CB 3.7Å; A82-W128 HydrophobicContact CB-CH2 3.97Å; A82-W128 HydrophobicContact CB-CZ2 4.2Å; A82-I159 CarbonylContact C-O 3.56Å; A82-I159 WeakPolarHBondContact CA-O 3.32Å; A82-K160 HydrophobicContact CB-CB 4.37Å; A82-K160 HydrophobicContact CB-CG 4.48Å
83	I	93	Very high	92.4	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.1	179.1	67.5	173.8	0	0	0	110	K25 V26 L60 L81 L85 Y158 I159 F178 V180	K25-I83 CarbonylContact O-C 3.5Å; K25-I83 VanDerWaalsContact O-CA 3.29Å; K25-I83 WeakPolarHBondContact O-CA 3.42Å; V26-I83 HydrophobicContact CG2-CG2 4.27Å; L60-I83 HydrophobicContact CD1-CB 4.35Å; L60-I83 HydrophobicContact CD1-CG2 3.84Å; L60-I83 HydrophobicContact CD2-CD1 3.93Å; L60-I83 HydrophobicContact CD2-CG2 3.94Å; L60-I83 HydrophobicContact CG-CG2 4.38Å; L81-I83 HydrophobicContact CD2-CG2 4.21Å; L81-I83 HydrophobicContact CG-CG2 4.19Å; I83-L85 HydrophobicContact CD1-CD2 3.99Å; I83-L85 HydrophobicContact CG1-CD2 4.33Å; I83-Y158 CarbonylContact O-C 3.59Å; I83-Y158 VanDerWaalsContact O-CA 3.32Å; I83-Y158 WeakPolarHBondContact O-CA 3.27Å; I83-I159 HydrophobicContact CD1-CB 4.39Å; I83-I159 HydrophobicContact CG1-CB 3.91Å; I83-I159 WeakPolarHBondContact CG1-O 3.27Å; I83-I159 PolarHBondContact N-O 3.46Å; I83-I159 PolarHBondContact O-N 3.05Å; I83-F178 HydrophobicContact CD1-CD1 4.18Å; I83-F178 HydrophobicContact CD1-CE1 4.11Å; I83-V180 HydrophobicContact CD1-CG2 3.89Å
84	A	92.6	Very high	92.4	Very high	20 Å²	20	36.8 Å²	36.8	17%	0.165	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.6	164	0	0	0	0	0	108.4	A24 K25 L27 Y158	A24-A84 CarbonylContact C-O 3.48Å; A24-A84 WeakPolarHBondContact CA-O 3.18Å; A24-A84 WeakPolarHBondContact CB-O 3.39Å; K25-A84 PolarHBondContact N-O 3.41Å; K25-A84 PolarHBondContact O-N 3.04Å; L27-A84 HydrophobicContact CD2-CB 3.91Å; A84-Y158 HydrophobicContact CB-CD1 3.88Å; A84-Y158 HydrophobicContact CB-CE1 3.84Å
85	L	90.8	Very high	92.5	Very high	6 Å²	6	37 Å²	37	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	158	169.8	-56	-179	0	0	0	109.9	I83 H87 V89 R157 I159 V180	I83-L85 HydrophobicContact CD1-CD2 3.99Å; I83-L85 HydrophobicContact CG1-CD2 4.33Å; L85-H87 VanDerWaalsContact C-N 3.32Å; L85-H87 WeakPolarHBondContact CB-O 3.4Å; L85-H87 PolarHBondContact O-N 3.18Å; L85-V89 HydrophobicContact CD1-CB 3.89Å; L85-V89 HydrophobicContact CD1-CG2 3.89Å; L85-R157 WeakPolarHBondContact CB-O 3.34Å; L85-R157 WeakPolarHBondContact CG-O 3.42Å; L85-R157 PolarHBondContact N-O 3.02Å; L85-I159 HydrophobicContact CD1-CD1 4.46Å; L85-I159 HydrophobicContact CD1-CG1 3.78Å; L85-I159 HydrophobicContact CD2-CG1 4.25Å; L85-I159 HydrophobicContact CG-CG1 4.05Å; L85-V180 HydrophobicContact CD1-CG1 4.2Å; L85-V180 HydrophobicContact CD2-CB 4.17Å; L85-V180 HydrophobicContact CD2-CG1 4.33Å; L85-V180 HydrophobicContact CD2-CG2 4.27Å
86	S	86.4	Confident	92.6	Very high	26 Å²	26	30.5 Å²	30.5	18%	0.182	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	-34.7	178.4	58	0	0	0	0	113.2	T22	T22-S86 WeakPolarHBondContact O-CB 3.16Å; T22-S86 PolarHBondContact O-OG 3.02Å; T22-S86 PolarHBondContact OG1-OG 3.01Å
87	H	87.6	Confident	92.6	Very high	87 Å²	87	29.3 Å²	29.3	40%	0.403	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	166.2	178.8	-59.6	76.6	0	0	0	109.2	L85 V89 F184	L85-H87 VanDerWaalsContact C-N 3.32Å; L85-H87 WeakPolarHBondContact CB-O 3.4Å; L85-H87 PolarHBondContact O-N 3.18Å; H87-V89 PolarHBondContact O-N 3.49Å; H87-F184 HydrophobicContact CB-CD1 3.72Å; H87-F184 HydrophobicContact CB-CE1 3.93Å; H87-F184 AromaticContact ND1-CE1 3.98Å
88	R	90	Very high	92.5	Very high	87 Å²	87	27.5 Å²	27.5	33%	0.328	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	129.6	168.5	-74.2	178.1	176	176.5	-1	109	D123 A155 F156 R157 A185	R88-D123 IonicContact CZ-OD1 3.94Å; R88-D123 IonicContact NH2-OD1 2.8Å; R88-D123 PolarHBondContact NH2-OD1 3.36Å; R88-D123 IonicContact NH2-OD2 3.34Å; R88-D123 PolarHBondContact NH2-OD2 2.79Å; R88-A155 HydrophobicContact CB-CB 4.28Å; R88-F156 WeakPolarHBondContact CA-O 2.88Å; R88-R157 HydrophobicContact CG-CB 4.03Å; R88-A185 HydrophobicContact CB-CB 4.03Å; R88-A185 PolarHBondContact O-N 2.89Å
89	V	88.9	Confident	92.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.7	-175.3	178.1	0	0	0	0	109.8	V18 L85 H87 V91 A155 F156 K183 F184	V18-V89 HydrophobicContact CB-CG2 4.28Å; V18-V89 HydrophobicContact CG1-CG2 3.67Å; V18-V89 HydrophobicContact CG2-CG1 4.19Å; V18-V89 HydrophobicContact CG2-CG2 4.25Å; L85-V89 HydrophobicContact CD1-CB 3.89Å; L85-V89 HydrophobicContact CD1-CG2 3.89Å; H87-V89 PolarHBondContact O-N 3.49Å; V89-V91 HydrophobicContact CB-CG2 4.42Å; V89-V91 HydrophobicContact CG1-CG2 4.21Å; V89-V91 PolarHBondContact O-N 2.9Å; V89-V91 VanDerWaalsContact O-N 3.16Å; V89-A155 WeakPolarHBondContact O-CA 3.2Å; V89-F156 PolarHBondContact N-O 3.28Å; V89-F156 PolarHBondContact O-N 2.92Å; V89-K183 CarbonylContact C-O 3.58Å; V89-K183 WeakPolarHBondContact CA-O 3.26Å; V89-F184 HydrophobicContact CG2-CD1 4.14Å; V89-F184 HydrophobicContact CG2-CE1 4.44Å
90	V	91.1	Very high	92.2	Very high	46 Å²	46	22.9 Å²	22.9	28%	0.279	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	96.6	164.1	-176.3	0	0	0	0	107.5	R153 A155 G182 K183	V90-R153 HydrophobicContact CG1-CB 4.1Å; V90-A155 HydrophobicContact CG2-CB 4.01Å; V90-G182 WeakPolarHBondContact O-CA 3.36Å; V90-K183 PolarHBondContact N-O 3.29Å; V90-K183 PolarHBondContact O-N 3.45Å
91	V	89.9	Confident	92	Very high	7 Å²	7	22.9 Å²	22.9	4%	0.042	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	131.2	-172.9	-165.3	0	0	0	0	110.2	V89 V94 L148 F156 I159 V180 H181	V89-V91 HydrophobicContact CB-CG2 4.42Å; V89-V91 HydrophobicContact CG1-CG2 4.21Å; V89-V91 PolarHBondContact O-N 2.9Å; V89-V91 VanDerWaalsContact O-N 3.16Å; V91-V94 HydrophobicContact CG1-CG1 4.46Å; V91-L148 HydrophobicContact CB-CD1 3.79Å; V91-L148 HydrophobicContact CG1-CD1 3.28Å; V91-F156 HydrophobicContact CG2-CD2 4.36Å; V91-I159 HydrophobicContact CG2-CD1 3.81Å; V91-V180 HydrophobicContact CB-CG1 4.34Å; V91-V180 HydrophobicContact CG1-CG1 3.52Å; V91-V180 HydrophobicContact CG2-CG1 3.79Å; V91-H181 WeakPolarHBondContact CA-O 3.35Å; V91-H181 VanDerWaalsContact CG1-O 3.28Å; V91-H181 WeakPolarHBondContact CG1-O 3.4Å
92	N	89.7	Confident	91.8	Very high	44 Å²	44	31.7 Å²	31.7	24%	0.235	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-29.6	178.2	63.8	7.3	0	0	0	113	L148 H181 G182	N92-L148 PolarHBondContact O-N 2.86Å; N92-H181 PolarHBondContact N-O 3.07Å; N92-H181 VanDerWaalsContact OD1-C 3.23Å; N92-H181 PolarHBondContact OD1-O 3.39Å; N92-G182 PolarHBondContact OD1-N 3.45Å
93	H	92	Very high	91.6	Very high	27 Å²	27	36.1 Å²	36.1	13%	0.125	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	158.1	177.3	-54.2	74.4	0	0	0	111	T145 F146 H181	H93-T145 HydrophobicContact CB-CG2 3.7Å; H93-F146 CarbonylContact C-O 3.58Å; H93-F146 WeakPolarHBondContact CA-O 3.28Å; H93-F146 WeakPolarHBondContact CB-O 3.33Å; H93-H181 HydrophobicContact CB-CB 4.08Å; H93-H181 PolarHBondContact N-O 3.26Å; H93-H181 PolarHBondContact O-N 2.8Å
94	V	93.4	Very high	91.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.9	165.1	-65.4	0	0	0	0	109.8	V91 F116 V118 F134 T145 F146 L148 F178 R179	V91-V94 HydrophobicContact CG1-CG1 4.46Å; V94-F116 HydrophobicContact CG2-CE2 4.38Å; V94-V118 HydrophobicContact CG1-CG1 4.21Å; V94-V118 HydrophobicContact CG1-CG2 4.21Å; V94-V118 HydrophobicContact CG2-CG2 4.04Å; V94-F134 HydrophobicContact CG2-CE2 4.14Å; V94-T145 CarbonylContact O-C 3.57Å; V94-T145 WeakPolarHBondContact O-CA 3.18Å; V94-F146 HydrophobicContact CG2-CB 4.05Å; V94-F146 HydrophobicContact CG2-CD2 4.39Å; V94-F146 PolarHBondContact N-O 2.81Å; V94-F146 PolarHBondContact O-N 2.97Å; V94-L148 HydrophobicContact CG1-CD1 4.42Å; V94-F178 HydrophobicContact CB-CE2 3.95Å; V94-F178 HydrophobicContact CB-CZ 4.35Å; V94-F178 HydrophobicContact CG1-CE2 4.22Å; V94-F178 HydrophobicContact CG1-CZ 4.11Å; V94-R179 CarbonylContact C-O 3.44Å; V94-R179 WeakPolarHBondContact CA-O 3.2Å
95	T	94.9	Very high	91	Very high	6 Å²	6	41.9 Å²	41.9	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.9	169.2	-57.4	0	0	0	0	109.2	L143 Q144 T145 F178 R179 H181	T95-L143 HydrophobicContact CG2-CB 4.1Å; T95-L143 HydrophobicContact CG2-CD2 4.23Å; T95-Q144 CarbonylContact C-O 3.56Å; T95-Q144 WeakPolarHBondContact CA-O 3.11Å; T95-Q144 WeakPolarHBondContact CG2-O 3.42Å; T95-T145 PolarHBondContact OG1-OG1 3.16Å; T95-F178 CarbonylContact O-C 3.48Å; T95-F178 WeakPolarHBondContact O-CA 3.49Å; T95-F178 WeakPolarHBondContact O-CD2 3.15Å; T95-R179 PolarHBondContact N-O 2.84Å; T95-R179 PolarHBondContact O-N 3.47Å; T95-H181 PolarHBondContact OG1-NE2 3.07Å
