A0A087YL64_POEFO Loading...

Chymotrypsin like elastase 3A

AlphaFold DB , UniProt , Accession A0A087YL64, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 269 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	39.6	Very low	47.5	Very low	249 Å²	249	154.4 Å²	154.4	100%	1.227	82%	0.818	S	S	*	*				0	100.7	0	-67.9	-175.6	-173.6	0	0	107.1
2	L	40	Very low	47.5	Very low	170 Å²	170	150.4 Å²	150.4	89%	0.89	80%	0.804	S	S	*	*			trans	-104.9	104.8	-178.1	-156.3	74.6	0	0	0	106.4	T4	L2-T4 PolarHBondContact O-N 3.38Å
3	Q	43.5	Very low	47.3	Very low	192 Å²	192	145 Å²	145	90%	0.897	79%	0.793	S	S	*	*			trans	-78	108.1	175.7	-87.6	178	-29.6	0	0	108.6	L5	Q3-L5 PolarHBondContact O-N 2.79Å
4	T	46.3	Very low	47.2	Very low	124 Å²	124	145.3 Å²	145.3	76%	0.761	78%	0.783	S	S	*	*			trans	-74.4	113.3	172.2	-34.6	0	0	0	0	108.7	L2 V6	L2-T4 PolarHBondContact O-N 3.38Å; T4-V6 PolarHBondContact O-N 3.16Å
5	L	53.2	Low	47.2	Very low	157 Å²	157	144.5 Å²	144.5	82%	0.822	79%	0.785	S	S	*	*			trans	-78.1	108.5	174	-149.1	86.2	0	0	0	108.5	Q3 V7	Q3-L5 PolarHBondContact O-N 2.79Å; L5-V7 PolarHBondContact O-N 3.12Å
6	V	52.2	Low	48.1	Very low	118 Å²	118	143.1 Å²	143.1	72%	0.715	77%	0.769	S	S	*	*			trans	-85.8	106	173.6	178.2	0	0	0	0	108.1	T4 V8	T4-V6 PolarHBondContact O-N 3.16Å; V6-V8 HydrophobicContact CG1-CG2 4.22Å; V6-V8 PolarHBondContact O-N 2.94Å
7	V	51.8	Low	50.2	Low	111 Å²	111	137.5 Å²	137.5	67%	0.673	75%	0.753	S	S	*	*			trans	-80.2	104.5	170.6	178.4	0	0	0	0	107.8	L5 L9	L5-V7 PolarHBondContact O-N 3.12Å; V7-L9 PolarHBondContact O-N 2.72Å
8	V	48.8	Very low	52.8	Low	111 Å²	111	131.4 Å²	131.4	67%	0.673	72%	0.722	S	S	*	*			trans	-77.3	100.5	171.3	180	0	0	0	0	107.8	V6 L10	V6-V8 HydrophobicContact CG1-CG2 4.22Å; V6-V8 PolarHBondContact O-N 2.94Å; V8-L10 PolarHBondContact O-N 2.95Å
9	L	51.3	Low	55.1	Low	143 Å²	143	124.5 Å²	124.5	75%	0.749	68%	0.684	S	S	*	*			trans	-67	96.7	165.6	-83.8	156.2	0	0	0	108.1	V7 Q11	V7-L9 PolarHBondContact O-N 2.72Å; L9-Q11 PolarHBondContact O-N 3.29Å
10	L	47.5	Very low	57.2	Low	151 Å²	151	121.7 Å²	121.7	79%	0.791	67%	0.674	S	S	*	*			trans	-65.2	88.9	163.8	-88.3	146.9	0	0	0	108	V8 V12	V8-L10 PolarHBondContact O-N 2.95Å; L10-V12 VanDerWaalsContact C-N 3.29Å; L10-V12 PolarHBondContact O-N 2.62Å
11	Q	48.4	Very low	59.1	Low	172 Å²	172	116.1 Å²	116.1	80%	0.804	64%	0.643	S	S	*	*			trans	-65.2	95.8	161.2	-70	-93.6	-38.5	0	0	106.3	L9 A13	L9-Q11 PolarHBondContact O-N 3.29Å; Q11-A13 PolarHBondContact O-N 2.72Å
12	V	47.3	Very low	61.8	Low	107 Å²	107	107.3 Å²	107.3	65%	0.648	61%	0.609	S	S	*	*			trans	-68.1	88.8	166	-176.8	0	0	0	0	106	L10 F14	L10-V12 VanDerWaalsContact C-N 3.29Å; L10-V12 PolarHBondContact O-N 2.62Å; V12-F14 VanDerWaalsContact C-N 3.3Å; V12-F14 HydrophobicContact CG1-CD2 3.96Å; V12-F14 HydrophobicContact CG1-CE2 3.98Å; V12-F14 PolarHBondContact O-N 3.45Å
13	A	45.3	Very low	64.5	Low	80 Å²	80	101.9 Å²	101.9	66%	0.661	58%	0.583	S	S	*	*			trans	-65.3	99.9	163.1	0	0	0	0	0	105.8	Q11 V15	Q11-A13 PolarHBondContact O-N 2.72Å; A13-V15 PolarHBondContact O-N 2.82Å
14	F	45.1	Very low	67	Low	149 Å²	149	98.1 Å²	98.1	65%	0.654	56%	0.564	S	S	*	*			trans	-60.8	97.2	162.5	-89.2	-92.7	0	0	0	106.2	V12 F16	V12-F14 VanDerWaalsContact C-N 3.3Å; V12-F14 HydrophobicContact CG1-CD2 3.96Å; V12-F14 HydrophobicContact CG1-CE2 3.98Å; V12-F14 PolarHBondContact O-N 3.45Å; F14-F16 HydrophobicContact CB-CD2 3.92Å; F14-F16 HydrophobicContact CB-CE1 4.42Å; F14-F16 HydrophobicContact CB-CE2 3.55Å; F14-F16 HydrophobicContact CB-CZ 3.83Å; F14-F16 HydrophobicContact CD1-CE1 4.38Å; F14-F16 HydrophobicContact CD1-CZ 4.35Å; F14-F16 HydrophobicContact CG-CE2 4.4Å; F14-F16 HydrophobicContact CG-CZ 4.2Å; F14-F16 WeakPolarHBondContact O-CD2 3.47Å; F14-F16 PolarHBondContact O-N 3.34Å
15	V	47.6	Very low	69.3	Low	133 Å²	133	92.6 Å²	92.6	81%	0.806	53%	0.53	S	S	*	.			trans	-69.3	88.8	162	-176.6	0	0	0	0	104.4	A13 G17	A13-V15 PolarHBondContact O-N 2.82Å; V15-G17 VanDerWaalsContact C-N 3.31Å; V15-G17 PolarHBondContact O-N 3.34Å
16	F	61.3	Low	71.1	Confident	122 Å²	122	87.1 Å²	87.1	54%	0.535	50%	0.502	S	S	.	.			trans	-63.1	100.4	169.5	-70.3	-79	0	0	0	106.6	F14 M134	F14-F16 HydrophobicContact CB-CD2 3.92Å; F14-F16 HydrophobicContact CB-CE1 4.42Å; F14-F16 HydrophobicContact CB-CE2 3.55Å; F14-F16 HydrophobicContact CB-CZ 3.83Å; F14-F16 HydrophobicContact CD1-CE1 4.38Å; F14-F16 HydrophobicContact CD1-CZ 4.35Å; F14-F16 HydrophobicContact CG-CE2 4.4Å; F14-F16 HydrophobicContact CG-CZ 4.2Å; F14-F16 WeakPolarHBondContact O-CD2 3.47Å; F14-F16 PolarHBondContact O-N 3.34Å; F16-M134 HydrophobicContact CD1-CB 4.25Å; F16-M134 HydrophobicContact CD2-CB 4.33Å; F16-M134 HydrophobicContact CE1-CB 4.23Å; F16-M134 HydrophobicContact CE2-CB 4.3Å; F16-M134 HydrophobicContact CG-CB 4.3Å; F16-M134 HydrophobicContact CZ-CB 4.25Å
17	G	84.6	Confident	72.6	Confident	48 Å²	48	85.5 Å²	85.5	50%	0.495	49%	0.492	S	S	.	.			trans	-62.8	155	173.2	0	0	0	0	0	110.5	V15	V15-G17 VanDerWaalsContact C-N 3.31Å; V15-G17 PolarHBondContact O-N 3.34Å
18	C	96.1	Very high	73.8	Confident	29 Å²	29	83.5 Å²	83.5	20%	0.196	48%	0.483	C	S	.	.	S	Bend	trans	-82.9	161.7	175.3	64.6	0	0	0	0	112.2	S20 V140 C142 R228	C18-S20 PolarHBondContact O-N 3.21Å; C18-S20 PolarHBondContact O-OG 3.45Å; C18-S20 VanDerWaalsContact O-OG 3.09Å; C18-V140 CarbonylContact C-O 3.56Å; C18-V140 VanDerWaalsContact CA-O 3.28Å; C18-V140 WeakPolarHBondContact CA-O 3.26Å; C18-V140 HydrophobicContact CB-CG2 3.9Å; C18-C142 HydrophobicContact CB-CB 3.98Å; C18-C142 WeakPolarHBondContact CB-SG 3.06Å; C18-C142 PolarHBondContact O-SG 2.83Å; C18-C142 WeakPolarHBondContact SG-CA 3.42Å; C18-C142 WeakPolarHBondContact SG-CB 3.35Å; C18-C142 CovalentContact SG-SG 2.04Å; C18-C142 PolarHBondContact SG-SG 2.87Å; C18-R228 WeakPolarHBondContact O-CD 3.4Å; C18-R228 PolarHBondContact SG-NH1 3Å; C18-R228 VanDerWaalsContact SG-NH1 3.45Å
19	G	97.4	Very high	74.2	Confident	0 Å²	0	89.2 Å²	89.2	0%	0	49%	0.493	C	S	.	.	S	Bend	trans	63.1	19	164.7	0	0	0	0	0	114.9	P21 V140 R228 W229	G19-P21 WeakPolarHBondContact O-CD 3.23Å; G19-V140 PolarHBondContact N-O 3.37Å; G19-R228 CarbonylContact O-C 3.53Å; G19-R228 WeakPolarHBondContact O-CA 3.28Å; G19-W229 WeakPolarHBondContact CA-O 3.3Å; G19-W229 PolarHBondContact O-N 3.02Å
20	S	96.9	Very high	74.4	Confident	68 Å²	68	83.3 Å²	83.3	48%	0.476	46%	0.463	S	S	.	.			trans	-124.4	82.5	-172.6	-62	0	0	0	0	110.1	C18	C18-S20 PolarHBondContact O-N 3.21Å; C18-S20 PolarHBondContact O-OG 3.45Å; C18-S20 VanDerWaalsContact O-OG 3.09Å
21	P	96.7	Very high	74.5	Confident	4 Å²	4	80 Å²	80	3%	0.026	45%	0.448	C	S	.	.			trans	-73.7	144.8	-175.9	32.7	-36.1	0	0	0	110.6	G19 V23 K24 P42 W43	G19-P21 WeakPolarHBondContact O-CD 3.23Å; P21-V23 WeakPolarHBondContact CB-O 3.4Å; P21-K24 HydrophobicContact CG-CD 4.32Å; P21-K24 PolarHBondContact O-NZ 2.98Å; P21-P42 HydrophobicContact CB-CG 3.77Å; P21-W43 HydrophobicContact CB-CH2 4.45Å; P21-W43 HydrophobicContact CB-CZ3 4.23Å; P21-W43 HydrophobicContact CG-CH2 4.14Å; P21-W43 HydrophobicContact CG-CZ3 4.33Å
22	A	96.4	Very high	75.1	Confident	64 Å²	64	77 Å²	77	53%	0.529	44%	0.438	S	S	.	.	S	Bend	trans	-65.6	-44.9	175	0	0	0	0	0	110.7	D136	A22-D136 HydrophobicContact CB-CB 3.9Å
23	V	96.7	Very high	76.3	Confident	56 Å²	56	73 Å²	73	34%	0.339	42%	0.419	S	S	.	.	S	Bend	trans	-91.2	121.4	169.8	-177.3	0	0	0	0	108.9	P21 R37 S40	P21-V23 WeakPolarHBondContact CB-O 3.4Å; V23-R37 HydrophobicContact CG1-CB 4.27Å; V23-S40 WeakPolarHBondContact O-CA 3.44Å
24	K	96.2	Very high	78.4	Confident	114 Å²	114	71.9 Å²	71.9	50%	0.496	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-77.2	135.5	178.3	-61.1	-55	-176.7	-163.3	0	111.2	P21	P21-K24 HydrophobicContact CG-CD 4.32Å; P21-K24 PolarHBondContact O-NZ 2.98Å
25	P	94.4	Very high	80.7	Confident	7 Å²	7	69.2 Å²	69.2	5%	0.045	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-65	152.5	174.7	27.9	-34.6	0	0	0	110.8	T27 W41 W229	P25-T27 HydrophobicContact CG-CG2 4.47Å; P25-T27 PolarHBondContact O-N 3.01Å; P25-W41 HydrophobicContact CB-CD2 4.35Å; P25-W41 HydrophobicContact CB-CH2 3.91Å; P25-W41 HydrophobicContact CB-CZ2 3.37Å; P25-W41 HydrophobicContact CG-CH2 3.68Å; P25-W41 HydrophobicContact CG-CZ2 3.72Å; P25-W41 HydrophobicContact CG-CZ3 4.14Å; P25-W229 HydrophobicContact CG-CH2 4.29Å; P25-W229 HydrophobicContact CG-CZ2 3.48Å; P25-W229 VanDerWaalsContact CG-CZ2 3.48Å
26	D	90.2	Very high	83	Confident	43 Å²	43	63 Å²	63	23%	0.23	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-73.7	116.8	172.2	-156.4	-41	0	0	0	109.4	S28 R37 Q176	D26-S28 VanDerWaalsContact OD1-CB 3.29Å; D26-S28 WeakPolarHBondContact OD1-CB 3.43Å; D26-S28 PolarHBondContact OD1-N 2.98Å; D26-S28 PolarHBondContact OD1-OG 2.68Å; D26-R37 IonicContact OD2-CZ 3.62Å; D26-R37 IonicContact OD2-NE 3.59Å; D26-R37 IonicContact OD2-NH2 2.79Å; D26-R37 PolarHBondContact OD2-NH2 3.24Å; D26-Q176 PolarHBondContact O-NE2 2.82Å
27	T	85.2	Confident	84.7	Confident	83 Å²	83	62.9 Å²	62.9	51%	0.509	36%	0.355	S	S	.	.			trans	-110.4	6.5	-178.7	54.7	0	0	0	0	112.4	P25 F157 W229	P25-T27 HydrophobicContact CG-CG2 4.47Å; P25-T27 PolarHBondContact O-N 3.01Å; T27-F157 HydrophobicContact CG2-CE2 4.08Å; T27-F157 HydrophobicContact CG2-CZ 3.98Å; T27-W229 HydrophobicContact CG2-CH2 3.93Å; T27-W229 HydrophobicContact CG2-CZ2 3.97Å
28	S	76	Confident	85.3	Confident	70 Å²	70	63.7 Å²	63.7	49%	0.49	35%	0.352	S	S	.	.	S	Bend	trans	-58.7	159.3	170.4	65.8	0	0	0	0	110.1	D26 V30	D26-S28 VanDerWaalsContact OD1-CB 3.29Å; D26-S28 WeakPolarHBondContact OD1-CB 3.43Å; D26-S28 PolarHBondContact OD1-N 2.98Å; D26-S28 PolarHBondContact OD1-OG 2.68Å; S28-V30 VanDerWaalsContact C-N 3.25Å; S28-V30 WeakPolarHBondContact O-CG2 3.33Å; S28-V30 PolarHBondContact O-N 2.65Å
29	R	58.4	Low	85.4	Confident	230 Å²	230	64 Å²	64	87%	0.868	35%	0.35	S	S	*	.			trans	-64.2	86.3	-175.8	-171	-177.5	70.2	120.5	1.2	110.5	V31	R29-V31 HydrophobicContact CG-CG2 4.22Å
30	V	53.8	Low	85.5	Confident	20 Å²	20	64 Å²	64	12%	0.121	35%	0.35	C	S	.	.			trans	-82	119.4	173.8	174	0	0	0	0	108.1	S28 V34	S28-V30 VanDerWaalsContact C-N 3.25Å; S28-V30 WeakPolarHBondContact O-CG2 3.33Å; S28-V30 PolarHBondContact O-N 2.65Å; V30-V34 HydrophobicContact CB-CG2 4.39Å; V30-V34 HydrophobicContact CG1-CB 4.1Å; V30-V34 HydrophobicContact CG1-CG1 3.53Å; V30-V34 HydrophobicContact CG1-CG2 3.7Å; V30-V34 HydrophobicContact CG2-CG1 4.36Å; V30-V34 HydrophobicContact CG2-CG2 3.79Å
31	V	51.3	Low	85.5	Confident	81 Å²	81	61 Å²	61	49%	0.491	33%	0.329	S	S	.	.			trans	-113.2	123.3	173.9	-173.7	0	0	0	0	106	R29	R29-V31 HydrophobicContact CG-CG2 4.22Å
32	N	60.3	Low	85.6	Confident	108 Å²	108	61.2 Å²	61.2	58%	0.578	33%	0.33	S	S	*	.	S	Bend	trans	87.5	22.1	178	-51.4	-30.4	0	0	0	119.1	V208	N32-V208 WeakPolarHBondContact OD1-CG1 3.46Å
33	G	72.1	Confident	85.7	Confident	25 Å²	25	58.2 Å²	58.2	26%	0.258	31%	0.305	S	S	.	.			trans	71.5	143.7	-179.5	0	0	0	0	0	112.2	Q176	G33-Q176 WeakPolarHBondContact CA-O 3.23Å
34	V	88.8	Confident	85.8	Confident	56 Å²	56	55.9 Å²	55.9	34%	0.339	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	159	176	-68.2	0	0	0	0	109.3	V30 A36 Q175 Q176	V30-V34 HydrophobicContact CB-CG2 4.39Å; V30-V34 HydrophobicContact CG1-CB 4.1Å; V30-V34 HydrophobicContact CG1-CG1 3.53Å; V30-V34 HydrophobicContact CG1-CG2 3.7Å; V30-V34 HydrophobicContact CG2-CG1 4.36Å; V30-V34 HydrophobicContact CG2-CG2 3.79Å; V34-A36 PolarHBondContact O-N 2.8Å; V34-Q175 VanDerWaalsContact C-OE1 3.29Å; V34-Q175 CarbonylContact O-C 3.57Å; V34-Q175 WeakPolarHBondContact O-CA 3.5Å; V34-Q176 HydrophobicContact CG2-CG 3.96Å; V34-Q176 PolarHBondContact N-O 2.83Å; V34-Q176 PolarHBondContact O-N 2.87Å
35	D	94.2	Very high	85.9	Confident	92 Å²	92	50.5 Å²	50.5	49%	0.492	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.2	122.9	163.5	-60	-14	0	0	0	109.3	I173 Q175	D35-I173 HydrophobicContact CB-CG2 3.86Å; D35-Q175 PolarHBondContact OD1-NE2 3.13Å
36	A	96	Very high	86.2	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.033	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-63.4	152.1	170.6	0	0	0	0	0	109.1	V34 H89 L174 Q176	V34-A36 PolarHBondContact O-N 2.8Å; A36-H89 PolarHBondContact O-CE1 3.01Å; A36-L174 HydrophobicContact CB-CB 4.36Å; A36-L174 HydrophobicContact CB-CD2 4.12Å; A36-L174 HydrophobicContact CB-CG 4.01Å; A36-L174 WeakPolarHBondContact CB-O 3.45Å; A36-L174 PolarHBondContact N-O 3.32Å; A36-Q176 HydrophobicContact CB-CB 4.22Å; A36-Q176 HydrophobicContact CB-CG 3.94Å
37	R	96.9	Very high	86.6	Confident	118 Å²	118	48.1 Å²	48.1	45%	0.445	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-65.8	137.3	168.7	-66.9	179.8	-177.1	-175.8	1.4	107.8	V23 D26 H39 S40	V23-R37 HydrophobicContact CG1-CB 4.27Å; D26-R37 IonicContact OD2-CZ 3.62Å; D26-R37 IonicContact OD2-NE 3.59Å; D26-R37 IonicContact OD2-NH2 2.79Å; D26-R37 PolarHBondContact OD2-NH2 3.24Å; R37-H39 PolarHBondContact O-N 3.3Å; R37-H39 VanDerWaalsContact O-N 3.09Å; R37-S40 WeakPolarHBondContact O-CB 3.41Å; R37-S40 PolarHBondContact O-N 3.4Å; R37-S40 PolarHBondContact O-OG 3.09Å
38	P	98	Very high	87.2	Confident	66 Å²	66	45 Å²	45	43%	0.429	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	123	179	-27.8	29.4	0	0	0	111.6	S40 H89	P38-S40 PolarHBondContact O-N 3.04Å; P38-S40 VanDerWaalsContact O-N 3.16Å; P38-H89 WeakPolarHBondContact CG-NE2 3.29Å
39	H	98	Very high	88.2	Confident	36 Å²	36	41.9 Å²	41.9	17%	0.167	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	21.4	178	-35.1	-60.1	0	0	0	116.6	R37 W41 G87 T97	R37-H39 PolarHBondContact O-N 3.3Å; R37-H39 VanDerWaalsContact O-N 3.09Å; H39-W41 PolarHBondContact O-N 3.47Å; H39-G87 PolarHBondContact CE1-O 3.43Å; H39-G87 PolarHBondContact ND1-O 2.97Å; H39-T97 PolarHBondContact CE1-OG1 3.13Å; H39-T97 VanDerWaalsContact CE1-OG1 3.29Å
40	S	98.2	Very high	90.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-72.1	-12.3	175.4	67	0	0	0	0	114.7	V23 R37 P38 P42	V23-S40 WeakPolarHBondContact O-CA 3.44Å; R37-S40 WeakPolarHBondContact O-CB 3.41Å; R37-S40 PolarHBondContact O-N 3.4Å; R37-S40 PolarHBondContact O-OG 3.09Å; P38-S40 PolarHBondContact O-N 3.04Å; P38-S40 VanDerWaalsContact O-N 3.16Å; S40-P42 VanDerWaalsContact C-CD 3.47Å; S40-P42 WeakPolarHBondContact O-CD 3.34Å
41	W	98.4	Very high	92.1	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.015	21%	0.207	C	C	.	.	S	Bend	trans	-119.9	67.4	172.5	-58.4	111	0	0	0	109.7	P25 H39 W43 Q44 F157 N221 W229	P25-W41 HydrophobicContact CB-CD2 4.35Å; P25-W41 HydrophobicContact CB-CH2 3.91Å; P25-W41 HydrophobicContact CB-CZ2 3.37Å; P25-W41 HydrophobicContact CG-CH2 3.68Å; P25-W41 HydrophobicContact CG-CZ2 3.72Å; P25-W41 HydrophobicContact CG-CZ3 4.14Å; H39-W41 PolarHBondContact O-N 3.47Å; W41-W43 AromaticContact CE3-CE2 3.91Å; W41-W43 HydrophobicContact CE3-CH2 4.22Å; W41-W43 AromaticContact CE3-CZ2 3.4Å; W41-W43 HydrophobicContact CE3-CZ2 3.4Å; W41-W43 VanDerWaalsContact CE3-CZ2 3.4Å; W41-W43 HydrophobicContact CZ3-CH2 4.44Å; W41-W43 AromaticContact CZ3-CZ2 3.7Å; W41-W43 HydrophobicContact CZ3-CZ2 3.7Å; W41-W43 PolarHBondContact O-N 3.09Å; W41-Q44 HydrophobicContact CB-CB 4.17Å; W41-Q44 WeakPolarHBondContact O-CB 3.45Å; W41-Q44 PolarHBondContact O-N 2.78Å; W41-F157 HydrophobicContact CH2-CB 3.89Å; W41-F157 HydrophobicContact CH2-CG 4.26Å; W41-F157 HydrophobicContact CZ2-CB 3.75Å; W41-F157 HydrophobicContact CZ2-CD1 4.43Å; W41-F157 HydrophobicContact CZ2-CG 4.06Å; W41-N221 HydrophobicContact CE3-CB 4.13Å; W41-N221 HydrophobicContact CH2-CB 3.77Å; W41-N221 HydrophobicContact CZ3-CB 3.44Å; W41-N221 VanDerWaalsContact CZ3-CB 3.44Å; W41-W229 AromaticContact CH2-CD2 3.93Å; W41-W229 HydrophobicContact CH2-CD2 3.93Å; W41-W229 AromaticContact CH2-CE3 3.69Å; W41-W229 HydrophobicContact CH2-CE3 3.69Å; W41-W229 AromaticContact CH2-CH2 3.65Å; W41-W229 HydrophobicContact CH2-CH2 3.65Å; W41-W229 AromaticContact CH2-CZ2 3.9Å; W41-W229 HydrophobicContact CH2-CZ2 3.9Å; W41-W229 AromaticContact CH2-CZ3 3.55Å; W41-W229 HydrophobicContact CH2-CZ3 3.55Å; W41-W229 AromaticContact CZ3-CD2 3.63Å; W41-W229 HydrophobicContact CZ3-CD2 3.63Å; W41-W229 AromaticContact CZ3-CE2 3.99Å; W41-W229 AromaticContact CZ3-CE3 3.65Å; W41-W229 HydrophobicContact CZ3-CE3 3.65Å; W41-W229 HydrophobicContact CZ3-CG 4.11Å; W41-W229 HydrophobicContact CZ3-CH2 4.36Å; W41-W229 HydrophobicContact CZ3-CZ2 4.35Å; W41-W229 HydrophobicContact CZ3-CZ3 4.03Å
