A0A077ZDT1_TRITR Loading...

WAP domain containing protein, SLPI-like

AlphaFold DB , UniProt , Accession A0A077ZDT1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 162 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	42.5	Very low	37.8	Very low	255 Å²	255	156.2 Å²	156.2	100%	1.256	79%	0.792	S	S	*	*				0	105.6	0	-69.1	159.2	-179.6	0	0	104.9
2	D	32.4	Very low	37.5	Very low	151 Å²	151	153.3 Å²	153.3	81%	0.807	79%	0.789	S	S	*	*			trans	-105.2	156.2	-163.2	-151.8	-21.3	0	0	0	111.5
3	C	36.6	Very low	37.5	Very low	101 Å²	101	153.5 Å²	153.5	68%	0.682	79%	0.792	S	S	*	*			trans	76.8	103.7	163.2	-58	0	0	0	0	119.9
4	S	40.8	Very low	37.4	Very low	117 Å²	117	149.1 Å²	149.1	82%	0.818	79%	0.789	S	S	*	*				167	121.5	91.6	-68.8	0	0	0	0	112.7
5	H	40	Very low	37	Very low	172 Å²	172	154.2 Å²	154.2	80%	0.796	80%	0.796	S	S	*	*			trans	-59.3	155.8	160.6	-80.4	-120.3	0	0	0	111.6
6	Q	37.1	Very low	36.7	Very low	150 Å²	150	150.1 Å²	150.1	70%	0.701	80%	0.803	S	S	*	*				164.2	109.9	107.6	-146.2	73.3	14.9	0	0	111.7
7	F	36.2	Very low	36.3	Very low	137 Å²	137	147.5 Å²	147.5	60%	0.601	79%	0.794	S	S	*	*			trans	73.6	80.1	143.7	-78.3	-111.1	0	0	0	121.4	R9	F7-R9 HydrophobicContact CD1-CG 4.25Å
8	D	35.5	Very low	36.1	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	80%	0.803	S	S	*	*			trans	-81.1	101.5	142.3	-87.9	-53.2	0	0	0	109.5
9	R	40.3	Very low	35.8	Very low	200 Å²	200	149.5 Å²	149.5	76%	0.755	80%	0.797	S	S	*	*			trans	-102.5	92.8	155.9	-82.4	-163.7	-145.4	171.1	7.7	108.4	F7 V11	F7-R9 HydrophobicContact CD1-CG 4.25Å; R9-V11 PolarHBondContact O-N 2.82Å; R9-V11 VanDerWaalsContact O-N 3.1Å
10	H	34.6	Very low	35.7	Very low	162 Å²	162	151.5 Å²	151.5	75%	0.75	80%	0.798	S	S	*	*			trans	-62.9	104.1	158.6	-83.8	-76	0	0	0	109.1	T12	H10-T12 PolarHBondContact O-N 3.17Å
11	V	40	Very low	35.9	Very low	125 Å²	125	152 Å²	152	76%	0.758	80%	0.796	S	S	*	*			trans	-84.5	101.8	161.3	-179.1	0	0	0	0	106.6	R9	R9-V11 PolarHBondContact O-N 2.82Å; R9-V11 VanDerWaalsContact O-N 3.1Å
12	T	34.5	Very low	35.6	Very low	122 Å²	122	147.8 Å²	147.8	75%	0.748	77%	0.774	S	S	*	*			trans	-82.9	131	167.2	50.1	0	0	0	0	108.2	H10	H10-T12 PolarHBondContact O-N 3.17Å
13	N	37.6	Very low	35.8	Very low	156 Å²	156	148 Å²	148	83%	0.834	77%	0.77	S	S	*	*			trans	-122	127.8	164.8	-111.1	-7	0	0	0	109.3	Y15	N13-Y15 PolarHBondContact O-N 2.87Å
14	A	35.8	Very low	36.3	Very low	91 Å²	91	150 Å²	150	75%	0.752	77%	0.772	S	S	*	*			trans	-81	87.6	-175.6	0	0	0	0	0	110.3
15	Y	31.7	Very low	36.7	Very low	226 Å²	226	150.2 Å²	150.2	89%	0.886	76%	0.764	S	S	*	*	S	Bend	trans	-168.1	120.4	152.3	-97.1	-73.8	0	0	0	107.1	N13 T17	N13-Y15 PolarHBondContact O-N 2.87Å; Y15-T17 PolarHBondContact O-N 2.83Å
16	G	31.6	Very low	37.4	Very low	89 Å²	89	142.5 Å²	142.5	92%	0.918	73%	0.731	S	S	*	*			trans	-68.6	84.8	-171.2	0	0	0	0	0	114.1
17	T	29.2	Very low	38.5	Very low	106 Å²	106	137.5 Å²	137.5	65%	0.65	72%	0.715	S	S	*	*			trans	-123.7	124.2	156.9	55.1	0	0	0	0	107.7	Y15 N19	Y15-T17 PolarHBondContact O-N 2.83Å; T17-N19 PolarHBondContact O-N 3.24Å
18	E	33.6	Very low	40.1	Very low	202 Å²	202	139.8 Å²	139.8	94%	0.944	72%	0.72	S	S	*	*			trans	-59.7	78.8	162.1	-69.5	-179	135.9	0	0	108.6	K20	E18-K20 PolarHBondContact O-N 3.3Å
19	N	30.6	Very low	41.9	Very low	131 Å²	131	133 Å²	133	70%	0.701	68%	0.684	S	S	*	*			trans	-70.1	96.3	158.7	-109	-50.4	0	0	0	104.3	T17 Q21	T17-N19 PolarHBondContact O-N 3.24Å; N19-Q21 PolarHBondContact O-N 2.78Å
20	K	34.3	Very low	43.2	Very low	188 Å²	188	128 Å²	128	82%	0.817	68%	0.677	S	S	*	*			trans	-43.3	102	150.7	-109.5	179.3	176.9	178.2	0	104.3	E18 Q22	E18-K20 PolarHBondContact O-N 3.3Å; K20-Q22 PolarHBondContact O-N 2.96Å
21	Q	38.1	Very low	44.7	Very low	162 Å²	162	123.7 Å²	123.7	76%	0.757	66%	0.66	S	S	*	*			trans	-53.3	98.1	165.6	-161.6	80.2	22.1	0	0	102.6	N19 H23	N19-Q21 PolarHBondContact O-N 2.78Å; Q21-H23 PolarHBondContact O-N 2.9Å
22	Q	36.8	Very low	46	Very low	167 Å²	167	119.8 Å²	119.8	78%	0.78	65%	0.645	S	S	*	*			trans	-61.1	98.1	169.8	-74.8	177	-4.8	0	0	101.6	K20 I24	K20-Q22 PolarHBondContact O-N 2.96Å; Q22-I24 WeakPolarHBondContact O-CG1 3.41Å; Q22-I24 PolarHBondContact O-N 2.92Å
23	H	36.9	Very low	47.7	Very low	157 Å²	157	116.4 Å²	116.4	73%	0.727	62%	0.624	S	S	*	*			trans	-51.1	97.6	153.5	-89.8	-98.5	0	0	0	103	Q21 D25	Q21-H23 PolarHBondContact O-N 2.9Å; H23-D25 PolarHBondContact O-N 3.25Å
24	I	46.6	Very low	49	Very low	142 Å²	142	114 Å²	114	73%	0.728	61%	0.608	S	S	*	*			trans	-70.1	81.5	167.1	-39.7	174.6	0	0	0	101.4	Q22 G26	Q22-I24 WeakPolarHBondContact O-CG1 3.41Å; Q22-I24 PolarHBondContact O-N 2.92Å; I24-G26 PolarHBondContact O-N 2.04Å
25	D	49.1	Very low	50.6	Low	121 Å²	121	110.1 Å²	110.1	65%	0.647	58%	0.575	S	S	*	*			trans	-53	109.4	173.4	-85.1	-25.5	0	0	0	104.7	H23 A27	H23-D25 PolarHBondContact O-N 3.25Å; D25-A27 PolarHBondContact O-N 3.27Å
26	G	54.7	Low	52.3	Low	10 Å²	10	103.5 Å²	103.5	10%	0.103	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-50.1	136.8	174.1	0	0	0	0	0	107.5	I24 R28 H34 S35	I24-G26 PolarHBondContact O-N 2.04Å; G26-R28 PolarHBondContact O-N 3.28Å; G26-H34 PolarHBondContact O-ND1 3.03Å; G26-S35 VanDerWaalsContact CA-O 3.28Å; G26-S35 WeakPolarHBondContact CA-O 2.98Å
27	A	60.7	Low	54.5	Low	45 Å²	45	101.8 Å²	101.8	37%	0.372	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	142.6	175.5	0	0	0	0	0	106.8	D25 C29 Q56	D25-A27 PolarHBondContact O-N 3.27Å; A27-C29 PolarHBondContact O-N 2.56Å; A27-Q56 VanDerWaalsContact CB-CD 3.44Å; A27-Q56 VanDerWaalsContact N-CD 3.32Å; A27-Q56 PolarHBondContact O-OE1 3.1Å
28	R	69	Low	56.9	Low	186 Å²	186	102.8 Å²	102.8	70%	0.702	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	127.6	179.5	-82.3	-179	165.4	175	2.1	109.4	G26 T33 H34	G26-R28 PolarHBondContact O-N 3.28Å; R28-T33 WeakPolarHBondContact CA-O 3.19Å; R28-H34 VanDerWaalsContact CG-NE2 3.33Å; R28-H34 WeakPolarHBondContact CG-NE2 3.45Å; R28-H34 PolarHBondContact NE-NE2 2.85Å
29	C	74.1	Confident	59.2	Low	5 Å²	5	93.6 Å²	93.6	3%	0.034	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-62.5	158.8	164.7	-67.7	0	0	0	0	110.3	A27 D31 G32 T33 C58	A27-C29 PolarHBondContact O-N 2.56Å; C29-D31 WeakPolarHBondContact CB-OD1 3.39Å; C29-D31 PolarHBondContact O-N 2.83Å; C29-D31 VanDerWaalsContact O-N 3.11Å; C29-G32 WeakPolarHBondContact O-CA 3.02Å; C29-G32 PolarHBondContact O-N 3.23Å; C29-T33 WeakPolarHBondContact CB-O 3.24Å; C29-T33 WeakPolarHBondContact CB-OG1 3.49Å; C29-T33 PolarHBondContact N-O 3.49Å; C29-C58 WeakPolarHBondContact CA-SG 3.36Å; C29-C58 HydrophobicContact CB-CB 3.68Å; C29-C58 WeakPolarHBondContact CB-SG 2.82Å; C29-C58 WeakPolarHBondContact SG-CA 3.46Å; C29-C58 WeakPolarHBondContact SG-CB 3.4Å; C29-C58 CovalentContact SG-SG 2.04Å; C29-C58 PolarHBondContact SG-SG 3.42Å
30	P	67.1	Low	61.4	Low	95 Å²	95	94.5 Å²	94.5	62%	0.617	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.6	-179.8	-25.3	34.8	0	0	0	114.2	G32 I53	P30-G32 VanDerWaalsContact C-N 3.28Å; P30-I53 HydrophobicContact CG-CD1 3.92Å; P30-I53 HydrophobicContact CG-CG2 4.27Å
31	D	66.9	Low	63.3	Low	72 Å²	72	88.8 Å²	88.8	39%	0.385	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	2.3	175.4	67.3	-9.3	0	0	0	113.6	C29 T33 L64	C29-D31 WeakPolarHBondContact CB-OD1 3.39Å; C29-D31 PolarHBondContact O-N 2.83Å; C29-D31 VanDerWaalsContact O-N 3.11Å; D31-T33 VanDerWaalsContact C-N 3.29Å; D31-T33 PolarHBondContact O-N 2.03Å; D31-T33 WeakPolarHBondContact OD1-CB 3.43Å; D31-T33 WeakPolarHBondContact OD1-CG2 3.31Å; D31-T33 PolarHBondContact OD1-N 3.44Å; D31-T33 PolarHBondContact OD1-OG1 3.48Å; D31-T33 VanDerWaalsContact OD2-CG2 3.31Å; D31-T33 WeakPolarHBondContact OD2-CG2 3.01Å; D31-T33 PolarHBondContact OD2-OG1 2.98Å; D31-L64 HydrophobicContact CB-CD1 4.31Å
32	G	67.4	Low	65	Low	42 Å²	42	83.1 Å²	83.1	43%	0.433	46%	0.456	S	S	.	.	S	Bend	trans	84	-4.2	-177.5	0	0	0	0	0	114.7	C29 P30	C29-G32 WeakPolarHBondContact O-CA 3.02Å; C29-G32 PolarHBondContact O-N 3.23Å; P30-G32 VanDerWaalsContact C-N 3.28Å
33	T	70.2	Confident	66.8	Low	52 Å²	52	78.8 Å²	78.8	32%	0.319	45%	0.448	S	S	.	.			trans	-69.5	151.6	175.8	64.6	0	0	0	0	110.9	R28 C29 D31	R28-T33 WeakPolarHBondContact CA-O 3.19Å; C29-T33 WeakPolarHBondContact CB-O 3.24Å; C29-T33 WeakPolarHBondContact CB-OG1 3.49Å; C29-T33 PolarHBondContact N-O 3.49Å; D31-T33 VanDerWaalsContact C-N 3.29Å; D31-T33 PolarHBondContact O-N 2.03Å; D31-T33 WeakPolarHBondContact OD1-CB 3.43Å; D31-T33 WeakPolarHBondContact OD1-CG2 3.31Å; D31-T33 PolarHBondContact OD1-N 3.44Å; D31-T33 PolarHBondContact OD1-OG1 3.48Å; D31-T33 VanDerWaalsContact OD2-CG2 3.31Å; D31-T33 WeakPolarHBondContact OD2-CG2 3.01Å; D31-T33 PolarHBondContact OD2-OG1 2.98Å