96	L	95.3	Very high	90.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.4	169.5	-165.2	71.4	0	0	0	109.2	P113 F116 Y136 Q144 F146 L161 V175 F178	L96-P113 HydrophobicContact CD2-CB 3.88Å; L96-P113 HydrophobicContact CD2-CG 4.06Å; L96-F116 HydrophobicContact CB-CE1 4.44Å; L96-F116 HydrophobicContact CB-CZ 4.19Å; L96-F116 HydrophobicContact CD2-CD1 3.73Å; L96-F116 HydrophobicContact CD2-CE1 3.64Å; L96-F116 HydrophobicContact CD2-CG 4.22Å; L96-F116 HydrophobicContact CD2-CZ 4.07Å; L96-Y136 HydrophobicContact CB-CD2 4.3Å; L96-Y136 HydrophobicContact CD2-CD2 4.15Å; L96-Y136 HydrophobicContact CD2-CG 4.41Å; L96-Y136 HydrophobicContact CG-CD2 4.44Å; L96-Q144 PolarHBondContact N-O 2.77Å; L96-Q144 PolarHBondContact O-N 2.88Å; L96-F146 HydrophobicContact CB-CE2 4.12Å; L96-L161 HydrophobicContact CD1-CD1 4.33Å; L96-L161 HydrophobicContact CD1-CD2 3.87Å; L96-V175 HydrophobicContact CD1-CG1 3.92Å; L96-F178 HydrophobicContact CD1-CB 4.41Å; L96-F178 HydrophobicContact CD1-CD2 3.88Å
97	G	94.4	Very high	90.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139	-176.6	0	0	0	0	0	113.7	P142 Y176 D177	G97-P142 CarbonylContact C-O 3.6Å; G97-P142 VanDerWaalsContact CA-O 3.27Å; G97-P142 WeakPolarHBondContact CA-O 3.24Å; G97-Y176 WeakPolarHBondContact O-CB 3.29Å; G97-Y176 PolarHBondContact O-N 3.02Å; G97-Y176 VanDerWaalsContact O-N 3.11Å; G97-D177 PolarHBondContact N-O 2.67Å; G97-D177 PolarHBondContact O-N 3.09Å
98	H	95.4	Very high	91.1	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.028	25%	0.252	C	S	.	.			trans	-137.1	151.2	167.3	-162.1	-86.2	0	0	0	111.7	L66 S111 A112 Y136 P142 C174 Y176	L66-H98 WeakPolarHBondContact CD1-O 3.36Å; H98-S111 PolarHBondContact NE2-OG 2.97Å; H98-A112 HydrophobicContact CB-CB 4.14Å; H98-A112 WeakPolarHBondContact CD2-CA 3.49Å; H98-A112 VanDerWaalsContact CD2-CB 3.43Å; H98-A112 WeakPolarHBondContact CD2-CB 3.46Å; H98-A112 WeakPolarHBondContact NE2-CA 3.34Å; H98-A112 PolarHBondContact NE2-N 3.31Å; H98-Y136 HydrophobicContact CB-CE1 4.04Å; H98-Y136 HydrophobicContact CB-CE2 4.44Å; H98-Y136 WeakPolarHBondContact CB-OH 3.4Å; H98-P142 PolarHBondContact N-O 2.75Å; H98-P142 WeakPolarHBondContact O-CB 3.26Å; H98-C174 PolarHBondContact CD2-O 2.88Å; H98-C174 PolarHBondContact NE2-O 3Å; H98-Y176 AromaticContact CD2-CD2 3.73Å; H98-Y176 AromaticContact CD2-CE2 3.98Å; H98-Y176 AromaticContact CE1-CE2 3.97Å; H98-Y176 AromaticContact NE2-CD2 4Å; H98-Y176 AromaticContact NE2-CE2 3.73Å
99	L	94.8	Very high	91.3	Very high	7 Å²	7	40.8 Å²	40.8	4%	0.037	24%	0.237	C	C	.	.			trans	-54.2	134.2	174.7	-171.5	74.5	0	0	0	111.2	L66 P68 L103 Y176	L66-L99 HydrophobicContact CB-CD1 4.26Å; L66-L99 VanDerWaalsContact O-CD1 3.27Å; L66-L99 WeakPolarHBondContact O-CD1 3.43Å; P68-L99 HydrophobicContact CB-CD2 4.21Å; P68-L99 HydrophobicContact CG-CD1 4.3Å; P68-L99 HydrophobicContact CG-CD2 4Å; L99-L103 HydrophobicContact CD1-CB 3.83Å; L99-L103 HydrophobicContact CD1-CD1 4.23Å; L99-L103 HydrophobicContact CD2-CB 4.25Å; L99-L103 HydrophobicContact CG-CB 3.94Å; L99-Y176 HydrophobicContact CB-CD2 4.13Å; L99-Y176 HydrophobicContact CB-CE1 4.09Å; L99-Y176 HydrophobicContact CB-CE2 3.65Å; L99-Y176 HydrophobicContact CD1-CE1 4.48Å
100	P	91.8	Very high	91.6	Very high	41 Å²	41	47.1 Å²	47.1	27%	0.266	26%	0.261	S	S	.	.			trans	-59.6	145.2	173.3	-11.7	19.7	0	0	0	111.8	M102 L103 S104 P142	P100-M102 PolarHBondContact O-N 3.38Å; P100-M102 VanDerWaalsContact O-N 3.15Å; P100-L103 HydrophobicContact CG-CD1 4.08Å; P100-L103 HydrophobicContact CG-CG 4.39Å; P100-L103 PolarHBondContact O-N 3.49Å; P100-S104 PolarHBondContact O-N 3.42Å; P100-P142 HydrophobicContact CB-CG 3.99Å; P100-P142 HydrophobicContact CG-CB 4.06Å; P100-P142 HydrophobicContact CG-CG 3.6Å
101	K	91	Very high	91.9	Very high	68 Å²	68	45.8 Å²	45.8	30%	0.296	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-52.3	-39.5	178.6	-71.9	-179.4	173.4	-178.8	0	113.2	L103 S104 S109 E138 N139	K101-L103 PolarHBondContact O-N 3.22Å; K101-S104 VanDerWaalsContact O-CB 3.29Å; K101-S104 WeakPolarHBondContact O-CB 3.48Å; K101-S104 PolarHBondContact O-N 3.11Å; K101-S109 WeakPolarHBondContact CE-OG 3.36Å; K101-E138 VanDerWaalsContact CE-O 3.29Å; K101-E138 WeakPolarHBondContact CE-O 3.49Å; K101-E138 IonicContact NZ-OE2 3.58Å; K101-N139 PolarHBondContact NZ-OD1 3.28Å
102	M	89.9	Confident	92.2	Very high	186 Å²	186	45.4 Å²	45.4	92%	0.916	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-63	-24.5	179.4	-66.7	-175.1	68.2	0	0	114.2	P100	P100-M102 PolarHBondContact O-N 3.38Å; P100-M102 VanDerWaalsContact O-N 3.15Å
103	L	90.1	Very high	92.6	Very high	93 Å²	93	43.3 Å²	43.3	49%	0.487	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-97.8	-7.4	177.5	-59.5	-176.5	0	0	0	112.1	P68 L99 P100 K101	P68-L103 WeakPolarHBondContact CG-O 3.43Å; L99-L103 HydrophobicContact CD1-CB 3.83Å; L99-L103 HydrophobicContact CD1-CD1 4.23Å; L99-L103 HydrophobicContact CD2-CB 4.25Å; L99-L103 HydrophobicContact CG-CB 3.94Å; P100-L103 HydrophobicContact CG-CD1 4.08Å; P100-L103 HydrophobicContact CG-CG 4.39Å; P100-L103 PolarHBondContact O-N 3.49Å; K101-L103 PolarHBondContact O-N 3.22Å
104	S	88.9	Confident	92.9	Very high	23 Å²	23	45.7 Å²	45.7	16%	0.161	25%	0.251	C	S	.	.	S	Bend	trans	-71	129.8	177.1	-177.2	0	0	0	0	110.4	P100 K101 T106 G107 N108	P100-S104 PolarHBondContact O-N 3.42Å; K101-S104 VanDerWaalsContact O-CB 3.29Å; K101-S104 WeakPolarHBondContact O-CB 3.48Å; K101-S104 PolarHBondContact O-N 3.11Å; S104-T106 PolarHBondContact O-N 2.81Å; S104-T106 VanDerWaalsContact O-N 3.1Å; S104-T106 PolarHBondContact OG-OG1 3.21Å; S104-G107 PolarHBondContact O-N 2.8Å; S104-N108 WeakPolarHBondContact CB-O 3.49Å; S104-N108 PolarHBondContact OG-O 2.9Å
105	P	85.4	Confident	93.1	Very high	120 Å²	120	48.4 Å²	48.4	78%	0.779	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-27.2	176.5	-26.1	34.8	0	0	0	114
106	T	86.5	Confident	93.3	Very high	96 Å²	96	48.1 Å²	48.1	59%	0.589	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-3.1	179	57.9	0	0	0	0	113.1	S104 N108	S104-T106 PolarHBondContact O-N 2.81Å; S104-T106 VanDerWaalsContact O-N 3.1Å; S104-T106 PolarHBondContact OG-OG1 3.21Å; T106-N108 WeakPolarHBondContact CB-ND2 3.08Å; T106-N108 PolarHBondContact O-N 2.82Å; T106-N108 VanDerWaalsContact OG1-CG 3.25Å; T106-N108 PolarHBondContact OG1-ND2 3.46Å; T106-N108 PolarHBondContact OG1-OD1 2.65Å; T106-N108 VanDerWaalsContact OG1-OD1 3.08Å
107	G	88.4	Confident	93.4	Very high	49 Å²	49	48.5 Å²	48.5	51%	0.505	26%	0.264	S	S	.	.	S	Bend	trans	67.6	5.8	-173	0	0	0	0	0	114.8	S104	S104-G107 PolarHBondContact O-N 2.8Å
108	N	91.6	Very high	93.5	Very high	33 Å²	33	48.5 Å²	48.5	18%	0.176	26%	0.264	C	S	.	.			trans	-124.2	169.9	179.5	68.7	55.7	0	0	0	112.6	S104 T106 W110	S104-N108 WeakPolarHBondContact CB-O 3.49Å; S104-N108 PolarHBondContact OG-O 2.9Å; T106-N108 WeakPolarHBondContact CB-ND2 3.08Å; T106-N108 PolarHBondContact O-N 2.82Å; T106-N108 VanDerWaalsContact OG1-CG 3.25Å; T106-N108 PolarHBondContact OG1-ND2 3.46Å; T106-N108 PolarHBondContact OG1-OD1 2.65Å; T106-N108 VanDerWaalsContact OG1-OD1 3.08Å; N108-W110 HydrophobicContact CB-CD2 4.26Å; N108-W110 HydrophobicContact CB-CG 4.32Å; N108-W110 PolarHBondContact OD1-N 2.82Å
109	S	94.1	Very high	93.5	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.028	27%	0.272	C	S	.	.			trans	-122.5	25.6	-177.3	45.2	0	0	0	0	111.9	K101 S111 A112 E138	K101-S109 WeakPolarHBondContact CE-OG 3.36Å; S109-S111 PolarHBondContact O-N 3.48Å; S109-S111 VanDerWaalsContact O-N 3.11Å; S109-A112 WeakPolarHBondContact O-CB 3.26Å; S109-A112 PolarHBondContact O-N 3.4Å; S109-E138 WeakPolarHBondContact OG-CB 3.17Å; S109-E138 PolarHBondContact OG-OE2 2.87Å
110	W	95.8	Very high	93.5	Very high	133 Å²	133	50.1 Å²	50.1	50%	0.504	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.8	-175.7	-63.8	-23.1	0	0	0	113.3	N108 A112 W167 G168 H169	N108-W110 HydrophobicContact CB-CD2 4.26Å; N108-W110 HydrophobicContact CB-CG 4.32Å; N108-W110 PolarHBondContact OD1-N 2.82Å; W110-A112 PolarHBondContact O-N 2.88Å; W110-W167 CarbonylContact O-C 3.35Å; W110-W167 WeakPolarHBondContact O-CA 3.39Å; W110-W167 PolarHBondContact O-N 2.81Å; W110-G168 PolarHBondContact O-N 3.17Å; W110-H169 VanDerWaalsContact C-CB 3.42Å; W110-H169 HydrophobicContact CB-CB 3.89Å; W110-H169 VanDerWaalsContact O-CB 3.31Å; W110-H169 WeakPolarHBondContact O-CB 3.3Å; W110-H169 PolarHBondContact O-N 3.37Å; W110-H169 VanDerWaalsContact O-N 3.07Å
111	S	95.9	Very high	93.5	Very high	18 Å²	18	48.4 Å²	48.4	13%	0.126	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.2	175.7	64.1	0	0	0	0	113.4	H98 S109 T173 C174	H98-S111 PolarHBondContact NE2-OG 2.97Å; S109-S111 PolarHBondContact O-N 3.48Å; S109-S111 VanDerWaalsContact O-N 3.11Å; S111-T173 CarbonylContact O-C 3.36Å; S111-T173 WeakPolarHBondContact O-CA 3.21Å; S111-T173 WeakPolarHBondContact O-CG2 3.18Å; S111-C174 PolarHBondContact O-N 2.83Å