42	P	98.4	Very high	94.1	Very high	8 Å²	8	38.5 Å²	38.5	5%	0.052	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.5	-166.3	31.1	-38.4	0	0	0	114.1	P21 S40 S137 V138 G139	P21-P42 HydrophobicContact CB-CG 3.77Å; S40-P42 VanDerWaalsContact C-CD 3.47Å; S40-P42 WeakPolarHBondContact O-CD 3.34Å; P42-S137 WeakPolarHBondContact CA-O 3.33Å; P42-S137 WeakPolarHBondContact CB-O 3.38Å; P42-V138 WeakPolarHBondContact O-CA 3.33Å; P42-G139 PolarHBondContact O-N 2.93Å
43	W	98.8	Very high	95.7	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.008	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-9.9	172.7	50.8	76.9	0	0	0	113.3	P21 W41 I45 T62 L63 G139 A141 N221 W229	P21-W43 HydrophobicContact CB-CH2 4.45Å; P21-W43 HydrophobicContact CB-CZ3 4.23Å; P21-W43 HydrophobicContact CG-CH2 4.14Å; P21-W43 HydrophobicContact CG-CZ3 4.33Å; W41-W43 AromaticContact CE3-CE2 3.91Å; W41-W43 HydrophobicContact CE3-CH2 4.22Å; W41-W43 AromaticContact CE3-CZ2 3.4Å; W41-W43 HydrophobicContact CE3-CZ2 3.4Å; W41-W43 VanDerWaalsContact CE3-CZ2 3.4Å; W41-W43 HydrophobicContact CZ3-CH2 4.44Å; W41-W43 AromaticContact CZ3-CZ2 3.7Å; W41-W43 HydrophobicContact CZ3-CZ2 3.7Å; W41-W43 PolarHBondContact O-N 3.09Å; W43-I45 PolarHBondContact O-N 3.17Å; W43-T62 HydrophobicContact CB-CG2 4.01Å; W43-T62 HydrophobicContact CG-CG2 4.05Å; W43-T62 CarbonylContact O-C 3.59Å; W43-T62 WeakPolarHBondContact O-CA 3.34Å; W43-L63 HydrophobicContact CB-CB 4.45Å; W43-L63 PolarHBondContact O-N 2.9Å; W43-G139 WeakPolarHBondContact CA-O 2.89Å; W43-G139 VanDerWaalsContact CB-O 3.25Å; W43-G139 WeakPolarHBondContact CB-O 2.97Å; W43-A141 HydrophobicContact CB-CB 3.9Å; W43-A141 HydrophobicContact CD2-CB 3.71Å; W43-A141 HydrophobicContact CE3-CB 4.26Å; W43-A141 HydrophobicContact CG-CB 3.54Å; W43-N221 PolarHBondContact NE1-OD1 3.1Å; W43-W229 HydrophobicContact CH2-CB 3.42Å; W43-W229 VanDerWaalsContact CH2-CB 3.42Å; W43-W229 AromaticContact CH2-CD1 3.78Å; W43-W229 AromaticContact CH2-CG 3.72Å; W43-W229 HydrophobicContact CH2-CG 3.72Å; W43-W229 HydrophobicContact CZ2-CB 3.48Å; W43-W229 VanDerWaalsContact CZ2-CB 3.48Å; W43-W229 AromaticContact CZ2-CG 3.93Å; W43-W229 HydrophobicContact CZ2-CG 3.93Å
44	Q	98.8	Very high	96.9	Very high	7 Å²	7	46 Å²	46	3%	0.033	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	134.8	172.2	179.9	68.3	52.5	0	0	108.9	W41 S159 W161 L174 P219	W41-Q44 HydrophobicContact CB-CB 4.17Å; W41-Q44 WeakPolarHBondContact O-CB 3.45Å; W41-Q44 PolarHBondContact O-N 2.78Å; Q44-S159 PolarHBondContact OE1-O 2.79Å; Q44-S159 PolarHBondContact OE1-OG 3.22Å; Q44-W161 HydrophobicContact CG-CH2 3.82Å; Q44-W161 HydrophobicContact CG-CZ3 3.6Å; Q44-L174 HydrophobicContact CG-CD1 3.95Å; Q44-L174 HydrophobicContact CG-CD2 4.27Å; Q44-P219 VanDerWaalsContact OE1-CD 3.26Å
45	I	98.8	Very high	97.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	159.1	170.5	68.1	76.9	0	0	0	110.8	W43 L47 G61 L63 V69 V84 V85 L86	W43-I45 PolarHBondContact O-N 3.17Å; I45-L47 HydrophobicContact CD1-CB 3.99Å; I45-L47 VanDerWaalsContact CD1-N 3.33Å; I45-G61 PolarHBondContact N-O 3.28Å; I45-G61 VanDerWaalsContact N-O 3.14Å; I45-L63 HydrophobicContact CG2-CB 4.49Å; I45-V69 HydrophobicContact CD1-CG1 3.95Å; I45-V69 HydrophobicContact CG1-CG1 3.65Å; I45-V69 HydrophobicContact CG1-CG2 4.37Å; I45-V69 HydrophobicContact CG2-CG2 4.41Å; I45-V84 HydrophobicContact CB-CG1 3.75Å; I45-V84 HydrophobicContact CD1-CG1 4.25Å; I45-V84 HydrophobicContact CG1-CG1 4.04Å; I45-V84 HydrophobicContact CG2-CG1 3.92Å; I45-V85 WeakPolarHBondContact CA-O 3.4Å; I45-L86 HydrophobicContact CG2-CB 4.45Å; I45-L86 HydrophobicContact CG2-CD2 3.68Å; I45-L86 HydrophobicContact CG2-CG 3.68Å
46	S	98.7	Very high	97.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	112.4	163.2	163.4	0	0	0	0	108.5	Q48 H57 V85	S46-Q48 VanDerWaalsContact OG-CG 3.3Å; S46-Q48 WeakPolarHBondContact OG-CG 3.49Å; S46-Q48 PolarHBondContact OG-NE2 2.83Å; S46-H57 PolarHBondContact OG-ND1 2.95Å; S46-V85 PolarHBondContact N-O 2.85Å; S46-V85 PolarHBondContact O-N 3.47Å
47	L	98.8	Very high	97.4	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.5	166.7	-178.9	62.3	0	0	0	107.5	I45 T58 C59 T71 C75 I76 Y82 V84 I103 L126	I45-L47 HydrophobicContact CD1-CB 3.99Å; I45-L47 VanDerWaalsContact CD1-N 3.33Å; L47-T58 HydrophobicContact CD2-CG2 4.47Å; L47-T58 HydrophobicContact CG-CG2 4.23Å; L47-T58 PolarHBondContact O-N 3.44Å; L47-C59 HydrophobicContact CB-CB 4.21Å; L47-C59 WeakPolarHBondContact CB-O 3.47Å; L47-C59 HydrophobicContact CD2-CB 4.18Å; L47-C59 PolarHBondContact N-O 2.9Å; L47-C59 PolarHBondContact O-N 3.02Å; L47-T71 HydrophobicContact CD2-CG2 4.45Å; L47-C75 HydrophobicContact CD2-CB 4.09Å; L47-I76 HydrophobicContact CD2-CD1 4.06Å; L47-Y82 HydrophobicContact CD1-CD1 4.11Å; L47-Y82 HydrophobicContact CD1-CG 4.29Å; L47-Y82 HydrophobicContact CD2-CD1 4.42Å; L47-Y82 HydrophobicContact CG-CD1 4.19Å; L47-V84 HydrophobicContact CD1-CG2 4.25Å; L47-I103 HydrophobicContact CD1-CD1 4.03Å; L47-L126 HydrophobicContact CD1-CD1 3.76Å; L47-L126 HydrophobicContact CD2-CD1 4.34Å
48	Q	98.4	Very high	97.4	Very high	17 Å²	17	43.8 Å²	43.8	8%	0.079	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.3	-179.2	-59.2	-176.1	-14.4	0	0	111	S46 F55 H56 Y82 R83 V85	S46-Q48 VanDerWaalsContact OG-CG 3.3Å; S46-Q48 WeakPolarHBondContact OG-CG 3.49Å; S46-Q48 PolarHBondContact OG-NE2 2.83Å; Q48-F55 HydrophobicContact CB-CB 4.08Å; Q48-F55 HydrophobicContact CB-CD1 4.3Å; Q48-H56 CarbonylContact C-O 3.6Å; Q48-H56 WeakPolarHBondContact CA-O 3.49Å; Q48-H56 WeakPolarHBondContact CB-O 3.41Å; Q48-Y82 CarbonylContact O-C 3.49Å; Q48-Y82 VanDerWaalsContact O-CA 3.24Å; Q48-Y82 WeakPolarHBondContact O-CA 3.42Å; Q48-R83 HydrophobicContact CB-CG 3.98Å; Q48-R83 PolarHBondContact N-O 2.9Å; Q48-R83 PolarHBondContact O-N 2.84Å; Q48-V85 HydrophobicContact CG-CG2 4.19Å
49	V	98	Very high	97.4	Very high	6 Å²	6	40.8 Å²	40.8	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	142.7	177.4	64.8	0	0	0	0	110.5	F55 H56 T58 D80 Y82	V49-F55 CarbonylContact O-C 3.58Å; V49-F55 WeakPolarHBondContact O-CA 3.4Å; V49-H56 PolarHBondContact N-O 2.82Å; V49-H56 PolarHBondContact O-N 3.39Å; V49-T58 HydrophobicContact CB-CG2 4.17Å; V49-T58 HydrophobicContact CG1-CG2 4.14Å; V49-D80 HydrophobicContact CG2-CB 3.96Å; V49-D80 WeakPolarHBondContact CG2-OD2 3.44Å; V49-Y82 HydrophobicContact CB-CD1 3.92Å; V49-Y82 HydrophobicContact CB-CE1 3.77Å; V49-Y82 HydrophobicContact CG2-CD1 4.13Å; V49-Y82 HydrophobicContact CG2-CE1 3.76Å
50	Q	98.1	Very high	97.4	Very high	75 Å²	75	39.1 Å²	39.1	35%	0.35	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	116.5	179.4	-170.6	178.4	-3.9	0	0	111.7	G52 R54 F55 V81	Q50-G52 PolarHBondContact NE2-O 2.83Å; Q50-R54 CarbonylContact C-O 3.52Å; Q50-R54 WeakPolarHBondContact CA-O 3.29Å; Q50-F55 HydrophobicContact CB-CD1 3.99Å; Q50-F55 HydrophobicContact CB-CE1 3.65Å; Q50-F55 HydrophobicContact CB-CE2 4.33Å; Q50-F55 HydrophobicContact CB-CG 4.49Å; Q50-F55 HydrophobicContact CB-CZ 3.83Å; Q50-F55 HydrophobicContact CG-CE1 4.38Å; Q50-F55 HydrophobicContact CG-CE2 4.17Å; Q50-F55 HydrophobicContact CG-CZ 4.1Å; Q50-V81 HydrophobicContact CB-CB 4.02Å; Q50-V81 HydrophobicContact CB-CG1 4.48Å; Q50-V81 PolarHBondContact N-O 2.74Å
51	H	95.1	Very high	97.4	Very high	117 Å²	117	39.1 Å²	39.1	54%	0.542	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	110.5	168.1	-69.7	-165.2	0	0	0	109.2	S53 R54	H51-S53 PolarHBondContact O-N 2.85Å; H51-R54 PolarHBondContact N-O 3.31Å; H51-R54 PolarHBondContact O-N 3.22Å
52	G	94.1	Very high	97.5	Very high	68 Å²	68	38.9 Å²	38.9	70%	0.701	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	-120	-173.1	0	0	0	0	0	111.7	Q50	Q50-G52 PolarHBondContact NE2-O 2.83Å
53	S	94	Very high	97.5	Very high	113 Å²	113	38.5 Å²	38.5	79%	0.79	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	2.9	178.9	61	0	0	0	0	114.3	H51	H51-S53 PolarHBondContact O-N 2.85Å
54	R	96.3	Very high	97.5	Very high	177 Å²	177	39.1 Å²	39.1	67%	0.668	21%	0.21	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	151.5	-174.8	-65	-175.1	-179.7	-174.2	-0.8	111.3	Q50 H51	Q50-R54 CarbonylContact C-O 3.52Å; Q50-R54 WeakPolarHBondContact CA-O 3.29Å; H51-R54 PolarHBondContact N-O 3.31Å; H51-R54 PolarHBondContact O-N 3.22Å
55	F	97.3	Very high	97.3	Very high	54 Å²	54	39.6 Å²	39.6	24%	0.237	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.3	171	-77.9	-92.6	0	0	0	109.2	Q48 V49 Q50 V81 R83	Q48-F55 HydrophobicContact CB-CB 4.08Å; Q48-F55 HydrophobicContact CB-CD1 4.3Å; V49-F55 CarbonylContact O-C 3.58Å; V49-F55 WeakPolarHBondContact O-CA 3.4Å; Q50-F55 HydrophobicContact CB-CD1 3.99Å; Q50-F55 HydrophobicContact CB-CE1 3.65Å; Q50-F55 HydrophobicContact CB-CE2 4.33Å; Q50-F55 HydrophobicContact CB-CG 4.49Å; Q50-F55 HydrophobicContact CB-CZ 3.83Å; Q50-F55 HydrophobicContact CG-CE1 4.38Å; Q50-F55 HydrophobicContact CG-CE2 4.17Å; Q50-F55 HydrophobicContact CG-CZ 4.1Å; F55-V81 HydrophobicContact CE1-CG1 4.44Å; F55-V81 HydrophobicContact CZ-CG1 4.32Å; F55-R83 HydrophobicContact CD1-CB 4.33Å; F55-R83 HydrophobicContact CD1-CG 3.57Å; F55-R83 HydrophobicContact CE1-CB 4.06Å; F55-R83 HydrophobicContact CE1-CG 3.81Å; F55-R83 HydrophobicContact CG-CG 4.08Å
56	H	95.8	Very high	97.1	Very high	87 Å²	87	43.1 Å²	43.1	40%	0.403	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.2	-179.1	-63.7	-86.3	0	0	0	109.8	Q48 V49 T58	Q48-H56 CarbonylContact C-O 3.6Å; Q48-H56 WeakPolarHBondContact CA-O 3.49Å; Q48-H56 WeakPolarHBondContact CB-O 3.41Å; V49-H56 PolarHBondContact N-O 2.82Å; V49-H56 PolarHBondContact O-N 3.39Å; H56-T58 PolarHBondContact O-N 3.19Å
57	H	96.6	Very high	97	Very high	31 Å²	31	47.1 Å²	47.1	14%	0.144	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	133.9	169.2	-179.7	75.9	0	0	0	110.1	S46 C59 M91 G214	S46-H57 PolarHBondContact OG-ND1 2.95Å; H57-C59 VanDerWaalsContact CE1-C 3.42Å; H57-C59 PolarHBondContact CE1-O 2.99Å; H57-M91 HydrophobicContact CB-CE 3.89Å; H57-M91 HydrophobicContact CB-SD 3.97Å; H57-M91 WeakPolarHBondContact ND1-CE 3.36Å; H57-G214 PolarHBondContact NE2-O 3.08Å
58	T	96.3	Very high	97	Very high	51 Å²	51	47.8 Å²	47.8	31%	0.313	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	-38.1	176.9	-169.2	0	0	0	0	112.1	L47 V49 H56 Y82	L47-T58 HydrophobicContact CD2-CG2 4.47Å; L47-T58 HydrophobicContact CG-CG2 4.23Å; L47-T58 PolarHBondContact O-N 3.44Å; V49-T58 HydrophobicContact CB-CG2 4.17Å; V49-T58 HydrophobicContact CG1-CG2 4.14Å; H56-T58 PolarHBondContact O-N 3.19Å; T58-Y82 HydrophobicContact CG2-CE1 4.42Å
59	C	98.4	Very high	97	Very high	4 Å²	4	47 Å²	47	3%	0.027	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160.4	-177.7	-79.3	0	0	0	0	111.3	L47 H57 C75 S216	L47-C59 HydrophobicContact CB-CB 4.21Å; L47-C59 WeakPolarHBondContact CB-O 3.47Å; L47-C59 HydrophobicContact CD2-CB 4.18Å; L47-C59 PolarHBondContact N-O 2.9Å; L47-C59 PolarHBondContact O-N 3.02Å; H57-C59 VanDerWaalsContact CE1-C 3.42Å; H57-C59 PolarHBondContact CE1-O 2.99Å; C59-C75 HydrophobicContact CB-CB 3.76Å; C59-C75 WeakPolarHBondContact CB-SG 3.42Å; C59-C75 WeakPolarHBondContact SG-CB 3.48Å; C59-C75 CovalentContact SG-SG 2.04Å; C59-C75 PolarHBondContact SG-SG 3.25Å; C59-S216 CarbonylContact C-O 3.44Å; C59-S216 WeakPolarHBondContact CA-O 3.42Å; C59-S216 WeakPolarHBondContact CB-O 3.02Å; C59-S216 VanDerWaalsContact SG-CB 3.54Å
60	G	98.4	Very high	97	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-175.2	162.9	0	0	0	0	0	113	T71 S216	G60-T71 PolarHBondContact O-OG1 3Å; G60-S216 PolarHBondContact N-O 2.95Å
61	G	98.7	Very high	97.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-178.7	172.9	0	0	0	0	0	110.3	I45 L70 G217	I45-G61 PolarHBondContact N-O 3.28Å; I45-G61 VanDerWaalsContact N-O 3.14Å; G61-L70 CarbonylContact C-O 3.51Å; G61-L70 WeakPolarHBondContact CA-O 3.41Å; G61-G217 WeakPolarHBondContact CA-O 3.41Å
62	T	98.9	Very high	97.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	127.7	-178.2	-50.9	0	0	0	0	111.4	W43 V64 V69 L70 A141 P219 I231	W43-T62 HydrophobicContact CB-CG2 4.01Å; W43-T62 HydrophobicContact CG-CG2 4.05Å; W43-T62 CarbonylContact O-C 3.59Å; W43-T62 WeakPolarHBondContact O-CA 3.34Å; T62-V64 HydrophobicContact CG2-CG1 3.92Å; T62-V64 PolarHBondContact O-N 2.84Å; T62-V69 CarbonylContact O-C 3.57Å; T62-V69 VanDerWaalsContact O-CA 3.23Å; T62-V69 WeakPolarHBondContact O-CA 3.24Å; T62-L70 PolarHBondContact N-O 2.91Å; T62-L70 PolarHBondContact O-N 2.95Å; T62-A141 HydrophobicContact CG2-CB 3.52Å; T62-P219 WeakPolarHBondContact OG1-CB 3.33Å; T62-I231 HydrophobicContact CG2-CD1 3.8Å; T62-I231 HydrophobicContact CG2-CG1 3.54Å
63	L	98.8	Very high	97.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	110.2	165.7	-168.1	70.5	0	0	0	109.6	W43 I45 A65 V69 L86 L128 P132 M134 V138 V140 A141	W43-L63 HydrophobicContact CB-CB 4.45Å; W43-L63 PolarHBondContact O-N 2.9Å; I45-L63 HydrophobicContact CG2-CB 4.49Å; L63-A65 VanDerWaalsContact CD1-O 3.25Å; L63-A65 WeakPolarHBondContact CD1-O 3.17Å; L63-V69 HydrophobicContact CD1-CG2 3.9Å; L63-L86 HydrophobicContact CB-CD2 4.17Å; L63-L86 HydrophobicContact CD1-CD2 4.02Å; L63-L86 HydrophobicContact CD2-CD2 3.7Å; L63-L86 HydrophobicContact CG-CD2 4.18Å; L63-L128 HydrophobicContact CD1-CD1 4.07Å; L63-P132 HydrophobicContact CD2-CG 3.87Å; L63-M134 HydrophobicContact CD2-CE 3.74Å; L63-M134 HydrophobicContact CD2-SD 4.23Å; L63-V138 HydrophobicContact CD2-CG1 4.07Å; L63-V140 HydrophobicContact CD2-CG1 3.99Å; L63-V140 HydrophobicContact CG-CG1 4.06Å; L63-V140 CarbonylContact O-C 3.56Å; L63-V140 VanDerWaalsContact O-CA 3.3Å; L63-V140 WeakPolarHBondContact O-CA 3.17Å; L63-A141 PolarHBondContact O-N 2.91Å
64	V	98.2	Very high	97.6	Very high	14 Å²	14	30.8 Å²	30.8	9%	0.085	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-16.6	-176.1	-66.8	0	0	0	0	112.9	T62 W68 L70 L125 L143 L266	T62-V64 HydrophobicContact CG2-CG1 3.92Å; T62-V64 PolarHBondContact O-N 2.84Å; V64-W68 HydrophobicContact CG2-CB 4.33Å; V64-W68 WeakPolarHBondContact CG2-O 3.35Å; V64-W68 PolarHBondContact N-O 2.98Å; V64-L70 HydrophobicContact CG1-CB 3.81Å; V64-L70 HydrophobicContact CG1-CD2 4.25Å; V64-L70 HydrophobicContact CG2-CB 4.08Å; V64-L125 HydrophobicContact CG2-CD2 4.34Å; V64-L143 HydrophobicContact CB-CD1 4.42Å; V64-L143 HydrophobicContact CB-CD2 4.47Å; V64-L143 HydrophobicContact CB-CG 4.39Å; V64-L143 HydrophobicContact CG1-CD2 3.96Å; V64-L143 HydrophobicContact CG1-CG 4.37Å; V64-L266 HydrophobicContact CG2-CD2 4.24Å
65	A	96.4	Very high	97.7	Very high	18 Å²	18	22.6 Å²	22.6	15%	0.149	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	168.3	169.3	0	0	0	0	0	109.6	L63 R67 W68 L266	L63-A65 VanDerWaalsContact CD1-O 3.25Å; L63-A65 WeakPolarHBondContact CD1-O 3.17Å; A65-R67 PolarHBondContact O-N 2.83Å; A65-W68 HydrophobicContact CB-CB 4.07Å; A65-W68 PolarHBondContact N-O 2.86Å; A65-W68 PolarHBondContact O-N 3.09Å; A65-L266 HydrophobicContact CB-CD2 4.15Å
66	P	93.5	Very high	97.7	Very high	73 Å²	73	21 Å²	21	47%	0.474	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.4	-170.3	-29.2	35.7	0	0	0	116.8	S131 P132 M134	P66-S131 WeakPolarHBondContact CB-OG 3.4Å; P66-S131 WeakPolarHBondContact O-CA 3.34Å; P66-S131 WeakPolarHBondContact O-CB 3.44Å; P66-S131 PolarHBondContact O-OG 2.97Å; P66-P132 WeakPolarHBondContact O-CD 3.4Å; P66-M134 HydrophobicContact CB-CE 4.09Å; P66-M134 HydrophobicContact CG-CE 4.45Å
67	R	96.9	Very high	97.7	Very high	84 Å²	84	23.6 Å²	23.6	32%	0.317	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.8	14.2	176	-69.6	-178.7	63.2	-169.6	-1.2	112.7	A65 K127 L128 D129	A65-R67 PolarHBondContact O-N 2.83Å; R67-K127 CarbonylContact O-C 3.58Å; R67-K127 VanDerWaalsContact O-CA 3.3Å; R67-K127 WeakPolarHBondContact O-CA 3.25Å; R67-L128 HydrophobicContact CB-CB 4.5Å; R67-L128 PolarHBondContact NE-O 3.21Å; R67-L128 PolarHBondContact NH2-O 3.24Å; R67-L128 PolarHBondContact O-N 2.97Å; R67-D129 PolarHBondContact NH2-O 3.07Å