34	H	65.5	Low	68.9	Low	106 Å²	106	75.6 Å²	75.6	49%	0.491	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.1	175.7	-90.4	-125.8	0	0	0	109	G26 R28	G26-H34 PolarHBondContact O-ND1 3.03Å; R28-H34 VanDerWaalsContact CG-NE2 3.33Å; R28-H34 WeakPolarHBondContact CG-NE2 3.45Å; R28-H34 PolarHBondContact NE-NE2 2.85Å
35	S	68.9	Low	70.5	Confident	9 Å²	9	68.9 Å²	68.9	6%	0.063	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.5	170.6	-174.7	0	0	0	0	110.5	G26 I37 Q56 C57	G26-S35 VanDerWaalsContact CA-O 3.28Å; G26-S35 WeakPolarHBondContact CA-O 2.98Å; S35-I37 VanDerWaalsContact C-N 3.31Å; S35-I37 PolarHBondContact OG-N 3.42Å; S35-Q56 PolarHBondContact O-OE1 2.75Å; S35-C57 WeakPolarHBondContact CB-O 3.46Å; S35-C57 PolarHBondContact OG-O 3.26Å
36	A	67.3	Low	71.4	Confident	87 Å²	87	67 Å²	67	72%	0.719	40%	0.395	S	S	*	.			trans	-89.7	-0.4	170.2	0	0	0	0	0	112.2	M38	A36-M38 PolarHBondContact O-N 2.6Å
37	I	76.4	Confident	72.1	Confident	52 Å²	52	71.7 Å²	71.7	27%	0.267	42%	0.424	S	S	.	.			trans	-88.5	109.9	-176	-56.9	-176.8	0	0	0	107.9	S35 W48 Q56 C57	S35-I37 VanDerWaalsContact C-N 3.31Å; S35-I37 PolarHBondContact OG-N 3.42Å; I37-W48 HydrophobicContact CD1-CD2 3.53Å; I37-W48 HydrophobicContact CD1-CE3 4.14Å; I37-W48 HydrophobicContact CD1-CG 3.92Å; I37-W48 HydrophobicContact CD1-CH2 4.06Å; I37-W48 HydrophobicContact CD1-CZ2 3.45Å; I37-W48 VanDerWaalsContact CD1-CZ2 3.45Å; I37-W48 HydrophobicContact CD1-CZ3 4.37Å; I37-W48 VanDerWaalsContact CD1-NE1 3.29Å; I37-Q56 CarbonylContact O-C 3.5Å; I37-Q56 VanDerWaalsContact O-CA 3.25Å; I37-Q56 WeakPolarHBondContact O-CA 3.35Å; I37-C57 HydrophobicContact CB-CB 3.98Å; I37-C57 HydrophobicContact CG2-CB 3.81Å; I37-C57 PolarHBondContact O-N 2.84Å
38	M	81.2	Confident	72.2	Confident	128 Å²	128	77.4 Å²	77.4	63%	0.631	44%	0.436	S	S	*	.	B	Isolated β-bridge	trans	-78.4	153.7	177.1	-59.3	-64.9	-114.7	0	0	111.1	A36 G55 Q56	A36-M38 PolarHBondContact O-N 2.6Å; M38-G55 CarbonylContact C-O 3.59Å; M38-G55 WeakPolarHBondContact CA-O 2.98Å; M38-Q56 HydrophobicContact SD-CG 3.66Å
39	C	81.8	Confident	72.1	Confident	9 Å²	9	78.4 Å²	78.4	6%	0.061	44%	0.44	C	S	.	.			trans	-153	158.6	176.1	55.9	0	0	0	0	111.5	Q44 C52 G55 Q56 C57	C39-Q44 HydrophobicContact CB-CB 4.15Å; C39-C52 HydrophobicContact CB-CB 3.82Å; C39-C52 WeakPolarHBondContact CB-SG 3.36Å; C39-C52 PolarHBondContact O-SG 2.99Å; C39-C52 WeakPolarHBondContact SG-CA 3.47Å; C39-C52 WeakPolarHBondContact SG-CB 3.46Å; C39-C52 CovalentContact SG-SG 2.02Å; C39-C52 PolarHBondContact SG-SG 2.83Å; C39-G55 PolarHBondContact N-O 3.04Å; C39-G55 CarbonylContact O-C 3.45Å; C39-G55 VanDerWaalsContact O-CA 3.24Å; C39-G55 WeakPolarHBondContact O-CA 3.02Å; C39-G55 VanDerWaalsContact SG-C 3.51Å; C39-Q56 VanDerWaalsContact SG-CA 3.54Å; C39-Q56 PolarHBondContact SG-N 2.74Å; C39-Q56 PolarHBondContact SG-O 2.95Å; C39-C57 VanDerWaalsContact CB-SG 3.52Å; C39-C57 PolarHBondContact SG-N 2.97Å
40	I	77.1	Confident	72.2	Confident	149 Å²	149	78.4 Å²	78.4	76%	0.764	44%	0.441	S	S	*	.	S	Bend	trans	-103.2	-36.7	167.3	-53.4	170.3	0	0	0	109.8
41	T	74.4	Confident	72.8	Confident	69 Å²	69	77.3 Å²	77.3	42%	0.423	43%	0.427	S	S	.	.	S	Bend	trans	-135.9	151.9	-177.7	63.5	0	0	0	0	110.5	A43 Q44 C52	T41-A43 PolarHBondContact O-N 3.33Å; T41-A43 VanDerWaalsContact O-N 3.08Å; T41-Q44 WeakPolarHBondContact O-CB 3.38Å; T41-Q44 PolarHBondContact O-N 2.88Å; T41-Q44 PolarHBondContact OG1-NE2 3.35Å; T41-C52 VanDerWaalsContact C-CB 3.48Å
42	S	72.4	Confident	73.5	Confident	43 Å²	43	74.6 Å²	74.6	30%	0.301	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-60.5	-20.5	179.4	-58.7	0	0	0	0	114.5	Q44 C45 H51 C52	S42-Q44 PolarHBondContact O-N 2.03Å; S42-C45 WeakPolarHBondContact O-CB 3.38Å; S42-C45 PolarHBondContact O-N 2.96Å; S42-H51 PolarHBondContact OG-CD2 3.15Å; S42-C52 PolarHBondContact OG-N 2.78Å
43	A	76	Confident	74	Confident	76 Å²	76	73.6 Å²	73.6	63%	0.628	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-60.9	-24.7	173.2	0	0	0	0	0	113.3	T41 C45 S46	T41-A43 PolarHBondContact O-N 3.33Å; T41-A43 VanDerWaalsContact O-N 3.08Å; A43-C45 PolarHBondContact O-N 3.23Å; A43-S46 PolarHBondContact O-OG 3.04Å
44	Q	80.2	Confident	74.2	Confident	90 Å²	90	82.2 Å²	82.2	42%	0.421	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-78.2	-13.7	176.6	-63.4	163.3	32.6	0	0	111.9	C39 T41 S42	C39-Q44 HydrophobicContact CB-CB 4.15Å; T41-Q44 WeakPolarHBondContact O-CB 3.38Å; T41-Q44 PolarHBondContact O-N 2.88Å; T41-Q44 PolarHBondContact OG1-NE2 3.35Å; S42-Q44 PolarHBondContact O-N 2.03Å
45	C	79.4	Confident	74.9	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-97.3	3.2	-179.2	-50.6	0	0	0	0	113	S42 A43 W48 R49 G50 C57	S42-C45 WeakPolarHBondContact O-CB 3.38Å; S42-C45 PolarHBondContact O-N 2.96Å; A43-C45 PolarHBondContact O-N 3.23Å; C45-W48 PolarHBondContact O-N 3.25Å; C45-R49 PolarHBondContact O-N 3.49Å; C45-G50 WeakPolarHBondContact CB-O 3.22Å; C45-G50 PolarHBondContact O-N 2.97Å; C45-G50 VanDerWaalsContact O-N 3.14Å; C45-C57 WeakPolarHBondContact CA-SG 3.31Å; C45-C57 HydrophobicContact CB-CB 3.63Å; C45-C57 WeakPolarHBondContact CB-SG 2.96Å; C45-C57 WeakPolarHBondContact SG-CA 2.92Å; C45-C57 WeakPolarHBondContact SG-CB 3.09Å; C45-C57 CovalentContact SG-SG 2.03Å; C45-C57 PolarHBondContact SG-SG 2.82Å
46	S	69.1	Low	75.6	Confident	82 Å²	82	79.2 Å²	79.2	57%	0.573	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-56.2	-36	-178.6	-62.7	0	0	0	0	115.1	A43 W48 R49	A43-S46 PolarHBondContact O-OG 3.04Å; S46-W48 PolarHBondContact O-N 3.31Å; S46-R49 PolarHBondContact O-N 3.27Å
47	P	68.1	Low	76.4	Confident	108 Å²	108	75.2 Å²	75.2	70%	0.701	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.9	175.8	-18.9	30.6	0	0	0	113.4
48	W	63.1	Low	76.6	Confident	166 Å²	166	72.9 Å²	72.9	63%	0.629	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-109.7	5.1	-171.9	-58.5	86.4	0	0	0	113.3	I37 C45 S46 G50	I37-W48 HydrophobicContact CD1-CD2 3.53Å; I37-W48 HydrophobicContact CD1-CE3 4.14Å; I37-W48 HydrophobicContact CD1-CG 3.92Å; I37-W48 HydrophobicContact CD1-CH2 4.06Å; I37-W48 HydrophobicContact CD1-CZ2 3.45Å; I37-W48 VanDerWaalsContact CD1-CZ2 3.45Å; I37-W48 HydrophobicContact CD1-CZ3 4.37Å; I37-W48 VanDerWaalsContact CD1-NE1 3.29Å; C45-W48 PolarHBondContact O-N 3.25Å; S46-W48 PolarHBondContact O-N 3.31Å; W48-G50 PolarHBondContact O-N 2.95Å; W48-G50 VanDerWaalsContact O-N 3.13Å
49	R	67.7	Low	76.2	Confident	206 Å²	206	69.8 Å²	69.8	78%	0.777	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	40.2	-167.1	-65.1	-172.6	-179.8	-110.6	4	111.8	C45 S46 M60	C45-R49 PolarHBondContact O-N 3.49Å; S46-R49 PolarHBondContact O-N 3.27Å; R49-M60 PolarHBondContact O-N 2.99Å
50	G	76.5	Confident	75.4	Confident	6 Å²	6	71.2 Å²	71.2	6%	0.062	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	174.2	-177.5	0	0	0	0	0	113.4	C45 W48 C58	C45-G50 WeakPolarHBondContact CB-O 3.22Å; C45-G50 PolarHBondContact O-N 2.97Å; C45-G50 VanDerWaalsContact O-N 3.14Å; W48-G50 PolarHBondContact O-N 2.95Å; W48-G50 VanDerWaalsContact O-N 3.13Å; G50-C58 CarbonylContact C-O 3.6Å; G50-C58 WeakPolarHBondContact CA-O 3.3Å
51	H	78.8	Confident	74.5	Confident	71 Å²	71	69.8 Å²	69.8	33%	0.329	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	151.2	168.1	-91.9	55.1	0	0	0	110.7	S42 I53 C57 C58 M60	S42-H51 PolarHBondContact OG-CD2 3.15Å; H51-I53 HydrophobicContact CB-CG1 4.32Å; H51-I53 PolarHBondContact O-N 3.38Å; H51-C57 CarbonylContact O-C 3.46Å; H51-C57 WeakPolarHBondContact O-CA 3.31Å; H51-C58 PolarHBondContact N-O 3.28Å; H51-C58 PolarHBondContact O-N 3.02Å; H51-M60 HydrophobicContact CB-CE 4.23Å; H51-M60 HydrophobicContact CB-CG 4.24Å
52	C	82.6	Confident	73.3	Confident	15 Å²	15	74.8 Å²	74.8	10%	0.101	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	107.4	175.2	-164.1	0	0	0	0	110.8	C39 T41 S42 Q56	C39-C52 HydrophobicContact CB-CB 3.82Å; C39-C52 WeakPolarHBondContact CB-SG 3.36Å; C39-C52 PolarHBondContact O-SG 2.99Å; C39-C52 WeakPolarHBondContact SG-CA 3.47Å; C39-C52 WeakPolarHBondContact SG-CB 3.46Å; C39-C52 CovalentContact SG-SG 2.02Å; C39-C52 PolarHBondContact SG-SG 2.83Å; T41-C52 VanDerWaalsContact C-CB 3.48Å; S42-C52 PolarHBondContact OG-N 2.78Å; C52-Q56 CarbonylContact C-O 3.42Å; C52-Q56 WeakPolarHBondContact CA-O 3.4Å