112	A	97.3	Very high	93.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	-68.4	142.7	178.9	0	0	0	0	0	110.3	H98 S109 W110 Y136 N166 W167	H98-A112 HydrophobicContact CB-CB 4.14Å; H98-A112 WeakPolarHBondContact CD2-CA 3.49Å; H98-A112 VanDerWaalsContact CD2-CB 3.43Å; H98-A112 WeakPolarHBondContact CD2-CB 3.46Å; H98-A112 WeakPolarHBondContact NE2-CA 3.34Å; H98-A112 PolarHBondContact NE2-N 3.31Å; S109-A112 WeakPolarHBondContact O-CB 3.26Å; S109-A112 PolarHBondContact O-N 3.4Å; W110-A112 PolarHBondContact O-N 2.88Å; A112-Y136 HydrophobicContact CB-CD1 4.32Å; A112-Y136 HydrophobicContact CB-CE1 4.11Å; A112-N166 VanDerWaalsContact O-CA 3.24Å; A112-N166 WeakPolarHBondContact O-CA 3.5Å; A112-N166 VanDerWaalsContact O-CB 3.27Å; A112-N166 WeakPolarHBondContact O-CB 3.25Å; A112-W167 PolarHBondContact O-N 3.25Å; A112-W167 VanDerWaalsContact O-N 3.11Å
113	P	97.8	Very high	93.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-54.9	143.6	168	-21.6	33.4	0	0	0	109.7	L96 Y136 I163 W167 T173 C174 V175	L96-P113 HydrophobicContact CD2-CB 3.88Å; L96-P113 HydrophobicContact CD2-CG 4.06Å; P113-Y136 WeakPolarHBondContact O-CB 3.43Å; P113-Y136 WeakPolarHBondContact O-CD1 3.39Å; P113-I163 HydrophobicContact CB-CD1 4.29Å; P113-I163 HydrophobicContact CB-CG1 4.34Å; P113-I163 HydrophobicContact CB-CG2 4.07Å; P113-I163 HydrophobicContact CG-CD1 4.07Å; P113-W167 VanDerWaalsContact O-CD1 3.31Å; P113-W167 PolarHBondContact O-NE1 3.36Å; P113-T173 HydrophobicContact CB-CG2 4.49Å; P113-T173 HydrophobicContact CG-CG2 4.05Å; P113-C174 WeakPolarHBondContact CD-O 3.37Å; P113-V175 HydrophobicContact CG-CG2 3.89Å
114	K	98	Very high	93.2	Very high	76 Å²	76	39.2 Å²	39.2	33%	0.33	22%	0.222	S	C	.	.			trans	-111.1	-76.9	177	176.7	177.2	179.5	-177.6	0	109.6	L135 Y136 S165 W167	K114-L135 HydrophobicContact CG-CD1 3.68Å; K114-L135 CarbonylContact O-C 3.57Å; K114-L135 WeakPolarHBondContact O-CA 3.35Å; K114-Y136 PolarHBondContact O-N 3.11Å; K114-S165 PolarHBondContact N-O 2.79Å; K114-W167 HydrophobicContact CB-CD2 4.2Å; K114-W167 HydrophobicContact CB-CG 4.13Å; K114-W167 HydrophobicContact CD-CD2 4.05Å; K114-W167 HydrophobicContact CD-CE3 4.11Å; K114-W167 HydrophobicContact CD-CH2 4.38Å; K114-W167 HydrophobicContact CD-CZ2 4.31Å; K114-W167 HydrophobicContact CD-CZ3 4.28Å; K114-W167 HydrophobicContact CG-CD2 4.09Å; K114-W167 HydrophobicContact CG-CH2 4.41Å; K114-W167 HydrophobicContact CG-CZ2 3.89Å
115	E	98.4	Very high	92.9	Very high	58 Å²	58	47.2 Å²	47.2	27%	0.271	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.3	175.2	-178.5	168.3	-175.1	0	0	109.9	F4 T133 L135 S164 S165	F4-E115 HydrophobicContact CE1-CG 3.88Å; F4-E115 WeakPolarHBondContact CE1-OE1 3.49Å; F4-E115 HydrophobicContact CZ-CG 4.39Å; F4-E115 WeakPolarHBondContact CZ-OE1 3.47Å; E115-T133 HydrophobicContact CG-CG2 4.09Å; E115-L135 HydrophobicContact CB-CD1 4.43Å; E115-S164 PolarHBondContact O-N 2.72Å; E115-S165 WeakPolarHBondContact CB-OG 3.17Å; E115-S165 PolarHBondContact N-OG 2.97Å; E115-S165 PolarHBondContact O-N 3.31Å
116	F	98.3	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.5	175.6	71.3	-83.4	0	0	0	111.4	V94 L96 V118 T133 F134 F146 L161 D162 I163	V94-F116 HydrophobicContact CG2-CE2 4.38Å; L96-F116 HydrophobicContact CB-CE1 4.44Å; L96-F116 HydrophobicContact CB-CZ 4.19Å; L96-F116 HydrophobicContact CD2-CD1 3.73Å; L96-F116 HydrophobicContact CD2-CE1 3.64Å; L96-F116 HydrophobicContact CD2-CG 4.22Å; L96-F116 HydrophobicContact CD2-CZ 4.07Å; F116-V118 HydrophobicContact CD2-CG2 4.19Å; F116-V118 HydrophobicContact CE2-CG2 4.04Å; F116-T133 WeakPolarHBondContact O-CA 3.47Å; F116-F134 HydrophobicContact CD1-CB 4.18Å; F116-F134 HydrophobicContact CD2-CB 4.48Å; F116-F134 HydrophobicContact CD2-CD2 4.19Å; F116-F134 HydrophobicContact CE1-CB 3.59Å; F116-F134 HydrophobicContact CE2-CB 3.94Å; F116-F134 AromaticContact CE2-CD2 3.58Å; F116-F134 HydrophobicContact CE2-CD2 3.58Å; F116-F134 HydrophobicContact CE2-CG 4.14Å; F116-F134 HydrophobicContact CZ-CB 3.46Å; F116-F134 VanDerWaalsContact CZ-CB 3.46Å; F116-F134 AromaticContact CZ-CD2 3.92Å; F116-F134 HydrophobicContact CZ-CD2 3.92Å; F116-F134 AromaticContact CZ-CG 3.99Å; F116-F134 HydrophobicContact CZ-CG 3.99Å; F116-F134 PolarHBondContact N-O 3.46Å; F116-F134 PolarHBondContact O-N 3.45Å; F116-F146 HydrophobicContact CE1-CD2 4.39Å; F116-F146 AromaticContact CE1-CE2 3.94Å; F116-F146 HydrophobicContact CE1-CE2 3.94Å; F116-F146 HydrophobicContact CE1-CZ 4.01Å; F116-F146 AromaticContact CZ-CD2 3.66Å; F116-F146 HydrophobicContact CZ-CD2 3.66Å; F116-F146 AromaticContact CZ-CE2 3.61Å; F116-F146 HydrophobicContact CZ-CE2 3.61Å; F116-F146 HydrophobicContact CZ-CG 4.17Å; F116-F146 HydrophobicContact CZ-CZ 4.1Å; F116-L161 HydrophobicContact CB-CD1 4.16Å; F116-L161 HydrophobicContact CD2-CD1 3.49Å; F116-L161 VanDerWaalsContact CD2-CD1 3.49Å; F116-L161 HydrophobicContact CE2-CD1 4.2Å; F116-L161 HydrophobicContact CG-CD1 4.1Å; F116-D162 CarbonylContact C-O 3.56Å; F116-D162 WeakPolarHBondContact CA-O 3.27Å; F116-D162 WeakPolarHBondContact CB-O 3.24Å; F116-I163 HydrophobicContact CB-CG1 4.2Å
117	S	97.5	Very high	93.2	Very high	7 Å²	7	49.9 Å²	49.9	5%	0.049	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	151.7	175.8	-63.3	0	0	0	0	110.4	G132 T133 D162	S117-G132 CarbonylContact C-O 3.59Å; S117-G132 VanDerWaalsContact CA-O 3.26Å; S117-G132 WeakPolarHBondContact CA-O 3.37Å; S117-T133 PolarHBondContact OG-OG1 3.4Å; S117-D162 PolarHBondContact N-O 3.1Å; S117-D162 PolarHBondContact O-N 2.95Å
118	V	96.1	Very high	93.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.2	175.1	-178.1	0	0	0	0	108.6	V94 F116 L131 G132 F134 I159 K160 F178	V94-V118 HydrophobicContact CG1-CG1 4.21Å; V94-V118 HydrophobicContact CG1-CG2 4.21Å; V94-V118 HydrophobicContact CG2-CG2 4.04Å; F116-V118 HydrophobicContact CD2-CG2 4.19Å; F116-V118 HydrophobicContact CE2-CG2 4.04Å; V118-L131 HydrophobicContact CG1-CD1 4.18Å; V118-L131 WeakPolarHBondContact O-CA 3.35Å; V118-L131 WeakPolarHBondContact O-CB 3.06Å; V118-L131 PolarHBondContact O-N 2.79Å; V118-G132 PolarHBondContact N-O 3.23Å; V118-G132 PolarHBondContact O-N 2.95Å; V118-F134 HydrophobicContact CB-CE2 4.31Å; V118-F134 HydrophobicContact CG2-CD2 4.21Å; V118-F134 HydrophobicContact CG2-CE2 3.89Å; V118-I159 HydrophobicContact CG1-CG2 3.79Å; V118-K160 WeakPolarHBondContact CA-O 3.37Å; V118-F178 HydrophobicContact CG2-CZ 4.43Å
119	Y	95.4	Very high	93.6	Very high	48 Å²	48	51.8 Å²	51.8	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	150.8	175	-54.4	-107.2	0	0	0	110.2	W128 T129 H130 I159 K160 D162	Y119-W128 HydrophobicContact CD1-CB 4.16Å; Y119-W128 HydrophobicContact CG-CB 4.42Å; Y119-T129 CarbonylContact C-O 3.55Å; Y119-T129 WeakPolarHBondContact CA-O 3.39Å; Y119-T129 WeakPolarHBondContact CB-O 3.29Å; Y119-H130 VanDerWaalsContact CD1-CA 3.46Å; Y119-H130 HydrophobicContact CD1-CB 3.88Å; Y119-H130 HydrophobicContact CE1-CB 3.74Å; Y119-H130 AromaticContact CE1-CD2 3.74Å; Y119-H130 AromaticContact CZ-CD2 3.76Å; Y119-I159 CarbonylContact O-C 3.58Å; Y119-I159 WeakPolarHBondContact O-CA 3.29Å; Y119-K160 PolarHBondContact N-O 3.12Å; Y119-K160 PolarHBondContact O-N 3.05Å; Y119-D162 HydrophobicContact CD2-CB 4.18Å; Y119-D162 HydrophobicContact CE2-CB 3.71Å
120	G	94.4	Very high	93.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.7	175.6	0	0	0	0	0	111.1	T129 Y158	G120-T129 PolarHBondContact N-O 3.06Å; G120-T129 WeakPolarHBondContact O-CB 3.31Å; G120-T129 PolarHBondContact O-N 2.69Å; G120-Y158 CarbonylContact C-O 3.57Å; G120-Y158 WeakPolarHBondContact CA-O 3.39Å
121	M	93.7	Very high	93.5	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.025	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	134.5	174	178.5	-178.2	71.2	0	0	108.8	D123 Q126 W128 R157 Y158	M121-D123 WeakPolarHBondContact CG-O 3.39Å; M121-D123 VanDerWaalsContact SD-O 3.39Å; M121-Q126 HydrophobicContact CG-CB 4.15Å; M121-W128 HydrophobicContact CB-CD2 4.16Å; M121-W128 HydrophobicContact CB-CE3 3.65Å; M121-W128 HydrophobicContact CB-CH2 4.28Å; M121-W128 HydrophobicContact CB-CZ3 3.72Å; M121-W128 HydrophobicContact CE-CH2 3.91Å; M121-W128 HydrophobicContact CE-CZ2 3.8Å; M121-W128 HydrophobicContact CE-CZ3 4.49Å; M121-W128 HydrophobicContact SD-CD2 4.38Å; M121-W128 HydrophobicContact SD-CZ2 4.22Å; M121-R157 PolarHBondContact O-N 3.15Å; M121-R157 VanDerWaalsContact O-N 3.11Å; M121-Y158 HydrophobicContact CE-CD1 4.45Å; M121-Y158 HydrophobicContact CE-CD2 3.74Å; M121-Y158 HydrophobicContact CE-CE2 4.45Å; M121-Y158 HydrophobicContact CE-CG 3.74Å; M121-Y158 PolarHBondContact N-O 3.31Å; M121-Y158 PolarHBondContact O-N 3.08Å