68	W	98.4	Very high	97.6	Very high	15 Å²	15	28.1 Å²	28.1	6%	0.057	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.8	-172.6	-68.9	108.4	0	0	0	110.6	V64 A65 L125 L126 K127 Q265 L266	V64-W68 HydrophobicContact CG2-CB 4.33Å; V64-W68 WeakPolarHBondContact CG2-O 3.35Å; V64-W68 PolarHBondContact N-O 2.98Å; A65-W68 HydrophobicContact CB-CB 4.07Å; A65-W68 PolarHBondContact N-O 2.86Å; A65-W68 PolarHBondContact O-N 3.09Å; W68-L125 HydrophobicContact CE3-CB 3.96Å; W68-L125 HydrophobicContact CZ3-CB 3.96Å; W68-L126 WeakPolarHBondContact CA-O 3.49Å; W68-K127 HydrophobicContact CD2-CB 4.3Å; W68-K127 HydrophobicContact CD2-CG 4.22Å; W68-K127 HydrophobicContact CE3-CB 3.85Å; W68-K127 HydrophobicContact CE3-CG 4.27Å; W68-K127 HydrophobicContact CH2-CB 3.87Å; W68-K127 HydrophobicContact CH2-CD 3.78Å; W68-K127 HydrophobicContact CH2-CG 4.04Å; W68-K127 HydrophobicContact CZ2-CB 4.28Å; W68-K127 HydrophobicContact CZ2-CD 3.62Å; W68-K127 HydrophobicContact CZ2-CG 3.95Å; W68-K127 HydrophobicContact CZ3-CB 3.62Å; W68-K127 HydrophobicContact CZ3-CD 4.41Å; W68-K127 HydrophobicContact CZ3-CG 4.19Å; W68-Q265 WeakPolarHBondContact CZ2-O 3.4Å; W68-L266 HydrophobicContact CB-CD2 3.34Å; W68-L266 HydrophobicContact CD2-CD2 3.96Å; W68-L266 HydrophobicContact CG-CD2 3.36Å; W68-L266 PolarHBondContact NE1-O 2.98Å
69	V	98.8	Very high	97.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.3	172.7	169.1	0	0	0	0	108.8	I45 T62 L63 V84 L125 L126 L128	I45-V69 HydrophobicContact CD1-CG1 3.95Å; I45-V69 HydrophobicContact CG1-CG1 3.65Å; I45-V69 HydrophobicContact CG1-CG2 4.37Å; I45-V69 HydrophobicContact CG2-CG2 4.41Å; T62-V69 CarbonylContact O-C 3.57Å; T62-V69 VanDerWaalsContact O-CA 3.23Å; T62-V69 WeakPolarHBondContact O-CA 3.24Å; L63-V69 HydrophobicContact CD1-CG2 3.9Å; V69-V84 HydrophobicContact CG2-CG1 4.12Å; V69-V84 HydrophobicContact CG2-CG2 4.45Å; V69-L125 CarbonylContact O-C 3.47Å; V69-L125 WeakPolarHBondContact O-CA 3.37Å; V69-L126 HydrophobicContact CB-CB 4.16Å; V69-L126 HydrophobicContact CB-CD1 4.34Å; V69-L126 HydrophobicContact CB-CG 4.45Å; V69-L126 HydrophobicContact CG1-CD1 3.99Å; V69-L126 HydrophobicContact CG1-CG 4.45Å; V69-L126 PolarHBondContact N-O 3.03Å; V69-L126 PolarHBondContact O-N 2.9Å; V69-L128 HydrophobicContact CG2-CD1 4.3Å; V69-L128 HydrophobicContact CG2-CD2 4.12Å; V69-L128 HydrophobicContact CG2-CG 4.41Å
70	L	98.9	Very high	97.4	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.8	169.2	179.3	61.7	0	0	0	109.2	G61 T62 V64 L123 L125 L143 V234 T255 L262	G61-L70 CarbonylContact C-O 3.51Å; G61-L70 WeakPolarHBondContact CA-O 3.41Å; T62-L70 PolarHBondContact N-O 2.91Å; T62-L70 PolarHBondContact O-N 2.95Å; V64-L70 HydrophobicContact CG1-CB 3.81Å; V64-L70 HydrophobicContact CG1-CD2 4.25Å; V64-L70 HydrophobicContact CG2-CB 4.08Å; L70-L123 HydrophobicContact CD1-CB 4.35Å; L70-L123 HydrophobicContact CD1-CD1 4.4Å; L70-L125 HydrophobicContact CB-CD2 4.25Å; L70-L125 HydrophobicContact CD1-CD2 4.14Å; L70-L143 HydrophobicContact CD2-CD2 4.2Å; L70-V234 HydrophobicContact CD1-CG2 4.2Å; L70-V234 HydrophobicContact CD2-CG2 3.63Å; L70-V234 HydrophobicContact CG-CG2 3.69Å; L70-T255 HydrophobicContact CD2-CG2 3.91Å; L70-L262 HydrophobicContact CD1-CD2 3.95Å
71	T	98.9	Very high	97.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	-176.8	174.7	-169.9	0	0	0	0	109.6	L47 G60 I76 L123 A124 L126	L47-T71 HydrophobicContact CD2-CG2 4.45Å; G60-T71 PolarHBondContact O-OG1 3Å; T71-I76 HydrophobicContact CG2-CD1 4.48Å; T71-L123 CarbonylContact O-C 3.58Å; T71-L123 WeakPolarHBondContact O-CA 3.02Å; T71-A124 HydrophobicContact CG2-CB 4.24Å; T71-A124 PolarHBondContact N-O 3.14Å; T71-A124 PolarHBondContact O-N 3.02Å; T71-L126 HydrophobicContact CG2-CD1 3.89Å; T71-L126 HydrophobicContact CG2-CD2 4.16Å; T71-L126 HydrophobicContact CG2-CG 4.03Å
72	A	98.7	Very high	97.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.			trans	-79.5	152.2	176.6	0	0	0	0	0	111.5	H74 C75 V234	A72-H74 WeakPolarHBondContact CB-ND1 3.42Å; A72-C75 WeakPolarHBondContact O-CB 3.3Å; A72-C75 PolarHBondContact O-N 3.3Å; A72-V234 HydrophobicContact CB-CG1 4.07Å
73	G	98.4	Very high	97.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-66.6	-40.5	174.9	0	0	0	0	0	111.8	C75 I76 D122	G73-C75 PolarHBondContact O-N 3.13Å; G73-C75 VanDerWaalsContact O-N 3.11Å; G73-I76 PolarHBondContact O-N 2.9Å; G73-D122 WeakPolarHBondContact CA-OD1 3.44Å; G73-D122 PolarHBondContact N-OD1 2.85Å
74	H	97.4	Very high	97.3	Very high	38 Å²	38	39.4 Å²	39.4	18%	0.176	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.5	-13.1	179.2	76	-102	0	0	0	114.5	A72 I76 W77 W112 D122 S216 S236	A72-H74 WeakPolarHBondContact CB-ND1 3.42Å; H74-I76 PolarHBondContact O-N 2.96Å; H74-W77 PolarHBondContact O-NE1 3.13Å; H74-W112 HydrophobicContact CB-CH2 4.05Å; H74-W112 HydrophobicContact CB-CZ2 3.46Å; H74-W112 VanDerWaalsContact CB-CZ2 3.46Å; H74-D122 IonicContact CE1-OD2 2.71Å; H74-D122 PolarHBondContact CE1-OD2 3.09Å; H74-D122 IonicContact CG-OD1 3.56Å; H74-D122 IonicContact CG-OD2 2.78Å; H74-D122 PolarHBondContact N-OD1 2.72Å; H74-D122 IonicContact ND1-OD1 3.55Å; H74-D122 PolarHBondContact ND1-OD1 3Å; H74-D122 IonicContact ND1-OD2 3.82Å; H74-D122 PolarHBondContact ND1-OD2 2.92Å; H74-S216 WeakPolarHBondContact NE2-CB 3.42Å; H74-S216 PolarHBondContact NE2-OG 2.75Å; H74-S236 PolarHBondContact CE1-O 3Å
75	C	97.9	Very high	97.4	Very high	4 Å²	4	38.9 Å²	38.9	3%	0.027	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-75.8	-12.2	174	-70.1	0	0	0	0	113.1	L47 C59 A72 G73 Y82	L47-C75 HydrophobicContact CD2-CB 4.09Å; C59-C75 HydrophobicContact CB-CB 3.76Å; C59-C75 WeakPolarHBondContact CB-SG 3.42Å; C59-C75 WeakPolarHBondContact SG-CB 3.48Å; C59-C75 CovalentContact SG-SG 2.04Å; C59-C75 PolarHBondContact SG-SG 3.25Å; A72-C75 WeakPolarHBondContact O-CB 3.3Å; A72-C75 PolarHBondContact O-N 3.3Å; G73-C75 PolarHBondContact O-N 3.13Å; G73-C75 VanDerWaalsContact O-N 3.11Å; C75-Y82 PolarHBondContact O-OH 2.93Å
76	I	97.9	Very high	97.5	Very high	21 Å²	21	38 Å²	38	11%	0.108	21%	0.211	C	C	.	.			trans	-109.2	119.7	-173.9	-53.2	-54.9	0	0	0	110.2	L47 T71 G73 H74 Y82 I106 V108 A124 L126	L47-I76 HydrophobicContact CD2-CD1 4.06Å; T71-I76 HydrophobicContact CG2-CD1 4.48Å; G73-I76 PolarHBondContact O-N 2.9Å; H74-I76 PolarHBondContact O-N 2.96Å; I76-Y82 HydrophobicContact CD1-CE2 4.33Å; I76-Y82 HydrophobicContact CG2-CE2 4.37Å; I76-I106 HydrophobicContact CD1-CG2 4.33Å; I76-I106 HydrophobicContact CG1-CG2 4.09Å; I76-I106 HydrophobicContact CG2-CD1 4.28Å; I76-I106 HydrophobicContact CG2-CG2 3.74Å; I76-V108 HydrophobicContact CB-CG2 4.02Å; I76-V108 HydrophobicContact CG1-CG2 4.27Å; I76-V108 HydrophobicContact CG2-CG2 3.94Å; I76-A124 HydrophobicContact CG1-CB 4.09Å; I76-L126 HydrophobicContact CD1-CD2 3.8Å; I76-L126 HydrophobicContact CG1-CD2 4.49Å
77	W	96.2	Very high	97.7	Very high	141 Å²	141	34.7 Å²	34.7	53%	0.534	19%	0.19	S	C	.	.			trans	-115.5	135.9	177.4	-69.3	85.8	0	0	0	111.3	H74 G79 D80 Y82 I114	H74-W77 PolarHBondContact O-NE1 3.13Å; W77-G79 PolarHBondContact O-N 2.96Å; W77-D80 PolarHBondContact O-N 3.48Å; W77-Y82 PolarHBondContact N-OH 3.06Å; W77-I114 HydrophobicContact CD2-CD1 4.26Å; W77-I114 HydrophobicContact CE3-CD1 4.16Å; W77-I114 HydrophobicContact CH2-CD1 3.37Å; W77-I114 HydrophobicContact CH2-CG1 4.28Å; W77-I114 HydrophobicContact CZ2-CD1 3.47Å; W77-I114 VanDerWaalsContact CZ2-CD1 3.47Å; W77-I114 HydrophobicContact CZ2-CG1 4.47Å; W77-I114 HydrophobicContact CZ3-CD1 3.73Å
78	P	92.9	Very high	97.8	Very high	127 Å²	127	31.9 Å²	31.9	83%	0.825	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	128.4	176.2	-24.5	34.2	0	0	0	112.3
79	G	93.8	Very high	97.8	Very high	79 Å²	79	31.9 Å²	31.9	81%	0.814	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.6	-12.9	177	0	0	0	0	0	114.9	W77	W77-G79 PolarHBondContact O-N 2.96Å
80	D	96.9	Very high	97.7	Very high	67 Å²	67	33 Å²	33	36%	0.358	19%	0.187	S	C	.	.			trans	-71.6	149.7	174.2	-81.1	-1.3	0	0	0	112	V49 W77 Y82	V49-D80 HydrophobicContact CG2-CB 3.96Å; V49-D80 WeakPolarHBondContact CG2-OD2 3.44Å; W77-D80 PolarHBondContact O-N 3.48Å; D80-Y82 HydrophobicContact CB-CD2 4.19Å; D80-Y82 HydrophobicContact CB-CE1 4.07Å; D80-Y82 HydrophobicContact CB-CE2 3.44Å; D80-Y82 VanDerWaalsContact CB-CE2 3.44Å; D80-Y82 VanDerWaalsContact CB-OH 3.24Å; D80-Y82 WeakPolarHBondContact CB-OH 3.49Å; D80-Y82 PolarHBondContact OD2-OH 3.39Å
81	V	97.9	Very high	97.5	Very high	76 Å²	76	35.5 Å²	35.5	46%	0.461	20%	0.2	S	C	.	.			trans	-106.7	122.3	172.2	-179.3	0	0	0	0	108.5	Q50 F55	Q50-V81 HydrophobicContact CB-CB 4.02Å; Q50-V81 HydrophobicContact CB-CG1 4.48Å; Q50-V81 PolarHBondContact N-O 2.74Å; F55-V81 HydrophobicContact CE1-CG1 4.44Å; F55-V81 HydrophobicContact CZ-CG1 4.32Å
82	Y	98.5	Very high	97.4	Very high	13 Å²	13	39 Å²	39	5%	0.051	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	153.2	-175.5	-63.3	-74.4	0	0	0	112.3	L47 Q48 V49 T58 C75 I76 W77 D80 I103 I106	L47-Y82 HydrophobicContact CD1-CD1 4.11Å; L47-Y82 HydrophobicContact CD1-CG 4.29Å; L47-Y82 HydrophobicContact CD2-CD1 4.42Å; L47-Y82 HydrophobicContact CG-CD1 4.19Å; Q48-Y82 CarbonylContact O-C 3.49Å; Q48-Y82 VanDerWaalsContact O-CA 3.24Å; Q48-Y82 WeakPolarHBondContact O-CA 3.42Å; V49-Y82 HydrophobicContact CB-CD1 3.92Å; V49-Y82 HydrophobicContact CB-CE1 3.77Å; V49-Y82 HydrophobicContact CG2-CD1 4.13Å; V49-Y82 HydrophobicContact CG2-CE1 3.76Å; T58-Y82 HydrophobicContact CG2-CE1 4.42Å; C75-Y82 PolarHBondContact O-OH 2.93Å; I76-Y82 HydrophobicContact CD1-CE2 4.33Å; I76-Y82 HydrophobicContact CG2-CE2 4.37Å; W77-Y82 PolarHBondContact N-OH 3.06Å; D80-Y82 HydrophobicContact CB-CD2 4.19Å; D80-Y82 HydrophobicContact CB-CE1 4.07Å; D80-Y82 HydrophobicContact CB-CE2 3.44Å; D80-Y82 VanDerWaalsContact CB-CE2 3.44Å; D80-Y82 VanDerWaalsContact CB-OH 3.24Å; D80-Y82 WeakPolarHBondContact CB-OH 3.49Å; D80-Y82 PolarHBondContact OD2-OH 3.39Å; Y82-I103 VanDerWaalsContact CB-CD1 3.46Å; Y82-I103 HydrophobicContact CG-CD1 4.45Å; Y82-I106 HydrophobicContact CD2-CD1 3.91Å; Y82-I106 HydrophobicContact CE2-CD1 4.41Å
83	R	98.6	Very high	97.3	Very high	57 Å²	57	44 Å²	44	22%	0.215	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	159.3	164.5	72.9	-175.5	-170.5	175.4	2	110.6	Q48 F55 I100	Q48-R83 HydrophobicContact CB-CG 3.98Å; Q48-R83 PolarHBondContact N-O 2.9Å; Q48-R83 PolarHBondContact O-N 2.84Å; F55-R83 HydrophobicContact CD1-CB 4.33Å; F55-R83 HydrophobicContact CD1-CG 3.57Å; F55-R83 HydrophobicContact CE1-CB 4.06Å; F55-R83 HydrophobicContact CE1-CG 3.81Å; F55-R83 HydrophobicContact CG-CG 4.08Å; R83-I100 HydrophobicContact CB-CG2 4.45Å; R83-I100 HydrophobicContact CG-CG2 4.38Å
84	V	98.8	Very high	97.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.3	175.6	173.7	0	0	0	0	109.2	I45 L47 V69 L86 I100 R101 I103 L126 L128	I45-V84 HydrophobicContact CB-CG1 3.75Å; I45-V84 HydrophobicContact CD1-CG1 4.25Å; I45-V84 HydrophobicContact CG1-CG1 4.04Å; I45-V84 HydrophobicContact CG2-CG1 3.92Å; L47-V84 HydrophobicContact CD1-CG2 4.25Å; V69-V84 HydrophobicContact CG2-CG1 4.12Å; V69-V84 HydrophobicContact CG2-CG2 4.45Å; V84-L86 HydrophobicContact CG1-CD1 3.75Å; V84-L86 HydrophobicContact CG1-CG 3.95Å; V84-I100 CarbonylContact O-C 3.55Å; V84-I100 WeakPolarHBondContact O-CA 3.38Å; V84-R101 PolarHBondContact N-O 3.32Å; V84-R101 PolarHBondContact O-N 2.04Å; V84-I103 HydrophobicContact CG2-CD1 4.32Å; V84-I103 HydrophobicContact CG2-CG1 4.36Å; V84-L126 HydrophobicContact CG2-CD1 4.18Å; V84-L128 HydrophobicContact CB-CD2 3.91Å; V84-L128 HydrophobicContact CG1-CD2 4.3Å; V84-L128 HydrophobicContact CG2-CD2 3.78Å
85	V	98.8	Very high	97	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.4	169.4	-169.1	0	0	0	0	108.7	I45 S46 Q48 E88 E98 I100	I45-V85 WeakPolarHBondContact CA-O 3.4Å; S46-V85 PolarHBondContact N-O 2.85Å; S46-V85 PolarHBondContact O-N 3.47Å; Q48-V85 HydrophobicContact CG-CG2 4.19Å; V85-E88 HydrophobicContact CG1-CB 4.09Å; V85-E98 HydrophobicContact CG1-CB 4.07Å; V85-E98 HydrophobicContact CG1-CG 4.41Å; V85-I100 HydrophobicContact CG1-CG1 4.44Å; V85-I100 HydrophobicContact CG2-CG1 4.25Å
86	L	98.8	Very high	97	Very high	0 Å²	0	57 Å²	57	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	155	176.9	-53.6	100.5	0	0	0	110.4	I45 L63 V84 E88 E98 Q99 R101 L128 P132 V138	I45-L86 HydrophobicContact CG2-CB 4.45Å; I45-L86 HydrophobicContact CG2-CD2 3.68Å; I45-L86 HydrophobicContact CG2-CG 3.68Å; L63-L86 HydrophobicContact CB-CD2 4.17Å; L63-L86 HydrophobicContact CD1-CD2 4.02Å; L63-L86 HydrophobicContact CD2-CD2 3.7Å; L63-L86 HydrophobicContact CG-CD2 4.18Å; V84-L86 HydrophobicContact CG1-CD1 3.75Å; V84-L86 HydrophobicContact CG1-CG 3.95Å; L86-E88 PolarHBondContact O-N 3.23Å; L86-E98 CarbonylContact O-C 3.56Å; L86-E98 VanDerWaalsContact O-CA 3.29Å; L86-E98 WeakPolarHBondContact O-CA 3.23Å; L86-Q99 HydrophobicContact CB-CB 4.46Å; L86-Q99 WeakPolarHBondContact CD1-O 3.27Å; L86-Q99 PolarHBondContact N-O 3.42Å; L86-Q99 PolarHBondContact O-N 2.88Å; L86-R101 HydrophobicContact CD1-CG 4.08Å; L86-L128 HydrophobicContact CD1-CD1 4.46Å; L86-P132 HydrophobicContact CD1-CB 4.24Å; L86-P132 HydrophobicContact CD2-CB 4.33Å; L86-P132 HydrophobicContact CD2-CG 3.96Å; L86-V138 HydrophobicContact CB-CG1 4.11Å; L86-V138 HydrophobicContact CB-CG2 3.92Å; L86-V138 HydrophobicContact CD2-CG1 3.86Å
87	G	98.3	Very high	97	Very high	3 Å²	3	57.8 Å²	57.8	3%	0.031	33%	0.334	C	S	.	.	S	Bend	trans	71.7	10.7	178.4	0	0	0	0	0	114.3	H39 T97 S137	H39-G87 PolarHBondContact CE1-O 3.43Å; H39-G87 PolarHBondContact ND1-O 2.97Å; G87-T97 WeakPolarHBondContact O-CB 3.29Å; G87-T97 PolarHBondContact O-OG1 3.44Å; G87-S137 WeakPolarHBondContact CA-O 3.36Å
88	E	98.4	Very high	97.1	Very high	24 Å²	24	52.9 Å²	52.9	11%	0.112	32%	0.317	C	S	.	.			trans	-74.2	142.8	173.5	-179.8	61.3	-93.6	0	0	110.8	V85 L86 D90 M91 E98 W161	V85-E88 HydrophobicContact CG1-CB 4.09Å; L86-E88 PolarHBondContact O-N 3.23Å; E88-D90 VanDerWaalsContact OE1-C 3.24Å; E88-D90 PolarHBondContact OE1-N 3.22Å; E88-M91 HydrophobicContact CG-CG 4.13Å; E88-E98 HydrophobicContact CB-CG 4.46Å; E88-W161 HydrophobicContact CB-CH2 4.13Å; E88-W161 HydrophobicContact CB-CZ2 4.15Å; E88-W161 HydrophobicContact CG-CH2 4.07Å; E88-W161 HydrophobicContact CG-CZ2 3.72Å
89	H	98.3	Very high	97.3	Very high	15 Å²	15	47.7 Å²	47.7	7%	0.069	28%	0.282	C	S	.	.	S	Bend	trans	-135.5	-47.5	171.6	177.9	58.9	0	0	0	112.1	A36 P38 E95 W161 I173 L174	A36-H89 PolarHBondContact O-CE1 3.01Å; P38-H89 WeakPolarHBondContact CG-NE2 3.29Å; H89-E95 WeakPolarHBondContact CA-OE2 3.09Å; H89-E95 VanDerWaalsContact CB-OE2 3.26Å; H89-E95 WeakPolarHBondContact CB-OE2 3.45Å; H89-E95 IonicContact CD2-OE1 2.78Å; H89-E95 PolarHBondContact N-OE2 2.73Å; H89-W161 PolarHBondContact O-NE1 3.5Å; H89-I173 CarbonylContact O-C 3.55Å; H89-I173 WeakPolarHBondContact O-CA 3.07Å; H89-L174 PolarHBondContact O-N 2.83Å
90	D	98	Very high	97.6	Very high	23 Å²	23	47.9 Å²	47.9	12%	0.123	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-117.1	101.7	176.7	-173.6	-22.5	0	0	0	111.3	E88 S92 L93 E95 D172 I173	E88-D90 VanDerWaalsContact OE1-C 3.24Å; E88-D90 PolarHBondContact OE1-N 3.22Å; D90-S92 PolarHBondContact O-N 3.02Å; D90-S92 WeakPolarHBondContact OD1-CB 3.49Å; D90-S92 PolarHBondContact OD1-N 2.78Å; D90-S92 PolarHBondContact OD1-OG 3.04Å; D90-L93 HydrophobicContact CB-CB 4.4Å; D90-L93 HydrophobicContact CB-CD1 4.26Å; D90-L93 HydrophobicContact CB-CG 4.38Å; D90-L93 PolarHBondContact O-N 3.48Å; D90-L93 WeakPolarHBondContact OD2-CD1 3.44Å; D90-E95 PolarHBondContact N-OE2 3.45Å; D90-E95 VanDerWaalsContact N-OE2 3.12Å; D90-D172 WeakPolarHBondContact CA-O 3.5Å; D90-D172 WeakPolarHBondContact OD1-CB 3.44Å; D90-I173 HydrophobicContact CB-CG1 4.38Å