53	I	76.9	Confident	72.1	Confident	21 Å²	21	78.6 Å²	78.6	11%	0.108	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	117.4	-178.7	-51.9	-173.6	0	0	0	107.7	P30 H51 G55 Q56 C58 M60 V89	P30-I53 HydrophobicContact CG-CD1 3.92Å; P30-I53 HydrophobicContact CG-CG2 4.27Å; H51-I53 HydrophobicContact CB-CG1 4.32Å; H51-I53 PolarHBondContact O-N 3.38Å; I53-G55 PolarHBondContact O-N 3.33Å; I53-G55 VanDerWaalsContact O-N 3.14Å; I53-Q56 PolarHBondContact N-O 3.39Å; I53-Q56 PolarHBondContact O-N 3.44Å; I53-C58 HydrophobicContact CB-CB 4.41Å; I53-C58 HydrophobicContact CD1-CB 3.7Å; I53-C58 HydrophobicContact CG1-CB 4.06Å; I53-M60 HydrophobicContact CD1-CE 4.22Å; I53-V89 HydrophobicContact CG1-CG1 4.2Å
54	R	74.6	Confident	70.7	Confident	233 Å²	233	80 Å²	80	88%	0.879	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	38.7	-179.4	-63.8	-179.5	171.2	147.6	-1	113.5
55	G	79.7	Confident	69.1	Low	31 Å²	31	79.6 Å²	79.6	32%	0.32	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	11.5	178.8	0	0	0	0	0	114.7	M38 C39 I53	M38-G55 CarbonylContact C-O 3.59Å; M38-G55 WeakPolarHBondContact CA-O 2.98Å; C39-G55 PolarHBondContact N-O 3.04Å; C39-G55 CarbonylContact O-C 3.45Å; C39-G55 VanDerWaalsContact O-CA 3.24Å; C39-G55 WeakPolarHBondContact O-CA 3.02Å; C39-G55 VanDerWaalsContact SG-C 3.51Å; I53-G55 PolarHBondContact O-N 3.33Å; I53-G55 VanDerWaalsContact O-N 3.14Å
56	Q	83.7	Confident	67.5	Low	21 Å²	21	82.4 Å²	82.4	10%	0.098	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.9	-177.7	-60.7	-179.3	-1.1	0	0	112.6	A27 S35 I37 M38 C39 C52 I53 C58	A27-Q56 VanDerWaalsContact CB-CD 3.44Å; A27-Q56 VanDerWaalsContact N-CD 3.32Å; A27-Q56 PolarHBondContact O-OE1 3.1Å; S35-Q56 PolarHBondContact O-OE1 2.75Å; I37-Q56 CarbonylContact O-C 3.5Å; I37-Q56 VanDerWaalsContact O-CA 3.25Å; I37-Q56 WeakPolarHBondContact O-CA 3.35Å; M38-Q56 HydrophobicContact SD-CG 3.66Å; C39-Q56 VanDerWaalsContact SG-CA 3.54Å; C39-Q56 PolarHBondContact SG-N 2.74Å; C39-Q56 PolarHBondContact SG-O 2.95Å; C52-Q56 CarbonylContact C-O 3.42Å; C52-Q56 WeakPolarHBondContact CA-O 3.4Å; I53-Q56 PolarHBondContact N-O 3.39Å; I53-Q56 PolarHBondContact O-N 3.44Å; Q56-C58 PolarHBondContact O-N 3.28Å
57	C	83.7	Confident	66.5	Low	4 Å²	4	84.8 Å²	84.8	3%	0.027	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	101.1	178.7	-71.6	0	0	0	0	110.1	S35 I37 C39 C45 H51	S35-C57 WeakPolarHBondContact CB-O 3.46Å; S35-C57 PolarHBondContact OG-O 3.26Å; I37-C57 HydrophobicContact CB-CB 3.98Å; I37-C57 HydrophobicContact CG2-CB 3.81Å; I37-C57 PolarHBondContact O-N 2.84Å; C39-C57 VanDerWaalsContact CB-SG 3.52Å; C39-C57 PolarHBondContact SG-N 2.97Å; C45-C57 WeakPolarHBondContact CA-SG 3.31Å; C45-C57 HydrophobicContact CB-CB 3.63Å; C45-C57 WeakPolarHBondContact CB-SG 2.96Å; C45-C57 WeakPolarHBondContact SG-CA 2.92Å; C45-C57 WeakPolarHBondContact SG-CB 3.09Å; C45-C57 CovalentContact SG-SG 2.03Å; C45-C57 PolarHBondContact SG-SG 2.82Å; H51-C57 CarbonylContact O-C 3.46Å; H51-C57 WeakPolarHBondContact O-CA 3.31Å
58	C	81.2	Confident	65.7	Low	3 Å²	3	83.2 Å²	83.2	2%	0.02	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	129.4	176.2	-72	0	0	0	0	111.1	C29 G50 H51 I53 Q56 M60	C29-C58 WeakPolarHBondContact CA-SG 3.36Å; C29-C58 HydrophobicContact CB-CB 3.68Å; C29-C58 WeakPolarHBondContact CB-SG 2.82Å; C29-C58 WeakPolarHBondContact SG-CA 3.46Å; C29-C58 WeakPolarHBondContact SG-CB 3.4Å; C29-C58 CovalentContact SG-SG 2.04Å; C29-C58 PolarHBondContact SG-SG 3.42Å; G50-C58 CarbonylContact C-O 3.6Å; G50-C58 WeakPolarHBondContact CA-O 3.3Å; H51-C58 PolarHBondContact N-O 3.28Å; H51-C58 PolarHBondContact O-N 3.02Å; I53-C58 HydrophobicContact CB-CB 4.41Å; I53-C58 HydrophobicContact CD1-CB 3.7Å; I53-C58 HydrophobicContact CG1-CB 4.06Å; Q56-C58 PolarHBondContact O-N 3.28Å; C58-M60 PolarHBondContact O-N 3.46Å
59	P	73	Confident	65	Low	62 Å²	62	80.6 Å²	80.6	40%	0.403	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	129.8	174	25.7	-30.8	0	0	0	109.2
60	M	65.4	Low	64	Low	40 Å²	40	77.1 Å²	77.1	20%	0.197	40%	0.401	C	S	.	.			trans	-108.3	107.7	175.3	-81.7	-91.5	-156.9	0	0	108.2	R49 H51 I53 C58 L65 L90	R49-M60 PolarHBondContact O-N 2.99Å; H51-M60 HydrophobicContact CB-CE 4.23Å; H51-M60 HydrophobicContact CB-CG 4.24Å; I53-M60 HydrophobicContact CD1-CE 4.22Å; C58-M60 PolarHBondContact O-N 3.46Å; M60-L65 HydrophobicContact CE-CD2 4.11Å; M60-L65 HydrophobicContact SD-CD2 3.68Å; M60-L65 HydrophobicContact SD-CG 4.29Å; M60-L90 HydrophobicContact CE-CD2 4.48Å
61	N	57.7	Low	62.9	Low	119 Å²	119	85.2 Å²	85.2	64%	0.636	44%	0.438	S	S	*	.			trans	-69.9	128.5	159	-102.8	-21.5	0	0	0	107.5	S63 L64 L65	N61-S63 PolarHBondContact O-N 3.08Å; N61-L64 HydrophobicContact CB-CD1 4.32Å; N61-L64 PolarHBondContact O-N 3.17Å; N61-L65 PolarHBondContact O-N 3.02Å
62	K	50.1	Low	62.6	Low	174 Å²	174	85.5 Å²	85.5	76%	0.757	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-52.7	-26.4	-179.9	-77.6	-179.3	176.1	-178.5	0	113.3	L64 L65	K62-L64 VanDerWaalsContact C-N 3.35Å; K62-L65 HydrophobicContact CB-CD1 4.48Å; K62-L65 HydrophobicContact CG-CD1 4.46Å
63	S	46.5	Very low	62.3	Low	122 Å²	122	86.7 Å²	86.7	85%	0.853	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-76.9	-13.9	176.8	-55.8	0	0	0	0	115	N61	N61-S63 PolarHBondContact O-N 3.08Å
64	L	46.6	Very low	62.1	Low	107 Å²	107	86.4 Å²	86.4	56%	0.56	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-108.6	3.7	177.5	-71.6	169.2	0	0	0	112.6	D31 N61 K62 P66	D31-L64 HydrophobicContact CB-CD1 4.31Å; N61-L64 HydrophobicContact CB-CD1 4.32Å; N61-L64 PolarHBondContact O-N 3.17Å; K62-L64 VanDerWaalsContact C-N 3.35Å; L64-P66 WeakPolarHBondContact O-CD 3.3Å; L64-P66 VanDerWaalsContact O-N 3.08Å
65	L	46.7	Very low	61.6	Low	81 Å²	81	85.2 Å²	85.2	42%	0.424	45%	0.448	S	S	.	.	S	Bend	trans	-55.7	115.6	168.3	-81.7	164.9	0	0	0	107.7	M60 N61 K62 Q67	M60-L65 HydrophobicContact CE-CD2 4.11Å; M60-L65 HydrophobicContact SD-CD2 3.68Å; M60-L65 HydrophobicContact SD-CG 4.29Å; N61-L65 PolarHBondContact O-N 3.02Å; K62-L65 HydrophobicContact CB-CD1 4.48Å; K62-L65 HydrophobicContact CG-CD1 4.46Å; L65-Q67 PolarHBondContact O-N 3Å
66	P	45.8	Very low	60.8	Low	59 Å²	59	87 Å²	87	38%	0.383	46%	0.46	S	S	.	.			trans	-66.3	107.6	173.7	-18	35	0	0	0	105.9	L64 K68 L90	L64-P66 WeakPolarHBondContact O-CD 3.3Å; L64-P66 VanDerWaalsContact O-N 3.08Å; P66-K68 VanDerWaalsContact C-N 3.29Å; P66-K68 PolarHBondContact O-N 2.65Å; P66-L90 HydrophobicContact CB-CD2 4.02Å; P66-L90 HydrophobicContact CG-CD1 4.18Å; P66-L90 HydrophobicContact CG-CD2 3.47Å; P66-L90 VanDerWaalsContact CG-CD2 3.47Å; P66-L90 HydrophobicContact CG-CG 4.39Å
67	Q	48.3	Very low	59.9	Low	131 Å²	131	86.8 Å²	86.8	61%	0.612	46%	0.462	S	S	*	.			trans	-2.1	73.9	178.8	-71.9	-177.6	-54.2	0	0	114.5	L65 E69 N91	L65-Q67 PolarHBondContact O-N 3Å; Q67-E69 HydrophobicContact CB-CB 4.3Å; Q67-E69 PolarHBondContact NE2-OE2 2.88Å; Q67-E69 PolarHBondContact O-N 2.6Å; Q67-N91 PolarHBondContact O-ND2 3.01Å
68	K	51.9	Low	59.2	Low	75 Å²	75	89.8 Å²	89.8	33%	0.326	48%	0.481	S	S	.	.			trans	-78.3	63.6	149.6	-165.2	175.8	-178.4	173.8	0	105.7	P66 T70 C100 D102	P66-K68 VanDerWaalsContact C-N 3.29Å; P66-K68 PolarHBondContact O-N 2.65Å; K68-T70 PolarHBondContact O-N 2.04Å; K68-T70 VanDerWaalsContact O-N 3.11Å; K68-C100 VanDerWaalsContact CE-O 3.28Å; K68-C100 WeakPolarHBondContact CE-O 3.42Å; K68-D102 IonicContact NZ-OD1 2.88Å; K68-D102 PolarHBondContact NZ-OD1 2.95Å; K68-D102 IonicContact NZ-OD2 2.65Å; K68-D102 PolarHBondContact NZ-OD2 2.82Å
69	E	48.4	Very low	58.8	Low	111 Å²	111	94.2 Å²	94.2	52%	0.519	50%	0.504	S	S	.	.			trans	-61.8	120.6	-175.7	-157.2	159.3	167.4	0	0	105.8	Q67 Q71	Q67-E69 HydrophobicContact CB-CB 4.3Å; Q67-E69 PolarHBondContact NE2-OE2 2.88Å; Q67-E69 PolarHBondContact O-N 2.6Å; E69-Q71 PolarHBondContact O-N 2.94Å
70	T	46.4	Very low	58.9	Low	133 Å²	133	99.5 Å²	99.5	82%	0.816	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	16.4	-153.2	-31.9	0	0	0	0	114.1	K68	K68-T70 PolarHBondContact O-N 2.04Å; K68-T70 VanDerWaalsContact O-N 3.11Å
71	Q	54	Low	59.3	Low	177 Å²	177	100 Å²	100	83%	0.827	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.7	-3.5	-167	-142	71.4	37.1	0	0	115.5	E69	E69-Q71 PolarHBondContact O-N 2.94Å
72	E	70.9	Confident	60.2	Low	77 Å²	77	94.9 Å²	94.9	36%	0.36	50%	0.495	S	S	.	.	S	Bend	trans	-101.5	-11.6	-179.1	-67.6	178.1	152.4	0	0	113.9	R99 P112	E72-R99 HydrophobicContact CB-CG 4.27Å; E72-R99 IonicContact OE1-NH2 3.74Å; E72-R99 IonicContact OE2-CZ 3.51Å; E72-R99 IonicContact OE2-NE 2.73Å; E72-R99 PolarHBondContact OE2-NE 2.85Å; E72-R99 IonicContact OE2-NH2 3.39Å; E72-R99 PolarHBondContact OE2-NH2 3.39Å; E72-P112 WeakPolarHBondContact O-CA 3.32Å