122	T	91	Very high	93.4	Very high	30 Å²	30	47.6 Å²	47.6	18%	0.184	23%	0.233	C	C	.	.	S	Bend	trans	-80.7	-45.1	-174.6	-47.8	0	0	0	0	111.1	Q126 R157	T122-Q126 PolarHBondContact OG1-OE1 2.9Å; T122-R157 VanDerWaalsContact O-CB 3.32Å; T122-R157 WeakPolarHBondContact O-CB 3.44Å
123	D	88.1	Confident	93.3	Very high	49 Å²	49	48.8 Å²	48.8	26%	0.262	24%	0.24	S	C	.	.	S	Bend	trans	-135.1	149	-176.6	-62.3	-61.5	0	0	0	109.5	R88 M121 E125 Q126	R88-D123 IonicContact CZ-OD1 3.94Å; R88-D123 IonicContact NH2-OD1 2.8Å; R88-D123 PolarHBondContact NH2-OD1 3.36Å; R88-D123 IonicContact NH2-OD2 3.34Å; R88-D123 PolarHBondContact NH2-OD2 2.79Å; M121-D123 WeakPolarHBondContact CG-O 3.39Å; M121-D123 VanDerWaalsContact SD-O 3.39Å; D123-E125 PolarHBondContact O-N 3.32Å; D123-Q126 HydrophobicContact CB-CG 4.27Å; D123-Q126 PolarHBondContact O-N 3.08Å; D123-Q126 PolarHBondContact OD2-NE2 3.26Å
124	P	84	Confident	93.3	Very high	75 Å²	75	48.8 Å²	48.8	49%	0.487	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-15.2	-171.3	26	-34.6	0	0	0	115.1	Y158	P124-Y158 HydrophobicContact CB-CE2 4.45Å
125	E	84.1	Confident	93.3	Very high	191 Å²	191	48.6 Å²	48.6	89%	0.893	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-7.2	179.4	-60.7	179.3	175	0	0	113.2	D123	D123-E125 PolarHBondContact O-N 3.32Å
126	Q	87	Confident	93.2	Very high	95 Å²	95	46.2 Å²	46.2	44%	0.444	23%	0.232	S	C	.	.	S	Bend	trans	-88.4	165.1	-179	-68.2	-179.3	15.1	0	0	112.4	M121 T122 D123	M121-Q126 HydrophobicContact CG-CB 4.15Å; T122-Q126 PolarHBondContact OG1-OE1 2.9Å; D123-Q126 HydrophobicContact CB-CG 4.27Å; D123-Q126 PolarHBondContact O-N 3.08Å; D123-Q126 PolarHBondContact OD2-NE2 3.26Å
127	E	90.2	Very high	93.2	Very high	176 Å²	176	48.9 Å²	48.9	82%	0.822	25%	0.246	S	C	*	.			trans	-77.8	151.5	173.4	-66.1	-168	161.3	0	0	112.6	T129	E127-T129 PolarHBondContact O-N 3.44Å
128	W	94	Very high	93	Very high	61 Å²	61	50.4 Å²	50.4	23%	0.231	25%	0.252	C	S	.	.			trans	-68.7	115.7	174.4	-70.2	100.9	0	0	0	111.3	M30 A82 Y119 M121 K160	M30-W128 HydrophobicContact CE-CZ2 4.36Å; M30-W128 HydrophobicContact SD-CZ2 3.59Å; M30-W128 VanDerWaalsContact SD-CZ2 3.59Å; A82-W128 HydrophobicContact CB-CH2 3.97Å; A82-W128 HydrophobicContact CB-CZ2 4.2Å; Y119-W128 HydrophobicContact CD1-CB 4.16Å; Y119-W128 HydrophobicContact CG-CB 4.42Å; M121-W128 HydrophobicContact CB-CD2 4.16Å; M121-W128 HydrophobicContact CB-CE3 3.65Å; M121-W128 HydrophobicContact CB-CH2 4.28Å; M121-W128 HydrophobicContact CB-CZ3 3.72Å; M121-W128 HydrophobicContact CE-CH2 3.91Å; M121-W128 HydrophobicContact CE-CZ2 3.8Å; M121-W128 HydrophobicContact CE-CZ3 4.49Å; M121-W128 HydrophobicContact SD-CD2 4.38Å; M121-W128 HydrophobicContact SD-CZ2 4.22Å; W128-K160 HydrophobicContact CD2-CB 4.25Å; W128-K160 HydrophobicContact CD2-CD 4.37Å; W128-K160 HydrophobicContact CE3-CB 3.77Å; W128-K160 HydrophobicContact CH2-CB 3.82Å; W128-K160 HydrophobicContact CZ2-CB 4.29Å; W128-K160 HydrophobicContact CZ3-CB 3.54Å
129	T	93.9	Very high	92.9	Very high	62 Å²	62	56 Å²	56	38%	0.38	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.3	173.1	-59.1	0	0	0	0	109.9	Y119 G120 E127 L131 F156	Y119-T129 CarbonylContact C-O 3.55Å; Y119-T129 WeakPolarHBondContact CA-O 3.39Å; Y119-T129 WeakPolarHBondContact CB-O 3.29Å; G120-T129 PolarHBondContact N-O 3.06Å; G120-T129 WeakPolarHBondContact O-CB 3.31Å; G120-T129 PolarHBondContact O-N 2.69Å; E127-T129 PolarHBondContact O-N 3.44Å; T129-L131 HydrophobicContact CG2-CD2 4.14Å; T129-L131 WeakPolarHBondContact O-CD2 3.46Å; T129-L131 PolarHBondContact O-N 3.27Å; T129-F156 HydrophobicContact CG2-CZ 4.42Å
130	H	94.4	Very high	92.8	Very high	58 Å²	58	55 Å²	55	27%	0.269	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	130.3	172.4	178.3	-102.7	0	0	0	110	Y119 G132 T133 R152	Y119-H130 VanDerWaalsContact CD1-CA 3.46Å; Y119-H130 HydrophobicContact CD1-CB 3.88Å; Y119-H130 HydrophobicContact CE1-CB 3.74Å; Y119-H130 AromaticContact CE1-CD2 3.74Å; Y119-H130 AromaticContact CZ-CD2 3.76Å; H130-G132 PolarHBondContact NE2-O 2.9Å; H130-T133 PolarHBondContact NE2-OG1 3.48Å; H130-R152 WeakPolarHBondContact O-CD 3.22Å; H130-R152 PolarHBondContact O-NH1 3.24Å
131	L	93.7	Very high	92.7	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-31.8	180	-49.5	-176.8	0	0	0	111.9	V118 T129 L148 P149 F156 I159	V118-L131 HydrophobicContact CG1-CD1 4.18Å; V118-L131 WeakPolarHBondContact O-CA 3.35Å; V118-L131 WeakPolarHBondContact O-CB 3.06Å; V118-L131 PolarHBondContact O-N 2.79Å; T129-L131 HydrophobicContact CG2-CD2 4.14Å; T129-L131 WeakPolarHBondContact O-CD2 3.46Å; T129-L131 PolarHBondContact O-N 3.27Å; L131-L148 HydrophobicContact CB-CD2 3.57Å; L131-P149 VanDerWaalsContact O-CD 3.25Å; L131-P149 WeakPolarHBondContact O-CD 3.29Å; L131-F156 HydrophobicContact CD1-CD2 4.03Å; L131-F156 HydrophobicContact CD1-CE2 3.94Å; L131-F156 HydrophobicContact CD2-CD2 4.25Å; L131-F156 HydrophobicContact CD2-CE1 4.22Å; L131-F156 HydrophobicContact CD2-CE2 3.39Å; L131-F156 HydrophobicContact CD2-CZ 3.36Å; L131-F156 HydrophobicContact CG-CE2 4.33Å; L131-I159 HydrophobicContact CD1-CD1 4.3Å
132	G	93.8	Very high	92.7	Very high	4 Å²	4	62.4 Å²	62.4	4%	0.041	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.1	163.1	177.2	0	0	0	0	0	112.8	S117 V118 H130	S117-G132 CarbonylContact C-O 3.59Å; S117-G132 VanDerWaalsContact CA-O 3.26Å; S117-G132 WeakPolarHBondContact CA-O 3.37Å; V118-G132 PolarHBondContact N-O 3.23Å; V118-G132 PolarHBondContact O-N 2.95Å; H130-G132 PolarHBondContact NE2-O 2.9Å
133	T	96.2	Very high	92.8	Very high	24 Å²	24	63.5 Å²	63.5	15%	0.147	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.2	173.8	-58.2	0	0	0	0	108.8	F4 A5 E115 F116 S117 H130	F4-T133 HydrophobicContact CD1-CG2 3.99Å; F4-T133 HydrophobicContact CE1-CG2 3.71Å; A5-T133 PolarHBondContact N-O 3.26Å; E115-T133 HydrophobicContact CG-CG2 4.09Å; F116-T133 WeakPolarHBondContact O-CA 3.47Å; S117-T133 PolarHBondContact OG-OG1 3.4Å; H130-T133 PolarHBondContact NE2-OG1 3.48Å
134	F	96.7	Very high	93.1	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	158	-167.1	-52.8	-75.5	0	0	0	111.1	A5 V94 F116 V118 F146 E147 L148	A5-F134 HydrophobicContact CB-CD1 3.93Å; A5-F134 HydrophobicContact CB-CE1 3.64Å; V94-F134 HydrophobicContact CG2-CE2 4.14Å; F116-F134 HydrophobicContact CD1-CB 4.18Å; F116-F134 HydrophobicContact CD2-CB 4.48Å; F116-F134 HydrophobicContact CD2-CD2 4.19Å; F116-F134 HydrophobicContact CE1-CB 3.59Å; F116-F134 HydrophobicContact CE2-CB 3.94Å; F116-F134 AromaticContact CE2-CD2 3.58Å; F116-F134 HydrophobicContact CE2-CD2 3.58Å; F116-F134 HydrophobicContact CE2-CG 4.14Å; F116-F134 HydrophobicContact CZ-CB 3.46Å; F116-F134 VanDerWaalsContact CZ-CB 3.46Å; F116-F134 AromaticContact CZ-CD2 3.92Å; F116-F134 HydrophobicContact CZ-CD2 3.92Å; F116-F134 AromaticContact CZ-CG 3.99Å; F116-F134 HydrophobicContact CZ-CG 3.99Å; F116-F134 PolarHBondContact N-O 3.46Å; F116-F134 PolarHBondContact O-N 3.45Å; V118-F134 HydrophobicContact CB-CE2 4.31Å; V118-F134 HydrophobicContact CG2-CD2 4.21Å; V118-F134 HydrophobicContact CG2-CE2 3.89Å; F134-F146 HydrophobicContact CB-CD1 3.84Å; F134-F146 HydrophobicContact CB-CE1 4.23Å; F134-F146 HydrophobicContact CB-CG 4.14Å; F134-F146 HydrophobicContact CD1-CB 3.5Å; F134-F146 VanDerWaalsContact CD1-CB 3.5Å; F134-F146 AromaticContact CD1-CD1 3.92Å; F134-F146 HydrophobicContact CD1-CD1 3.92Å; F134-F146 AromaticContact CD1-CG 3.96Å; F134-F146 HydrophobicContact CD1-CG 3.96Å; F134-F146 HydrophobicContact CD2-CB 4.46Å; F134-F146 HydrophobicContact CE1-CB 3.63Å; F134-F146 HydrophobicContact CG-CB 3.92Å; F134-F146 HydrophobicContact CG-CD1 4.1Å; F134-F146 HydrophobicContact CG-CG 4.05Å; F134-F146 HydrophobicContact CZ-CB 4.19Å; F134-E147 WeakPolarHBondContact CE1-O 3.26Å; F134-L148 HydrophobicContact CE2-CD2 4.09Å; F134-L148 HydrophobicContact CZ-CD2 3.71Å; F134-L148 HydrophobicContact CZ-CG 4.26Å
135	L	98	Very high	93.6	Very high	73 Å²	73	58.9 Å²	58.9	38%	0.382	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115.4	175.7	-167.1	81.6	0	0	0	109.3	F4 K114 E115 F146	F4-L135 HydrophobicContact CD1-CB 4.49Å; K114-L135 HydrophobicContact CG-CD1 3.68Å; K114-L135 CarbonylContact O-C 3.57Å; K114-L135 WeakPolarHBondContact O-CA 3.35Å; E115-L135 HydrophobicContact CB-CD1 4.43Å; L135-F146 WeakPolarHBondContact O-CE1 3.4Å