91	M	95.4	Very high	97.7	Very high	55 Å²	55	46.9 Å²	46.9	27%	0.271	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.7	-177	-69.3	-170	176.9	0	0	114.5	H57 E88 L93 W161 D172	H57-M91 HydrophobicContact CB-CE 3.89Å; H57-M91 HydrophobicContact CB-SD 3.97Å; H57-M91 WeakPolarHBondContact ND1-CE 3.36Å; E88-M91 HydrophobicContact CG-CG 4.13Å; M91-L93 VanDerWaalsContact C-N 3.35Å; M91-W161 HydrophobicContact CE-CB 3.78Å; M91-W161 HydrophobicContact CE-CD2 3.25Å; M91-W161 HydrophobicContact CE-CE3 3.49Å; M91-W161 VanDerWaalsContact CE-CE3 3.49Å; M91-W161 HydrophobicContact CE-CG 3.39Å; M91-W161 HydrophobicContact CE-CZ2 4.33Å; M91-W161 HydrophobicContact CE-CZ3 4.13Å; M91-W161 HydrophobicContact CG-CG 4.45Å; M91-W161 HydrophobicContact SD-CB 4.23Å; M91-W161 HydrophobicContact SD-CD2 4.39Å; M91-W161 HydrophobicContact SD-CG 4.01Å; M91-D172 PolarHBondContact N-O 2.77Å
92	S	95.6	Very high	97.7	Very high	73 Å²	73	47.9 Å²	47.9	51%	0.51	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.5	176.2	77.5	0	0	0	0	113.1	D90	D90-S92 PolarHBondContact O-N 3.02Å; D90-S92 WeakPolarHBondContact OD1-CB 3.49Å; D90-S92 PolarHBondContact OD1-N 2.78Å; D90-S92 PolarHBondContact OD1-OG 3.04Å
93	L	96.1	Very high	97.7	Very high	104 Å²	104	48.9 Å²	48.9	55%	0.545	26%	0.263	S	S	.	.	S	Bend	trans	-119.2	167.8	-174.7	-58.8	-179.3	0	0	0	111.5	D90 M91 E95	D90-L93 HydrophobicContact CB-CB 4.4Å; D90-L93 HydrophobicContact CB-CD1 4.26Å; D90-L93 HydrophobicContact CB-CG 4.38Å; D90-L93 PolarHBondContact O-N 3.48Å; D90-L93 WeakPolarHBondContact OD2-CD1 3.44Å; M91-L93 VanDerWaalsContact C-N 3.35Å; L93-E95 HydrophobicContact CB-CG 4.31Å
94	Q	94.4	Very high	97.6	Very high	181 Å²	181	51.4 Å²	51.4	85%	0.846	28%	0.28	S	S	*	.			trans	-116.2	98.1	164	-176.9	172.4	1.9	0	0	106.8	G96	Q94-G96 VanDerWaalsContact C-N 3.35Å
95	E	95.6	Very high	97.6	Very high	70 Å²	70	56.9 Å²	56.9	33%	0.327	30%	0.301	S	S	.	.			trans	-79.4	-21.5	-172.6	-55.3	178.8	98.7	0	0	111.7	H89 D90 L93 T97 E98	H89-E95 WeakPolarHBondContact CA-OE2 3.09Å; H89-E95 VanDerWaalsContact CB-OE2 3.26Å; H89-E95 WeakPolarHBondContact CB-OE2 3.45Å; H89-E95 IonicContact CD2-OE1 2.78Å; H89-E95 PolarHBondContact N-OE2 2.73Å; D90-E95 PolarHBondContact N-OE2 3.45Å; D90-E95 VanDerWaalsContact N-OE2 3.12Å; L93-E95 HydrophobicContact CB-CG 4.31Å; E95-T97 VanDerWaalsContact C-N 3.33Å; E95-E98 WeakPolarHBondContact CA-OE1 3.33Å; E95-E98 VanDerWaalsContact CB-OE1 3.23Å; E95-E98 WeakPolarHBondContact CB-OE1 3.41Å; E95-E98 WeakPolarHBondContact CG-OE1 3.07Å; E95-E98 PolarHBondContact N-OE1 3.04Å; E95-E98 PolarHBondContact N-OE2 2.74Å
96	G	97.1	Very high	97.6	Very high	66 Å²	66	59.9 Å²	59.9	68%	0.68	32%	0.316	S	S	*	.	S	Bend	trans	89.2	-1.8	-179.6	0	0	0	0	0	113.7	Q94 E98	Q94-G96 VanDerWaalsContact C-N 3.35Å; G96-E98 WeakPolarHBondContact CA-OE2 3.28Å; G96-E98 PolarHBondContact N-OE2 3.21Å
97	T	98	Very high	97.5	Very high	36 Å²	36	60.7 Å²	60.7	22%	0.221	32%	0.321	C	S	.	.			trans	-88.2	-15.5	172.2	48.8	0	0	0	0	112.8	H39 G87 E95	H39-T97 PolarHBondContact CE1-OG1 3.13Å; H39-T97 VanDerWaalsContact CE1-OG1 3.29Å; G87-T97 WeakPolarHBondContact O-CB 3.29Å; G87-T97 PolarHBondContact O-OG1 3.44Å; E95-T97 VanDerWaalsContact C-N 3.33Å
98	E	98.5	Very high	97.5	Very high	38 Å²	38	63 Å²	63	18%	0.178	33%	0.334	C	S	.	.			trans	-69.1	132.8	-171.7	-54.2	81.4	178.1	0	0	111.6	V85 L86 E88 E95 G96	V85-E98 HydrophobicContact CG1-CB 4.07Å; V85-E98 HydrophobicContact CG1-CG 4.41Å; L86-E98 CarbonylContact O-C 3.56Å; L86-E98 VanDerWaalsContact O-CA 3.29Å; L86-E98 WeakPolarHBondContact O-CA 3.23Å; E88-E98 HydrophobicContact CB-CG 4.46Å; E95-E98 WeakPolarHBondContact CA-OE1 3.33Å; E95-E98 VanDerWaalsContact CB-OE1 3.23Å; E95-E98 WeakPolarHBondContact CB-OE1 3.41Å; E95-E98 WeakPolarHBondContact CG-OE1 3.07Å; E95-E98 PolarHBondContact N-OE1 3.04Å; E95-E98 PolarHBondContact N-OE2 2.74Å; G96-E98 WeakPolarHBondContact CA-OE2 3.28Å; G96-E98 PolarHBondContact N-OE2 3.21Å
99	Q	98.6	Very high	97.5	Very high	19 Å²	19	62.7 Å²	62.7	9%	0.089	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	112.3	174.3	-62.9	-171.8	55.4	0	0	109.3	L86 I133	L86-Q99 HydrophobicContact CB-CB 4.46Å; L86-Q99 WeakPolarHBondContact CD1-O 3.27Å; L86-Q99 PolarHBondContact N-O 3.42Å; L86-Q99 PolarHBondContact O-N 2.88Å; Q99-I133 PolarHBondContact NE2-O 3.26Å
100	I	98.6	Very high	97.5	Very high	82 Å²	82	67.1 Å²	67.1	42%	0.421	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.3	177.4	-56.7	175.1	0	0	0	109.2	R83 V84 V85	R83-I100 HydrophobicContact CB-CG2 4.45Å; R83-I100 HydrophobicContact CG-CG2 4.38Å; V84-I100 CarbonylContact O-C 3.55Å; V84-I100 WeakPolarHBondContact O-CA 3.38Å; V85-I100 HydrophobicContact CG1-CG1 4.44Å; V85-I100 HydrophobicContact CG2-CG1 4.25Å
101	R	98.6	Very high	97.5	Very high	46 Å²	46	72.1 Å²	72.1	17%	0.174	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	137.1	175.8	-65.7	-63.7	178.3	-83.3	-3.2	111.1	V84 L86 L128 S131	V84-R101 PolarHBondContact N-O 3.32Å; V84-R101 PolarHBondContact O-N 2.04Å; L86-R101 HydrophobicContact CD1-CG 4.08Å; R101-L128 HydrophobicContact CB-CB 4.29Å; R101-L128 HydrophobicContact CB-CD1 4.25Å; R101-L128 HydrophobicContact CB-CD2 4.13Å; R101-L128 HydrophobicContact CB-CG 4.45Å; R101-L128 HydrophobicContact CG-CD1 4.29Å; R101-S131 PolarHBondContact NE-O 2.99Å
102	D	98.4	Very high	97.6	Very high	97 Å²	97	71.1 Å²	71.1	52%	0.519	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	158.4	172.9	-65.8	-32.5	0	0	0	109.6	D129	D102-D129 HydrophobicContact CB-CB 4.26Å; D102-D129 PolarHBondContact N-OD1 2.85Å; D102-D129 PolarHBondContact O-N 2.82Å
103	I	98.4	Very high	97.7	Very high	34 Å²	34	70.4 Å²	70.4	17%	0.174	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.1	179	-52.5	-172.4	0	0	0	109.5	L47 Y82 V84 R105 I106 L126	L47-I103 HydrophobicContact CD1-CD1 4.03Å; Y82-I103 VanDerWaalsContact CB-CD1 3.46Å; Y82-I103 HydrophobicContact CG-CD1 4.45Å; V84-I103 HydrophobicContact CG2-CD1 4.32Å; V84-I103 HydrophobicContact CG2-CG1 4.36Å; I103-R105 WeakPolarHBondContact CG2-O 3.36Å; I103-I106 HydrophobicContact CG2-CD1 4.34Å; I103-I106 HydrophobicContact CG2-CG1 3.58Å; I103-L126 HydrophobicContact CD1-CB 4.23Å; I103-L126 HydrophobicContact CD1-CD1 3.92Å; I103-L126 HydrophobicContact CD1-CD2 4.33Å; I103-L126 HydrophobicContact CD1-CG 4.38Å; I103-L126 HydrophobicContact CG2-CB 4.22Å
104	L	97.8	Very high	97.6	Very high	110 Å²	110	68.3 Å²	68.3	58%	0.576	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	-38.8	175.5	177.9	62.7	0	0	0	112.1	K127	L104-K127 WeakPolarHBondContact CB-O 2.97Å; L104-K127 HydrophobicContact CD2-CD 4.43Å; L104-K127 PolarHBondContact N-O 2.84Å
105	R	97.5	Very high	97.6	Very high	116 Å²	116	66.2 Å²	66.2	44%	0.438	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	137.5	-177.8	-176	178.7	175.8	-169.2	-7.1	110.2	I103 V107 K127	I103-R105 WeakPolarHBondContact CG2-O 3.36Å; R105-V107 HydrophobicContact CG-CG2 4Å; R105-K127 HydrophobicContact CB-CB 3.95Å; R105-K127 PolarHBondContact N-O 2.78Å; R105-K127 PolarHBondContact O-N 3.44Å
106	I	98.3	Very high	97.5	Very high	65 Å²	65	67.7 Å²	67.7	33%	0.333	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.5	170.2	-58.2	171.2	0	0	0	107.9	I76 Y82 I103 V108 L126	I76-I106 HydrophobicContact CD1-CG2 4.33Å; I76-I106 HydrophobicContact CG1-CG2 4.09Å; I76-I106 HydrophobicContact CG2-CD1 4.28Å; I76-I106 HydrophobicContact CG2-CG2 3.74Å; Y82-I106 HydrophobicContact CD2-CD1 3.91Å; Y82-I106 HydrophobicContact CE2-CD1 4.41Å; I103-I106 HydrophobicContact CG2-CD1 4.34Å; I103-I106 HydrophobicContact CG2-CG1 3.58Å; I106-V108 HydrophobicContact CG2-CG2 4.08Å; I106-L126 HydrophobicContact CB-CD2 4.37Å; I106-L126 HydrophobicContact CG1-CD2 4Å; I106-L126 HydrophobicContact CG2-CD2 3.85Å
107	V	98.3	Very high	97.4	Very high	18 Å²	18	67 Å²	67	11%	0.109	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	95.1	176.6	-170.2	0	0	0	0	107.9	R105 A124 L125 W261 Q265	R105-V107 HydrophobicContact CG-CG2 4Å; V107-A124 CarbonylContact O-C 3.46Å; V107-A124 VanDerWaalsContact O-CA 3.3Å; V107-A124 WeakPolarHBondContact O-CA 3.33Å; V107-L125 HydrophobicContact CB-CB 4.43Å; V107-L125 PolarHBondContact N-O 2.03Å; V107-L125 PolarHBondContact O-N 3.33Å; V107-W261 HydrophobicContact CG1-CZ2 4.01Å; V107-Q265 HydrophobicContact CG1-CG 4.22Å
108	V	98.5	Very high	97.2	Very high	50 Å²	50	67.1 Å²	67.1	30%	0.303	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	142.1	170.9	-176.3	0	0	0	0	108.5	I76 I106 W112 A124	I76-V108 HydrophobicContact CB-CG2 4.02Å; I76-V108 HydrophobicContact CG1-CG2 4.27Å; I76-V108 HydrophobicContact CG2-CG2 3.94Å; I106-V108 HydrophobicContact CG2-CG2 4.08Å; V108-W112 HydrophobicContact CG1-CB 3.85Å; V108-W112 VanDerWaalsContact CG1-CD1 3.46Å; V108-W112 HydrophobicContact CG1-CG 3.93Å; V108-A124 HydrophobicContact CB-CB 4.45Å; V108-A124 HydrophobicContact CG2-CB 4.11Å
109	H	98.4	Very high	97.1	Very high	19 Å²	19	69.7 Å²	69.7	9%	0.088	36%	0.361	C	S	.	.			trans	-55.9	132.5	177.1	-168.4	-87	0	0	0	110.1	E111 W112 L123 F258 W261	H109-E111 PolarHBondContact ND1-N 2.82Å; H109-E111 PolarHBondContact O-N 2.81Å; H109-E111 VanDerWaalsContact O-N 3.14Å; H109-W112 HydrophobicContact CB-CB 4.41Å; H109-W112 VanDerWaalsContact O-CB 3.25Å; H109-W112 WeakPolarHBondContact O-CB 3.36Å; H109-W112 PolarHBondContact O-N 2.75Å; H109-L123 HydrophobicContact CB-CD2 3.63Å; H109-L123 HydrophobicContact CB-CG 4.12Å; H109-L123 WeakPolarHBondContact CB-O 3.25Å; H109-L123 PolarHBondContact N-O 3.02Å; H109-F258 AromaticContact CD2-CD1 3.83Å; H109-F258 AromaticContact NE2-CD1 3.61Å; H109-F258 AromaticContact NE2-CE1 3.73Å; H109-W261 HydrophobicContact CB-CZ2 4.19Å; H109-W261 AromaticContact CD2-CD1 3.85Å; H109-W261 AromaticContact CD2-CD2 3.56Å; H109-W261 AromaticContact CD2-CE2 3.68Å; H109-W261 AromaticContact CD2-CG 3.68Å; H109-W261 AromaticContact CD2-NE1 3.84Å; H109-W261 AromaticContact NE2-CG 3.95Å
110	P	97.7	Very high	97	Very high	107 Å²	107	68.8 Å²	68.8	70%	0.695	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-22.1	-171.5	24.9	-35.4	0	0	0	113.9
111	E	98	Very high	97	Very high	129 Å²	129	65.9 Å²	65.9	60%	0.603	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	9.8	176.1	-55.9	-171.4	163.1	0	0	113.6	H109 N121	H109-E111 PolarHBondContact ND1-N 2.82Å; H109-E111 PolarHBondContact O-N 2.81Å; H109-E111 VanDerWaalsContact O-N 3.14Å; E111-N121 HydrophobicContact CB-CB 4.23Å; E111-N121 WeakPolarHBondContact CB-ND2 3.26Å; E111-N121 WeakPolarHBondContact O-CB 3.18Å; E111-N121 PolarHBondContact O-ND2 2.85Å; E111-N121 PolarHBondContact OE2-ND2 3.48Å
112	W	98	Very high	97	Very high	34 Å²	34	63.7 Å²	63.7	13%	0.129	33%	0.334	C	S	.	.			trans	-70	131	169.5	171.6	-119.6	0	0	0	109.8	H74 V108 H109 I114 V117 N121 D122	H74-W112 HydrophobicContact CB-CH2 4.05Å; H74-W112 HydrophobicContact CB-CZ2 3.46Å; H74-W112 VanDerWaalsContact CB-CZ2 3.46Å; V108-W112 HydrophobicContact CG1-CB 3.85Å; V108-W112 VanDerWaalsContact CG1-CD1 3.46Å; V108-W112 HydrophobicContact CG1-CG 3.93Å; H109-W112 HydrophobicContact CB-CB 4.41Å; H109-W112 VanDerWaalsContact O-CB 3.25Å; H109-W112 WeakPolarHBondContact O-CB 3.36Å; H109-W112 PolarHBondContact O-N 2.75Å; W112-I114 HydrophobicContact CZ2-CB 4.14Å; W112-I114 HydrophobicContact CZ2-CG1 4.17Å; W112-V117 HydrophobicContact CH2-CB 4.3Å; W112-V117 HydrophobicContact CH2-CG1 4.25Å; W112-V117 HydrophobicContact CH2-CG2 4.06Å; W112-N121 WeakPolarHBondContact CB-O 3.4Å; W112-D122 HydrophobicContact CD2-CB 4.42Å; W112-D122 VanDerWaalsContact CE3-CA 3.41Å; W112-D122 HydrophobicContact CE3-CB 3.61Å; W112-D122 HydrophobicContact CH2-CB 3.95Å; W112-D122 HydrophobicContact CZ3-CB 3.35Å
113	D	96.4	Very high	97	Very high	58 Å²	58	59.1 Å²	59.1	31%	0.31	31%	0.31	S	S	.	.			trans	-129.1	110.4	175.4	-174.9	-10.6	0	0	0	109.8	D115 H116	D113-D115 PolarHBondContact O-N 2.99Å; D113-D115 PolarHBondContact OD1-N 2.76Å; D113-H116 HydrophobicContact CB-CB 4.3Å; D113-H116 CarbonylContact O-C 3.29Å; D113-H116 VanDerWaalsContact O-C 3.29Å; D113-H116 PolarHBondContact O-N 2.89Å; D113-H116 IonicContact OD1-ND1 3.61Å; D113-H116 IonicContact OD2-CE1 3.72Å; D113-H116 IonicContact OD2-CG 3.47Å; D113-H116 IonicContact OD2-ND1 2.73Å; D113-H116 PolarHBondContact OD2-ND1 2.8Å
114	I	94	Very high	97	Very high	59 Å²	59	57.5 Å²	57.5	30%	0.303	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-27	-177.2	-161.7	161.7	0	0	0	113	W77 W112 H116	W77-I114 HydrophobicContact CD2-CD1 4.26Å; W77-I114 HydrophobicContact CE3-CD1 4.16Å; W77-I114 HydrophobicContact CH2-CD1 3.37Å; W77-I114 HydrophobicContact CH2-CG1 4.28Å; W77-I114 HydrophobicContact CZ2-CD1 3.47Å; W77-I114 VanDerWaalsContact CZ2-CD1 3.47Å; W77-I114 HydrophobicContact CZ2-CG1 4.47Å; W77-I114 HydrophobicContact CZ3-CD1 3.73Å; W112-I114 HydrophobicContact CZ2-CB 4.14Å; W112-I114 HydrophobicContact CZ2-CG1 4.17Å; I114-H116 VanDerWaalsContact C-N 3.28Å
115	D	94.3	Very high	97.1	Very high	137 Å²	137	52.2 Å²	52.2	73%	0.733	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.5	178.4	-65.3	-40	0	0	0	111.6	D113	D113-D115 PolarHBondContact O-N 2.99Å; D113-D115 PolarHBondContact OD1-N 2.76Å
116	H	94.8	Very high	97.1	Very high	101 Å²	101	46.7 Å²	46.7	47%	0.468	25%	0.253	S	S	.	.			trans	-135.8	59.4	-176.3	-57.3	99	0	0	0	112.7	D113 I114 A118 N119	D113-H116 HydrophobicContact CB-CB 4.3Å; D113-H116 CarbonylContact O-C 3.29Å; D113-H116 VanDerWaalsContact O-C 3.29Å; D113-H116 PolarHBondContact O-N 2.89Å; D113-H116 IonicContact OD1-ND1 3.61Å; D113-H116 IonicContact OD2-CE1 3.72Å; D113-H116 IonicContact OD2-CG 3.47Å; D113-H116 IonicContact OD2-ND1 2.73Å; D113-H116 PolarHBondContact OD2-ND1 2.8Å; I114-H116 VanDerWaalsContact C-N 3.28Å; H116-A118 PolarHBondContact O-N 2.95Å; H116-N119 HydrophobicContact CB-CB 4.39Å; H116-N119 VanDerWaalsContact CB-ND2 3.25Å; H116-N119 WeakPolarHBondContact CB-ND2 3.3Å; H116-N119 VanDerWaalsContact O-CB 3.29Å; H116-N119 WeakPolarHBondContact O-CB 3.25Å; H116-N119 PolarHBondContact O-N 2.92Å
117	V	94	Very high	97.1	Very high	53 Å²	53	44.4 Å²	44.4	32%	0.321	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-45.8	-39.7	179.4	-175.3	0	0	0	0	113.6	W112 N119 G120 F237	W112-V117 HydrophobicContact CH2-CB 4.3Å; W112-V117 HydrophobicContact CH2-CG1 4.25Å; W112-V117 HydrophobicContact CH2-CG2 4.06Å; V117-N119 PolarHBondContact O-N 2.73Å; V117-N119 VanDerWaalsContact O-N 3.15Å; V117-G120 PolarHBondContact O-N 2.89Å; V117-F237 HydrophobicContact CG1-CB 4.27Å; V117-F237 HydrophobicContact CG1-CD1 3.61Å; V117-F237 HydrophobicContact CG1-CE1 4.28Å; V117-F237 HydrophobicContact CG1-CG 4.19Å
118	A	94.3	Very high	97.2	Very high	37 Å²	37	43.5 Å²	43.5	31%	0.306	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-65.1	-14.3	179.9	0	0	0	0	0	114.6	H116 G120 T196 K198	H116-A118 PolarHBondContact O-N 2.95Å; A118-G120 PolarHBondContact O-N 3.4Å; A118-T196 HydrophobicContact CB-CG2 3.84Å; A118-K198 WeakPolarHBondContact O-CE 2.98Å
119	N	96.3	Very high	97.1	Very high	92 Å²	92	43.4 Å²	43.4	49%	0.492	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-73.7	-13.5	173.3	-68.3	-13.2	0	0	0	112.4	H116 V117	H116-N119 HydrophobicContact CB-CB 4.39Å; H116-N119 VanDerWaalsContact CB-ND2 3.25Å; H116-N119 WeakPolarHBondContact CB-ND2 3.3Å; H116-N119 VanDerWaalsContact O-CB 3.29Å; H116-N119 WeakPolarHBondContact O-CB 3.25Å; H116-N119 PolarHBondContact O-N 2.92Å; V117-N119 PolarHBondContact O-N 2.73Å; V117-N119 VanDerWaalsContact O-N 3.15Å
120	G	97.2	Very high	97.1	Very high	1 Å²	1	49 Å²	49	1%	0.01	26%	0.257	C	S	.	.			trans	82.2	-151	179.1	0	0	0	0	0	112.4	V117 A118 D122	V117-G120 PolarHBondContact O-N 2.89Å; A118-G120 PolarHBondContact O-N 3.4Å; G120-D122 PolarHBondContact O-N 3.45Å
121	N	98.2	Very high	97	Very high	21 Å²	21	46.3 Å²	46.3	11%	0.112	24%	0.241	C	C	.	.			trans	58.4	25.5	-176.7	-54.2	-36.4	0	0	0	113.5	E111 W112 L123 F258	E111-N121 HydrophobicContact CB-CB 4.23Å; E111-N121 WeakPolarHBondContact CB-ND2 3.26Å; E111-N121 WeakPolarHBondContact O-CB 3.18Å; E111-N121 PolarHBondContact O-ND2 2.85Å; E111-N121 PolarHBondContact OE2-ND2 3.48Å; W112-N121 WeakPolarHBondContact CB-O 3.4Å; N121-L123 VanDerWaalsContact C-N 3.3Å; N121-L123 WeakPolarHBondContact O-CD2 3.41Å; N121-L123 PolarHBondContact O-N 2.92Å; N121-F258 HydrophobicContact CB-CE1 4.35Å; N121-F258 HydrophobicContact CB-CZ 4.47Å; N121-F258 WeakPolarHBondContact OD1-CE1 3.41Å; N121-F258 VanDerWaalsContact OD1-CZ 3.22Å; N121-F258 WeakPolarHBondContact OD1-CZ 3.32Å