73	C	76.6	Confident	61.6	Low	40 Å²	40	95.5 Å²	95.5	27%	0.27	49%	0.493	S	S	.	.	S	Bend	trans	-79.4	138.8	178.4	-72.7	0	0	0	0	111.5	F75 C101	C73-F75 PolarHBondContact O-N 3.4Å; C73-C101 WeakPolarHBondContact CA-SG 2.95Å; C73-C101 HydrophobicContact CB-CB 3.78Å; C73-C101 WeakPolarHBondContact CB-SG 3.29Å; C73-C101 WeakPolarHBondContact SG-CA 3.04Å; C73-C101 WeakPolarHBondContact SG-CB 3.33Å; C73-C101 CovalentContact SG-SG 2.04Å; C73-C101 PolarHBondContact SG-SG 3.48Å
74	P	72.2	Confident	63.3	Low	15 Å²	15	94.7 Å²	94.7	10%	0.097	49%	0.487	C	S	.	.			trans	-64.1	127.7	175.5	26.6	-34.4	0	0	0	112	A76 A77 L110 L113 F161	P74-A76 PolarHBondContact O-N 3.11Å; P74-A77 HydrophobicContact CB-CB 4.35Å; P74-A77 HydrophobicContact CG-CB 3.94Å; P74-L110 HydrophobicContact CG-CB 3.97Å; P74-L110 HydrophobicContact CG-CD1 3.62Å; P74-L110 HydrophobicContact CG-CG 4.42Å; P74-L113 HydrophobicContact CB-CD1 4.21Å; P74-L113 HydrophobicContact CB-CD2 3.47Å; P74-L113 VanDerWaalsContact CB-CD2 3.47Å; P74-L113 HydrophobicContact CB-CG 3.67Å; P74-F161 HydrophobicContact CB-CE1 3.32Å; P74-F161 HydrophobicContact CB-CZ 3.59Å; P74-F161 HydrophobicContact CG-CE1 3.87Å
75	F	64.9	Low	65.3	Low	208 Å²	208	90.4 Å²	90.4	91%	0.912	47%	0.467	S	S	*	.	S	Bend	trans	-57.2	-34.5	174.7	-173.7	-95.5	0	0	0	111.8	C73	C73-F75 PolarHBondContact O-N 3.4Å
76	A	62.6	Low	67.3	Low	69 Å²	69	92.5 Å²	92.5	57%	0.57	47%	0.473	S	S	*	.	S	Bend	trans	-148.3	93.8	177.6	0	0	0	0	0	111.4	P74 F161	P74-A76 PolarHBondContact O-N 3.11Å; A76-F161 VanDerWaalsContact O-CE2 3.29Å; A76-F161 WeakPolarHBondContact O-CE2 3.43Å; A76-F161 WeakPolarHBondContact O-CZ 3.47Å
77	A	65.7	Low	69.4	Low	16 Å²	16	94.1 Å²	94.1	13%	0.132	48%	0.483	C	S	.	.			trans	-80.2	142.6	171.1	0	0	0	0	0	111.5	P74 L79 I82 L110 F161	P74-A77 HydrophobicContact CB-CB 4.35Å; P74-A77 HydrophobicContact CG-CB 3.94Å; A77-L79 PolarHBondContact O-N 3.12Å; A77-I82 HydrophobicContact CB-CD1 4.08Å; A77-I82 HydrophobicContact CB-CG1 3.78Å; A77-L110 HydrophobicContact CB-CD1 4.05Å; A77-F161 HydrophobicContact CB-CE1 3.86Å; A77-F161 HydrophobicContact CB-CZ 4.23Å
78	P	68.9	Low	71.3	Confident	66 Å²	66	88.4 Å²	88.4	43%	0.429	46%	0.458	S	S	.	.			trans	-53.9	133.7	172.5	-24.7	32.8	0	0	0	111.2	K80 Q81 I82 F161	P78-K80 PolarHBondContact O-N 3.23Å; P78-Q81 HydrophobicContact CB-CB 4.36Å; P78-Q81 WeakPolarHBondContact O-CA 3.35Å; P78-Q81 VanDerWaalsContact O-CB 3.31Å; P78-Q81 WeakPolarHBondContact O-CB 3.46Å; P78-Q81 PolarHBondContact O-N 3.27Å; P78-I82 PolarHBondContact O-N 3.33Å; P78-I82 VanDerWaalsContact O-N 3.1Å; P78-F161 HydrophobicContact CG-CD2 4.42Å
79	L	72.4	Confident	72.8	Confident	96 Å²	96	87.8 Å²	87.8	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-51.5	-35.4	-179.9	-69	178.3	0	0	0	113.2	A77 Q81 I82 R83 F105	A77-L79 PolarHBondContact O-N 3.12Å; L79-Q81 VanDerWaalsContact C-N 3.33Å; L79-I82 PolarHBondContact O-N 3.18Å; L79-R83 WeakPolarHBondContact O-CB 3.48Å; L79-R83 WeakPolarHBondContact O-CG 3.32Å; L79-R83 PolarHBondContact O-N 2.97Å; L79-F105 HydrophobicContact CD2-CD2 4.32Å; L79-F105 HydrophobicContact CD2-CE2 3.3Å; L79-F105 HydrophobicContact CD2-CZ 3.75Å
80	K	75.1	Confident	74.3	Confident	174 Å²	174	84 Å²	84	76%	0.757	44%	0.443	S	S	*	.	H	α-helix	trans	-64.3	-38.5	177	-164.6	179.1	-178.2	-175	0	111.9	P78 S84	P78-K80 PolarHBondContact O-N 3.23Å; K80-S84 PolarHBondContact O-N 2.7Å; K80-S84 PolarHBondContact O-OG 3.11Å
81	Q	73.9	Confident	75.9	Confident	49 Å²	49	79 Å²	79	23%	0.229	41%	0.412	C	S	.	.	H	α-helix	trans	-67.5	-45.7	175.4	-174.2	176.5	-1	0	0	110.6	P78 L79 R83 S84 A85 F161	P78-Q81 HydrophobicContact CB-CB 4.36Å; P78-Q81 WeakPolarHBondContact O-CA 3.35Å; P78-Q81 VanDerWaalsContact O-CB 3.31Å; P78-Q81 WeakPolarHBondContact O-CB 3.46Å; P78-Q81 PolarHBondContact O-N 3.27Å; L79-Q81 VanDerWaalsContact C-N 3.33Å; Q81-R83 PolarHBondContact O-N 3.22Å; Q81-S84 PolarHBondContact O-N 3.37Å; Q81-A85 WeakPolarHBondContact O-CB 3.31Å; Q81-A85 PolarHBondContact O-N 3.44Å; Q81-F161 VanDerWaalsContact OE1-CD1 3.31Å
82	I	76.8	Confident	77.2	Confident	12 Å²	12	76.2 Å²	76.2	6%	0.062	41%	0.407	C	S	.	.	H	α-helix	trans	-59.6	-48	178.4	-57.9	172	0	0	0	110.6	A77 P78 L79 S84 A85 T103 F105 H108	A77-I82 HydrophobicContact CB-CD1 4.08Å; A77-I82 HydrophobicContact CB-CG1 3.78Å; P78-I82 PolarHBondContact O-N 3.33Å; P78-I82 VanDerWaalsContact O-N 3.1Å; L79-I82 PolarHBondContact O-N 3.18Å; I82-S84 PolarHBondContact O-N 3.01Å; I82-A85 WeakPolarHBondContact O-CB 3.41Å; I82-A85 PolarHBondContact O-N 3.14Å; I82-A85 VanDerWaalsContact O-N 3.12Å; I82-T103 HydrophobicContact CD1-CG2 4.02Å; I82-T103 HydrophobicContact CG1-CG2 4.2Å; I82-T103 HydrophobicContact CG2-CG2 3.96Å; I82-T103 WeakPolarHBondContact CG2-OG1 3.38Å; I82-F105 HydrophobicContact CD1-CD2 4.5Å; I82-F105 HydrophobicContact CG2-CB 4.22Å; I82-F105 HydrophobicContact CG2-CD2 4Å; I82-H108 PolarHBondContact O-CD2 2.88Å
83	R	79	Confident	77.9	Confident	188 Å²	188	75.4 Å²	75.4	71%	0.709	41%	0.405	S	S	*	.	H	α-helix	trans	-64.7	-24.9	-178.6	-74.2	-178.8	-179.7	-179.9	0.9	114.4	L79 Q81	L79-R83 WeakPolarHBondContact O-CB 3.48Å; L79-R83 WeakPolarHBondContact O-CG 3.32Å; L79-R83 PolarHBondContact O-N 2.97Å; Q81-R83 PolarHBondContact O-N 3.22Å
84	S	83.1	Confident	78.5	Confident	105 Å²	105	74.1 Å²	74.1	73%	0.734	40%	0.396	S	S	*	.	H	α-helix	trans	-97.7	-6.3	177.6	-61.9	0	0	0	0	113	K80 Q81 I82	K80-S84 PolarHBondContact O-N 2.7Å; K80-S84 PolarHBondContact O-OG 3.11Å; Q81-S84 PolarHBondContact O-N 3.37Å; I82-S84 PolarHBondContact O-N 3.01Å
85	A	87.2	Confident	79.3	Confident	17 Å²	17	81.8 Å²	81.8	14%	0.14	43%	0.428	C	S	.	.	S	Bend	trans	-75.9	147	-179.1	0	0	0	0	0	111.4	Q81 I82 P87 H108 C109 L110	Q81-A85 WeakPolarHBondContact O-CB 3.31Å; Q81-A85 PolarHBondContact O-N 3.44Å; I82-A85 WeakPolarHBondContact O-CB 3.41Å; I82-A85 PolarHBondContact O-N 3.14Å; I82-A85 VanDerWaalsContact O-N 3.12Å; A85-P87 WeakPolarHBondContact O-CD 3.4Å; A85-H108 HydrophobicContact CB-CB 3.79Å; A85-H108 PolarHBondContact O-CD2 2.75Å; A85-C109 WeakPolarHBondContact CB-O 3.45Å; A85-L110 HydrophobicContact CB-CD2 3.9Å
86	K	90.2	Very high	80.1	Confident	124 Å²	124	77 Å²	77	54%	0.539	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-68.6	128.8	178.7	-175.3	-170	168.7	-169.2	0	109.6	D93 H108 C109	K86-D93 PolarHBondContact NZ-O 3.41Å; K86-H108 CarbonylContact O-C 3.47Å; K86-H108 WeakPolarHBondContact O-CA 3.19Å; K86-C109 HydrophobicContact CB-CB 4.38Å; K86-C109 PolarHBondContact O-N 2.73Å
87	P	89.6	Confident	81.1	Confident	93 Å²	93	77.6 Å²	77.6	60%	0.604	42%	0.418	S	S	*	.	B	Isolated β-bridge	trans	-60.1	143.9	169.8	-22.8	33.6	0	0	0	111.5	A85 S107	A85-P87 WeakPolarHBondContact O-CD 3.4Å; P87-S107 WeakPolarHBondContact CA-O 3.39Å
88	C	87.9	Confident	82.1	Confident	12 Å²	12	79.7 Å²	79.7	8%	0.081	43%	0.425	C	S	.	.			trans	-146.7	163.2	-178	59.2	0	0	0	0	111.1	D93 C100 S107 H108 C109	C88-D93 HydrophobicContact CB-CB 3.82Å; C88-C100 HydrophobicContact CB-CB 3.81Å; C88-C100 WeakPolarHBondContact CB-SG 3Å; C88-C100 PolarHBondContact O-SG 2.9Å; C88-C100 VanDerWaalsContact O-SG 3.41Å; C88-C100 WeakPolarHBondContact SG-CA 3.01Å; C88-C100 WeakPolarHBondContact SG-CB 3.38Å; C88-C100 CovalentContact SG-SG 2.03Å; C88-C100 PolarHBondContact SG-SG 2.04Å; C88-S107 PolarHBondContact N-O 3.17Å; C88-S107 WeakPolarHBondContact O-CB 3.24Å; C88-H108 VanDerWaalsContact SG-CA 3.6Å; C88-C109 VanDerWaalsContact CB-SG 3.58Å; C88-C109 PolarHBondContact SG-N 2.02Å
89	V	83	Confident	82.9	Confident	62 Å²	62	80.1 Å²	80.1	38%	0.376	42%	0.419	S	S	.	.	S	Bend	trans	-113.9	-36.8	169.3	-177	0	0	0	0	109.9	I53 D93	I53-V89 HydrophobicContact CG1-CG1 4.2Å; V89-D93 PolarHBondContact N-OD2 2.87Å
90	L	80.1	Confident	83.6	Confident	31 Å²	31	75.8 Å²	75.8	16%	0.162	40%	0.396	C	S	.	.	S	Bend	trans	-130.2	157.8	-176.8	-61.9	175.9	0	0	0	110.9	M60 P66 T92 D93 C100	M60-L90 HydrophobicContact CE-CD2 4.48Å; P66-L90 HydrophobicContact CB-CD2 4.02Å; P66-L90 HydrophobicContact CG-CD1 4.18Å; P66-L90 HydrophobicContact CG-CD2 3.47Å; P66-L90 VanDerWaalsContact CG-CD2 3.47Å; P66-L90 HydrophobicContact CG-CG 4.39Å; L90-T92 WeakPolarHBondContact CB-OG1 3Å; L90-T92 PolarHBondContact O-N 3.39Å; L90-T92 VanDerWaalsContact O-N 3.12Å; L90-D93 PolarHBondContact N-OD2 3.23Å; L90-D93 VanDerWaalsContact O-CB 3.31Å; L90-D93 WeakPolarHBondContact O-CB 3.44Å; L90-D93 PolarHBondContact O-N 2.73Å; L90-C100 VanDerWaalsContact C-CB 3.44Å; L90-C100 WeakPolarHBondContact O-CB 3.35Å
91	N	79.4	Confident	84.1	Confident	29 Å²	29	67.6 Å²	67.6	16%	0.155	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-56.7	-28.8	174	-69.1	-13.6	0	0	0	113.1	Q67 D93 C94 C100	Q67-N91 PolarHBondContact O-ND2 3.01Å; N91-D93 PolarHBondContact O-N 3.04Å; N91-C94 WeakPolarHBondContact O-CB 3.36Å; N91-C94 PolarHBondContact O-N 3.22Å; N91-C100 PolarHBondContact OD1-N 3.46Å