136	Y	97.4	Very high	94.1	Very high	8 Å²	8	50 Å²	50	3%	0.031	26%	0.259	C	S	.	.			trans	-76.8	123.9	171.5	178.4	-86.6	0	0	0	109.8	L96 H98 A112 P113 K114 P142 Q144 F146 W167	L96-Y136 HydrophobicContact CB-CD2 4.3Å; L96-Y136 HydrophobicContact CD2-CD2 4.15Å; L96-Y136 HydrophobicContact CD2-CG 4.41Å; L96-Y136 HydrophobicContact CG-CD2 4.44Å; H98-Y136 HydrophobicContact CB-CE1 4.04Å; H98-Y136 HydrophobicContact CB-CE2 4.44Å; H98-Y136 WeakPolarHBondContact CB-OH 3.4Å; A112-Y136 HydrophobicContact CB-CD1 4.32Å; A112-Y136 HydrophobicContact CB-CE1 4.11Å; P113-Y136 WeakPolarHBondContact O-CB 3.43Å; P113-Y136 WeakPolarHBondContact O-CD1 3.39Å; K114-Y136 PolarHBondContact O-N 3.11Å; Y136-P142 PolarHBondContact OH-O 2.74Å; Y136-Q144 HydrophobicContact CD2-CB 4.19Å; Y136-Q144 HydrophobicContact CD2-CG 4.1Å; Y136-Q144 HydrophobicContact CE2-CB 4.16Å; Y136-Q144 HydrophobicContact CE2-CG 3.72Å; Y136-F146 HydrophobicContact CD2-CZ 4.45Å; Y136-W167 VanDerWaalsContact O-CE2 3.28Å; Y136-W167 WeakPolarHBondContact O-CZ2 3.25Å; Y136-W167 PolarHBondContact O-NE1 3.2Å
137	D	96.8	Very high	94.4	Very high	55 Å²	55	49.8 Å²	49.8	29%	0.294	26%	0.258	S	S	.	.			trans	-88.8	111.1	-177.2	168.8	19	0	0	0	111	K7 N139 G140 Q144	K7-D137 IonicContact NZ-OD2 3.73Å; K7-D137 PolarHBondContact NZ-OD2 2.93Å; D137-N139 PolarHBondContact O-N 2.9Å; D137-N139 VanDerWaalsContact O-N 3.12Å; D137-N139 PolarHBondContact OD1-N 3.35Å; D137-G140 PolarHBondContact O-N 3.4Å; D137-G140 VanDerWaalsContact O-N 3.08Å; D137-G140 PolarHBondContact OD1-N 2.06Å; D137-G140 WeakPolarHBondContact OD2-CA 3.43Å; D137-G140 PolarHBondContact OD2-N 2.9Å; D137-Q144 VanDerWaalsContact N-OE1 3.07Å; D137-Q144 PolarHBondContact O-NE2 2.65Å
138	E	94.6	Very high	94.3	Very high	39 Å²	39	42.1 Å²	42.1	18%	0.182	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.7	-178.4	68.3	163.2	176.1	0	0	115.3	K101 S109 W167	K101-E138 VanDerWaalsContact CE-O 3.29Å; K101-E138 WeakPolarHBondContact CE-O 3.49Å; K101-E138 IonicContact NZ-OE2 3.58Å; S109-E138 WeakPolarHBondContact OG-CB 3.17Å; S109-E138 PolarHBondContact OG-OE2 2.87Å; E138-W167 HydrophobicContact CB-CD2 3.86Å; E138-W167 HydrophobicContact CB-CG 3.91Å; E138-W167 HydrophobicContact CB-CZ2 4.39Å; E138-W167 HydrophobicContact CG-CD2 3.68Å; E138-W167 HydrophobicContact CG-CE3 3.85Å; E138-W167 HydrophobicContact CG-CG 4.15Å; E138-W167 HydrophobicContact CG-CH2 4.32Å; E138-W167 HydrophobicContact CG-CZ2 4.17Å; E138-W167 HydrophobicContact CG-CZ3 4.16Å
139	N	93.9	Very high	93.9	Very high	118 Å²	118	41.2 Å²	41.2	63%	0.631	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-3.8	177	-61.3	-56.3	0	0	0	112.8	K101 D137	K101-N139 PolarHBondContact NZ-OD1 3.28Å; D137-N139 PolarHBondContact O-N 2.9Å; D137-N139 VanDerWaalsContact O-N 3.12Å; D137-N139 PolarHBondContact OD1-N 3.35Å
140	G	92.8	Very high	92.8	Very high	27 Å²	27	41.3 Å²	41.3	28%	0.278	23%	0.228	S	C	.	.	S	Bend	trans	-86.4	-169.2	178.7	0	0	0	0	0	113.3	D137	D137-G140 PolarHBondContact O-N 3.4Å; D137-G140 VanDerWaalsContact O-N 3.08Å; D137-G140 PolarHBondContact OD1-N 2.06Å; D137-G140 WeakPolarHBondContact OD2-CA 3.43Å; D137-G140 PolarHBondContact OD2-N 2.9Å
141	E	93.2	Very high	91.5	Very high	124 Å²	124	45.2 Å²	45.2	58%	0.579	25%	0.246	S	C	*	.			trans	-57.6	146.7	174.8	-68.2	-56.8	133.3	0	0	112.4	L143 Q144	E141-L143 VanDerWaalsContact C-N 3.25Å; E141-L143 PolarHBondContact O-N 2.88Å; E141-Q144 WeakPolarHBondContact O-CG 3.34Å; E141-Q144 PolarHBondContact O-NE2 2.99Å
142	P	93	Very high	90.2	Very high	36 Å²	36	49.9 Å²	49.9	23%	0.234	26%	0.263	C	S	.	.	S	Bend	trans	-58.7	-32.7	179.1	-26.1	35.2	0	0	0	114.2	G97 H98 P100 Y136	G97-P142 CarbonylContact C-O 3.6Å; G97-P142 VanDerWaalsContact CA-O 3.27Å; G97-P142 WeakPolarHBondContact CA-O 3.24Å; H98-P142 PolarHBondContact N-O 2.75Å; H98-P142 WeakPolarHBondContact O-CB 3.26Å; P100-P142 HydrophobicContact CB-CG 3.99Å; P100-P142 HydrophobicContact CG-CB 4.06Å; P100-P142 HydrophobicContact CG-CG 3.6Å; Y136-P142 PolarHBondContact OH-O 2.74Å
143	L	93.6	Very high	89.2	Confident	53 Å²	53	57.7 Å²	57.7	28%	0.277	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.2	175.4	-69.3	170.7	0	0	0	108.4	L66 T95 E141 D177	L66-L143 HydrophobicContact CD1-CD2 4.37Å; T95-L143 HydrophobicContact CG2-CB 4.1Å; T95-L143 HydrophobicContact CG2-CD2 4.23Å; E141-L143 VanDerWaalsContact C-N 3.25Å; E141-L143 PolarHBondContact O-N 2.88Å; L143-D177 HydrophobicContact CD2-CB 3.99Å
144	Q	94.6	Very high	88.6	Confident	3 Å²	3	58.7 Å²	58.7	1%	0.014	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130.4	-176.7	-57.4	-169.3	17.3	0	0	110.5	K7 T95 L96 Y136 D137 E141 F146	K7-Q144 VanDerWaalsContact NZ-CD 3.3Å; K7-Q144 VanDerWaalsContact NZ-OE1 3.1Å; T95-Q144 CarbonylContact C-O 3.56Å; T95-Q144 WeakPolarHBondContact CA-O 3.11Å; T95-Q144 WeakPolarHBondContact CG2-O 3.42Å; L96-Q144 PolarHBondContact N-O 2.77Å; L96-Q144 PolarHBondContact O-N 2.88Å; Y136-Q144 HydrophobicContact CD2-CB 4.19Å; Y136-Q144 HydrophobicContact CD2-CG 4.1Å; Y136-Q144 HydrophobicContact CE2-CB 4.16Å; Y136-Q144 HydrophobicContact CE2-CG 3.72Å; D137-Q144 VanDerWaalsContact N-OE1 3.07Å; D137-Q144 PolarHBondContact O-NE2 2.65Å; E141-Q144 WeakPolarHBondContact O-CG 3.34Å; E141-Q144 PolarHBondContact O-NE2 2.99Å; Q144-F146 HydrophobicContact CB-CE2 3.66Å; Q144-F146 HydrophobicContact CB-CZ 3.59Å; Q144-F146 WeakPolarHBondContact O-CD2 3.28Å; Q144-F146 WeakPolarHBondContact O-CE2 3.4Å
145	T	94.7	Very high	88.3	Confident	25 Å²	25	60 Å²	60	15%	0.153	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.7	-179.8	-56.5	0	0	0	0	111.1	L13 H93 V94 T95	L13-T145 HydrophobicContact CD1-CG2 3.56Å; H93-T145 HydrophobicContact CB-CG2 3.7Å; V94-T145 CarbonylContact O-C 3.57Å; V94-T145 WeakPolarHBondContact O-CA 3.18Å; T95-T145 PolarHBondContact OG1-OG1 3.16Å
146	F	94.1	Very high	88	Confident	3 Å²	3	56.8 Å²	56.8	1%	0.013	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.9	-174.5	-53.5	-89.6	0	0	0	109.4	H93 V94 L96 F116 F134 L135 Y136 Q144	H93-F146 CarbonylContact C-O 3.58Å; H93-F146 WeakPolarHBondContact CA-O 3.28Å; H93-F146 WeakPolarHBondContact CB-O 3.33Å; V94-F146 HydrophobicContact CG2-CB 4.05Å; V94-F146 HydrophobicContact CG2-CD2 4.39Å; V94-F146 PolarHBondContact N-O 2.81Å; V94-F146 PolarHBondContact O-N 2.97Å; L96-F146 HydrophobicContact CB-CE2 4.12Å; F116-F146 HydrophobicContact CE1-CD2 4.39Å; F116-F146 AromaticContact CE1-CE2 3.94Å; F116-F146 HydrophobicContact CE1-CE2 3.94Å; F116-F146 HydrophobicContact CE1-CZ 4.01Å; F116-F146 AromaticContact CZ-CD2 3.66Å; F116-F146 HydrophobicContact CZ-CD2 3.66Å; F116-F146 AromaticContact CZ-CE2 3.61Å; F116-F146 HydrophobicContact CZ-CE2 3.61Å; F116-F146 HydrophobicContact CZ-CG 4.17Å; F116-F146 HydrophobicContact CZ-CZ 4.1Å; F134-F146 HydrophobicContact CB-CD1 3.84Å; F134-F146 HydrophobicContact CB-CE1 4.23Å; F134-F146 HydrophobicContact CB-CG 4.14Å; F134-F146 HydrophobicContact CD1-CB 3.5Å; F134-F146 VanDerWaalsContact CD1-CB 3.5Å; F134-F146 AromaticContact CD1-CD1 3.92Å; F134-F146 HydrophobicContact CD1-CD1 3.92Å; F134-F146 AromaticContact CD1-CG 3.96Å; F134-F146 HydrophobicContact CD1-CG 3.96Å; F134-F146 HydrophobicContact CD2-CB 4.46Å; F134-F146 HydrophobicContact CE1-CB 3.63Å; F134-F146 HydrophobicContact CG-CB 3.92Å; F134-F146 HydrophobicContact CG-CD1 4.1Å; F134-F146 HydrophobicContact CG-CG 4.05Å; F134-F146 HydrophobicContact CZ-CB 4.19Å; L135-F146 WeakPolarHBondContact O-CE1 3.4Å; Y136-F146 HydrophobicContact CD2-CZ 4.45Å; Q144-F146 HydrophobicContact CB-CE2 3.66Å; Q144-F146 HydrophobicContact CB-CZ 3.59Å; Q144-F146 WeakPolarHBondContact O-CD2 3.28Å; Q144-F146 WeakPolarHBondContact O-CE2 3.4Å
147	E	92.6	Very high	87.7	Confident	92 Å²	92	61.6 Å²	61.6	43%	0.43	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.4	178.3	-174.7	173.1	177.5	0	0	110.3	F134	F134-E147 WeakPolarHBondContact CE1-O 3.26Å
148	L	88.4	Confident	87.6	Confident	15 Å²	15	60.6 Å²	60.6	8%	0.079	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-80.8	142.2	178.2	-71.5	154.3	0	0	0	110.7	V91 N92 V94 L131 F134 S150	V91-L148 HydrophobicContact CB-CD1 3.79Å; V91-L148 HydrophobicContact CG1-CD1 3.28Å; N92-L148 PolarHBondContact O-N 2.86Å; V94-L148 HydrophobicContact CG1-CD1 4.42Å; L131-L148 HydrophobicContact CB-CD2 3.57Å; F134-L148 HydrophobicContact CE2-CD2 4.09Å; F134-L148 HydrophobicContact CZ-CD2 3.71Å; F134-L148 HydrophobicContact CZ-CG 4.26Å; L148-S150 PolarHBondContact O-N 2.92Å
149	P	85.3	Confident	87.6	Confident	41 Å²	41	58.7 Å²	58.7	27%	0.266	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-52	127.2	174	-26.5	32.5	0	0	0	113.7	L131 H151 R152	L131-P149 VanDerWaalsContact O-CD 3.25Å; L131-P149 WeakPolarHBondContact O-CD 3.29Å; P149-H151 WeakPolarHBondContact CB-CE1 3.36Å; P149-H151 PolarHBondContact O-N 3.46Å; P149-R152 PolarHBondContact O-N 3.13Å