122	D	98.6	Very high	97	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.			trans	-82.2	76	-178.4	-172.4	12.4	0	0	0	110.5	G73 H74 W112 G120 S236 T253	G73-D122 WeakPolarHBondContact CA-OD1 3.44Å; G73-D122 PolarHBondContact N-OD1 2.85Å; H74-D122 IonicContact CE1-OD2 2.71Å; H74-D122 PolarHBondContact CE1-OD2 3.09Å; H74-D122 IonicContact CG-OD1 3.56Å; H74-D122 IonicContact CG-OD2 2.78Å; H74-D122 PolarHBondContact N-OD1 2.72Å; H74-D122 IonicContact ND1-OD1 3.55Å; H74-D122 PolarHBondContact ND1-OD1 3Å; H74-D122 IonicContact ND1-OD2 3.82Å; H74-D122 PolarHBondContact ND1-OD2 2.92Å; W112-D122 HydrophobicContact CD2-CB 4.42Å; W112-D122 VanDerWaalsContact CE3-CA 3.41Å; W112-D122 HydrophobicContact CE3-CB 3.61Å; W112-D122 HydrophobicContact CH2-CB 3.95Å; W112-D122 HydrophobicContact CZ3-CB 3.35Å; G120-D122 PolarHBondContact O-N 3.45Å; D122-S236 WeakPolarHBondContact CB-OG 3.38Å; D122-S236 WeakPolarHBondContact OD2-CA 3.45Å; D122-S236 VanDerWaalsContact OD2-CB 3.28Å; D122-S236 WeakPolarHBondContact OD2-CB 3.29Å; D122-S236 PolarHBondContact OD2-OG 3.17Å; D122-T253 PolarHBondContact O-OG1 3.04Å
123	L	98.3	Very high	97	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.237	C	C	.	.			trans	-149.5	150.8	175.3	72.5	167.5	0	0	0	112.4	L70 T71 H109 N121 T253 F258 W261 L262	L70-L123 HydrophobicContact CD1-CB 4.35Å; L70-L123 HydrophobicContact CD1-CD1 4.4Å; T71-L123 CarbonylContact O-C 3.58Å; T71-L123 WeakPolarHBondContact O-CA 3.02Å; H109-L123 HydrophobicContact CB-CD2 3.63Å; H109-L123 HydrophobicContact CB-CG 4.12Å; H109-L123 WeakPolarHBondContact CB-O 3.25Å; H109-L123 PolarHBondContact N-O 3.02Å; N121-L123 VanDerWaalsContact C-N 3.3Å; N121-L123 WeakPolarHBondContact O-CD2 3.41Å; N121-L123 PolarHBondContact O-N 2.92Å; L123-T253 HydrophobicContact CB-CG2 4.25Å; L123-T253 HydrophobicContact CD2-CG2 4.06Å; L123-F258 HydrophobicContact CD1-CB 3.77Å; L123-F258 HydrophobicContact CD1-CD1 4.1Å; L123-F258 HydrophobicContact CD1-CD2 4.23Å; L123-F258 HydrophobicContact CD1-CG 3.77Å; L123-F258 HydrophobicContact CD2-CD1 3.69Å; L123-F258 HydrophobicContact CD2-CD2 4.35Å; L123-F258 HydrophobicContact CD2-CE1 3.69Å; L123-F258 HydrophobicContact CD2-CE2 4.37Å; L123-F258 HydrophobicContact CD2-CG 4.04Å; L123-F258 HydrophobicContact CD2-CZ 4.05Å; L123-W261 HydrophobicContact CD1-CE3 3.75Å; L123-W261 HydrophobicContact CD1-CH2 4.44Å; L123-W261 HydrophobicContact CD1-CZ3 3.5Å; L123-W261 VanDerWaalsContact CD1-CZ3 3.5Å; L123-W261 HydrophobicContact CG-CE3 4.3Å; L123-W261 HydrophobicContact CG-CH2 4.26Å; L123-W261 HydrophobicContact CG-CZ3 3.78Å; L123-L262 HydrophobicContact CD1-CD2 4.37Å
124	A	98.8	Very high	97	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	151.3	175.2	0	0	0	0	0	111.2	T71 I76 V107 V108	T71-A124 HydrophobicContact CG2-CB 4.24Å; T71-A124 PolarHBondContact N-O 3.14Å; T71-A124 PolarHBondContact O-N 3.02Å; I76-A124 HydrophobicContact CG1-CB 4.09Å; V107-A124 CarbonylContact O-C 3.46Å; V107-A124 VanDerWaalsContact O-CA 3.3Å; V107-A124 WeakPolarHBondContact O-CA 3.33Å; V108-A124 HydrophobicContact CB-CB 4.45Å; V108-A124 HydrophobicContact CG2-CB 4.11Å
125	L	98.8	Very high	97.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.4	172.2	-76.3	170.7	0	0	0	110.7	V64 W68 V69 L70 V107 W261 L262 Q265 L266	V64-L125 HydrophobicContact CG2-CD2 4.34Å; W68-L125 HydrophobicContact CE3-CB 3.96Å; W68-L125 HydrophobicContact CZ3-CB 3.96Å; V69-L125 CarbonylContact O-C 3.47Å; V69-L125 WeakPolarHBondContact O-CA 3.37Å; L70-L125 HydrophobicContact CB-CD2 4.25Å; L70-L125 HydrophobicContact CD1-CD2 4.14Å; V107-L125 HydrophobicContact CB-CB 4.43Å; V107-L125 PolarHBondContact N-O 2.03Å; V107-L125 PolarHBondContact O-N 3.33Å; L125-W261 HydrophobicContact CB-CH2 4.27Å; L125-W261 HydrophobicContact CD1-CE3 4.42Å; L125-W261 HydrophobicContact CD1-CH2 3.9Å; L125-W261 HydrophobicContact CD1-CZ3 3.8Å; L125-W261 HydrophobicContact CG-CH2 3.83Å; L125-W261 HydrophobicContact CG-CZ3 3.87Å; L125-L262 HydrophobicContact CD1-CD2 4.1Å; L125-L262 HydrophobicContact CD2-CD2 4.16Å; L125-L262 HydrophobicContact CG-CD2 4.28Å; L125-Q265 HydrophobicContact CD1-CB 3.38Å; L125-Q265 HydrophobicContact CD1-CG 3.99Å; L125-L266 HydrophobicContact CD2-CD2 4.4Å
126	L	98.8	Very high	97.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	115.6	177	-39.1	173.7	0	0	0	108.5	L47 W68 V69 T71 I76 V84 I103 I106	L47-L126 HydrophobicContact CD1-CD1 3.76Å; L47-L126 HydrophobicContact CD2-CD1 4.34Å; W68-L126 WeakPolarHBondContact CA-O 3.49Å; V69-L126 HydrophobicContact CB-CB 4.16Å; V69-L126 HydrophobicContact CB-CD1 4.34Å; V69-L126 HydrophobicContact CB-CG 4.45Å; V69-L126 HydrophobicContact CG1-CD1 3.99Å; V69-L126 HydrophobicContact CG1-CG 4.45Å; V69-L126 PolarHBondContact N-O 3.03Å; V69-L126 PolarHBondContact O-N 2.9Å; T71-L126 HydrophobicContact CG2-CD1 3.89Å; T71-L126 HydrophobicContact CG2-CD2 4.16Å; T71-L126 HydrophobicContact CG2-CG 4.03Å; I76-L126 HydrophobicContact CD1-CD2 3.8Å; I76-L126 HydrophobicContact CG1-CD2 4.49Å; V84-L126 HydrophobicContact CG2-CD1 4.18Å; I103-L126 HydrophobicContact CD1-CB 4.23Å; I103-L126 HydrophobicContact CD1-CD1 3.92Å; I103-L126 HydrophobicContact CD1-CD2 4.33Å; I103-L126 HydrophobicContact CD1-CG 4.38Å; I103-L126 HydrophobicContact CG2-CB 4.22Å; I106-L126 HydrophobicContact CB-CD2 4.37Å; I106-L126 HydrophobicContact CG1-CD2 4Å; I106-L126 HydrophobicContact CG2-CD2 3.85Å
127	K	98.4	Very high	97.4	Very high	16 Å²	16	38.8 Å²	38.8	7%	0.07	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.8	172.2	-161.9	172.3	-171.8	161.1	0	108.9	R67 W68 L104 R105 S268 T269	R67-K127 CarbonylContact O-C 3.58Å; R67-K127 VanDerWaalsContact O-CA 3.3Å; R67-K127 WeakPolarHBondContact O-CA 3.25Å; W68-K127 HydrophobicContact CD2-CB 4.3Å; W68-K127 HydrophobicContact CD2-CG 4.22Å; W68-K127 HydrophobicContact CE3-CB 3.85Å; W68-K127 HydrophobicContact CE3-CG 4.27Å; W68-K127 HydrophobicContact CH2-CB 3.87Å; W68-K127 HydrophobicContact CH2-CD 3.78Å; W68-K127 HydrophobicContact CH2-CG 4.04Å; W68-K127 HydrophobicContact CZ2-CB 4.28Å; W68-K127 HydrophobicContact CZ2-CD 3.62Å; W68-K127 HydrophobicContact CZ2-CG 3.95Å; W68-K127 HydrophobicContact CZ3-CB 3.62Å; W68-K127 HydrophobicContact CZ3-CD 4.41Å; W68-K127 HydrophobicContact CZ3-CG 4.19Å; L104-K127 WeakPolarHBondContact CB-O 2.97Å; L104-K127 HydrophobicContact CD2-CD 4.43Å; L104-K127 PolarHBondContact N-O 2.84Å; R105-K127 HydrophobicContact CB-CB 3.95Å; R105-K127 PolarHBondContact N-O 2.78Å; R105-K127 PolarHBondContact O-N 3.44Å; K127-S268 PolarHBondContact NZ-O 2.99Å; K127-T269 PolarHBondContact NZ-OXT 2.73Å
128	L	98.6	Very high	97.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	145.7	177.8	-53.8	-178.3	0	0	0	111	L63 R67 V69 V84 L86 R101 K130	L63-L128 HydrophobicContact CD1-CD1 4.07Å; R67-L128 HydrophobicContact CB-CB 4.5Å; R67-L128 PolarHBondContact NE-O 3.21Å; R67-L128 PolarHBondContact NH2-O 3.24Å; R67-L128 PolarHBondContact O-N 2.97Å; V69-L128 HydrophobicContact CG2-CD1 4.3Å; V69-L128 HydrophobicContact CG2-CD2 4.12Å; V69-L128 HydrophobicContact CG2-CG 4.41Å; V84-L128 HydrophobicContact CB-CD2 3.91Å; V84-L128 HydrophobicContact CG1-CD2 4.3Å; V84-L128 HydrophobicContact CG2-CD2 3.78Å; L86-L128 HydrophobicContact CD1-CD1 4.46Å; R101-L128 HydrophobicContact CB-CB 4.29Å; R101-L128 HydrophobicContact CB-CD1 4.25Å; R101-L128 HydrophobicContact CB-CD2 4.13Å; R101-L128 HydrophobicContact CB-CG 4.45Å; R101-L128 HydrophobicContact CG-CD1 4.29Å; L128-K130 WeakPolarHBondContact CB-O 3.42Å; L128-K130 PolarHBondContact O-N 3.42Å
129	D	98.1	Very high	97.8	Very high	47 Å²	47	35.3 Å²	35.3	25%	0.251	19%	0.189	S	C	.	.	S	Bend	trans	-55.8	-40.4	175.2	77.9	-51.5	0	0	0	111.9	R67 D102	R67-D129 PolarHBondContact NH2-O 3.07Å; D102-D129 HydrophobicContact CB-CB 4.26Å; D102-D129 PolarHBondContact N-OD1 2.85Å; D102-D129 PolarHBondContact O-N 2.82Å
130	K	96.9	Very high	97.9	Very high	137 Å²	137	32 Å²	32	60%	0.596	17%	0.171	S	C	*	.	S	Bend	trans	-140	154.4	178.3	-66.7	171.7	-166.6	170.4	0	110.6	L128	L128-K130 WeakPolarHBondContact CB-O 3.42Å; L128-K130 PolarHBondContact O-N 3.42Å
131	S	97.1	Very high	97.9	Very high	51 Å²	51	32 Å²	32	36%	0.357	17%	0.171	S	C	.	.			trans	-66.3	139.1	172.5	-162.1	0	0	0	0	110	P66 R101	P66-S131 WeakPolarHBondContact CB-OG 3.4Å; P66-S131 WeakPolarHBondContact O-CA 3.34Å; P66-S131 WeakPolarHBondContact O-CB 3.44Å; P66-S131 PolarHBondContact O-OG 2.97Å; R101-S131 PolarHBondContact NE-O 2.99Å
132	P	97.6	Very high	98	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.039	17%	0.167	C	C	.	.			trans	-70.5	157.8	166.8	32.1	-27.7	0	0	0	109.7	L63 P66 L86 M134 V138	L63-P132 HydrophobicContact CD2-CG 3.87Å; P66-P132 WeakPolarHBondContact O-CD 3.4Å; L86-P132 HydrophobicContact CD1-CB 4.24Å; L86-P132 HydrophobicContact CD2-CB 4.33Å; L86-P132 HydrophobicContact CD2-CG 3.96Å; P132-M134 HydrophobicContact CG-CE 4.22Å; P132-M134 PolarHBondContact O-N 2.89Å; P132-V138 HydrophobicContact CB-CG1 3.94Å; P132-V138 HydrophobicContact CG-CG1 3.96Å
133	I	97.5	Very high	97.9	Very high	120 Å²	120	33.1 Å²	33.1	62%	0.615	18%	0.177	S	C	*	.			trans	-77.1	111.3	174.2	-58.5	171.2	0	0	0	106.5	Q99 N135	Q99-I133 PolarHBondContact NE2-O 3.26Å; I133-N135 PolarHBondContact O-N 2.88Å
134	M	97.3	Very high	97.9	Very high	37 Å²	37	33.5 Å²	33.5	18%	0.182	18%	0.18	C	C	.	.			trans	-67.2	130.4	176.3	-60.4	-63.3	172.8	0	0	109.8	F16 L63 P66 P132 V138 V140	F16-M134 HydrophobicContact CD1-CB 4.25Å; F16-M134 HydrophobicContact CD2-CB 4.33Å; F16-M134 HydrophobicContact CE1-CB 4.23Å; F16-M134 HydrophobicContact CE2-CB 4.3Å; F16-M134 HydrophobicContact CG-CB 4.3Å; F16-M134 HydrophobicContact CZ-CB 4.25Å; L63-M134 HydrophobicContact CD2-CE 3.74Å; L63-M134 HydrophobicContact CD2-SD 4.23Å; P66-M134 HydrophobicContact CB-CE 4.09Å; P66-M134 HydrophobicContact CG-CE 4.45Å; P132-M134 HydrophobicContact CG-CE 4.22Å; P132-M134 PolarHBondContact O-N 2.89Å; M134-V138 WeakPolarHBondContact CA-O 3.44Å; M134-V138 HydrophobicContact SD-CG1 4.31Å; M134-V140 HydrophobicContact CE-CG1 3.63Å; M134-V140 HydrophobicContact SD-CG1 4.3Å
135	N	96.6	Very high	97.8	Very high	72 Å²	72	40.9 Å²	40.9	39%	0.385	21%	0.214	S	C	.	.	S	Bend	trans	-158.1	-166.8	-179.1	64.3	13.7	0	0	0	109.2	I133 S137 V138	I133-N135 PolarHBondContact O-N 2.88Å; N135-S137 PolarHBondContact O-N 3.15Å; N135-S137 PolarHBondContact OD1-N 3.18Å; N135-S137 PolarHBondContact OD1-OG 3.42Å; N135-V138 PolarHBondContact N-O 3.28Å; N135-V138 CarbonylContact O-C 3.58Å; N135-V138 PolarHBondContact O-N 2.86Å; N135-V138 PolarHBondContact OD1-N 2.87Å
136	D	96.9	Very high	97.7	Very high	119 Å²	119	44 Å²	44	64%	0.636	24%	0.24	S	C	*	.	S	Bend	trans	-66.7	-20.2	-178.2	-64	-19.9	0	0	0	113.6	A22	A22-D136 HydrophobicContact CB-CB 3.9Å
137	S	98	Very high	97.6	Very high	6 Å²	6	49.2 Å²	49.2	4%	0.042	27%	0.265	C	S	.	.	S	Bend	trans	-102.6	-13.8	178.7	65.5	0	0	0	0	115.1	P42 G87 N135	P42-S137 WeakPolarHBondContact CA-O 3.33Å; P42-S137 WeakPolarHBondContact CB-O 3.38Å; G87-S137 WeakPolarHBondContact CA-O 3.36Å; N135-S137 PolarHBondContact O-N 3.15Å; N135-S137 PolarHBondContact OD1-N 3.18Å; N135-S137 PolarHBondContact OD1-OG 3.42Å
138	V	98.5	Very high	97.6	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	28%	0.276	C	S	.	.			trans	-131.1	116.1	179.4	-176.5	0	0	0	0	110.4	P42 L63 L86 P132 M134 N135	P42-V138 WeakPolarHBondContact O-CA 3.33Å; L63-V138 HydrophobicContact CD2-CG1 4.07Å; L86-V138 HydrophobicContact CB-CG1 4.11Å; L86-V138 HydrophobicContact CB-CG2 3.92Å; L86-V138 HydrophobicContact CD2-CG1 3.86Å; P132-V138 HydrophobicContact CB-CG1 3.94Å; P132-V138 HydrophobicContact CG-CG1 3.96Å; M134-V138 WeakPolarHBondContact CA-O 3.44Å; M134-V138 HydrophobicContact SD-CG1 4.31Å; N135-V138 PolarHBondContact N-O 3.28Å; N135-V138 CarbonylContact O-C 3.58Å; N135-V138 PolarHBondContact O-N 2.86Å; N135-V138 PolarHBondContact OD1-N 2.87Å
139	G	97.8	Very high	97.5	Very high	16 Å²	16	58 Å²	58	17%	0.165	31%	0.309	C	S	.	.			trans	-147.2	169.5	-178.7	0	0	0	0	0	112.3	P42 W43	P42-G139 PolarHBondContact O-N 2.93Å; W43-G139 WeakPolarHBondContact CA-O 2.89Å; W43-G139 VanDerWaalsContact CB-O 3.25Å; W43-G139 WeakPolarHBondContact CB-O 2.97Å
140	V	98	Very high	97.5	Very high	21 Å²	21	57 Å²	57	13%	0.127	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-99.4	139.9	178.6	-58.3	0	0	0	0	111.1	C18 G19 L63 M134	C18-V140 CarbonylContact C-O 3.56Å; C18-V140 VanDerWaalsContact CA-O 3.28Å; C18-V140 WeakPolarHBondContact CA-O 3.26Å; C18-V140 HydrophobicContact CB-CG2 3.9Å; G19-V140 PolarHBondContact N-O 3.37Å; L63-V140 HydrophobicContact CD2-CG1 3.99Å; L63-V140 HydrophobicContact CG-CG1 4.06Å; L63-V140 CarbonylContact O-C 3.56Å; L63-V140 VanDerWaalsContact O-CA 3.3Å; L63-V140 WeakPolarHBondContact O-CA 3.17Å; M134-V140 HydrophobicContact CE-CG1 3.63Å; M134-V140 HydrophobicContact SD-CG1 4.3Å
141	A	98.3	Very high	97.5	Very high	2 Å²	2	53.5 Å²	53.5	2%	0.017	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-82.7	157.5	172	0	0	0	0	0	111.7	W43 T62 L63 I231	W43-A141 HydrophobicContact CB-CB 3.9Å; W43-A141 HydrophobicContact CD2-CB 3.71Å; W43-A141 HydrophobicContact CE3-CB 4.26Å; W43-A141 HydrophobicContact CG-CB 3.54Å; T62-A141 HydrophobicContact CG2-CB 3.52Å; L63-A141 PolarHBondContact O-N 2.91Å; A141-I231 HydrophobicContact CB-CD1 3.52Å; A141-I231 HydrophobicContact CB-CG1 3.34Å
142	C	98.4	Very high	97.5	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.014	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-82.2	145.7	170.8	-59.4	0	0	0	0	110.8	C18 W229 Y230 I231	C18-C142 HydrophobicContact CB-CB 3.98Å; C18-C142 WeakPolarHBondContact CB-SG 3.06Å; C18-C142 PolarHBondContact O-SG 2.83Å; C18-C142 WeakPolarHBondContact SG-CA 3.42Å; C18-C142 WeakPolarHBondContact SG-CB 3.35Å; C18-C142 CovalentContact SG-SG 2.04Å; C18-C142 PolarHBondContact SG-SG 2.87Å; C142-W229 WeakPolarHBondContact CB-O 3.16Å; C142-W229 PolarHBondContact N-O 2.78Å; C142-Y230 HydrophobicContact CB-CD1 3.47Å; C142-Y230 VanDerWaalsContact CB-CD1 3.47Å; C142-Y230 HydrophobicContact CB-CD2 4.42Å; C142-Y230 HydrophobicContact CB-CE1 3.54Å; C142-Y230 HydrophobicContact CB-CE2 4.46Å; C142-Y230 HydrophobicContact CB-CG 3.96Å; C142-Y230 WeakPolarHBondContact O-CA 3.48Å; C142-I231 PolarHBondContact O-N 2.97Å
143	L	97.9	Very high	97.4	Very high	42 Å²	42	57.3 Å²	57.3	22%	0.22	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-93.6	143.3	165.1	-68.8	173.2	0	0	0	109.5	V64 L70 Y230 L262 L266	V64-L143 HydrophobicContact CB-CD1 4.42Å; V64-L143 HydrophobicContact CB-CD2 4.47Å; V64-L143 HydrophobicContact CB-CG 4.39Å; V64-L143 HydrophobicContact CG1-CD2 3.96Å; V64-L143 HydrophobicContact CG1-CG 4.37Å; L70-L143 HydrophobicContact CD2-CD2 4.2Å; L143-Y230 WeakPolarHBondContact O-CD1 3.24Å; L143-Y230 WeakPolarHBondContact O-CE1 3.32Å; L143-L262 HydrophobicContact CD1-CD1 4.16Å; L143-L262 HydrophobicContact CD2-CD1 4.3Å; L143-L266 HydrophobicContact CD1-CD1 3.98Å
144	P	97.4	Very high	97.3	Very high	8 Å²	8	53.7 Å²	53.7	5%	0.052	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-70.2	171	-178.4	30.6	-36.7	0	0	0	112	E148 Y230 I231 Q232 T255	P144-E148 HydrophobicContact CB-CB 4.33Å; P144-E148 WeakPolarHBondContact CB-OE2 3.47Å; P144-Y230 HydrophobicContact CB-CD1 4.48Å; P144-I231 VanDerWaalsContact CD-O 3.27Å; P144-I231 WeakPolarHBondContact CD-O 3.34Å; P144-Q232 VanDerWaalsContact CB-OE1 3.31Å; P144-T255 WeakPolarHBondContact CD-OG1 3.37Å; P144-T255 WeakPolarHBondContact CG-OG1 3.35Å
145	Q	96.4	Very high	97.2	Very high	155 Å²	155	57.8 Å²	57.8	72%	0.724	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-68.7	153.6	172.3	-66.6	-162.3	-26.9	0	0	111.2	E147 E148 S256	Q145-E147 PolarHBondContact O-N 2.96Å; Q145-E148 HydrophobicContact CB-CB 4.47Å; Q145-E148 PolarHBondContact N-OE2 2.82Å; Q145-E148 VanDerWaalsContact N-OE2 3.08Å; Q145-E148 VanDerWaalsContact O-CB 3.25Å; Q145-E148 WeakPolarHBondContact O-CB 3.34Å; Q145-E148 PolarHBondContact O-N 2.69Å; Q145-E148 VanDerWaalsContact O-N 3.13Å; Q145-S256 WeakPolarHBondContact O-CB 3.39Å