92	T	82.2	Confident	84.5	Confident	117 Å²	117	70 Å²	70	72%	0.718	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-67.4	-17.2	177.2	52.9	0	0	0	0	113.4	L90	L90-T92 WeakPolarHBondContact CB-OG1 3Å; L90-T92 PolarHBondContact O-N 3.39Å; L90-T92 VanDerWaalsContact O-N 3.12Å
93	D	85.5	Confident	84.5	Confident	60 Å²	60	71 Å²	71	32%	0.321	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-76.9	-17.2	173.1	-57.8	-38.4	0	0	0	111.9	K86 C88 V89 L90 N91	K86-D93 PolarHBondContact NZ-O 3.41Å; C88-D93 HydrophobicContact CB-CB 3.82Å; V89-D93 PolarHBondContact N-OD2 2.87Å; L90-D93 PolarHBondContact N-OD2 3.23Å; L90-D93 VanDerWaalsContact O-CB 3.31Å; L90-D93 WeakPolarHBondContact O-CB 3.44Å; L90-D93 PolarHBondContact O-N 2.73Å; N91-D93 PolarHBondContact O-N 3.04Å
94	C	88.3	Confident	84.3	Confident	14 Å²	14	70.9 Å²	70.9	10%	0.095	39%	0.389	C	S	.	.	S	Bend	trans	-97.6	151.7	-176.8	-54	0	0	0	0	111.3	N91 E98 C109	N91-C94 WeakPolarHBondContact O-CB 3.36Å; N91-C94 PolarHBondContact O-N 3.22Å; C94-E98 HydrophobicContact CB-CB 3.87Å; C94-C109 WeakPolarHBondContact CA-SG 3.02Å; C94-C109 HydrophobicContact CB-CB 3.7Å; C94-C109 WeakPolarHBondContact CB-SG 2.95Å; C94-C109 WeakPolarHBondContact SG-CA 3.23Å; C94-C109 WeakPolarHBondContact SG-CB 3.4Å; C94-C109 CovalentContact SG-SG 2.04Å; C94-C109 PolarHBondContact SG-SG 3.34Å
95	K	90.4	Very high	84.2	Confident	176 Å²	176	70.7 Å²	70.7	77%	0.765	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-84.5	130.2	173.8	-70.8	-178	178.5	-179	0	108.3	E98	K95-E98 WeakPolarHBondContact O-CA 3.5Å; K95-E98 WeakPolarHBondContact O-CB 3.44Å; K95-E98 WeakPolarHBondContact O-CG 3.35Å; K95-E98 PolarHBondContact O-N 2.03Å
96	S	81.9	Confident	83.9	Confident	107 Å²	107	71.4 Å²	71.4	75%	0.748	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	132.1	172.3	-172.5	0	0	0	0	110.2
97	P	82.6	Confident	83.7	Confident	81 Å²	81	67.4 Å²	67.4	53%	0.526	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.5	6.2	13.7	37.6	-37	0	0	0	115.8	P112	P97-P112 HydrophobicContact CB-CG 4.33Å; P97-P112 VanDerWaalsContact O-CD 3.25Å; P97-P112 WeakPolarHBondContact O-CD 3.27Å
98	E	86.8	Confident	83.7	Confident	60 Å²	60	64.2 Å²	64.2	28%	0.28	35%	0.349	S	S	.	.			trans	-65.3	152.4	-176.3	-58.9	173	156.4	0	0	112.8	C94 K95 C109 L110	C94-E98 HydrophobicContact CB-CB 3.87Å; K95-E98 WeakPolarHBondContact O-CA 3.5Å; K95-E98 WeakPolarHBondContact O-CB 3.44Å; K95-E98 WeakPolarHBondContact O-CG 3.35Å; K95-E98 PolarHBondContact O-N 2.03Å; E98-C109 HydrophobicContact CB-CB 4.25Å; E98-L110 WeakPolarHBondContact CA-O 3.49Å
99	R	85.2	Confident	83.8	Confident	76 Å²	76	63.7 Å²	63.7	29%	0.287	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	154.2	177.8	-61.6	-62.3	-164.7	-130.7	-0.9	110.5	E72 C101 C109 L110	E72-R99 HydrophobicContact CB-CG 4.27Å; E72-R99 IonicContact OE1-NH2 3.74Å; E72-R99 IonicContact OE2-CZ 3.51Å; E72-R99 IonicContact OE2-NE 2.73Å; E72-R99 PolarHBondContact OE2-NE 2.85Å; E72-R99 IonicContact OE2-NH2 3.39Å; E72-R99 PolarHBondContact OE2-NH2 3.39Å; R99-C101 PolarHBondContact O-N 3.45Å; R99-C109 CarbonylContact O-C 3.54Å; R99-C109 WeakPolarHBondContact O-CA 3.36Å; R99-L110 PolarHBondContact N-O 3.42Å; R99-L110 PolarHBondContact O-N 2.83Å
100	C	86.9	Confident	84	Confident	5 Å²	5	60.9 Å²	60.9	3%	0.034	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	109.1	177.6	-168.4	0	0	0	0	110.7	K68 C88 L90 N91	K68-C100 VanDerWaalsContact CE-O 3.28Å; K68-C100 WeakPolarHBondContact CE-O 3.42Å; C88-C100 HydrophobicContact CB-CB 3.81Å; C88-C100 WeakPolarHBondContact CB-SG 3Å; C88-C100 PolarHBondContact O-SG 2.9Å; C88-C100 VanDerWaalsContact O-SG 3.41Å; C88-C100 WeakPolarHBondContact SG-CA 3.01Å; C88-C100 WeakPolarHBondContact SG-CB 3.38Å; C88-C100 CovalentContact SG-SG 2.03Å; C88-C100 PolarHBondContact SG-SG 2.04Å; L90-C100 VanDerWaalsContact C-CB 3.44Å; L90-C100 WeakPolarHBondContact O-CB 3.35Å; N91-C100 PolarHBondContact OD1-N 3.46Å
101	C	85.7	Confident	84.1	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.014	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	141	-171.7	-65.5	0	0	0	0	111.3	C73 R99 S107 H108 L110	C73-C101 WeakPolarHBondContact CA-SG 2.95Å; C73-C101 HydrophobicContact CB-CB 3.78Å; C73-C101 WeakPolarHBondContact CB-SG 3.29Å; C73-C101 WeakPolarHBondContact SG-CA 3.04Å; C73-C101 WeakPolarHBondContact SG-CB 3.33Å; C73-C101 CovalentContact SG-SG 2.04Å; C73-C101 PolarHBondContact SG-SG 3.48Å; R99-C101 PolarHBondContact O-N 3.45Å; C101-S107 CarbonylContact O-C 3.41Å; C101-S107 VanDerWaalsContact O-CA 3.23Å; C101-S107 WeakPolarHBondContact O-CA 3.28Å; C101-H108 PolarHBondContact N-O 2.03Å; C101-H108 PolarHBondContact O-N 2.83Å; C101-L110 HydrophobicContact CB-CB 4.17Å; C101-L110 HydrophobicContact CB-CD1 3.67Å; C101-L110 HydrophobicContact CB-CG 3.99Å
102	D	82.3	Confident	83.8	Confident	100 Å²	100	60.6 Å²	60.6	54%	0.535	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	132.9	177.6	-69.5	-15.4	0	0	0	106.9	K68 S107	K68-D102 IonicContact NZ-OD1 2.88Å; K68-D102 PolarHBondContact NZ-OD1 2.95Å; K68-D102 IonicContact NZ-OD2 2.65Å; K68-D102 PolarHBondContact NZ-OD2 2.82Å; D102-S107 WeakPolarHBondContact OD1-CB 2.89Å; D102-S107 PolarHBondContact OD1-OG 2.87Å
103	T	76.4	Confident	83.1	Confident	31 Å²	31	57.3 Å²	57.3	19%	0.19	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	170.1	173.7	73.8	0	0	0	0	108.5	I82 F105 G106 L110	I82-T103 HydrophobicContact CD1-CG2 4.02Å; I82-T103 HydrophobicContact CG1-CG2 4.2Å; I82-T103 HydrophobicContact CG2-CG2 3.96Å; I82-T103 WeakPolarHBondContact CG2-OG1 3.38Å; T103-F105 PolarHBondContact O-N 3.13Å; T103-F105 PolarHBondContact OG1-N 2.96Å; T103-F105 VanDerWaalsContact OG1-N 3.15Å; T103-G106 PolarHBondContact N-O 2.82Å; T103-G106 PolarHBondContact O-N 3.49Å; T103-G106 PolarHBondContact OG1-N 3.44Å; T103-G106 PolarHBondContact OG1-O 3.37Å; T103-L110 HydrophobicContact CG2-CD1 3.91Å
104	E	75.7	Confident	82.3	Confident	187 Å²	187	59.7 Å²	59.7	87%	0.874	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-18.8	171.7	-60.7	-173.2	139.1	0	0	113
105	F	80	Confident	81.1	Confident	100 Å²	100	63.1 Å²	63.1	44%	0.439	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	8.6	178.8	-52.7	-76.5	0	0	0	113.2	L79 I82 T103 H108	L79-F105 HydrophobicContact CD2-CD2 4.32Å; L79-F105 HydrophobicContact CD2-CE2 3.3Å; L79-F105 HydrophobicContact CD2-CZ 3.75Å; I82-F105 HydrophobicContact CD1-CD2 4.5Å; I82-F105 HydrophobicContact CG2-CB 4.22Å; I82-F105 HydrophobicContact CG2-CD2 4Å; T103-F105 PolarHBondContact O-N 3.13Å; T103-F105 PolarHBondContact OG1-N 2.96Å; T103-F105 VanDerWaalsContact OG1-N 3.15Å; F105-H108 PolarHBondContact O-CE1 2.83Å; F105-H108 VanDerWaalsContact O-CE1 3.27Å
106	G	81.7	Confident	80	Confident	33 Å²	33	57.3 Å²	57.3	34%	0.34	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	103.4	-173.4	-176.9	0	0	0	0	0	113.4	T103 H108	T103-G106 PolarHBondContact N-O 2.82Å; T103-G106 PolarHBondContact O-N 3.49Å; T103-G106 PolarHBondContact OG1-N 3.44Å; T103-G106 PolarHBondContact OG1-O 3.37Å; G106-H108 PolarHBondContact O-ND1 2.92Å
107	S	85.6	Confident	79.4	Confident	40 Å²	40	57.9 Å²	57.9	28%	0.28	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.5	-173.4	-49.3	0	0	0	0	112.2	P87 C88 C101 D102	P87-S107 WeakPolarHBondContact CA-O 3.39Å; C88-S107 PolarHBondContact N-O 3.17Å; C88-S107 WeakPolarHBondContact O-CB 3.24Å; C101-S107 CarbonylContact O-C 3.41Å; C101-S107 VanDerWaalsContact O-CA 3.23Å; C101-S107 WeakPolarHBondContact O-CA 3.28Å; D102-S107 WeakPolarHBondContact OD1-CB 2.89Å; D102-S107 PolarHBondContact OD1-OG 2.87Å
108	H	89.4	Confident	79	Confident	25 Å²	25	64.3 Å²	64.3	12%	0.116	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147.4	-172.2	-65.2	57.2	0	0	0	111.3	I82 A85 K86 C88 C101 F105 G106 L110	I82-H108 PolarHBondContact O-CD2 2.88Å; A85-H108 HydrophobicContact CB-CB 3.79Å; A85-H108 PolarHBondContact O-CD2 2.75Å; K86-H108 CarbonylContact O-C 3.47Å; K86-H108 WeakPolarHBondContact O-CA 3.19Å; C88-H108 VanDerWaalsContact SG-CA 3.6Å; C101-H108 PolarHBondContact N-O 2.03Å; C101-H108 PolarHBondContact O-N 2.83Å; F105-H108 PolarHBondContact O-CE1 2.83Å; F105-H108 VanDerWaalsContact O-CE1 3.27Å; G106-H108 PolarHBondContact O-ND1 2.92Å; H108-L110 HydrophobicContact CB-CD2 4.44Å; H108-L110 PolarHBondContact O-N 2.62Å