150	S	71.7	Confident	87.7	Confident	65 Å²	65	54.7 Å²	54.7	46%	0.455	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-57.1	-20.3	-174.8	-80.9	0	0	0	0	116.4	L148 R152 R153	L148-S150 PolarHBondContact O-N 2.92Å; S150-R152 VanDerWaalsContact C-N 3.34Å; S150-R153 WeakPolarHBondContact O-CG 3.49Å; S150-R153 PolarHBondContact O-NE 3.37Å
151	H	66.8	Low	87.9	Confident	140 Å²	140	53.4 Å²	53.4	65%	0.648	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-83.8	-6.5	-174.5	65.5	-83.5	0	0	0	113.8	P149	P149-H151 WeakPolarHBondContact CB-CE1 3.36Å; P149-H151 PolarHBondContact O-N 3.46Å
152	R	66.8	Low	88.1	Confident	102 Å²	102	49.4 Å²	49.4	39%	0.385	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-116.2	33.2	180	-54.8	-165.6	-175.5	-154.9	-1.7	112.9	H130 P149 S150 A154	H130-R152 WeakPolarHBondContact O-CD 3.22Å; H130-R152 PolarHBondContact O-NH1 3.24Å; P149-R152 PolarHBondContact O-N 3.13Å; S150-R152 VanDerWaalsContact C-N 3.34Å; R152-A154 PolarHBondContact O-N 3.47Å
153	R	71	Confident	88.4	Confident	169 Å²	169	47.7 Å²	47.7	64%	0.638	23%	0.232	S	C	*	.			trans	-75.3	70.5	178.2	-73.5	-175.3	-87.6	-164.1	-2.4	110.8	V90 S150	V90-R153 HydrophobicContact CG1-CB 4.1Å; S150-R153 WeakPolarHBondContact O-CG 3.49Å; S150-R153 PolarHBondContact O-NE 3.37Å
154	A	84.8	Confident	88.6	Confident	45 Å²	45	47.2 Å²	47.2	37%	0.372	23%	0.233	S	C	.	.			trans	-103.1	162.8	166.3	0	0	0	0	0	110.1	R152 F156	R152-A154 PolarHBondContact O-N 3.47Å; A154-F156 HydrophobicContact CB-CE1 4.26Å; A154-F156 HydrophobicContact CB-CE2 3.95Å; A154-F156 HydrophobicContact CB-CZ 3.69Å; A154-F156 WeakPolarHBondContact O-CD2 3.29Å; A154-F156 WeakPolarHBondContact O-CE2 3.18Å
155	A	90.3	Very high	88.7	Confident	26 Å²	26	48.4 Å²	48.4	22%	0.215	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123.1	175.8	0	0	0	0	0	110.3	R88 V89 V90 A185	R88-A155 HydrophobicContact CB-CB 4.28Å; V89-A155 WeakPolarHBondContact O-CA 3.2Å; V90-A155 HydrophobicContact CG2-CB 4.01Å; A155-A185 HydrophobicContact CB-CB 3.59Å
156	F	92	Very high	88.9	Confident	6 Å²	6	48 Å²	48	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.9	-178.4	-60	-73.3	0	0	0	110.8	R88 V89 V91 T129 L131 A154 I159	R88-F156 WeakPolarHBondContact CA-O 2.88Å; V89-F156 PolarHBondContact N-O 3.28Å; V89-F156 PolarHBondContact O-N 2.92Å; V91-F156 HydrophobicContact CG2-CD2 4.36Å; T129-F156 HydrophobicContact CG2-CZ 4.42Å; L131-F156 HydrophobicContact CD1-CD2 4.03Å; L131-F156 HydrophobicContact CD1-CE2 3.94Å; L131-F156 HydrophobicContact CD2-CD2 4.25Å; L131-F156 HydrophobicContact CD2-CE1 4.22Å; L131-F156 HydrophobicContact CD2-CE2 3.39Å; L131-F156 HydrophobicContact CD2-CZ 3.36Å; L131-F156 HydrophobicContact CG-CE2 4.33Å; A154-F156 HydrophobicContact CB-CE1 4.26Å; A154-F156 HydrophobicContact CB-CE2 3.95Å; A154-F156 HydrophobicContact CB-CZ 3.69Å; A154-F156 WeakPolarHBondContact O-CD2 3.29Å; A154-F156 WeakPolarHBondContact O-CE2 3.18Å; F156-I159 HydrophobicContact CB-CD1 3.89Å
157	R	91.6	Very high	89.1	Confident	109 Å²	109	50.6 Å²	50.6	41%	0.411	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-29.4	171.9	-170.4	169.7	-172.7	167.6	2.4	111.9	L85 R88 M121 T122	L85-R157 WeakPolarHBondContact CB-O 3.34Å; L85-R157 WeakPolarHBondContact CG-O 3.42Å; L85-R157 PolarHBondContact N-O 3.02Å; R88-R157 HydrophobicContact CG-CB 4.03Å; M121-R157 PolarHBondContact O-N 3.15Å; M121-R157 VanDerWaalsContact O-N 3.11Å; T122-R157 VanDerWaalsContact O-CB 3.32Å; T122-R157 WeakPolarHBondContact O-CB 3.44Å
158	Y	93.9	Very high	89.2	Confident	34 Å²	34	48.5 Å²	48.5	13%	0.133	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136	-179	-54.2	-86.9	0	0	0	109.6	L27 I83 A84 G120 M121 P124	L27-Y158 HydrophobicContact CD1-CD1 3.9Å; L27-Y158 HydrophobicContact CD1-CE1 4.43Å; L27-Y158 HydrophobicContact CD2-CD1 4.23Å; L27-Y158 HydrophobicContact CD2-CE1 4.18Å; I83-Y158 CarbonylContact O-C 3.59Å; I83-Y158 VanDerWaalsContact O-CA 3.32Å; I83-Y158 WeakPolarHBondContact O-CA 3.27Å; A84-Y158 HydrophobicContact CB-CD1 3.88Å; A84-Y158 HydrophobicContact CB-CE1 3.84Å; G120-Y158 CarbonylContact C-O 3.57Å; G120-Y158 WeakPolarHBondContact CA-O 3.39Å; M121-Y158 HydrophobicContact CE-CD1 4.45Å; M121-Y158 HydrophobicContact CE-CD2 3.74Å; M121-Y158 HydrophobicContact CE-CE2 4.45Å; M121-Y158 HydrophobicContact CE-CG 3.74Å; M121-Y158 PolarHBondContact N-O 3.31Å; M121-Y158 PolarHBondContact O-N 3.08Å; P124-Y158 HydrophobicContact CB-CE2 4.45Å
159	I	94.5	Very high	89.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.7	178.3	-58.6	-64.3	0	0	0	108.5	A82 I83 L85 V91 V118 Y119 L131 F156 F178 V180	A82-I159 CarbonylContact C-O 3.56Å; A82-I159 WeakPolarHBondContact CA-O 3.32Å; I83-I159 HydrophobicContact CD1-CB 4.39Å; I83-I159 HydrophobicContact CG1-CB 3.91Å; I83-I159 WeakPolarHBondContact CG1-O 3.27Å; I83-I159 PolarHBondContact N-O 3.46Å; I83-I159 PolarHBondContact O-N 3.05Å; L85-I159 HydrophobicContact CD1-CD1 4.46Å; L85-I159 HydrophobicContact CD1-CG1 3.78Å; L85-I159 HydrophobicContact CD2-CG1 4.25Å; L85-I159 HydrophobicContact CG-CG1 4.05Å; V91-I159 HydrophobicContact CG2-CD1 3.81Å; V118-I159 HydrophobicContact CG1-CG2 3.79Å; Y119-I159 CarbonylContact O-C 3.58Å; Y119-I159 WeakPolarHBondContact O-CA 3.29Å; L131-I159 HydrophobicContact CD1-CD1 4.3Å; F156-I159 HydrophobicContact CB-CD1 3.89Å; I159-F178 HydrophobicContact CG2-CE1 4.01Å; I159-F178 HydrophobicContact CG2-CZ 4.12Å; I159-V180 HydrophobicContact CB-CG2 4.26Å; I159-V180 HydrophobicContact CG1-CG1 4.18Å; I159-V180 HydrophobicContact CG1-CG2 4.17Å; I159-V180 HydrophobicContact CG2-CG2 3.97Å
160	K	95.9	Very high	89.9	Confident	33 Å²	33	54.4 Å²	54.4	14%	0.143	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.9	173.2	-176.6	-177.5	68.6	167.6	0	109.5	L81 A82 V118 Y119 W128	L81-K160 CarbonylContact O-C 3.53Å; L81-K160 WeakPolarHBondContact O-CA 3.1Å; A82-K160 HydrophobicContact CB-CB 4.37Å; A82-K160 HydrophobicContact CB-CG 4.48Å; V118-K160 WeakPolarHBondContact CA-O 3.37Å; Y119-K160 PolarHBondContact N-O 3.12Å; Y119-K160 PolarHBondContact O-N 3.05Å; W128-K160 HydrophobicContact CD2-CB 4.25Å; W128-K160 HydrophobicContact CD2-CD 4.37Å; W128-K160 HydrophobicContact CE3-CB 3.77Å; W128-K160 HydrophobicContact CH2-CB 3.82Å; W128-K160 HydrophobicContact CZ2-CB 4.29Å; W128-K160 HydrophobicContact CZ3-CB 3.54Å
161	L	97.1	Very high	90.8	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.5	163.7	172.9	64.3	0	0	0	107.8	H80 L81 L96 F116 I163 V175 F178	H80-L161 CarbonylContact C-O 3.54Å; H80-L161 VanDerWaalsContact CA-O 3.22Å; H80-L161 WeakPolarHBondContact CA-O 3.36Å; L81-L161 PolarHBondContact N-O 2.87Å; L81-L161 PolarHBondContact O-N 2.97Å; L96-L161 HydrophobicContact CD1-CD1 4.33Å; L96-L161 HydrophobicContact CD1-CD2 3.87Å; F116-L161 HydrophobicContact CB-CD1 4.16Å; F116-L161 HydrophobicContact CD2-CD1 3.49Å; F116-L161 VanDerWaalsContact CD2-CD1 3.49Å; F116-L161 HydrophobicContact CE2-CD1 4.2Å; F116-L161 HydrophobicContact CG-CD1 4.1Å; L161-I163 HydrophobicContact CD1-CG1 4.46Å; L161-I163 HydrophobicContact CD2-CD1 4.33Å; L161-I163 HydrophobicContact CG-CG1 4.28Å; L161-V175 HydrophobicContact CD2-CG1 4.36Å; L161-F178 HydrophobicContact CB-CD1 4.36Å; L161-F178 HydrophobicContact CB-CE1 4.11Å; L161-F178 HydrophobicContact CB-CE2 4.39Å; L161-F178 HydrophobicContact CB-CZ 4.12Å; L161-F178 HydrophobicContact CD1-CD2 4.27Å; L161-F178 HydrophobicContact CD1-CE2 4Å; L161-F178 HydrophobicContact CD1-CZ 4.46Å; L161-F178 HydrophobicContact CD2-CB 4.29Å; L161-F178 HydrophobicContact CD2-CD1 4.46Å; L161-F178 HydrophobicContact CD2-CD2 4Å; L161-F178 HydrophobicContact CD2-CE2 4.46Å; L161-F178 HydrophobicContact CD2-CG 4Å
162	D	97.8	Very high	92.1	Very high	39 Å²	39	52.8 Å²	52.8	21%	0.209	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	112	-179.8	-166.6	7.6	0	0	0	109.5	F116 S117 Y119	F116-D162 CarbonylContact C-O 3.56Å; F116-D162 WeakPolarHBondContact CA-O 3.27Å; F116-D162 WeakPolarHBondContact CB-O 3.24Å; S117-D162 PolarHBondContact N-O 3.1Å; S117-D162 PolarHBondContact O-N 2.95Å; Y119-D162 HydrophobicContact CD2-CB 4.18Å; Y119-D162 HydrophobicContact CE2-CB 3.71Å
163	I	98.3	Very high	93.5	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.7	-176.4	-62.3	162.2	0	0	0	108	W72 F74 Q78 G79 P113 F116 L161 S165 T173 V175	W72-I163 HydrophobicContact CZ3-CD1 4.42Å; F74-I163 HydrophobicContact CE1-CD1 3.57Å; F74-I163 HydrophobicContact CZ-CB 4.01Å; F74-I163 HydrophobicContact CZ-CD1 3.6Å; F74-I163 HydrophobicContact CZ-CG1 4.41Å; F74-I163 HydrophobicContact CZ-CG2 4.08Å; Q78-I163 VanDerWaalsContact CA-O 3.27Å; Q78-I163 WeakPolarHBondContact CA-O 3.38Å; G79-I163 PolarHBondContact N-O 3.33Å; G79-I163 VanDerWaalsContact N-O 3.09Å; G79-I163 WeakPolarHBondContact O-CA 3.11Å; G79-I163 WeakPolarHBondContact O-CB 3.43Å; G79-I163 PolarHBondContact O-N 2.79Å; P113-I163 HydrophobicContact CB-CD1 4.29Å; P113-I163 HydrophobicContact CB-CG1 4.34Å; P113-I163 HydrophobicContact CB-CG2 4.07Å; P113-I163 HydrophobicContact CG-CD1 4.07Å; F116-I163 HydrophobicContact CB-CG1 4.2Å; L161-I163 HydrophobicContact CD1-CG1 4.46Å; L161-I163 HydrophobicContact CD2-CD1 4.33Å; L161-I163 HydrophobicContact CG-CG1 4.28Å; I163-S165 WeakPolarHBondContact CG2-O 3.4Å; I163-T173 HydrophobicContact CG2-CG2 4.38Å; I163-V175 HydrophobicContact CD1-CG2 3.33Å