146	A	97.6	Very high	97.2	Very high	66 Å²	66	54.3 Å²	54.3	55%	0.545	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	132.5	176	0	0	0	0	0	110.5	E148 T259	A146-E148 PolarHBondContact O-N 3.27Å; A146-E148 VanDerWaalsContact O-N 3.1Å; A146-T259 WeakPolarHBondContact CA-OG1 3.09Å; A146-T259 HydrophobicContact CB-CG2 4.25Å; A146-T259 WeakPolarHBondContact CB-OG1 3.24Å
147	E	97.3	Very high	97.1	Very high	110 Å²	110	49.2 Å²	49.2	51%	0.514	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	14.8	-179.1	-61.2	-54.8	140.7	0	0	116.2	Q145 I149 R254 S256	Q145-E147 PolarHBondContact O-N 2.96Å; E147-I149 PolarHBondContact O-N 3.42Å; E147-R254 PolarHBondContact O-NH1 2.59Å; E147-R254 IonicContact OE2-CZ 3.67Å; E147-R254 IonicContact OE2-NH1 3.83Å; E147-R254 PolarHBondContact OE2-NH1 3.48Å; E147-R254 IonicContact OE2-NH2 3.59Å; E147-R254 PolarHBondContact OE2-NH2 2.9Å; E147-S256 PolarHBondContact N-O 2.98Å
148	E	97.6	Very high	97	Very high	64 Å²	64	49.5 Å²	49.5	30%	0.299	28%	0.277	S	S	.	.			trans	-56.4	133.5	172.3	-169.2	179.7	144.3	0	0	111.1	P144 Q145 A146 Q232 R254 S256	P144-E148 HydrophobicContact CB-CB 4.33Å; P144-E148 WeakPolarHBondContact CB-OE2 3.47Å; Q145-E148 HydrophobicContact CB-CB 4.47Å; Q145-E148 PolarHBondContact N-OE2 2.82Å; Q145-E148 VanDerWaalsContact N-OE2 3.08Å; Q145-E148 VanDerWaalsContact O-CB 3.25Å; Q145-E148 WeakPolarHBondContact O-CB 3.34Å; Q145-E148 PolarHBondContact O-N 2.69Å; Q145-E148 VanDerWaalsContact O-N 3.13Å; A146-E148 PolarHBondContact O-N 3.27Å; A146-E148 VanDerWaalsContact O-N 3.1Å; E148-Q232 PolarHBondContact OE1-NE2 3.3Å; E148-R254 PolarHBondContact O-NH1 2.71Å; E148-S256 WeakPolarHBondContact O-CB 3.39Å; E148-S256 PolarHBondContact O-OG 2.92Å
149	I	97.3	Very high	97	Very high	135 Å²	135	49.6 Å²	49.6	69%	0.692	28%	0.278	S	S	*	.			trans	-123	123.3	177.3	-59.3	176.5	0	0	0	107.9	E147	E147-I149 PolarHBondContact O-N 3.42Å
150	L	97	Very high	96.9	Very high	26 Å²	26	49 Å²	49	14%	0.136	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-71.2	141.2	176	-66.5	176.8	0	0	0	111.2	T154 V181 C222 Q232	L150-T154 HydrophobicContact CD2-CG2 4.45Å; L150-V181 HydrophobicContact CB-CG1 4Å; L150-V181 HydrophobicContact CB-CG2 4.13Å; L150-V181 HydrophobicContact CD1-CG2 3.6Å; L150-C222 VanDerWaalsContact CD1-SG 3.51Å; L150-Q232 HydrophobicContact CD1-CB 3.73Å; L150-Q232 HydrophobicContact CD1-CG 3.79Å; L150-Q232 HydrophobicContact CD2-CG 4.07Å; L150-Q232 HydrophobicContact CG-CB 4.45Å; L150-Q232 HydrophobicContact CG-CG 4.18Å
151	A	97.3	Very high	96.8	Very high	65 Å²	65	48.1 Å²	48.1	54%	0.537	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-67.6	146.5	173.6	0	0	0	0	0	111.2	G153 T154	A151-G153 PolarHBondContact O-N 3.45Å; A151-T154 VanDerWaalsContact O-CB 3.27Å; A151-T154 WeakPolarHBondContact O-CB 3.38Å; A151-T154 PolarHBondContact O-N 2.74Å; A151-T154 VanDerWaalsContact O-N 3.12Å; A151-T154 PolarHBondContact O-OG1 2.94Å
152	H	97.1	Very high	96.4	Very high	105 Å²	105	48.2 Å²	48.2	49%	0.486	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	137.9	172.1	-173.9	47	0	0	0	111.2	T154 V181 E183	H152-T154 PolarHBondContact O-N 2.87Å; H152-V181 PolarHBondContact ND1-O 3.35Å; H152-E183 HydrophobicContact CB-CB 3.94Å; H152-E183 HydrophobicContact CB-CG 3.87Å; H152-E183 PolarHBondContact ND1-N 3.12Å
153	G	95.6	Very high	95.7	Very high	32 Å²	32	49.1 Å²	49.1	33%	0.33	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	-1.3	-178.8	0	0	0	0	0	114.7	A151 H155 V181	A151-G153 PolarHBondContact O-N 3.45Å; G153-H155 PolarHBondContact O-CD2 2.92Å; G153-H155 PolarHBondContact O-N 2.58Å; G153-V181 PolarHBondContact N-O 2.82Å
154	T	96.1	Very high	94.8	Very high	44 Å²	44	51.7 Å²	51.7	27%	0.27	29%	0.285	S	S	.	.			trans	-56.6	125	171.6	-58.9	0	0	0	0	109.4	L150 A151 H152 C156 P180 V181	L150-T154 HydrophobicContact CD2-CG2 4.45Å; A151-T154 VanDerWaalsContact O-CB 3.27Å; A151-T154 WeakPolarHBondContact O-CB 3.38Å; A151-T154 PolarHBondContact O-N 2.74Å; A151-T154 VanDerWaalsContact O-N 3.12Å; A151-T154 PolarHBondContact O-OG1 2.94Å; H152-T154 PolarHBondContact O-N 2.87Å; T154-C156 PolarHBondContact O-N 2.03Å; T154-P180 CarbonylContact O-C 3.46Å; T154-P180 WeakPolarHBondContact O-CA 3.27Å; T154-V181 WeakPolarHBondContact O-CG2 3.46Å; T154-V181 PolarHBondContact O-N 3.29Å
155	H	93.7	Very high	93.9	Very high	122 Å²	122	57.9 Å²	57.9	57%	0.565	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	116.8	177.7	-78.7	-89.2	0	0	0	110.3	G153 S178	G153-H155 PolarHBondContact O-CD2 2.92Å; G153-H155 PolarHBondContact O-N 2.58Å; H155-S178 PolarHBondContact ND1-OG 3.29Å; H155-S178 VanDerWaalsContact ND1-OG 3.13Å
156	C	96.2	Very high	93.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	171.8	170.9	-61.8	0	0	0	0	109.8	T154 S178 L179 L220 N221 C222	T154-C156 PolarHBondContact O-N 2.03Å; C156-S178 CarbonylContact O-C 3.48Å; C156-S178 VanDerWaalsContact O-CA 3.29Å; C156-S178 WeakPolarHBondContact O-CA 3.43Å; C156-S178 PolarHBondContact O-OG 3Å; C156-L179 PolarHBondContact N-O 3.04Å; C156-L179 PolarHBondContact O-N 2.8Å; C156-L220 HydrophobicContact CB-CD1 3.58Å; C156-L220 HydrophobicContact CB-CG 3.9Å; C156-N221 CarbonylContact C-O 3.52Å; C156-N221 VanDerWaalsContact CA-O 3.27Å; C156-N221 WeakPolarHBondContact CA-O 3.1Å; C156-N221 WeakPolarHBondContact CB-O 3.24Å; C156-C222 HydrophobicContact CB-CB 4.13Å; C156-C222 WeakPolarHBondContact CB-SG 3.43Å; C156-C222 WeakPolarHBondContact SG-CB 3.45Å; C156-C222 CovalentContact SG-SG 2.03Å; C156-C222 PolarHBondContact SG-SG 3.03Å
157	F	96.6	Very high	92.4	Very high	11 Å²	11	56.7 Å²	56.7	5%	0.048	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.3	-177.6	-70.1	-99.1	0	0	0	110.5	T27 W41 A177 N221 W229	T27-F157 HydrophobicContact CG2-CE2 4.08Å; T27-F157 HydrophobicContact CG2-CZ 3.98Å; W41-F157 HydrophobicContact CH2-CB 3.89Å; W41-F157 HydrophobicContact CH2-CG 4.26Å; W41-F157 HydrophobicContact CZ2-CB 3.75Å; W41-F157 HydrophobicContact CZ2-CD1 4.43Å; W41-F157 HydrophobicContact CZ2-CG 4.06Å; F157-A177 CarbonylContact C-O 3.6Å; F157-A177 VanDerWaalsContact CA-O 3.23Å; F157-A177 WeakPolarHBondContact CA-O 3.34Å; F157-N221 HydrophobicContact CB-CB 4.37Å; F157-N221 PolarHBondContact N-O 2.9Å; F157-N221 WeakPolarHBondContact O-CB 3.12Å; F157-N221 PolarHBondContact O-N 2.76Å; F157-N221 PolarHBondContact O-ND2 3.34Å; F157-W229 AromaticContact CD2-CH2 3.81Å; F157-W229 HydrophobicContact CD2-CH2 3.81Å; F157-W229 AromaticContact CD2-CZ3 3.82Å; F157-W229 HydrophobicContact CD2-CZ3 3.82Å; F157-W229 HydrophobicContact CE2-CH2 4.04Å; F157-W229 HydrophobicContact CE2-CZ3 4.43Å
158	I	95.9	Very high	91.7	Very high	13 Å²	13	52 Å²	52	7%	0.067	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	151.8	161.1	58.5	168	0	0	0	109.3	Q176 A177 L179 A211 L220 F252	I158-Q176 VanDerWaalsContact O-CA 3.24Å; I158-Q176 WeakPolarHBondContact O-CA 3.41Å; I158-A177 HydrophobicContact CD1-CB 4.15Å; I158-A177 HydrophobicContact CG1-CB 3.79Å; I158-A177 PolarHBondContact N-O 2.79Å; I158-A177 PolarHBondContact O-N 2.91Å; I158-L179 HydrophobicContact CD1-CD1 4.05Å; I158-L179 HydrophobicContact CG1-CD1 4.18Å; I158-L179 HydrophobicContact CG1-CG 4.35Å; I158-L179 HydrophobicContact CG2-CD1 3.7Å; I158-L179 HydrophobicContact CG2-CG 4.44Å; I158-A211 HydrophobicContact CD1-CB 4Å; I158-L220 HydrophobicContact CG2-CD1 4.03Å; I158-F252 HydrophobicContact CG2-CE1 3.71Å; I158-F252 HydrophobicContact CG2-CZ 3.54Å
159	S	97.1	Very high	91.2	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	141.5	171.8	54.1	0	0	0	0	110	Q44 Q175 P219 N221	Q44-S159 PolarHBondContact OE1-O 2.79Å; Q44-S159 PolarHBondContact OE1-OG 3.22Å; S159-Q175 VanDerWaalsContact CA-O 3.25Å; S159-Q175 WeakPolarHBondContact CA-O 3.35Å; S159-P219 WeakPolarHBondContact OG-CG 3.3Å; S159-N221 PolarHBondContact OG-ND2 3.33Å
160	G	97	Very high	90.8	Very high	3 Å²	3	50.5 Å²	50.5	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.7	178.1	-178	0	0	0	0	0	114.3	Q175 D215	G160-Q175 PolarHBondContact N-O 2.8Å; G160-Q175 VanDerWaalsContact N-O 3.13Å; G160-Q175 WeakPolarHBondContact O-CB 3.38Å; G160-Q175 PolarHBondContact O-N 3.49Å; G160-D215 WeakPolarHBondContact CA-OD1 3.11Å
161	W	95.9	Very high	90.6	Very high	2 Å²	2	50 Å²	50	1%	0.008	27%	0.27	C	S	.	.			trans	-113.7	24.6	175.2	-62.2	-95.3	0	0	0	111	Q44 E88 H89 M91 D172 L174	Q44-W161 HydrophobicContact CG-CH2 3.82Å; Q44-W161 HydrophobicContact CG-CZ3 3.6Å; E88-W161 HydrophobicContact CB-CH2 4.13Å; E88-W161 HydrophobicContact CB-CZ2 4.15Å; E88-W161 HydrophobicContact CG-CH2 4.07Å; E88-W161 HydrophobicContact CG-CZ2 3.72Å; H89-W161 PolarHBondContact O-NE1 3.5Å; M91-W161 HydrophobicContact CE-CB 3.78Å; M91-W161 HydrophobicContact CE-CD2 3.25Å; M91-W161 HydrophobicContact CE-CE3 3.49Å; M91-W161 VanDerWaalsContact CE-CE3 3.49Å; M91-W161 HydrophobicContact CE-CG 3.39Å; M91-W161 HydrophobicContact CE-CZ2 4.33Å; M91-W161 HydrophobicContact CE-CZ3 4.13Å; M91-W161 HydrophobicContact CG-CG 4.45Å; M91-W161 HydrophobicContact SD-CB 4.23Å; M91-W161 HydrophobicContact SD-CD2 4.39Å; M91-W161 HydrophobicContact SD-CG 4.01Å; W161-D172 VanDerWaalsContact CD1-O 3.27Å; W161-D172 PolarHBondContact NE1-O 2.6Å; W161-L174 HydrophobicContact CD2-CB 4.48Å; W161-L174 HydrophobicContact CD2-CD1 3.76Å; W161-L174 HydrophobicContact CE3-CD1 3.85Å; W161-L174 HydrophobicContact CH2-CD1 3.82Å; W161-L174 HydrophobicContact CZ2-CB 3.71Å; W161-L174 HydrophobicContact CZ2-CD1 3.73Å; W161-L174 HydrophobicContact CZ2-CD2 4.39Å; W161-L174 HydrophobicContact CZ2-CG 4.13Å; W161-L174 HydrophobicContact CZ3-CD1 3.88Å; W161-L174 VanDerWaalsContact NE1-CA 3.32Å; W161-L174 VanDerWaalsContact NE1-N 3.13Å
162	G	89.3	Confident	90.5	Very high	4 Å²	4	51.2 Å²	51.2	4%	0.041	27%	0.268	C	S	.	.			trans	-66.1	165.5	173.2	0	0	0	0	0	112.6	L164 P171 N213 D215	G162-L164 PolarHBondContact O-N 2.79Å; G162-P171 WeakPolarHBondContact O-CD 3.2Å; G162-N213 CarbonylContact C-O 3.51Å; G162-N213 WeakPolarHBondContact CA-O 3.02Å; G162-D215 WeakPolarHBondContact CA-OD1 3.33Å; G162-D215 PolarHBondContact N-OD1 3.45Å
163	N	83.9	Confident	90.4	Very high	21 Å²	21	48.6 Å²	48.6	11%	0.112	26%	0.257	C	S	.	.			trans	-52.7	136	-179.4	-67.7	-7.8	0	0	0	111.1	Y165 G168 P169 M170 C212 N213	N163-Y165 WeakPolarHBondContact CB-O 3.42Å; N163-Y165 PolarHBondContact O-N 3Å; N163-Y165 VanDerWaalsContact O-N 3.13Å; N163-G168 VanDerWaalsContact CG-O 3.26Å; N163-G168 PolarHBondContact ND2-O 3.42Å; N163-G168 PolarHBondContact OD1-O 3.08Å; N163-P169 WeakPolarHBondContact CA-O 3.27Å; N163-M170 WeakPolarHBondContact OD1-CG 3.43Å; N163-C212 HydrophobicContact CB-CB 4.09Å; N163-C212 WeakPolarHBondContact O-CB 3.42Å; N163-C212 PolarHBondContact O-SG 2.51Å; N163-N213 PolarHBondContact N-O 2.94Å
164	L	78.3	Confident	90.5	Very high	96 Å²	96	47.2 Å²	47.2	50%	0.503	24%	0.242	S	C	.	.	S	Bend	trans	-63.7	-22.5	179.4	-64.9	178.4	0	0	0	113.7	G162 P169 P171 Q175	G162-L164 PolarHBondContact O-N 2.79Å; L164-P169 HydrophobicContact CD1-CG 4.43Å; L164-P169 PolarHBondContact N-O 2.94Å; L164-P171 HydrophobicContact CD2-CB 4.02Å; L164-P171 HydrophobicContact CD2-CG 3.87Å; L164-P171 HydrophobicContact CG-CB 4.32Å; L164-P171 HydrophobicContact CG-CG 4.33Å; L164-Q175 HydrophobicContact CD2-CG 3.83Å
165	Y	78.1	Confident	90.5	Very high	139 Å²	139	46.5 Å²	46.5	55%	0.545	24%	0.235	S	C	.	.	S	Bend	trans	-160.9	174.1	174.1	56.1	-89.9	0	0	0	109.4	N163 H167 G168 C212	N163-Y165 WeakPolarHBondContact CB-O 3.42Å; N163-Y165 PolarHBondContact O-N 3Å; N163-Y165 VanDerWaalsContact O-N 3.13Å; Y165-H167 PolarHBondContact O-N 3.38Å; Y165-G168 VanDerWaalsContact CZ-CA 3.46Å; Y165-G168 WeakPolarHBondContact O-CA 3.42Å; Y165-G168 PolarHBondContact O-N 2.94Å; Y165-C212 VanDerWaalsContact C-SG 3.5Å
166	T	81.4	Confident	90.6	Very high	33 Å²	33	40.8 Å²	40.8	20%	0.202	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	122	-179.9	-56.6	0	0	0	0	112	G168 V242 C243	T166-G168 PolarHBondContact O-N 2.84Å; T166-G168 VanDerWaalsContact O-N 3.15Å; T166-V242 HydrophobicContact CG2-CG1 4.33Å; T166-V242 VanDerWaalsContact OG1-CA 3.28Å; T166-V242 WeakPolarHBondContact OG1-CA 3.35Å; T166-C243 PolarHBondContact OG1-N 2.86Å
167	H	81.5	Confident	90.4	Very high	163 Å²	163	41.1 Å²	41.1	76%	0.755	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	19.9	-172.8	-51.9	-62.1	0	0	0	115	Y165	Y165-H167 PolarHBondContact O-N 3.38Å
168	G	82.7	Confident	90.2	Very high	11 Å²	11	41.5 Å²	41.5	11%	0.113	22%	0.216	C	C	.	.			trans	-81.5	177.4	172.5	0	0	0	0	0	113.2	N163 Y165 T166	N163-G168 VanDerWaalsContact CG-O 3.26Å; N163-G168 PolarHBondContact ND2-O 3.42Å; N163-G168 PolarHBondContact OD1-O 3.08Å; Y165-G168 VanDerWaalsContact CZ-CA 3.46Å; Y165-G168 WeakPolarHBondContact O-CA 3.42Å; Y165-G168 PolarHBondContact O-N 2.94Å; T166-G168 PolarHBondContact O-N 2.84Å; T166-G168 VanDerWaalsContact O-N 3.15Å
169	P	86.3	Confident	90.1	Very high	74 Å²	74	41 Å²	41	48%	0.481	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-70.2	149.2	176.9	31.1	-34.6	0	0	0	111.5	N163 L164	N163-P169 WeakPolarHBondContact CA-O 3.27Å; L164-P169 HydrophobicContact CD1-CG 4.43Å; L164-P169 PolarHBondContact N-O 2.94Å
170	M	89	Confident	90	Very high	93 Å²	93	43.2 Å²	43.2	46%	0.458	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-75.2	129.8	160.9	-68.3	-178.4	171.1	0	0	108.2	N163	N163-M170 WeakPolarHBondContact OD1-CG 3.43Å
171	P	93.1	Very high	90	Very high	16 Å²	16	43.2 Å²	43.2	10%	0.104	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-74.2	147.6	176.2	31.9	-34	0	0	0	110.7	G162 L164 Q175	G162-P171 WeakPolarHBondContact O-CD 3.2Å; L164-P171 HydrophobicContact CD2-CB 4.02Å; L164-P171 HydrophobicContact CD2-CG 3.87Å; L164-P171 HydrophobicContact CG-CB 4.32Å; L164-P171 HydrophobicContact CG-CG 4.33Å; P171-Q175 HydrophobicContact CB-CG 3.99Å; P171-Q175 HydrophobicContact CG-CG 3.5Å; P171-Q175 VanDerWaalsContact CG-CG 3.5Å
172	D	94.8	Very high	90.1	Very high	90 Å²	90	43.4 Å²	43.4	48%	0.481	23%	0.229	S	C	.	.	S	Bend	trans	-75.7	-39.2	171.9	-61.9	-51.7	0	0	0	111	D90 M91 W161	D90-D172 WeakPolarHBondContact CA-O 3.5Å; D90-D172 WeakPolarHBondContact OD1-CB 3.44Å; M91-D172 PolarHBondContact N-O 2.77Å; W161-D172 VanDerWaalsContact CD1-O 3.27Å; W161-D172 PolarHBondContact NE1-O 2.6Å
173	I	97.1	Very high	90.5	Very high	50 Å²	50	47.2 Å²	47.2	26%	0.256	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-83.8	134.5	179.4	-59.2	175.1	0	0	0	110.4	D35 H89 D90 Q175	D35-I173 HydrophobicContact CB-CG2 3.86Å; H89-I173 CarbonylContact O-C 3.55Å; H89-I173 WeakPolarHBondContact O-CA 3.07Å; D90-I173 HydrophobicContact CB-CG1 4.38Å; I173-Q175 PolarHBondContact O-N 2.9Å; I173-Q175 PolarHBondContact O-NE2 3.41Å
174	L	97.6	Very high	91.2	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.016	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-54.5	125.4	176.6	178.5	63.4	0	0	0	110.4	A36 Q44 H89 W161	A36-L174 HydrophobicContact CB-CB 4.36Å; A36-L174 HydrophobicContact CB-CD2 4.12Å; A36-L174 HydrophobicContact CB-CG 4.01Å; A36-L174 WeakPolarHBondContact CB-O 3.45Å; A36-L174 PolarHBondContact N-O 3.32Å; Q44-L174 HydrophobicContact CG-CD1 3.95Å; Q44-L174 HydrophobicContact CG-CD2 4.27Å; H89-L174 PolarHBondContact O-N 2.83Å; W161-L174 HydrophobicContact CD2-CB 4.48Å; W161-L174 HydrophobicContact CD2-CD1 3.76Å; W161-L174 HydrophobicContact CE3-CD1 3.85Å; W161-L174 HydrophobicContact CH2-CD1 3.82Å; W161-L174 HydrophobicContact CZ2-CB 3.71Å; W161-L174 HydrophobicContact CZ2-CD1 3.73Å; W161-L174 HydrophobicContact CZ2-CD2 4.39Å; W161-L174 HydrophobicContact CZ2-CG 4.13Å; W161-L174 HydrophobicContact CZ3-CD1 3.88Å; W161-L174 VanDerWaalsContact NE1-CA 3.32Å; W161-L174 VanDerWaalsContact NE1-N 3.13Å