109	C	90	Very high	78.7	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.014	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	110.3	173.6	-65.9	0	0	0	0	109.9	A85 K86 C88 C94 E98 R99	A85-C109 WeakPolarHBondContact CB-O 3.45Å; K86-C109 HydrophobicContact CB-CB 4.38Å; K86-C109 PolarHBondContact O-N 2.73Å; C88-C109 VanDerWaalsContact CB-SG 3.58Å; C88-C109 PolarHBondContact SG-N 2.02Å; C94-C109 WeakPolarHBondContact CA-SG 3.02Å; C94-C109 HydrophobicContact CB-CB 3.7Å; C94-C109 WeakPolarHBondContact CB-SG 2.95Å; C94-C109 WeakPolarHBondContact SG-CA 3.23Å; C94-C109 WeakPolarHBondContact SG-CB 3.4Å; C94-C109 CovalentContact SG-SG 2.04Å; C94-C109 PolarHBondContact SG-SG 3.34Å; E98-C109 HydrophobicContact CB-CB 4.25Å; R99-C109 CarbonylContact O-C 3.54Å; R99-C109 WeakPolarHBondContact O-CA 3.36Å
110	L	86.9	Confident	78.6	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.016	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.7	179.2	-58.9	-178.3	0	0	0	110.2	P74 A77 A85 E98 R99 C101 T103 H108	P74-L110 HydrophobicContact CG-CB 3.97Å; P74-L110 HydrophobicContact CG-CD1 3.62Å; P74-L110 HydrophobicContact CG-CG 4.42Å; A77-L110 HydrophobicContact CB-CD1 4.05Å; A85-L110 HydrophobicContact CB-CD2 3.9Å; E98-L110 WeakPolarHBondContact CA-O 3.49Å; R99-L110 PolarHBondContact N-O 3.42Å; R99-L110 PolarHBondContact O-N 2.83Å; C101-L110 HydrophobicContact CB-CB 4.17Å; C101-L110 HydrophobicContact CB-CD1 3.67Å; C101-L110 HydrophobicContact CB-CG 3.99Å; T103-L110 HydrophobicContact CG2-CD1 3.91Å; H108-L110 HydrophobicContact CB-CD2 4.44Å; H108-L110 PolarHBondContact O-N 2.62Å
111	S	83.5	Confident	78	Confident	20 Å²	20	64.6 Å²	64.6	14%	0.14	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-61.8	139.7	168.5	-57.7	0	0	0	0	109.8	M162	S111-M162 PolarHBondContact OG-O 2.96Å
112	P	72.6	Confident	77.5	Confident	33 Å²	33	73.8 Å²	73.8	21%	0.214	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-61.8	150.3	171.8	23.8	-31.2	0	0	0	111.2	E72 P97 K114	E72-P112 WeakPolarHBondContact O-CA 3.32Å; P97-P112 HydrophobicContact CB-CG 4.33Å; P97-P112 VanDerWaalsContact O-CD 3.25Å; P97-P112 WeakPolarHBondContact O-CD 3.27Å; P112-K114 PolarHBondContact O-N 2.75Å
113	L	68.8	Low	76.8	Confident	48 Å²	48	72 Å²	72	25%	0.251	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	127.8	175.4	-69	173.1	0	0	0	110	P74 I115 V159 F161	P74-L113 HydrophobicContact CB-CD1 4.21Å; P74-L113 HydrophobicContact CB-CD2 3.47Å; P74-L113 VanDerWaalsContact CB-CD2 3.47Å; P74-L113 HydrophobicContact CB-CG 3.67Å; L113-I115 PolarHBondContact O-N 2.78Å; L113-V159 HydrophobicContact CD1-CG1 4.05Å; L113-V159 HydrophobicContact CD2-CB 4.14Å; L113-F161 HydrophobicContact CD2-CD1 4.24Å; L113-F161 HydrophobicContact CD2-CE1 3.62Å; L113-F161 HydrophobicContact CD2-CE2 3.94Å; L113-F161 HydrophobicContact CD2-CZ 3.38Å
114	K	67.4	Low	75.9	Confident	111 Å²	111	77.5 Å²	77.5	48%	0.483	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	111.4	161.5	-142.3	-176.2	-159.3	165.5	0	107.7	P112 N116 E160 M162	P112-K114 PolarHBondContact O-N 2.75Å; K114-N116 PolarHBondContact O-N 3.46Å; K114-E160 WeakPolarHBondContact CB-O 3.43Å; K114-E160 PolarHBondContact N-O 2.71Å; K114-E160 PolarHBondContact O-N 3.4Å; K114-M162 HydrophobicContact CB-CE 3.89Å; K114-M162 HydrophobicContact CB-CG 4.34Å; K114-M162 HydrophobicContact CD-CE 3.51Å; K114-M162 HydrophobicContact CD-CG 4.05Å; K114-M162 HydrophobicContact CD-SD 3.6Å; K114-M162 HydrophobicContact CG-CE 3.64Å; K114-M162 HydrophobicContact CG-SD 4.38Å; K114-M162 PolarHBondContact NZ-SD 2.75Å; K114-M162 VanDerWaalsContact NZ-SD 3.37Å
115	I	62.4	Low	75	Confident	85 Å²	85	71.4 Å²	71.4	44%	0.436	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	118.8	172.9	-55.1	176.1	0	0	0	107.4	L113 Y117 P158	L113-I115 PolarHBondContact O-N 2.78Å; I115-Y117 HydrophobicContact CB-CE2 4.4Å; I115-Y117 HydrophobicContact CG2-CD1 3.69Å; I115-Y117 HydrophobicContact CG2-CD2 4.13Å; I115-Y117 HydrophobicContact CG2-CE1 3.35Å; I115-Y117 HydrophobicContact CG2-CE2 3.84Å; I115-Y117 HydrophobicContact CG2-CG 4.07Å; I115-Y117 VanDerWaalsContact CG2-CZ 3.45Å; I115-P158 HydrophobicContact CG2-CG 4.39Å; I115-P158 WeakPolarHBondContact CG2-O 3.48Å
116	N	69.3	Low	73.5	Confident	54 Å²	54	78.5 Å²	78.5	29%	0.289	39%	0.392	S	S	.	.			trans	-116.5	83.2	173.7	-177.7	-4.6	0	0	0	108.7	K114 R118 T119 P158	K114-N116 PolarHBondContact O-N 3.46Å; N116-R118 PolarHBondContact O-N 3.48Å; N116-R118 PolarHBondContact OD1-N 3.32Å; N116-T119 PolarHBondContact O-N 2.97Å; N116-P158 PolarHBondContact N-O 2.74Å; N116-P158 WeakPolarHBondContact O-CB 3.49Å
117	Y	68.9	Low	72.2	Confident	120 Å²	120	81.4 Å²	81.4	47%	0.471	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-11.4	-177.3	-59.2	-73.9	0	0	0	115.8	I115 Q143 P158	I115-Y117 HydrophobicContact CB-CE2 4.4Å; I115-Y117 HydrophobicContact CG2-CD1 3.69Å; I115-Y117 HydrophobicContact CG2-CD2 4.13Å; I115-Y117 HydrophobicContact CG2-CE1 3.35Å; I115-Y117 HydrophobicContact CG2-CE2 3.84Å; I115-Y117 HydrophobicContact CG2-CG 4.07Å; I115-Y117 VanDerWaalsContact CG2-CZ 3.45Å; Y117-Q143 HydrophobicContact CD1-CB 4.24Å; Y117-Q143 HydrophobicContact CE1-CB 4.11Å; Y117-Q143 HydrophobicContact CE1-CG 4.21Å; Y117-P158 HydrophobicContact CD1-CG 4.15Å
118	R	73	Confident	70.3	Confident	215 Å²	215	85.6 Å²	85.6	81%	0.811	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-21.5	179.7	-62.4	-176.4	-179.5	-96.9	0.1	113.6	N116 K145	N116-R118 PolarHBondContact O-N 3.48Å; N116-R118 PolarHBondContact OD1-N 3.32Å; R118-K145 WeakPolarHBondContact O-CE 3.25Å
119	T	80.5	Confident	68.5	Low	77 Å²	77	91.2 Å²	91.2	47%	0.472	46%	0.461	S	S	.	.	S	Bend	trans	-131	143.3	-164.8	-46.7	0	0	0	0	112.3	N116 P158	N116-T119 PolarHBondContact O-N 2.97Å; T119-P158 VanDerWaalsContact O-CB 3.3Å; T119-P158 WeakPolarHBondContact O-CB 3.34Å
120	C	83	Confident	67.1	Low	45 Å²	45	95 Å²	95	30%	0.304	48%	0.479	S	S	.	.			trans	-67.5	141.3	171.9	-76	0	0	0	0	111.4	C147	C120-C147 VanDerWaalsContact CA-SG 3.5Å; C120-C147 HydrophobicContact CB-CB 3.68Å; C120-C147 WeakPolarHBondContact CB-SG 3.5Å; C120-C147 WeakPolarHBondContact SG-CA 3.47Å; C120-C147 WeakPolarHBondContact SG-CB 3.21Å; C120-C147 CovalentContact SG-SG 2.03Å; C120-C147 PolarHBondContact SG-SG 2.96Å
121	P	76.1	Confident	66.5	Low	26 Å²	26	103.3 Å²	103.3	17%	0.169	52%	0.518	C	S	.	.			trans	-60.8	142.5	174.5	28	-34.9	0	0	0	109.6	V123 L156 F157 V159	P121-V123 HydrophobicContact CB-CG2 4.31Å; P121-V123 HydrophobicContact CG-CG2 4.03Å; P121-V123 PolarHBondContact O-N 3.28Å; P121-L156 HydrophobicContact CG-CB 3.81Å; P121-L156 HydrophobicContact CG-CD1 3.67Å; P121-L156 HydrophobicContact CG-CG 4.36Å; P121-F157 WeakPolarHBondContact CD-O 3.31Å; P121-F157 WeakPolarHBondContact CG-O 3.47Å; P121-V159 HydrophobicContact CB-CG2 4.21Å; P121-V159 WeakPolarHBondContact CB-O 3.33Å
122	K	73.8	Confident	66.5	Low	194 Å²	194	106.4 Å²	106.4	84%	0.843	53%	0.533	S	S	*	.			trans	-72.7	99.7	171.7	-72.5	179	-178.6	166.4	0	108.8
123	V	67	Low	67.2	Low	64 Å²	64	113.4 Å²	113.4	39%	0.388	56%	0.555	S	S	.	*			trans	-104.6	120.7	175.7	-156.8	0	0	0	0	109.7	P121 T125 L149 L156	P121-V123 HydrophobicContact CB-CG2 4.31Å; P121-V123 HydrophobicContact CG-CG2 4.03Å; P121-V123 PolarHBondContact O-N 3.28Å; V123-T125 HydrophobicContact CB-CG2 4.37Å; V123-T125 HydrophobicContact CG1-CG2 3.39Å; V123-T125 PolarHBondContact O-N 2.84Å; V123-L149 HydrophobicContact CB-CD2 3.72Å; V123-L149 HydrophobicContact CG1-CD2 4.39Å; V123-L149 HydrophobicContact CG2-CD2 4.11Å; V123-L156 HydrophobicContact CG2-CD1 3.79Å
124	T	57.9	Low	68.2	Low	145 Å²	145	111.2 Å²	111.2	89%	0.89	54%	0.544	S	S	*	.			trans	-96.1	82.1	170.9	40.4	0	0	0	0	109.3
125	T	57.8	Low	69.4	Low	59 Å²	59	111 Å²	111	36%	0.362	54%	0.544	S	S	.	.			trans	-101.1	147.8	169.8	78.4	0	0	0	0	110.6	V123	V123-T125 HydrophobicContact CB-CG2 4.37Å; V123-T125 HydrophobicContact CG1-CG2 3.39Å; V123-T125 PolarHBondContact O-N 2.84Å
126	R	47.7	Very low	70.8	Confident	249 Å²	249	109 Å²	109	94%	0.94	54%	0.538	S	S	*	.			trans	-111.3	9.5	179.6	-76	-169.2	176.2	-171.4	-0.8	113.6
127	S	55.4	Low	71.7	Confident	94 Å²	94	109.2 Å²	109.2	66%	0.657	54%	0.539	S	S	*	.			trans	-89.9	168.7	-172.6	-65	0	0	0	0	112.2	T151	S127-T151 VanDerWaalsContact C-CG2 3.47Å; S127-T151 WeakPolarHBondContact O-CG2 3.4Å
128	V	45	Very low	72.8	Confident	128 Å²	128	111.2 Å²	111.2	78%	0.776	55%	0.553	S	S	*	*			trans	-107	133.3	-158	177.6	0	0	0	0	110.2
129	N	51.7	Low	73.7	Confident	143 Å²	143	106.3 Å²	106.3	77%	0.765	54%	0.539	S	S	*	.			trans	32	104.3	168.1	-77.2	-8.8	0	0	0	117.7