164	S	97.9	Very high	94.6	Very high	43 Å²	43	40.2 Å²	40.2	30%	0.301	22%	0.221	S	C	.	.			trans	-99	-23.9	-175.9	-48.9	0	0	0	0	112.6	Q78 E115	Q78-S164 VanDerWaalsContact CG-O 3.26Å; Q78-S164 WeakPolarHBondContact CG-O 3.41Å; E115-S164 PolarHBondContact O-N 2.72Å
165	S	98.1	Very high	95.2	Very high	27 Å²	27	38.1 Å²	38.1	19%	0.189	20%	0.203	C	C	.	.			trans	-158.7	169	176.2	63	0	0	0	0	112.7	S77 K114 E115 I163	S77-S165 CarbonylContact O-C 3.48Å; S77-S165 WeakPolarHBondContact O-CA 3.38Å; S77-S165 PolarHBondContact O-N 2.92Å; K114-S165 PolarHBondContact N-O 2.79Å; E115-S165 WeakPolarHBondContact CB-OG 3.17Å; E115-S165 PolarHBondContact N-OG 2.97Å; E115-S165 PolarHBondContact O-N 3.31Å; I163-S165 WeakPolarHBondContact CG2-O 3.4Å
166	N	98	Very high	95.4	Very high	17 Å²	17	37.7 Å²	37.7	9%	0.091	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-123.8	-179.3	170.9	71.3	15.8	0	0	0	111.1	A112 G168 H169 H172 T173	A112-N166 VanDerWaalsContact O-CA 3.24Å; A112-N166 WeakPolarHBondContact O-CA 3.5Å; A112-N166 VanDerWaalsContact O-CB 3.27Å; A112-N166 WeakPolarHBondContact O-CB 3.25Å; N166-G168 PolarHBondContact O-N 3.31Å; N166-G168 PolarHBondContact OD1-N 3.08Å; N166-H169 PolarHBondContact ND2-O 3.11Å; N166-H169 PolarHBondContact OD1-N 3.11Å; N166-H172 PolarHBondContact ND2-O 2.9Å; N166-T173 HydrophobicContact CB-CG2 4.04Å; N166-T173 WeakPolarHBondContact CB-OG1 3.15Å; N166-T173 PolarHBondContact ND2-OG1 3.29Å
167	W	97.5	Very high	95.5	Very high	58 Å²	58	37.5 Å²	37.5	22%	0.22	20%	0.195	C	C	.	.	S	Bend	trans	-83.1	19.9	-178.9	-76.2	98.8	0	0	0	114.6	W110 A112 P113 K114 Y136 E138	W110-W167 CarbonylContact O-C 3.35Å; W110-W167 WeakPolarHBondContact O-CA 3.39Å; W110-W167 PolarHBondContact O-N 2.81Å; A112-W167 PolarHBondContact O-N 3.25Å; A112-W167 VanDerWaalsContact O-N 3.11Å; P113-W167 VanDerWaalsContact O-CD1 3.31Å; P113-W167 PolarHBondContact O-NE1 3.36Å; K114-W167 HydrophobicContact CB-CD2 4.2Å; K114-W167 HydrophobicContact CB-CG 4.13Å; K114-W167 HydrophobicContact CD-CD2 4.05Å; K114-W167 HydrophobicContact CD-CE3 4.11Å; K114-W167 HydrophobicContact CD-CH2 4.38Å; K114-W167 HydrophobicContact CD-CZ2 4.31Å; K114-W167 HydrophobicContact CD-CZ3 4.28Å; K114-W167 HydrophobicContact CG-CD2 4.09Å; K114-W167 HydrophobicContact CG-CH2 4.41Å; K114-W167 HydrophobicContact CG-CZ2 3.89Å; Y136-W167 VanDerWaalsContact O-CE2 3.28Å; Y136-W167 WeakPolarHBondContact O-CZ2 3.25Å; Y136-W167 PolarHBondContact O-NE1 3.2Å; E138-W167 HydrophobicContact CB-CD2 3.86Å; E138-W167 HydrophobicContact CB-CG 3.91Å; E138-W167 HydrophobicContact CB-CZ2 4.39Å; E138-W167 HydrophobicContact CG-CD2 3.68Å; E138-W167 HydrophobicContact CG-CE3 3.85Å; E138-W167 HydrophobicContact CG-CG 4.15Å; E138-W167 HydrophobicContact CG-CH2 4.32Å; E138-W167 HydrophobicContact CG-CZ2 4.17Å; E138-W167 HydrophobicContact CG-CZ3 4.16Å
168	G	95.4	Very high	95.6	Very high	47 Å²	47	32.3 Å²	32.3	49%	0.485	18%	0.176	S	C	.	.	S	Bend	trans	112.7	6.6	170	0	0	0	0	0	115.2	W110 N166 V170	W110-G168 PolarHBondContact O-N 3.17Å; N166-G168 PolarHBondContact O-N 3.31Å; N166-G168 PolarHBondContact OD1-N 3.08Å; G168-V170 PolarHBondContact O-N 3.2Å
169	H	95	Very high	95.6	Very high	50 Å²	50	32.2 Å²	32.2	23%	0.231	18%	0.175	C	C	.	.			trans	-74.1	116.1	174.9	-168.1	-84.6	0	0	0	110.6	W110 N166 K171 H172	W110-H169 VanDerWaalsContact C-CB 3.42Å; W110-H169 HydrophobicContact CB-CB 3.89Å; W110-H169 VanDerWaalsContact O-CB 3.31Å; W110-H169 WeakPolarHBondContact O-CB 3.3Å; W110-H169 PolarHBondContact O-N 3.37Å; W110-H169 VanDerWaalsContact O-N 3.07Å; N166-H169 PolarHBondContact ND2-O 3.11Å; N166-H169 PolarHBondContact OD1-N 3.11Å; H169-K171 VanDerWaalsContact C-N 3.32Å; H169-K171 PolarHBondContact ND1-N 3.46Å; H169-K171 PolarHBondContact O-N 2.86Å; H169-H172 WeakPolarHBondContact CB-O 3.38Å; H169-H172 AromaticContact CE1-CE1 3.12Å; H169-H172 PolarHBondContact CE1-CE1 2.99Å; H169-H172 AromaticContact CE1-CG 3.84Å; H169-H172 AromaticContact CE1-ND1 3.07Å; H169-H172 PolarHBondContact CE1-ND1 2.82Å; H169-H172 AromaticContact CE1-NE2 3.91Å; H169-H172 AromaticContact ND1-CE1 3.62Å; H169-H172 AromaticContact ND1-CG 3.74Å; H169-H172 PolarHBondContact ND1-N 2.84Å; H169-H172 AromaticContact ND1-ND1 3.45Å; H169-H172 PolarHBondContact ND1-ND1 3.03Å; H169-H172 PolarHBondContact ND1-O 3.12Å; H169-H172 VanDerWaalsContact ND1-O 3.12Å; H169-H172 AromaticContact NE2-CE1 3.61Å; H169-H172 AromaticContact NE2-ND1 4Å
170	V	92.6	Very high	95.4	Very high	131 Å²	131	32.2 Å²	32.2	79%	0.794	18%	0.175	S	C	*	.	S	Bend	trans	-71.6	-19.9	-167.5	-59.6	0	0	0	0	115.1	G168	G168-V170 PolarHBondContact O-N 3.2Å
171	K	92.4	Very high	95.1	Very high	125 Å²	125	30.9 Å²	30.9	54%	0.543	17%	0.169	S	C	.	.	S	Bend	trans	-105.2	-29.7	-173	-55.8	-169.3	175.9	-179.9	0	114.9	G76 H169	G76-K171 PolarHBondContact N-O 2.83Å; H169-K171 VanDerWaalsContact C-N 3.32Å; H169-K171 PolarHBondContact ND1-N 3.46Å; H169-K171 PolarHBondContact O-N 2.86Å
172	H	93.5	Very high	94.7	Very high	45 Å²	45	31 Å²	31	21%	0.208	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	164.6	-170.3	72.3	-100.6	0	0	0	111.6	F74 G76 N166 H169	F74-H172 WeakPolarHBondContact O-CA 3.35Å; F74-H172 WeakPolarHBondContact O-CB 3.36Å; G76-H172 CarbonylContact O-C 3.1Å; G76-H172 VanDerWaalsContact O-CA 3.3Å; G76-H172 WeakPolarHBondContact O-CA 3.5Å; N166-H172 PolarHBondContact ND2-O 2.9Å; H169-H172 WeakPolarHBondContact CB-O 3.38Å; H169-H172 AromaticContact CE1-CE1 3.12Å; H169-H172 PolarHBondContact CE1-CE1 2.99Å; H169-H172 AromaticContact CE1-CG 3.84Å; H169-H172 AromaticContact CE1-ND1 3.07Å; H169-H172 PolarHBondContact CE1-ND1 2.82Å; H169-H172 AromaticContact CE1-NE2 3.91Å; H169-H172 AromaticContact ND1-CE1 3.62Å; H169-H172 AromaticContact ND1-CG 3.74Å; H169-H172 PolarHBondContact ND1-N 2.84Å; H169-H172 AromaticContact ND1-ND1 3.45Å; H169-H172 PolarHBondContact ND1-ND1 3.03Å; H169-H172 PolarHBondContact ND1-O 3.12Å; H169-H172 VanDerWaalsContact ND1-O 3.12Å; H169-H172 AromaticContact NE2-CE1 3.61Å; H169-H172 AromaticContact NE2-ND1 4Å
173	T	95.9	Very high	94.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.3	170.6	-56.4	0	0	0	0	108.4	G73 F74 G76 S77 S111 P113 I163 N166	G73-T173 VanDerWaalsContact CA-O 3.28Å; G73-T173 WeakPolarHBondContact CA-O 3.46Å; F74-T173 HydrophobicContact CE1-CG2 3.99Å; F74-T173 HydrophobicContact CE2-CG2 4.19Å; F74-T173 HydrophobicContact CZ-CG2 3.55Å; F74-T173 PolarHBondContact N-O 3.12Å; F74-T173 PolarHBondContact O-N 2.79Å; G76-T173 PolarHBondContact O-N 3.25Å; G76-T173 VanDerWaalsContact O-N 3.13Å; G76-T173 PolarHBondContact O-OG1 3.35Å; S77-T173 WeakPolarHBondContact CA-OG1 3.3Å; S111-T173 CarbonylContact O-C 3.36Å; S111-T173 WeakPolarHBondContact O-CA 3.21Å; S111-T173 WeakPolarHBondContact O-CG2 3.18Å; P113-T173 HydrophobicContact CB-CG2 4.49Å; P113-T173 HydrophobicContact CG-CG2 4.05Å; I163-T173 HydrophobicContact CG2-CG2 4.38Å; N166-T173 HydrophobicContact CB-CG2 4.04Å; N166-T173 WeakPolarHBondContact CB-OG1 3.15Å; N166-T173 PolarHBondContact ND2-OG1 3.29Å
174	C	95.1	Very high	93.6	Very high	8 Å²	8	41 Å²	41	5%	0.054	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125.8	-179.4	-114.7	0	0	0	0	111.2	C71 W72 G73 H98 S111 P113 Y176	C71-C174 HydrophobicContact CB-CB 3.63Å; C71-C174 WeakPolarHBondContact CB-SG 3.28Å; C71-C174 WeakPolarHBondContact SG-CB 3.33Å; C71-C174 CovalentContact SG-SG 2.06Å; C71-C174 PolarHBondContact SG-SG 2.93Å; W72-C174 WeakPolarHBondContact O-CA 3.45Å; G73-C174 VanDerWaalsContact CA-SG 3.56Å; H98-C174 PolarHBondContact CD2-O 2.88Å; H98-C174 PolarHBondContact NE2-O 3Å; S111-C174 PolarHBondContact O-N 2.83Å; P113-C174 WeakPolarHBondContact CD-O 3.37Å; C174-Y176 HydrophobicContact CB-CE2 4.27Å
175	V	96	Very high	92.9	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125	175.1	-175.7	0	0	0	0	108.6	V59 C71 W72 F74 L96 P113 L161 I163	V59-V175 HydrophobicContact CB-CG1 4.36Å; V59-V175 HydrophobicContact CG1-CB 4.01Å; V59-V175 HydrophobicContact CG1-CG1 3.87Å; V59-V175 WeakPolarHBondContact CG1-O 3.27Å; C71-V175 CarbonylContact C-O 3.57Å; C71-V175 VanDerWaalsContact CA-O 3.26Å; C71-V175 WeakPolarHBondContact CA-O 3.34Å; C71-V175 VanDerWaalsContact CB-O 3.3Å; C71-V175 WeakPolarHBondContact CB-O 3.35Å; W72-V175 HydrophobicContact CE3-CB 3.99Å; W72-V175 HydrophobicContact CE3-CG2 3.84Å; W72-V175 HydrophobicContact CZ3-CG2 4.02Å; W72-V175 PolarHBondContact N-O 3.13Å; W72-V175 PolarHBondContact O-N 3.25Å; F74-V175 HydrophobicContact CE1-CG2 4.1Å; L96-V175 HydrophobicContact CD1-CG1 3.92Å; P113-V175 HydrophobicContact CG-CG2 3.89Å; L161-V175 HydrophobicContact CD2-CG1 4.36Å; I163-V175 HydrophobicContact CD1-CG2 3.33Å