175	Q	96	Very high	92.1	Very high	29 Å²	29	48.2 Å²	48.2	14%	0.136	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	159.7	176.9	-57.8	-61.3	-66.4	0	0	111.4	V34 D35 S159 G160 L164 P171 I173	V34-Q175 VanDerWaalsContact C-OE1 3.29Å; V34-Q175 CarbonylContact O-C 3.57Å; V34-Q175 WeakPolarHBondContact O-CA 3.5Å; D35-Q175 PolarHBondContact OD1-NE2 3.13Å; S159-Q175 VanDerWaalsContact CA-O 3.25Å; S159-Q175 WeakPolarHBondContact CA-O 3.35Å; G160-Q175 PolarHBondContact N-O 2.8Å; G160-Q175 VanDerWaalsContact N-O 3.13Å; G160-Q175 WeakPolarHBondContact O-CB 3.38Å; G160-Q175 PolarHBondContact O-N 3.49Å; L164-Q175 HydrophobicContact CD2-CG 3.83Å; P171-Q175 HydrophobicContact CB-CG 3.99Å; P171-Q175 HydrophobicContact CG-CG 3.5Å; P171-Q175 VanDerWaalsContact CG-CG 3.5Å; I173-Q175 PolarHBondContact O-N 2.9Å; I173-Q175 PolarHBondContact O-NE2 3.41Å
176	Q	95	Very high	93	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.014	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.1	166	59.7	166.1	51.3	0	0	111.6	D26 G33 V34 A36 I158	D26-Q176 PolarHBondContact O-NE2 2.82Å; G33-Q176 WeakPolarHBondContact CA-O 3.23Å; V34-Q176 HydrophobicContact CG2-CG 3.96Å; V34-Q176 PolarHBondContact N-O 2.83Å; V34-Q176 PolarHBondContact O-N 2.87Å; A36-Q176 HydrophobicContact CB-CB 4.22Å; A36-Q176 HydrophobicContact CB-CG 3.94Å; I158-Q176 VanDerWaalsContact O-CA 3.24Å; I158-Q176 WeakPolarHBondContact O-CA 3.41Å
177	A	92.3	Very high	93.8	Very high	7 Å²	7	41.3 Å²	41.3	6%	0.058	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	139.6	178	0	0	0	0	0	111.7	F157 I158 V209	F157-A177 CarbonylContact C-O 3.6Å; F157-A177 VanDerWaalsContact CA-O 3.23Å; F157-A177 WeakPolarHBondContact CA-O 3.34Å; I158-A177 HydrophobicContact CD1-CB 4.15Å; I158-A177 HydrophobicContact CG1-CB 3.79Å; I158-A177 PolarHBondContact N-O 2.79Å; I158-A177 PolarHBondContact O-N 2.91Å; A177-V209 HydrophobicContact CB-CG1 3.52Å
178	S	92.9	Very high	94.5	Very high	19 Å²	19	35.4 Å²	35.4	13%	0.133	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	126.5	172.7	-173.2	0	0	0	0	110.6	H155 C156	H155-S178 PolarHBondContact ND1-OG 3.29Å; H155-S178 VanDerWaalsContact ND1-OG 3.13Å; C156-S178 CarbonylContact O-C 3.48Å; C156-S178 VanDerWaalsContact O-CA 3.29Å; C156-S178 WeakPolarHBondContact O-CA 3.43Å; C156-S178 PolarHBondContact O-OG 3Å
179	L	93.3	Very high	95.3	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.2	173.6	-61.4	-174.7	0	0	0	109.9	C156 I158 A204 V209 F252	C156-L179 PolarHBondContact N-O 3.04Å; C156-L179 PolarHBondContact O-N 2.8Å; I158-L179 HydrophobicContact CD1-CD1 4.05Å; I158-L179 HydrophobicContact CG1-CD1 4.18Å; I158-L179 HydrophobicContact CG1-CG 4.35Å; I158-L179 HydrophobicContact CG2-CD1 3.7Å; I158-L179 HydrophobicContact CG2-CG 4.44Å; L179-A204 HydrophobicContact CB-CB 3.7Å; L179-A204 HydrophobicContact CD1-CB 4.15Å; L179-V209 HydrophobicContact CD2-CB 3.96Å; L179-V209 HydrophobicContact CD2-CG1 3.83Å; L179-V209 VanDerWaalsContact CD2-O 3.26Å; L179-V209 WeakPolarHBondContact CD2-O 3.25Å; L179-F252 HydrophobicContact CD1-CZ 4.19Å
180	P	95	Very high	95.8	Very high	51 Å²	51	43 Å²	43	33%	0.331	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	136.1	169.4	30.3	-33.4	0	0	0	110	T154 A204 G205	T154-P180 CarbonylContact O-C 3.46Å; T154-P180 WeakPolarHBondContact O-CA 3.27Å; P180-A204 CarbonylContact O-C 3.56Å; P180-A204 VanDerWaalsContact O-CA 3.3Å; P180-A204 WeakPolarHBondContact O-CA 3.47Å; P180-G205 PolarHBondContact O-N 3.3Å
181	V	97.5	Very high	96	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	133.9	174.5	170.9	0	0	0	0	110.4	L150 H152 G153 T154 V202	L150-V181 HydrophobicContact CB-CG1 4Å; L150-V181 HydrophobicContact CB-CG2 4.13Å; L150-V181 HydrophobicContact CD1-CG2 3.6Å; H152-V181 PolarHBondContact ND1-O 3.35Å; G153-V181 PolarHBondContact N-O 2.82Å; T154-V181 WeakPolarHBondContact O-CG2 3.46Å; T154-V181 PolarHBondContact O-N 3.29Å; V181-V202 HydrophobicContact CG1-CG2 4.2Å
182	V	97.8	Very high	96.2	Very high	7 Å²	7	42.6 Å²	42.6	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118.7	171.2	-178.5	0	0	0	0	107.4	V186 C187 W192 C203 G205 P249	V182-V186 HydrophobicContact CG1-CB 3.87Å; V182-V186 HydrophobicContact CG1-CG1 3.75Å; V182-C187 HydrophobicContact CG1-CB 3.92Å; V182-W192 HydrophobicContact CB-CZ3 4.25Å; V182-W192 HydrophobicContact CG1-CE3 4.01Å; V182-W192 HydrophobicContact CG1-CH2 4Å; V182-W192 HydrophobicContact CG1-CZ3 3.42Å; V182-W192 VanDerWaalsContact CG1-CZ3 3.42Å; V182-W192 HydrophobicContact CG2-CH2 4.38Å; V182-W192 HydrophobicContact CG2-CZ3 3.92Å; V182-C203 HydrophobicContact CB-CB 3.85Å; V182-C203 HydrophobicContact CG1-CB 4.5Å; V182-C203 PolarHBondContact N-O 2.83Å; V182-G205 WeakPolarHBondContact CG2-O 3.08Å; V182-P249 HydrophobicContact CB-CG 4.49Å; V182-P249 HydrophobicContact CG2-CB 4.23Å; V182-P249 HydrophobicContact CG2-CG 4.32Å
183	E	97.1	Very high	96.3	Very high	83 Å²	83	40 Å²	40	39%	0.388	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-63	151.1	178	57.8	174.3	178.5	0	0	111.3	H152 S185 V186 C187	H152-E183 HydrophobicContact CB-CB 3.94Å; H152-E183 HydrophobicContact CB-CG 3.87Å; H152-E183 PolarHBondContact ND1-N 3.12Å; E183-S185 VanDerWaalsContact C-N 3.27Å; E183-S185 WeakPolarHBondContact CG-OG 3.29Å; E183-S185 PolarHBondContact O-N 2.84Å; E183-S185 PolarHBondContact OE1-OG 2.04Å; E183-S185 PolarHBondContact OE2-OG 3.08Å; E183-V186 HydrophobicContact CG-CB 4.1Å; E183-V186 HydrophobicContact CG-CG2 3.67Å; E183-V186 PolarHBondContact O-N 3.35Å; E183-V186 WeakPolarHBondContact OE1-CG2 3.47Å; E183-C187 PolarHBondContact O-N 3.24Å
184	H	97.8	Very high	96.3	Very high	71 Å²	71	38.1 Å²	38.1	33%	0.329	21%	0.21	S	C	.	.	H	α-helix	trans	-55.8	-40.9	-175	179.4	-82.1	0	0	0	112.5	V186 C187 S188 K198 T199	H184-V186 VanDerWaalsContact C-N 3.27Å; H184-V186 PolarHBondContact O-N 2.97Å; H184-C187 PolarHBondContact O-N 3.43Å; H184-S188 WeakPolarHBondContact O-CB 3.32Å; H184-S188 PolarHBondContact O-N 2.78Å; H184-S188 PolarHBondContact O-OG 2.93Å; H184-K198 PolarHBondContact CD2-O 3.43Å; H184-K198 VanDerWaalsContact NE2-C 3.33Å; H184-T199 PolarHBondContact NE2-N 2.84Å
185	S	97.7	Very high	96.2	Very high	67 Å²	67	46.4 Å²	46.4	47%	0.469	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-35.5	179.2	52.5	0	0	0	0	113.4	E183	E183-S185 VanDerWaalsContact C-N 3.27Å; E183-S185 WeakPolarHBondContact CG-OG 3.29Å; E183-S185 PolarHBondContact O-N 2.84Å; E183-S185 PolarHBondContact OE1-OG 2.04Å; E183-S185 PolarHBondContact OE2-OG 3.08Å
186	V	97.6	Very high	96.2	Very high	27 Å²	27	47.5 Å²	47.5	16%	0.164	26%	0.257	C	S	.	.	H	α-helix	trans	-78.7	-48	174.5	175.9	0	0	0	0	109.9	V182 E183 H184 S188 R189 W192	V182-V186 HydrophobicContact CG1-CB 3.87Å; V182-V186 HydrophobicContact CG1-CG1 3.75Å; E183-V186 HydrophobicContact CG-CB 4.1Å; E183-V186 HydrophobicContact CG-CG2 3.67Å; E183-V186 PolarHBondContact O-N 3.35Å; E183-V186 WeakPolarHBondContact OE1-CG2 3.47Å; H184-V186 VanDerWaalsContact C-N 3.27Å; H184-V186 PolarHBondContact O-N 2.97Å; V186-S188 PolarHBondContact O-N 2.82Å; V186-R189 WeakPolarHBondContact O-CB 3.37Å; V186-R189 VanDerWaalsContact O-CG 3.29Å; V186-R189 WeakPolarHBondContact O-CG 3.22Å; V186-R189 PolarHBondContact O-N 3.37Å; V186-R189 VanDerWaalsContact O-N 3.11Å; V186-W192 HydrophobicContact CG1-CD2 4.06Å; V186-W192 HydrophobicContact CG1-CE3 4.18Å; V186-W192 HydrophobicContact CG1-CH2 3.69Å; V186-W192 HydrophobicContact CG1-CZ2 3.55Å; V186-W192 HydrophobicContact CG1-CZ3 4.03Å
187	C	97.2	Very high	96.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-30.9	-177.4	-160	0	0	0	0	112.5	V182 E183 H184 R189 W192 W193 V197 C203	V182-C187 HydrophobicContact CG1-CB 3.92Å; E183-C187 PolarHBondContact O-N 3.24Å; H184-C187 PolarHBondContact O-N 3.43Å; C187-R189 VanDerWaalsContact C-N 3.35Å; C187-W192 VanDerWaalsContact O-CB 3.26Å; C187-W192 WeakPolarHBondContact O-CB 3.42Å; C187-W193 WeakPolarHBondContact O-CB 3.34Å; C187-W193 PolarHBondContact O-N 3.33Å; C187-W193 VanDerWaalsContact SG-CD1 3.56Å; C187-V197 HydrophobicContact CB-CG1 4.3Å; C187-C203 HydrophobicContact CB-CB 3.75Å; C187-C203 WeakPolarHBondContact CB-SG 3.48Å; C187-C203 WeakPolarHBondContact SG-CB 3.45Å; C187-C203 CovalentContact SG-SG 2.03Å; C187-C203 PolarHBondContact SG-SG 2.82Å
188	S	98	Very high	96.6	Very high	40 Å²	40	50.8 Å²	50.8	28%	0.28	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	6.5	180	73.8	0	0	0	0	114.4	H184 V186 G194	H184-S188 WeakPolarHBondContact O-CB 3.32Å; H184-S188 PolarHBondContact O-N 2.78Å; H184-S188 PolarHBondContact O-OG 2.93Å; V186-S188 PolarHBondContact O-N 2.82Å; S188-G194 WeakPolarHBondContact CA-O 3.41Å; S188-G194 WeakPolarHBondContact O-CA 3.44Å
189	R	98.1	Very high	96.9	Very high	124 Å²	124	54.5 Å²	54.5	47%	0.468	29%	0.292	S	S	.	.	S	Bend	trans	-65.8	152.5	173.5	-68.5	169.4	50.8	154.5	-3.2	110.6	V186 C187 D191 W192 G194	V186-R189 WeakPolarHBondContact O-CB 3.37Å; V186-R189 VanDerWaalsContact O-CG 3.29Å; V186-R189 WeakPolarHBondContact O-CG 3.22Å; V186-R189 PolarHBondContact O-N 3.37Å; V186-R189 VanDerWaalsContact O-N 3.11Å; C187-R189 VanDerWaalsContact C-N 3.35Å; R189-D191 VanDerWaalsContact C-N 3.26Å; R189-D191 WeakPolarHBondContact CB-OD1 3.3Å; R189-D191 IonicContact CZ-OD1 3.16Å; R189-D191 IonicContact CZ-OD2 2.74Å; R189-D191 IonicContact NE-OD1 3.91Å; R189-D191 PolarHBondContact NE-OD1 3.15Å; R189-D191 IonicContact NE-OD2 3.29Å; R189-D191 IonicContact NH2-OD1 3.95Å; R189-D191 PolarHBondContact NH2-OD1 3.35Å; R189-D191 IonicContact NH2-OD2 2.73Å; R189-D191 PolarHBondContact NH2-OD2 3.06Å; R189-D191 PolarHBondContact O-N 2.87Å; R189-W192 HydrophobicContact CB-CB 4.31Å; R189-W192 HydrophobicContact CB-CG 4.31Å; R189-W192 CarbonylContact O-C 3.45Å; R189-W192 WeakPolarHBondContact O-CA 3.34Å; R189-W192 WeakPolarHBondContact O-CB 3.3Å; R189-W192 PolarHBondContact O-N 2.87Å; R189-G194 VanDerWaalsContact O-CA 3.26Å; R189-G194 WeakPolarHBondContact O-CA 3.1Å; R189-G194 PolarHBondContact O-N 3.21Å
190	S	96.5	Very high	97.1	Very high	121 Å²	121	56.3 Å²	56.3	85%	0.846	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.5	-177.8	53.6	0	0	0	0	114.1	W192	S190-W192 VanDerWaalsContact C-N 3.3Å
191	D	94.3	Very high	97.3	Very high	58 Å²	58	54.3 Å²	54.3	31%	0.31	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.7	172.5	54.9	-26.2	0	0	0	113.2	R189 K248	R189-D191 VanDerWaalsContact C-N 3.26Å; R189-D191 WeakPolarHBondContact CB-OD1 3.3Å; R189-D191 IonicContact CZ-OD1 3.16Å; R189-D191 IonicContact CZ-OD2 2.74Å; R189-D191 IonicContact NE-OD1 3.91Å; R189-D191 PolarHBondContact NE-OD1 3.15Å; R189-D191 IonicContact NE-OD2 3.29Å; R189-D191 IonicContact NH2-OD1 3.95Å; R189-D191 PolarHBondContact NH2-OD1 3.35Å; R189-D191 IonicContact NH2-OD2 2.73Å; R189-D191 PolarHBondContact NH2-OD2 3.06Å; R189-D191 PolarHBondContact O-N 2.87Å; D191-K248 PolarHBondContact O-NZ 3.42Å
192	W	96.6	Very high	97.3	Very high	42 Å²	42	54.9 Å²	54.9	16%	0.159	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-132.7	177.3	-70	57.3	0	0	0	110.1	V182 V186 C187 R189 S190 G194 Q247 K248 P249	V182-W192 HydrophobicContact CB-CZ3 4.25Å; V182-W192 HydrophobicContact CG1-CE3 4.01Å; V182-W192 HydrophobicContact CG1-CH2 4Å; V182-W192 HydrophobicContact CG1-CZ3 3.42Å; V182-W192 VanDerWaalsContact CG1-CZ3 3.42Å; V182-W192 HydrophobicContact CG2-CH2 4.38Å; V182-W192 HydrophobicContact CG2-CZ3 3.92Å; V186-W192 HydrophobicContact CG1-CD2 4.06Å; V186-W192 HydrophobicContact CG1-CE3 4.18Å; V186-W192 HydrophobicContact CG1-CH2 3.69Å; V186-W192 HydrophobicContact CG1-CZ2 3.55Å; V186-W192 HydrophobicContact CG1-CZ3 4.03Å; C187-W192 VanDerWaalsContact O-CB 3.26Å; C187-W192 WeakPolarHBondContact O-CB 3.42Å; R189-W192 HydrophobicContact CB-CB 4.31Å; R189-W192 HydrophobicContact CB-CG 4.31Å; R189-W192 CarbonylContact O-C 3.45Å; R189-W192 WeakPolarHBondContact O-CA 3.34Å; R189-W192 WeakPolarHBondContact O-CB 3.3Å; R189-W192 PolarHBondContact O-N 2.87Å; S190-W192 VanDerWaalsContact C-N 3.3Å; W192-G194 VanDerWaalsContact C-N 3.29Å; W192-Q247 WeakPolarHBondContact CA-O 3.28Å; W192-Q247 HydrophobicContact CD2-CB 3.98Å; W192-Q247 HydrophobicContact CD2-CG 4.4Å; W192-Q247 HydrophobicContact CE3-CB 4.49Å; W192-Q247 HydrophobicContact CG-CB 4.11Å; W192-Q247 HydrophobicContact CZ2-CB 4.49Å; W192-Q247 HydrophobicContact CZ2-CG 4.12Å; W192-K248 WeakPolarHBondContact O-CE 3.43Å; W192-K248 PolarHBondContact O-NZ 3.45Å; W192-P249 HydrophobicContact CE3-CG 4.09Å; W192-P249 HydrophobicContact CZ3-CG 4.03Å
193	W	96.4	Very high	97.3	Very high	34 Å²	34	54.7 Å²	54.7	13%	0.129	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.5	177.8	-76.8	116	0	0	0	113.4	C187 H195 T196 V197 F237 K248 P249 V251	C187-W193 WeakPolarHBondContact O-CB 3.34Å; C187-W193 PolarHBondContact O-N 3.33Å; C187-W193 VanDerWaalsContact SG-CD1 3.56Å; W193-H195 PolarHBondContact O-N 3.2Å; W193-T196 HydrophobicContact CE3-CG2 4.23Å; W193-T196 WeakPolarHBondContact O-CB 3.2Å; W193-T196 PolarHBondContact O-N 3.02Å; W193-T196 VanDerWaalsContact O-N 3.08Å; W193-T196 PolarHBondContact O-OG1 2.84Å; W193-V197 HydrophobicContact CB-CB 4.16Å; W193-V197 HydrophobicContact CB-CG1 4.26Å; W193-F237 HydrophobicContact CD2-CE2 4.33Å; W193-F237 HydrophobicContact CE3-CE2 4.25Å; W193-F237 HydrophobicContact CH2-CD2 4.08Å; W193-F237 AromaticContact CH2-CE2 3.97Å; W193-F237 HydrophobicContact CH2-CE2 3.97Å; W193-F237 HydrophobicContact CZ2-CD2 4.26Å; W193-F237 HydrophobicContact CZ2-CE2 4.08Å; W193-F237 HydrophobicContact CZ3-CE2 4.08Å; W193-K248 HydrophobicContact CD2-CD 3.77Å; W193-K248 HydrophobicContact CE3-CD 3.91Å; W193-K248 HydrophobicContact CG-CD 4.33Å; W193-K248 HydrophobicContact CH2-CB 4.49Å; W193-K248 HydrophobicContact CH2-CD 4.25Å; W193-K248 HydrophobicContact CZ2-CB 3.84Å; W193-K248 HydrophobicContact CZ2-CD 4.1Å; W193-K248 HydrophobicContact CZ2-CG 4.49Å; W193-K248 HydrophobicContact CZ3-CD 4.14Å; W193-P249 PolarHBondContact NE1-O 3.18Å; W193-V251 HydrophobicContact CD2-CG2 4.39Å; W193-V251 HydrophobicContact CG-CG2 4.33Å; W193-V251 HydrophobicContact CZ2-CG2 4.42Å
194	G	97.5	Very high	97.3	Very high	11 Å²	11	50.7 Å²	50.7	11%	0.113	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	54.9	-132.6	178.1	0	0	0	0	0	112.3	S188 R189 W192 T196	S188-G194 WeakPolarHBondContact CA-O 3.41Å; S188-G194 WeakPolarHBondContact O-CA 3.44Å; R189-G194 VanDerWaalsContact O-CA 3.26Å; R189-G194 WeakPolarHBondContact O-CA 3.1Å; R189-G194 PolarHBondContact O-N 3.21Å; W192-G194 VanDerWaalsContact C-N 3.29Å; G194-T196 PolarHBondContact O-N 2.59Å
195	H	95.8	Very high	97.1	Very high	177 Å²	177	47.8 Å²	47.8	82%	0.819	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-77.7	-3.9	-179.6	-57.8	-65.1	0	0	0	114.4	W193 K198	W193-H195 PolarHBondContact O-N 3.2Å; H195-K198 PolarHBondContact O-NZ 2.82Å
196	T	96.9	Very high	96.2	Very high	52 Å²	52	45.2 Å²	45.2	32%	0.319	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-66.9	-42.9	178.5	-56.9	0	0	0	0	110.9	A118 W193 G194 F237	A118-T196 HydrophobicContact CB-CG2 3.84Å; W193-T196 HydrophobicContact CE3-CG2 4.23Å; W193-T196 WeakPolarHBondContact O-CB 3.2Å; W193-T196 PolarHBondContact O-N 3.02Å; W193-T196 VanDerWaalsContact O-N 3.08Å; W193-T196 PolarHBondContact O-OG1 2.84Å; G194-T196 PolarHBondContact O-N 2.59Å; T196-F237 HydrophobicContact CG2-CE2 4.17Å; T196-F237 HydrophobicContact CG2-CZ 3.96Å
197	V	97.5	Very high	95.4	Very high	6 Å²	6	48.8 Å²	48.8	4%	0.036	27%	0.265	C	S	.	.			trans	-76.1	140.2	178	70.8	0	0	0	0	111	C187 W193 M201	C187-V197 HydrophobicContact CB-CG1 4.3Å; W193-V197 HydrophobicContact CB-CB 4.16Å; W193-V197 HydrophobicContact CB-CG1 4.26Å; V197-M201 HydrophobicContact CG2-CB 3.92Å; V197-M201 HydrophobicContact CG2-SD 4.12Å
198	K	97.8	Very high	94.3	Very high	73 Å²	73	52.5 Å²	52.5	32%	0.317	29%	0.287	S	S	.	.			trans	-114.8	165.7	178.1	-51.2	-57.3	178.2	-168.3	0	111.1	A118 H184 H195 T200 M201	A118-K198 WeakPolarHBondContact O-CE 2.98Å; H184-K198 PolarHBondContact CD2-O 3.43Å; H184-K198 VanDerWaalsContact NE2-C 3.33Å; H195-K198 PolarHBondContact O-NZ 2.82Å; K198-T200 PolarHBondContact O-N 3.01Å; K198-M201 HydrophobicContact CB-CE 4.37Å; K198-M201 HydrophobicContact CB-CG 4.33Å; K198-M201 HydrophobicContact CB-SD 4.17Å; K198-M201 HydrophobicContact CG-CE 3.96Å; K198-M201 HydrophobicContact CG-SD 4.22Å; K198-M201 PolarHBondContact N-SD 3.21Å; K198-M201 VanDerWaalsContact N-SD 3.38Å; K198-M201 WeakPolarHBondContact O-CB 3.02Å; K198-M201 PolarHBondContact O-N 2.93Å