130	Q	61.1	Low	74.1	Confident	82 Å²	82	103.2 Å²	103.2	38%	0.383	52%	0.52	S	S	.	.			trans	-113.3	141	158.4	-95	178.1	-98.9	0	0	110	R133 T151	Q130-R133 VanDerWaalsContact NE2-NH1 3.16Å; Q130-R133 VanDerWaalsContact NE2-NH2 3.14Å; Q130-T151 CarbonylContact C-O 3.57Å; Q130-T151 WeakPolarHBondContact CA-O 3.01Å; Q130-T151 PolarHBondContact N-O 3.11Å
131	E	73.3	Confident	74.3	Confident	178 Å²	178	109.1 Å²	109.1	83%	0.832	54%	0.544	S	S	*	.			trans	-59.8	147.5	167.6	-66.9	-178.5	156	0	0	110.6	R133	E131-R133 PolarHBondContact O-N 2.64Å
132	N	83.5	Confident	74.6	Confident	85 Å²	85	111.8 Å²	111.8	46%	0.455	58%	0.575	S	S	.	*			trans	-60.4	118.3	176	-68.7	-36	0	0	0	109.5	K153	N132-K153 HydrophobicContact CB-CB 4.22Å; N132-K153 PolarHBondContact OD1-N 2.88Å
133	R	87.4	Confident	74.9	Confident	180 Å²	180	107.8 Å²	107.8	68%	0.679	56%	0.56	S	S	*	*	S	Bend	trans	-90.8	-8.7	177.4	-65.7	-171.8	172.4	159.9	-1.6	113.4	Q130 E131 K153	Q130-R133 VanDerWaalsContact NE2-NH1 3.16Å; Q130-R133 VanDerWaalsContact NE2-NH2 3.14Å; E131-R133 PolarHBondContact O-N 2.64Å; R133-K153 PolarHBondContact N-O 3.14Å
134	C	91.3	Very high	75.8	Confident	2 Å²	2	107.3 Å²	107.3	1%	0.014	55%	0.554	C	S	.	*			trans	-152.4	156.2	173.9	58.6	0	0	0	0	109.5	E139 C146 K153	C134-E139 WeakPolarHBondContact CA-OE2 3.34Å; C134-E139 HydrophobicContact CB-CB 4.25Å; C134-C146 HydrophobicContact CB-CB 3.78Å; C134-C146 WeakPolarHBondContact CB-SG 3.43Å; C134-C146 PolarHBondContact O-SG 2.87Å; C134-C146 WeakPolarHBondContact SG-CA 3.38Å; C134-C146 WeakPolarHBondContact SG-CB 3.38Å; C134-C146 CovalentContact SG-SG 2.03Å; C134-C146 PolarHBondContact SG-SG 2.64Å; C134-K153 VanDerWaalsContact O-CB 3.24Å; C134-K153 WeakPolarHBondContact O-CB 3.11Å; C134-K153 WeakPolarHBondContact O-CD 3.35Å
135	Q	91.3	Very high	77.1	Confident	105 Å²	105	102 Å²	102	49%	0.491	52%	0.518	S	S	.	.	S	Bend	trans	-107.2	-31.3	167.9	-64.6	-61.9	-25.5	0	0	113.5	E139 K153	Q135-E139 WeakPolarHBondContact CB-OE1 3Å; Q135-E139 PolarHBondContact N-OE2 2.82Å; Q135-K153 PolarHBondContact O-NZ 2.77Å
136	S	91.3	Very high	78.6	Confident	43 Å²	43	100.1 Å²	100.1	30%	0.301	51%	0.507	S	S	.	.	S	Bend	trans	-143.6	167.1	-179.1	71.6	0	0	0	0	112	E138 E139 C146	S136-E138 WeakPolarHBondContact CB-OE2 3.33Å; S136-E138 PolarHBondContact O-N 3.29Å; S136-E138 PolarHBondContact OG-OE2 2.95Å; S136-E139 PolarHBondContact O-N 3.05Å; S136-C146 VanDerWaalsContact C-CB 3.41Å; S136-C146 VanDerWaalsContact O-CB 3.31Å; S136-C146 WeakPolarHBondContact O-CB 3.25Å
137	D	89.7	Confident	80.6	Confident	60 Å²	60	88.4 Å²	88.4	32%	0.321	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-62.5	-28.3	-177	-68.9	-20.3	0	0	0	112.4	E139 C140 K145 C146	D137-E139 PolarHBondContact O-N 2.76Å; D137-C140 WeakPolarHBondContact O-CB 3.47Å; D137-C140 PolarHBondContact O-N 3.26Å; D137-K145 WeakPolarHBondContact OD1-CA 3.13Å; D137-K145 WeakPolarHBondContact OD1-CB 3.21Å; D137-K145 IonicContact OD1-NZ 3.78Å; D137-K145 IonicContact OD2-NZ 2.6Å; D137-K145 PolarHBondContact OD2-NZ 3.12Å; D137-C146 PolarHBondContact OD1-N 3.1Å
138	E	90.9	Very high	82.1	Confident	162 Å²	162	91.8 Å²	91.8	76%	0.757	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-68	-19.3	-179.1	-57.3	80.2	-172.4	0	0	113.3	S136 C140	S136-E138 WeakPolarHBondContact CB-OE2 3.33Å; S136-E138 PolarHBondContact O-N 3.29Å; S136-E138 PolarHBondContact OG-OE2 2.95Å; E138-C140 VanDerWaalsContact C-N 3.27Å
139	E	93.2	Very high	83.8	Confident	112 Å²	112	86.8 Å²	86.8	52%	0.523	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-80.3	-11.8	173.8	-66.5	175.6	-153.8	0	0	112.3	C134 Q135 S136 D137	C134-E139 WeakPolarHBondContact CA-OE2 3.34Å; C134-E139 HydrophobicContact CB-CB 4.25Å; Q135-E139 WeakPolarHBondContact CB-OE1 3Å; Q135-E139 PolarHBondContact N-OE2 2.82Å; S136-E139 PolarHBondContact O-N 3.05Å; D137-E139 PolarHBondContact O-N 2.76Å
140	C	88.6	Confident	84.9	Confident	12 Å²	12	85.4 Å²	85.4	8%	0.081	44%	0.437	C	S	.	.	S	Bend	trans	-93.7	143.2	-178.4	-60.2	0	0	0	0	111.9	D137 E138 G142 M144 C155	D137-C140 WeakPolarHBondContact O-CB 3.47Å; D137-C140 PolarHBondContact O-N 3.26Å; E138-C140 VanDerWaalsContact C-N 3.27Å; C140-G142 PolarHBondContact O-N 2.04Å; C140-M144 HydrophobicContact CB-CB 3.65Å; C140-C155 WeakPolarHBondContact CA-SG 3.28Å; C140-C155 HydrophobicContact CB-CB 3.7Å; C140-C155 WeakPolarHBondContact CB-SG 3.42Å; C140-C155 VanDerWaalsContact SG-CA 3.53Å; C140-C155 WeakPolarHBondContact SG-CB 2.99Å; C140-C155 CovalentContact SG-SG 2.04Å; C140-C155 PolarHBondContact SG-SG 3.28Å
141	E	86.3	Confident	85.8	Confident	169 Å²	169	82 Å²	82	79%	0.79	42%	0.422	S	S	*	.	S	Bend	trans	-70.7	132.8	180	-70.8	-177.6	-167.4	0	0	112.3	Q143 M144	E141-Q143 PolarHBondContact O-N 3.3Å; E141-M144 WeakPolarHBondContact O-CB 3.21Å; E141-M144 WeakPolarHBondContact O-CG 3.49Å; E141-M144 PolarHBondContact O-N 3.24Å
142	G	83	Confident	86.3	Confident	81 Å²	81	74.2 Å²	74.2	84%	0.835	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	-115.6	171.6	0	0	0	0	0	113.3	C140	C140-G142 PolarHBondContact O-N 2.04Å
143	Q	80	Confident	86.5	Confident	111 Å²	111	72.7 Å²	72.7	52%	0.519	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	13.1	-174.8	-62.5	-179.6	-43.3	0	0	112.8	Y117 E141 P158	Y117-Q143 HydrophobicContact CD1-CB 4.24Å; Y117-Q143 HydrophobicContact CE1-CB 4.11Å; Y117-Q143 HydrophobicContact CE1-CG 4.21Å; E141-Q143 PolarHBondContact O-N 3.3Å; Q143-P158 WeakPolarHBondContact O-CD 3.01Å; Q143-P158 VanDerWaalsContact O-CG 3.31Å; Q143-P158 WeakPolarHBondContact O-CG 3.14Å
144	M	84.5	Confident	86.6	Confident	54 Å²	54	64.9 Å²	64.9	27%	0.266	35%	0.351	S	S	.	.			trans	-71.5	156	176.3	-72.4	-174.3	174.4	0	0	111.4	C140 E141 C155 L156 F157	C140-M144 HydrophobicContact CB-CB 3.65Å; E141-M144 WeakPolarHBondContact O-CB 3.21Å; E141-M144 WeakPolarHBondContact O-CG 3.49Å; E141-M144 PolarHBondContact O-N 3.24Å; M144-C155 HydrophobicContact CB-CB 4.31Å; M144-C155 HydrophobicContact SD-CB 3.93Å; M144-L156 CarbonylContact C-O 3.56Å; M144-L156 WeakPolarHBondContact CA-O 2.98Å; M144-F157 HydrophobicContact CE-CD2 3.57Å; M144-F157 HydrophobicContact CE-CE2 3.15Å; M144-F157 HydrophobicContact CE-CG 4.45Å; M144-F157 HydrophobicContact CE-CZ 3.72Å; M144-F157 HydrophobicContact CG-CD1 4.17Å; M144-F157 HydrophobicContact CG-CD2 4.23Å; M144-F157 HydrophobicContact CG-CE1 4.14Å; M144-F157 HydrophobicContact CG-CE2 4.22Å; M144-F157 HydrophobicContact CG-CG 4.21Å; M144-F157 HydrophobicContact CG-CZ 4.16Å
145	K	86.2	Confident	86.4	Confident	33 Å²	33	66.7 Å²	66.7	14%	0.143	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.6	174.9	-65.1	-172.7	69.9	63.9	0	110.9	R118 D137 C147 C155 L156 P158	R118-K145 WeakPolarHBondContact O-CE 3.25Å; D137-K145 WeakPolarHBondContact OD1-CA 3.13Å; D137-K145 WeakPolarHBondContact OD1-CB 3.21Å; D137-K145 IonicContact OD1-NZ 3.78Å; D137-K145 IonicContact OD2-NZ 2.6Å; D137-K145 PolarHBondContact OD2-NZ 3.12Å; K145-C147 PolarHBondContact O-N 2.81Å; K145-C147 PolarHBondContact O-SG 3.45Å; K145-C155 CarbonylContact O-C 3.57Å; K145-C155 VanDerWaalsContact O-CA 3.31Å; K145-C155 WeakPolarHBondContact O-CA 3.38Å; K145-L156 PolarHBondContact N-O 2.92Å; K145-L156 PolarHBondContact O-N 2.88Å; K145-P158 HydrophobicContact CD-CB 3.86Å; K145-P158 HydrophobicContact CG-CB 4.14Å; K145-P158 HydrophobicContact CG-CG 4.38Å
146	C	90.3	Very high	86	Confident	19 Å²	19	63.6 Å²	63.6	13%	0.128	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	101.3	172.2	-172.7	0	0	0	0	109.8	C134 S136 D137	C134-C146 HydrophobicContact CB-CB 3.78Å; C134-C146 WeakPolarHBondContact CB-SG 3.43Å; C134-C146 PolarHBondContact O-SG 2.87Å; C134-C146 WeakPolarHBondContact SG-CA 3.38Å; C134-C146 WeakPolarHBondContact SG-CB 3.38Å; C134-C146 CovalentContact SG-SG 2.03Å; C134-C146 PolarHBondContact SG-SG 2.64Å; S136-C146 VanDerWaalsContact C-CB 3.41Å; S136-C146 VanDerWaalsContact O-CB 3.31Å; S136-C146 WeakPolarHBondContact O-CB 3.25Å; D137-C146 PolarHBondContact OD1-N 3.1Å
147	C	88.5	Confident	85.5	Confident	3 Å²	3	67 Å²	67	2%	0.02	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	129.6	-170.8	-64.7	0	0	0	0	111.8	C120 K145 L149 K153 V154 L156	C120-C147 VanDerWaalsContact CA-SG 3.5Å; C120-C147 HydrophobicContact CB-CB 3.68Å; C120-C147 WeakPolarHBondContact CB-SG 3.5Å; C120-C147 WeakPolarHBondContact SG-CA 3.47Å; C120-C147 WeakPolarHBondContact SG-CB 3.21Å; C120-C147 CovalentContact SG-SG 2.03Å; C120-C147 PolarHBondContact SG-SG 2.96Å; K145-C147 PolarHBondContact O-N 2.81Å; K145-C147 PolarHBondContact O-SG 3.45Å; C147-L149 PolarHBondContact O-N 3.5Å; C147-K153 WeakPolarHBondContact O-CA 2.94Å; C147-V154 PolarHBondContact N-O 3.33Å; C147-V154 PolarHBondContact O-N 3.44Å; C147-L156 HydrophobicContact CB-CB 4.35Å; C147-L156 HydrophobicContact CB-CD1 3.71Å; C147-L156 HydrophobicContact CB-CG 4.1Å