176	Y	94.4	Very high	91.8	Very high	17 Å²	17	44.2 Å²	44.2	7%	0.067	23%	0.234	C	C	.	.			trans	-95.2	-35.6	-178.3	-79.9	-93.8	0	0	0	113.2	L66 Q67 C71 G97 H98 L99 C174	L66-Y176 HydrophobicContact CB-CD1 4.3Å; Q67-Y176 VanDerWaalsContact O-CE1 3.24Å; Q67-Y176 WeakPolarHBondContact O-CE1 3.4Å; C71-Y176 HydrophobicContact CB-CD1 3.88Å; C71-Y176 HydrophobicContact CB-CD2 3.68Å; C71-Y176 HydrophobicContact CB-CE1 3.77Å; C71-Y176 HydrophobicContact CB-CE2 3.59Å; C71-Y176 HydrophobicContact CB-CG 3.84Å; G97-Y176 WeakPolarHBondContact O-CB 3.29Å; G97-Y176 PolarHBondContact O-N 3.02Å; G97-Y176 VanDerWaalsContact O-N 3.11Å; H98-Y176 AromaticContact CD2-CD2 3.73Å; H98-Y176 AromaticContact CD2-CE2 3.98Å; H98-Y176 AromaticContact CE1-CE2 3.97Å; H98-Y176 AromaticContact NE2-CD2 4Å; H98-Y176 AromaticContact NE2-CE2 3.73Å; L99-Y176 HydrophobicContact CB-CD2 4.13Å; L99-Y176 HydrophobicContact CB-CE1 4.09Å; L99-Y176 HydrophobicContact CB-CE2 3.65Å; L99-Y176 HydrophobicContact CD1-CE1 4.48Å; C174-Y176 HydrophobicContact CB-CE2 4.27Å
177	D	93.9	Very high	90.1	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.011	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	139.9	-176.2	-157.9	-56.7	0	0	0	109.4	V59 G62 R63 L66 G97 L143 R179	V59-D177 CarbonylContact O-C 3.52Å; V59-D177 WeakPolarHBondContact O-CA 3.28Å; G62-D177 VanDerWaalsContact CA-OD2 3.27Å; G62-D177 WeakPolarHBondContact CA-OD2 3.49Å; R63-D177 PolarHBondContact N-OD2 3.19Å; R63-D177 VanDerWaalsContact N-OD2 3.16Å; L66-D177 HydrophobicContact CD2-CB 4.24Å; G97-D177 PolarHBondContact N-O 2.67Å; G97-D177 PolarHBondContact O-N 3.09Å; L143-D177 HydrophobicContact CD2-CB 3.99Å; D177-R179 WeakPolarHBondContact OD1-CG 3.31Å; D177-R179 IonicContact OD1-CZ 3.77Å; D177-R179 IonicContact OD1-NE 2.87Å; D177-R179 PolarHBondContact OD1-NE 3.32Å; D177-R179 IonicContact OD1-NH2 3.75Å; D177-R179 IonicContact OD2-CZ 3.52Å; D177-R179 IonicContact OD2-NE 3.37Å; D177-R179 PolarHBondContact OD2-NE 2.98Å; D177-R179 IonicContact OD2-NH2 2.77Å; D177-R179 PolarHBondContact OD2-NH2 3.17Å
178	F	94.3	Very high	88.2	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	125	169.7	-179	-115.7	0	0	0	109.4	V59 I83 V94 T95 L96 V118 I159 L161 V180	V59-F178 HydrophobicContact CB-CB 4.44Å; V59-F178 HydrophobicContact CG2-CB 4.28Å; V59-F178 PolarHBondContact O-N 2.87Å; I83-F178 HydrophobicContact CD1-CD1 4.18Å; I83-F178 HydrophobicContact CD1-CE1 4.11Å; V94-F178 HydrophobicContact CB-CE2 3.95Å; V94-F178 HydrophobicContact CB-CZ 4.35Å; V94-F178 HydrophobicContact CG1-CE2 4.22Å; V94-F178 HydrophobicContact CG1-CZ 4.11Å; T95-F178 CarbonylContact O-C 3.48Å; T95-F178 WeakPolarHBondContact O-CA 3.49Å; T95-F178 WeakPolarHBondContact O-CD2 3.15Å; L96-F178 HydrophobicContact CD1-CB 4.41Å; L96-F178 HydrophobicContact CD1-CD2 3.88Å; V118-F178 HydrophobicContact CG2-CZ 4.43Å; I159-F178 HydrophobicContact CG2-CE1 4.01Å; I159-F178 HydrophobicContact CG2-CZ 4.12Å; L161-F178 HydrophobicContact CB-CD1 4.36Å; L161-F178 HydrophobicContact CB-CE1 4.11Å; L161-F178 HydrophobicContact CB-CE2 4.39Å; L161-F178 HydrophobicContact CB-CZ 4.12Å; L161-F178 HydrophobicContact CD1-CD2 4.27Å; L161-F178 HydrophobicContact CD1-CE2 4Å; L161-F178 HydrophobicContact CD1-CZ 4.46Å; L161-F178 HydrophobicContact CD2-CB 4.29Å; L161-F178 HydrophobicContact CD2-CD1 4.46Å; L161-F178 HydrophobicContact CD2-CD2 4Å; L161-F178 HydrophobicContact CD2-CE2 4.46Å; L161-F178 HydrophobicContact CD2-CG 4Å; F178-V180 HydrophobicContact CE1-CG2 3.79Å; F178-V180 HydrophobicContact CZ-CG2 4.14Å
179	R	93	Very high	87.8	Confident	31 Å²	31	59.8 Å²	59.8	12%	0.117	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.6	-177.8	-44.8	-176.8	-175.5	179.3	0.2	110.4	G62 R63 V94 T95 D177	G62-R179 PolarHBondContact O-NH2 3.01Å; R63-R179 PolarHBondContact O-NH2 3.25Å; V94-R179 CarbonylContact C-O 3.44Å; V94-R179 WeakPolarHBondContact CA-O 3.2Å; T95-R179 PolarHBondContact N-O 2.84Å; T95-R179 PolarHBondContact O-N 3.47Å; D177-R179 WeakPolarHBondContact OD1-CG 3.31Å; D177-R179 IonicContact OD1-CZ 3.77Å; D177-R179 IonicContact OD1-NE 2.87Å; D177-R179 PolarHBondContact OD1-NE 3.32Å; D177-R179 IonicContact OD1-NH2 3.75Å; D177-R179 IonicContact OD2-CZ 3.52Å; D177-R179 IonicContact OD2-NE 3.37Å; D177-R179 PolarHBondContact OD2-NE 2.98Å; D177-R179 IonicContact OD2-NH2 2.77Å; D177-R179 PolarHBondContact OD2-NH2 3.17Å
180	V	91.6	Very high	87.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.6	172.7	-177.7	0	0	0	0	108.3	V18 I83 L85 V91 I159 F178	V18-V180 PolarHBondContact N-O 3.3Å; I83-V180 HydrophobicContact CD1-CG2 3.89Å; L85-V180 HydrophobicContact CD1-CG1 4.2Å; L85-V180 HydrophobicContact CD2-CB 4.17Å; L85-V180 HydrophobicContact CD2-CG1 4.33Å; L85-V180 HydrophobicContact CD2-CG2 4.27Å; V91-V180 HydrophobicContact CB-CG1 4.34Å; V91-V180 HydrophobicContact CG1-CG1 3.52Å; V91-V180 HydrophobicContact CG2-CG1 3.79Å; I159-V180 HydrophobicContact CB-CG2 4.26Å; I159-V180 HydrophobicContact CG1-CG1 4.18Å; I159-V180 HydrophobicContact CG1-CG2 4.17Å; I159-V180 HydrophobicContact CG2-CG2 3.97Å; F178-V180 HydrophobicContact CE1-CG2 3.79Å; F178-V180 HydrophobicContact CZ-CG2 4.14Å
181	H	89.7	Confident	87.2	Confident	5 Å²	5	56.4 Å²	56.4	2%	0.023	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.9	-179.6	-50.3	-84.1	0	0	0	110.5	F16 C17 V91 N92 H93 T95	F16-H181 HydrophobicContact CB-CB 4.35Å; F16-H181 WeakPolarHBondContact O-CA 3.38Å; C17-H181 WeakPolarHBondContact CA-ND1 3.33Å; V91-H181 WeakPolarHBondContact CA-O 3.35Å; V91-H181 VanDerWaalsContact CG1-O 3.28Å; V91-H181 WeakPolarHBondContact CG1-O 3.4Å; N92-H181 PolarHBondContact N-O 3.07Å; N92-H181 VanDerWaalsContact OD1-C 3.23Å; N92-H181 PolarHBondContact OD1-O 3.39Å; H93-H181 HydrophobicContact CB-CB 4.08Å; H93-H181 PolarHBondContact N-O 3.26Å; H93-H181 PolarHBondContact O-N 2.8Å; T95-H181 PolarHBondContact OG1-NE2 3.07Å
182	G	87.6	Confident	86.9	Confident	4 Å²	4	52.4 Å²	52.4	4%	0.041	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.3	-167.3	-178.4	0	0	0	0	0	112.4	F16 V90 N92	F16-G182 PolarHBondContact O-N 3.34Å; V90-G182 WeakPolarHBondContact O-CA 3.36Å; N92-G182 PolarHBondContact OD1-N 3.45Å
183	K	87	Confident	86.5	Confident	136 Å²	136	52.8 Å²	52.8	59%	0.591	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	143.7	172.8	-65.4	-177.9	179	-177.6	0	109.2	F16 V89 V90 A185	F16-K183 HydrophobicContact CD1-CG 4.38Å; F16-K183 HydrophobicContact CE1-CG 4Å; V89-K183 CarbonylContact C-O 3.58Å; V89-K183 WeakPolarHBondContact CA-O 3.26Å; V90-K183 PolarHBondContact N-O 3.29Å; V90-K183 PolarHBondContact O-N 3.45Å; K183-A185 PolarHBondContact O-N 3.28Å
184	F	86.4	Confident	85.8	Confident	113 Å²	113	56.3 Å²	56.3	50%	0.496	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	136.9	169	-62.3	-53.5	0	0	0	109.6	V18 H87 V89	V18-F184 HydrophobicContact CG1-CD1 4.31Å; V18-F184 HydrophobicContact CG1-CE1 3.45Å; V18-F184 VanDerWaalsContact CG1-CE1 3.45Å; V18-F184 HydrophobicContact CG1-CZ 4.01Å; V18-F184 HydrophobicContact CG2-CE1 4.34Å; H87-F184 HydrophobicContact CB-CD1 3.72Å; H87-F184 HydrophobicContact CB-CE1 3.93Å; H87-F184 AromaticContact ND1-CE1 3.98Å; V89-F184 HydrophobicContact CG2-CD1 4.14Å; V89-F184 HydrophobicContact CG2-CE1 4.44Å
185	A	83.9	Confident	85.2	Confident	22 Å²	22	59.8 Å²	59.8	18%	0.182	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-68.2	147.6	165.8	0	0	0	0	0	108.7	R88 A155 K183 E187	R88-A185 HydrophobicContact CB-CB 4.03Å; R88-A185 PolarHBondContact O-N 2.89Å; A155-A185 HydrophobicContact CB-CB 3.59Å; K183-A185 PolarHBondContact O-N 3.28Å; A185-E187 PolarHBondContact O-N 3.38Å
186	P	74.8	Confident	84.3	Confident	116 Å²	116	64.4 Å²	64.4	75%	0.753	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-52.6	139.3	165.7	-18.3	30	0	0	0	109.4
187	E	62.9	Low	83.5	Confident	173 Å²	173	68.3 Å²	68.3	81%	0.808	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-70.4	132.6	166.1	-69.4	-178.4	160	0	0	107.9	A185	A185-E187 PolarHBondContact O-N 3.38Å
188	D	56.8	Low	82.5	Confident	217 Å²	217	74.4 Å²	74.4	100%	1.16	38%	0.38	S	S	*	.			trans	-76.3	0	172.3	-64.8	-45.4	0	0	0	110.7

Retrieved 188 of 188 residues in 94.1 ms (Link to these results)

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