148	E	87	Confident	84.7	Confident	165 Å²	165	64.3 Å²	64.3	77%	0.771	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	117	174.2	-170.4	166.5	-157.9	0	0	110.1	K153	E148-K153 HydrophobicContact CB-CG 4.49Å
149	L	80.4	Confident	83.6	Confident	23 Å²	23	58.2 Å²	58.2	12%	0.12	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	161.1	170.4	-67.6	146.1	0	0	0	108.4	V123 C147 T151 G152 V154 L156	V123-L149 HydrophobicContact CB-CD2 3.72Å; V123-L149 HydrophobicContact CG1-CD2 4.39Å; V123-L149 HydrophobicContact CG2-CD2 4.11Å; C147-L149 PolarHBondContact O-N 3.5Å; L149-T151 WeakPolarHBondContact CB-OG1 3.31Å; L149-T151 PolarHBondContact O-N 2.87Å; L149-G152 WeakPolarHBondContact CB-O 3.33Å; L149-G152 PolarHBondContact N-O 2.78Å; L149-G152 PolarHBondContact O-N 3.2Å; L149-V154 HydrophobicContact CD1-CB 4.25Å; L149-V154 HydrophobicContact CD1-CG1 3.84Å; L149-V154 HydrophobicContact CD1-CG2 3.47Å; L149-V154 VanDerWaalsContact CD1-CG2 3.47Å; L149-L156 HydrophobicContact CD1-CD1 4.3Å
150	P	75.8	Confident	82.1	Confident	115 Å²	115	57 Å²	57	75%	0.747	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-22.4	171.4	-25.3	34.5	0	0	0	113.5
151	T	79.1	Confident	80.5	Confident	11 Å²	11	59.1 Å²	59.1	7%	0.067	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-12.8	177.8	45.9	0	0	0	0	114.7	S127 Q130 L149	S127-T151 VanDerWaalsContact C-CG2 3.47Å; S127-T151 WeakPolarHBondContact O-CG2 3.4Å; Q130-T151 CarbonylContact C-O 3.57Å; Q130-T151 WeakPolarHBondContact CA-O 3.01Å; Q130-T151 PolarHBondContact N-O 3.11Å; L149-T151 WeakPolarHBondContact CB-OG1 3.31Å; L149-T151 PolarHBondContact O-N 2.87Å
152	G	84.1	Confident	78.9	Confident	14 Å²	14	58.3 Å²	58.3	14%	0.144	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.8	-177.3	-169.1	0	0	0	0	0	112.3	L149	L149-G152 WeakPolarHBondContact CB-O 3.33Å; L149-G152 PolarHBondContact N-O 2.78Å; L149-G152 PolarHBondContact O-N 3.2Å
153	K	88.7	Confident	78.7	Confident	52 Å²	52	57.2 Å²	57.2	23%	0.226	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	130.6	-179.8	-67.6	-177.9	177.7	-177.2	0	112.4	N132 R133 C134 Q135 C147 E148	N132-K153 HydrophobicContact CB-CB 4.22Å; N132-K153 PolarHBondContact OD1-N 2.88Å; R133-K153 PolarHBondContact N-O 3.14Å; C134-K153 VanDerWaalsContact O-CB 3.24Å; C134-K153 WeakPolarHBondContact O-CB 3.11Å; C134-K153 WeakPolarHBondContact O-CD 3.35Å; Q135-K153 PolarHBondContact O-NZ 2.77Å; C147-K153 WeakPolarHBondContact O-CA 2.94Å; E148-K153 HydrophobicContact CB-CG 4.49Å
154	V	87.9	Confident	78.6	Confident	16 Å²	16	54.4 Å²	54.4	10%	0.097	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	149.8	177.8	-35.4	0	0	0	0	111.6	C147 L149 L156	C147-V154 PolarHBondContact N-O 3.33Å; C147-V154 PolarHBondContact O-N 3.44Å; L149-V154 HydrophobicContact CD1-CB 4.25Å; L149-V154 HydrophobicContact CD1-CG1 3.84Å; L149-V154 HydrophobicContact CD1-CG2 3.47Å; L149-V154 VanDerWaalsContact CD1-CG2 3.47Å; V154-L156 HydrophobicContact CG2-CD1 4.18Å; V154-L156 HydrophobicContact CG2-CD2 3.52Å; V154-L156 HydrophobicContact CG2-CG 3.6Å; V154-L156 PolarHBondContact O-N 3.42Å
155	C	88.2	Confident	78.3	Confident	40 Å²	40	54.4 Å²	54.4	27%	0.27	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	120.8	172.9	-63.8	0	0	0	0	111.1	C140 M144 K145	C140-C155 WeakPolarHBondContact CA-SG 3.28Å; C140-C155 HydrophobicContact CB-CB 3.7Å; C140-C155 WeakPolarHBondContact CB-SG 3.42Å; C140-C155 VanDerWaalsContact SG-CA 3.53Å; C140-C155 WeakPolarHBondContact SG-CB 2.99Å; C140-C155 CovalentContact SG-SG 2.04Å; C140-C155 PolarHBondContact SG-SG 3.28Å; M144-C155 HydrophobicContact CB-CB 4.31Å; M144-C155 HydrophobicContact SD-CB 3.93Å; K145-C155 CarbonylContact O-C 3.57Å; K145-C155 VanDerWaalsContact O-CA 3.31Å; K145-C155 WeakPolarHBondContact O-CA 3.38Å
156	L	82.7	Confident	77.8	Confident	41 Å²	41	55.6 Å²	55.6	22%	0.215	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.4	177.7	-61.2	178.5	0	0	0	110.8	P121 V123 M144 K145 C147 L149 V154	P121-L156 HydrophobicContact CG-CB 3.81Å; P121-L156 HydrophobicContact CG-CD1 3.67Å; P121-L156 HydrophobicContact CG-CG 4.36Å; V123-L156 HydrophobicContact CG2-CD1 3.79Å; M144-L156 CarbonylContact C-O 3.56Å; M144-L156 WeakPolarHBondContact CA-O 2.98Å; K145-L156 PolarHBondContact N-O 2.92Å; K145-L156 PolarHBondContact O-N 2.88Å; C147-L156 HydrophobicContact CB-CB 4.35Å; C147-L156 HydrophobicContact CB-CD1 3.71Å; C147-L156 HydrophobicContact CB-CG 4.1Å; L149-L156 HydrophobicContact CD1-CD1 4.3Å; V154-L156 HydrophobicContact CG2-CD1 4.18Å; V154-L156 HydrophobicContact CG2-CD2 3.52Å; V154-L156 HydrophobicContact CG2-CG 3.6Å; V154-L156 PolarHBondContact O-N 3.42Å
157	F	80	Confident	77	Confident	115 Å²	115	57.9 Å²	57.9	50%	0.504	30%	0.3	S	S	.	.			trans	-67	133.7	167.4	-84.2	-75.4	0	0	0	110.2	P121 M144 V159	P121-F157 WeakPolarHBondContact CD-O 3.31Å; P121-F157 WeakPolarHBondContact CG-O 3.47Å; M144-F157 HydrophobicContact CE-CD2 3.57Å; M144-F157 HydrophobicContact CE-CE2 3.15Å; M144-F157 HydrophobicContact CE-CG 4.45Å; M144-F157 HydrophobicContact CE-CZ 3.72Å; M144-F157 HydrophobicContact CG-CD1 4.17Å; M144-F157 HydrophobicContact CG-CD2 4.23Å; M144-F157 HydrophobicContact CG-CE1 4.14Å; M144-F157 HydrophobicContact CG-CE2 4.22Å; M144-F157 HydrophobicContact CG-CG 4.21Å; M144-F157 HydrophobicContact CG-CZ 4.16Å; F157-V159 VanDerWaalsContact C-N 3.28Å; F157-V159 HydrophobicContact CB-CG1 4.08Å; F157-V159 PolarHBondContact O-N 2.69Å
158	P	73.5	Confident	76.3	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.013	32%	0.319	C	S	.	.			trans	-78.2	78.3	-178.6	32.5	-36	0	0	0	110.6	I115 N116 Y117 T119 Q143 K145	I115-P158 HydrophobicContact CG2-CG 4.39Å; I115-P158 WeakPolarHBondContact CG2-O 3.48Å; N116-P158 PolarHBondContact N-O 2.74Å; N116-P158 WeakPolarHBondContact O-CB 3.49Å; Y117-P158 HydrophobicContact CD1-CG 4.15Å; T119-P158 VanDerWaalsContact O-CB 3.3Å; T119-P158 WeakPolarHBondContact O-CB 3.34Å; Q143-P158 WeakPolarHBondContact O-CD 3.01Å; Q143-P158 VanDerWaalsContact O-CG 3.31Å; Q143-P158 WeakPolarHBondContact O-CG 3.14Å; K145-P158 HydrophobicContact CD-CB 3.86Å; K145-P158 HydrophobicContact CG-CB 4.14Å; K145-P158 HydrophobicContact CG-CG 4.38Å
159	V	67.3	Low	75.5	Confident	34 Å²	34	54.2 Å²	54.2	21%	0.206	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.2	-176.3	-63.6	0	0	0	0	111.7	L113 P121 F157	L113-V159 HydrophobicContact CD1-CG1 4.05Å; L113-V159 HydrophobicContact CD2-CB 4.14Å; P121-V159 HydrophobicContact CB-CG2 4.21Å; P121-V159 WeakPolarHBondContact CB-O 3.33Å; F157-V159 VanDerWaalsContact C-N 3.28Å; F157-V159 HydrophobicContact CB-CG1 4.08Å; F157-V159 PolarHBondContact O-N 2.69Å
160	E	61.9	Low	75.1	Confident	87 Å²	87	56.6 Å²	56.6	41%	0.407	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.7	173.5	-165	165.5	-155	0	0	109.9	K114	K114-E160 WeakPolarHBondContact CB-O 3.43Å; K114-E160 PolarHBondContact N-O 2.71Å; K114-E160 PolarHBondContact O-N 3.4Å
161	F	55	Low	75.1	Confident	56 Å²	56	51.8 Å²	51.8	25%	0.246	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	125.6	174.7	-73.3	-87.7	0	0	0	109.1	P74 A76 A77 P78 Q81 L113	P74-F161 HydrophobicContact CB-CE1 3.32Å; P74-F161 HydrophobicContact CB-CZ 3.59Å; P74-F161 HydrophobicContact CG-CE1 3.87Å; A76-F161 VanDerWaalsContact O-CE2 3.29Å; A76-F161 WeakPolarHBondContact O-CE2 3.43Å; A76-F161 WeakPolarHBondContact O-CZ 3.47Å; A77-F161 HydrophobicContact CB-CE1 3.86Å; A77-F161 HydrophobicContact CB-CZ 4.23Å; P78-F161 HydrophobicContact CG-CD2 4.42Å; Q81-F161 VanDerWaalsContact OE1-CD1 3.31Å; L113-F161 HydrophobicContact CD2-CD1 4.24Å; L113-F161 HydrophobicContact CD2-CE1 3.62Å; L113-F161 HydrophobicContact CD2-CE2 3.94Å; L113-F161 HydrophobicContact CD2-CZ 3.38Å
162	M	52.8	Low	74.7	Confident	153 Å²	153	55.5 Å²	55.5	75%	0.754	28%	0.28	S	S	*	.			trans	-86.1	0	169	-80.3	-168.8	-76.2	0	0	111.4	S111 K114	S111-M162 PolarHBondContact OG-O 2.96Å; K114-M162 HydrophobicContact CB-CE 3.89Å; K114-M162 HydrophobicContact CB-CG 4.34Å; K114-M162 HydrophobicContact CD-CE 3.51Å; K114-M162 HydrophobicContact CD-CG 4.05Å; K114-M162 HydrophobicContact CD-SD 3.6Å; K114-M162 HydrophobicContact CG-CE 3.64Å; K114-M162 HydrophobicContact CG-SD 4.38Å; K114-M162 PolarHBondContact NZ-SD 2.75Å; K114-M162 VanDerWaalsContact NZ-SD 3.37Å

Retrieved 162 of 162 residues in 219.7 ms (Link to these results)

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