199	T	97.6	Very high	93.5	Very high	98 Å²	98	51.9 Å²	51.9	60%	0.601	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.1	174.5	53.1	0	0	0	0	113.5	H184 M201 R254	H184-T199 PolarHBondContact NE2-N 2.84Å; T199-M201 PolarHBondContact O-N 3.37Å; T199-R254 PolarHBondContact O-NE 2.81Å; T199-R254 PolarHBondContact O-NH2 3.15Å
200	T	98.3	Very high	92.6	Very high	38 Å²	38	47 Å²	47	23%	0.233	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	6.2	170.7	52.6	0	0	0	0	112.8	K198 R254 A257 F258	K198-T200 PolarHBondContact O-N 3.01Å; T200-R254 WeakPolarHBondContact O-CB 3.49Å; T200-R254 PolarHBondContact O-N 2.74Å; T200-A257 HydrophobicContact CG2-CB 4.2Å; T200-F258 HydrophobicContact CG2-CZ 4.39Å
201	M	98.6	Very high	91.8	Very high	9 Å²	9	41.2 Å²	41.2	4%	0.044	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	158.5	178.3	-59.1	169.4	178.5	0	0	111	V197 K198 T199 F237 V251 F252	V197-M201 HydrophobicContact CG2-CB 3.92Å; V197-M201 HydrophobicContact CG2-SD 4.12Å; K198-M201 HydrophobicContact CB-CE 4.37Å; K198-M201 HydrophobicContact CB-CG 4.33Å; K198-M201 HydrophobicContact CB-SD 4.17Å; K198-M201 HydrophobicContact CG-CE 3.96Å; K198-M201 HydrophobicContact CG-SD 4.22Å; K198-M201 PolarHBondContact N-SD 3.21Å; K198-M201 VanDerWaalsContact N-SD 3.38Å; K198-M201 WeakPolarHBondContact O-CB 3.02Å; K198-M201 PolarHBondContact O-N 2.93Å; T199-M201 PolarHBondContact O-N 3.37Å; M201-F237 HydrophobicContact CE-CE1 4.18Å; M201-F237 HydrophobicContact SD-CE1 4.24Å; M201-F237 HydrophobicContact SD-CZ 4.42Å; M201-V251 HydrophobicContact CB-CG1 3.86Å; M201-V251 HydrophobicContact CG-CG1 4.08Å; M201-V251 HydrophobicContact SD-CG1 3.71Å; M201-F252 CarbonylContact C-O 3.4Å; M201-F252 WeakPolarHBondContact CA-O 3.41Å; M201-F252 WeakPolarHBondContact CB-O 3.09Å
202	V	98.2	Very high	91.4	Very high	15 Å²	15	38.9 Å²	38.9	9%	0.091	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.5	169.5	63.4	0	0	0	0	109.3	V181 L220 F252 R254	V181-V202 HydrophobicContact CG1-CG2 4.2Å; V202-L220 HydrophobicContact CG1-CD2 3.87Å; V202-L220 HydrophobicContact CG2-CD2 4.48Å; V202-F252 HydrophobicContact CG1-CB 3.69Å; V202-F252 HydrophobicContact CG1-CD2 4.36Å; V202-F252 HydrophobicContact CG1-CG 4.34Å; V202-F252 PolarHBondContact N-O 2.03Å; V202-F252 PolarHBondContact O-N 2.94Å; V202-R254 HydrophobicContact CB-CB 4.4Å
203	C	97.9	Very high	90.2	Very high	2 Å²	2	41 Å²	41	1%	0.014	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	140.2	177.3	-60.9	0	0	0	0	109.7	V182 C187 P249 T250	V182-C203 HydrophobicContact CB-CB 3.85Å; V182-C203 HydrophobicContact CG1-CB 4.5Å; V182-C203 PolarHBondContact N-O 2.83Å; C187-C203 HydrophobicContact CB-CB 3.75Å; C187-C203 WeakPolarHBondContact CB-SG 3.48Å; C187-C203 WeakPolarHBondContact SG-CB 3.45Å; C187-C203 CovalentContact SG-SG 2.03Å; C187-C203 PolarHBondContact SG-SG 2.82Å; C203-P249 HydrophobicContact CB-CB 4.17Å; C203-P249 HydrophobicContact CB-CG 3.75Å; C203-T250 WeakPolarHBondContact CA-O 3.26Å
204	A	96.6	Very high	89.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	145.2	171.2	0	0	0	0	0	111.5	L179 P180 L220 P249 T250 F252	L179-A204 HydrophobicContact CB-CB 3.7Å; L179-A204 HydrophobicContact CD1-CB 4.15Å; P180-A204 CarbonylContact O-C 3.56Å; P180-A204 VanDerWaalsContact O-CA 3.3Å; P180-A204 WeakPolarHBondContact O-CA 3.47Å; A204-L220 HydrophobicContact CB-CD1 4.14Å; A204-L220 HydrophobicContact CB-CD2 4.38Å; A204-P249 VanDerWaalsContact O-CB 3.27Å; A204-P249 WeakPolarHBondContact O-CB 3.45Å; A204-T250 PolarHBondContact N-O 3.36Å; A204-T250 PolarHBondContact O-N 2.96Å; A204-F252 HydrophobicContact CB-CE2 3.88Å
205	G	93.2	Very high	88.7	Confident	10 Å²	10	39.8 Å²	39.8	10%	0.103	22%	0.223	C	C	.	.			trans	89.1	-133.1	-175.2	0	0	0	0	0	112.4	P180 V182	P180-G205 PolarHBondContact O-N 3.3Å; V182-G205 WeakPolarHBondContact CG2-O 3.08Å
206	G	79.6	Confident	88.7	Confident	12 Å²	12	32.6 Å²	32.6	12%	0.124	19%	0.193	C	C	.	.			trans	97	19.1	-177.9	0	0	0	0	0	114.2	Q247	G206-Q247 PolarHBondContact O-N 2.79Å
207	D	80	Confident	88.7	Confident	103 Å²	103	30.1 Å²	30.1	55%	0.551	18%	0.178	S	C	*	.	S	Bend	trans	-138.4	-146.2	173.3	-163.6	-4.3	0	0	0	108.4	V209	D207-V209 PolarHBondContact O-N 2.82Å; D207-V209 VanDerWaalsContact O-N 3.09Å
208	V	75.4	Confident	88.8	Confident	78 Å²	78	29.9 Å²	29.9	47%	0.473	18%	0.177	S	C	.	.	S	Bend	trans	-58	-25.9	-172.4	-161.5	0	0	0	0	115.3	N32 N244	N32-V208 WeakPolarHBondContact OD1-CG1 3.46Å; V208-N244 WeakPolarHBondContact O-CB 3.23Å; V208-N244 PolarHBondContact O-ND2 2.93Å
209	V	79.8	Confident	88.8	Confident	26 Å²	26	26.4 Å²	26.4	16%	0.158	16%	0.161	C	C	.	.			trans	-112.5	134.1	-173.2	-168.3	0	0	0	0	110.9	A177 L179 D207	A177-V209 HydrophobicContact CB-CG1 3.52Å; L179-V209 HydrophobicContact CD2-CB 3.96Å; L179-V209 HydrophobicContact CD2-CG1 3.83Å; L179-V209 VanDerWaalsContact CD2-O 3.26Å; L179-V209 WeakPolarHBondContact CD2-O 3.25Å; D207-V209 PolarHBondContact O-N 2.82Å; D207-V209 VanDerWaalsContact O-N 3.09Å
210	S	80.3	Confident	88.9	Confident	21 Å²	21	21.7 Å²	21.7	15%	0.147	13%	0.133	C	C	.	.			trans	-158.6	163.2	-177.1	-167.8	0	0	0	0	111	C243 T250	S210-C243 WeakPolarHBondContact CB-O 3.24Å; S210-C243 PolarHBondContact OG-O 3.36Å; S210-T250 PolarHBondContact OG-OG1 2.92Å
211	A	79.9	Confident	88.9	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.008	12%	0.122	C	C	.	.			trans	-69.5	160.5	164.5	0	0	0	0	0	111	I158 D215 T235 V238 C243 T250	I158-A211 HydrophobicContact CD1-CB 4Å; A211-D215 HydrophobicContact CB-CB 4Å; A211-T235 HydrophobicContact CB-CG2 3.88Å; A211-V238 HydrophobicContact CB-CG1 4.48Å; A211-V238 WeakPolarHBondContact O-CG1 3.21Å; A211-C243 VanDerWaalsContact O-CB 3.3Å; A211-C243 WeakPolarHBondContact O-CB 3.34Å; A211-T250 HydrophobicContact CB-CG2 3.62Å; A211-T250 PolarHBondContact N-OG1 3.15Å; A211-T250 VanDerWaalsContact N-OG1 3.08Å
212	C	84.8	Confident	88.8	Confident	9 Å²	9	19.6 Å²	19.6	6%	0.061	12%	0.121	C	C	.	.			trans	-141.1	-179.5	179.5	-109.8	0	0	0	0	111.7	N163 Y165 G214 D215 C243	N163-C212 HydrophobicContact CB-CB 4.09Å; N163-C212 WeakPolarHBondContact O-CB 3.42Å; N163-C212 PolarHBondContact O-SG 2.51Å; Y165-C212 VanDerWaalsContact C-SG 3.5Å; C212-G214 PolarHBondContact O-N 3.42Å; C212-D215 PolarHBondContact N-OD2 3.11Å; C212-D215 WeakPolarHBondContact O-CB 3.34Å; C212-D215 PolarHBondContact O-N 3.29Å; C212-C243 WeakPolarHBondContact CA-SG 3.38Å; C212-C243 HydrophobicContact CB-CB 4.07Å; C212-C243 WeakPolarHBondContact CB-SG 3.27Å; C212-C243 WeakPolarHBondContact SG-CB 3.21Å; C212-C243 CovalentContact SG-SG 2.03Å; C212-C243 PolarHBondContact SG-SG 3.19Å
213	N	72.3	Confident	88.8	Confident	85 Å²	85	23.5 Å²	23.5	46%	0.455	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	126.6	177	-66.5	-29	0	0	0	111.3	G162 N163	G162-N213 CarbonylContact C-O 3.51Å; G162-N213 WeakPolarHBondContact CA-O 3.02Å; N163-N213 PolarHBondContact N-O 2.94Å
214	G	75.6	Confident	88.7	Confident	6 Å²	6	24.4 Å²	24.4	6%	0.062	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.7	-21.2	-174.8	0	0	0	0	0	114.1	H57 C212 S216	H57-G214 PolarHBondContact NE2-O 3.08Å; C212-G214 PolarHBondContact O-N 3.42Å; G214-S216 VanDerWaalsContact C-N 3.28Å
215	D	87.3	Confident	88.6	Confident	14 Å²	14	34.6 Å²	34.6	8%	0.075	20%	0.198	C	C	.	.			trans	-81.2	-10.5	171.5	-62.1	-43.9	0	0	0	112.9	G160 G162 A211 C212 G217 G218 T235	G160-D215 WeakPolarHBondContact CA-OD1 3.11Å; G162-D215 WeakPolarHBondContact CA-OD1 3.33Å; G162-D215 PolarHBondContact N-OD1 3.45Å; A211-D215 HydrophobicContact CB-CB 4Å; C212-D215 PolarHBondContact N-OD2 3.11Å; C212-D215 WeakPolarHBondContact O-CB 3.34Å; C212-D215 PolarHBondContact O-N 3.29Å; D215-G217 PolarHBondContact O-N 3.28Å; D215-G218 VanDerWaalsContact O-CA 3.29Å; D215-G218 WeakPolarHBondContact O-CA 3.19Å; D215-G218 PolarHBondContact O-N 3.33Å; D215-T235 HydrophobicContact CB-CG2 4.49Å; D215-T235 VanDerWaalsContact O-CB 3.32Å; D215-T235 WeakPolarHBondContact O-CB 3.17Å; D215-T235 PolarHBondContact O-OG1 2.96Å
216	S	95.1	Very high	88.7	Confident	26 Å²	26	38 Å²	38	18%	0.182	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.4	132.5	173.9	-78.9	0	0	0	0	112.3	C59 G60 H74 G214 G218	C59-S216 CarbonylContact C-O 3.44Å; C59-S216 WeakPolarHBondContact CA-O 3.42Å; C59-S216 WeakPolarHBondContact CB-O 3.02Å; C59-S216 VanDerWaalsContact SG-CB 3.54Å; G60-S216 PolarHBondContact N-O 2.95Å; H74-S216 WeakPolarHBondContact NE2-CB 3.42Å; H74-S216 PolarHBondContact NE2-OG 2.75Å; G214-S216 VanDerWaalsContact C-N 3.28Å; S216-G218 PolarHBondContact O-N 2.84Å; S216-G218 VanDerWaalsContact O-N 3.13Å
217	G	98	Very high	89.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	-9.1	-174.9	0	0	0	0	0	115.6	G61 D215 T235	G61-G217 WeakPolarHBondContact CA-O 3.41Å; D215-G217 PolarHBondContact O-N 3.28Å; G217-T235 PolarHBondContact N-O 3.48Å
218	G	98.1	Very high	90.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.01	22%	0.219	C	C	.	.			trans	-67.6	159.6	177.3	0	0	0	0	0	113.5	D215 S216 T235	D215-G218 VanDerWaalsContact O-CA 3.29Å; D215-G218 WeakPolarHBondContact O-CA 3.19Å; D215-G218 PolarHBondContact O-N 3.33Å; S216-G218 PolarHBondContact O-N 2.84Å; S216-G218 VanDerWaalsContact O-N 3.13Å; G218-T235 PolarHBondContact O-N 3.21Å; G218-T235 PolarHBondContact O-OG1 2.8Å
219	P	98.6	Very high	91.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	143.8	-173.7	27.6	-32.5	0	0	0	114.3	Q44 T62 S159 I231	Q44-P219 VanDerWaalsContact OE1-CD 3.26Å; T62-P219 WeakPolarHBondContact OG1-CB 3.33Å; S159-P219 WeakPolarHBondContact OG-CG 3.3Å; P219-I231 HydrophobicContact CB-CD1 3.77Å; P219-I231 HydrophobicContact CB-CG2 4.18Å
220	L	98.5	Very high	92.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	100	152.8	-175.9	67.4	0	0	0	109.1	C156 I158 V202 A204 Q232 G233 F252	C156-L220 HydrophobicContact CB-CD1 3.58Å; C156-L220 HydrophobicContact CB-CG 3.9Å; I158-L220 HydrophobicContact CG2-CD1 4.03Å; V202-L220 HydrophobicContact CG1-CD2 3.87Å; V202-L220 HydrophobicContact CG2-CD2 4.48Å; A204-L220 HydrophobicContact CB-CD1 4.14Å; A204-L220 HydrophobicContact CB-CD2 4.38Å; L220-Q232 PolarHBondContact O-N 2.93Å; L220-G233 PolarHBondContact N-O 3.07Å; L220-F252 HydrophobicContact CB-CD1 3.76Å; L220-F252 HydrophobicContact CB-CE1 3.82Å; L220-F252 HydrophobicContact CB-CG 4.27Å; L220-F252 HydrophobicContact CB-CZ 4.36Å; L220-F252 HydrophobicContact CD1-CE1 4.21Å; L220-F252 HydrophobicContact CD1-CE2 4.22Å; L220-F252 HydrophobicContact CD1-CZ 3.94Å; L220-F252 HydrophobicContact CD2-CD2 4.1Å; L220-F252 HydrophobicContact CD2-CE2 4.28Å; L220-F252 HydrophobicContact CD2-CG 4.26Å; L220-F252 HydrophobicContact CG-CE1 4.47Å
221	N	98.5	Very high	93.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	120.9	-176.8	-51.6	-84.4	0	0	0	110.9	W41 W43 C156 F157 S159 W229 I231	W41-N221 HydrophobicContact CE3-CB 4.13Å; W41-N221 HydrophobicContact CH2-CB 3.77Å; W41-N221 HydrophobicContact CZ3-CB 3.44Å; W41-N221 VanDerWaalsContact CZ3-CB 3.44Å; W43-N221 PolarHBondContact NE1-OD1 3.1Å; C156-N221 CarbonylContact C-O 3.52Å; C156-N221 VanDerWaalsContact CA-O 3.27Å; C156-N221 WeakPolarHBondContact CA-O 3.1Å; C156-N221 WeakPolarHBondContact CB-O 3.24Å; F157-N221 HydrophobicContact CB-CB 4.37Å; F157-N221 PolarHBondContact N-O 2.9Å; F157-N221 WeakPolarHBondContact O-CB 3.12Å; F157-N221 PolarHBondContact O-N 2.76Å; F157-N221 PolarHBondContact O-ND2 3.34Å; S159-N221 PolarHBondContact OG-ND2 3.33Å; N221-W229 HydrophobicContact CB-CE3 3.93Å; N221-W229 HydrophobicContact CB-CZ3 4.34Å; N221-I231 WeakPolarHBondContact OD1-CD1 3.2Å
222	C	98.1	Very high	94	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.02	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.5	176.4	-51.7	0	0	0	0	110.6	L150 C156 G224 Y230 Q232	L150-C222 VanDerWaalsContact CD1-SG 3.51Å; C156-C222 HydrophobicContact CB-CB 4.13Å; C156-C222 WeakPolarHBondContact CB-SG 3.43Å; C156-C222 WeakPolarHBondContact SG-CB 3.45Å; C156-C222 CovalentContact SG-SG 2.03Å; C156-C222 PolarHBondContact SG-SG 3.03Å; C222-G224 PolarHBondContact O-N 3.2Å; C222-Y230 PolarHBondContact N-O 3.5Å; C222-Y230 PolarHBondContact O-N 3.2Å; C222-Q232 HydrophobicContact CB-CG 3.67Å; C222-Q232 WeakPolarHBondContact SG-CG 3.47Å
223	L	97.2	Very high	94.7	Very high	96 Å²	96	34.9 Å²	34.9	50%	0.503	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	118.4	179.8	-174.1	65.4	0	0	0	109.8	W229	L223-W229 HydrophobicContact CB-CD2 4.37Å; L223-W229 HydrophobicContact CB-CE3 4.08Å; L223-W229 HydrophobicContact CB-CH2 3.97Å; L223-W229 HydrophobicContact CB-CZ2 4.25Å; L223-W229 HydrophobicContact CB-CZ3 3.86Å; L223-W229 HydrophobicContact CD1-CD2 4.06Å; L223-W229 HydrophobicContact CD1-CG 4.36Å; L223-W229 HydrophobicContact CD1-CZ2 4.1Å
224	G	95.7	Very high	95.9	Very high	22 Å²	22	30.9 Å²	30.9	23%	0.227	17%	0.167	C	C	.	.			trans	-74.6	162.9	174.7	0	0	0	0	0	112.5	C222 D226 G227 R228	C222-G224 PolarHBondContact O-N 3.2Å; G224-D226 PolarHBondContact O-N 3.47Å; G224-G227 PolarHBondContact O-N 2.98Å; G224-R228 PolarHBondContact N-O 2.64Å
225	Q	93.9	Very high	97	Very high	213 Å²	213	30.8 Å²	30.8	100%	0.995	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.7	178.2	-64.6	-178.4	-6.2	0	0	113.2	G227	Q225-G227 PolarHBondContact O-N 3.36Å
226	D	95.5	Very high	97.5	Very high	83 Å²	83	30.5 Å²	30.5	44%	0.444	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	2.7	175.2	67.8	-6.7	0	0	0	113.3	G224 R228 Y230	G224-D226 PolarHBondContact O-N 3.47Å; D226-R228 VanDerWaalsContact C-N 3.33Å; D226-R228 WeakPolarHBondContact OD1-CB 3.45Å; D226-R228 PolarHBondContact OD1-N 3.36Å; D226-R228 IonicContact OD1-NE 3.48Å; D226-R228 IonicContact OD2-CZ 3.76Å; D226-R228 IonicContact OD2-NE 2.97Å; D226-R228 PolarHBondContact OD2-NE 3.37Å; D226-R228 IonicContact OD2-NH2 3.36Å; D226-R228 PolarHBondContact OD2-NH2 3.13Å; D226-Y230 PolarHBondContact OD2-OH 2.89Å
227	G	95.3	Very high	97.5	Very high	44 Å²	44	30.9 Å²	30.9	45%	0.454	16%	0.163	S	C	.	.	S	Bend	trans	80.5	7.9	179.2	0	0	0	0	0	114.8	G224 Q225	G224-G227 PolarHBondContact O-N 2.98Å; Q225-G227 PolarHBondContact O-N 3.36Å
228	R	97.6	Very high	97.3	Very high	86 Å²	86	32.4 Å²	32.4	33%	0.325	17%	0.173	S	C	.	.			trans	-97.6	155.5	174.5	-61.4	-173.1	-67.4	168.6	-5	111.7	C18 G19 G224 D226 Y230	C18-R228 WeakPolarHBondContact O-CD 3.4Å; C18-R228 PolarHBondContact SG-NH1 3Å; C18-R228 VanDerWaalsContact SG-NH1 3.45Å; G19-R228 CarbonylContact O-C 3.53Å; G19-R228 WeakPolarHBondContact O-CA 3.28Å; G224-R228 PolarHBondContact N-O 2.64Å; D226-R228 VanDerWaalsContact C-N 3.33Å; D226-R228 WeakPolarHBondContact OD1-CB 3.45Å; D226-R228 PolarHBondContact OD1-N 3.36Å; D226-R228 IonicContact OD1-NE 3.48Å; D226-R228 IonicContact OD2-CZ 3.76Å; D226-R228 IonicContact OD2-NE 2.97Å; D226-R228 PolarHBondContact OD2-NE 3.37Å; D226-R228 IonicContact OD2-NH2 3.36Å; D226-R228 PolarHBondContact OD2-NH2 3.13Å; R228-Y230 HydrophobicContact CB-CE2 3.96Å; R228-Y230 PolarHBondContact NH2-OH 3.36Å; R228-Y230 WeakPolarHBondContact O-CD2 3.49Å
229	W	98.4	Very high	96.9	Very high	10 Å²	10	33.1 Å²	33.1	4%	0.038	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	132.9	176	-67.1	92.2	0	0	0	111.7	G19 P25 T27 W41 W43 C142 F157 N221 L223	G19-W229 WeakPolarHBondContact CA-O 3.3Å; G19-W229 PolarHBondContact O-N 3.02Å; P25-W229 HydrophobicContact CG-CH2 4.29Å; P25-W229 HydrophobicContact CG-CZ2 3.48Å; P25-W229 VanDerWaalsContact CG-CZ2 3.48Å; T27-W229 HydrophobicContact CG2-CH2 3.93Å; T27-W229 HydrophobicContact CG2-CZ2 3.97Å; W41-W229 AromaticContact CH2-CD2 3.93Å; W41-W229 HydrophobicContact CH2-CD2 3.93Å; W41-W229 AromaticContact CH2-CE3 3.69Å; W41-W229 HydrophobicContact CH2-CE3 3.69Å; W41-W229 AromaticContact CH2-CH2 3.65Å; W41-W229 HydrophobicContact CH2-CH2 3.65Å; W41-W229 AromaticContact CH2-CZ2 3.9Å; W41-W229 HydrophobicContact CH2-CZ2 3.9Å; W41-W229 AromaticContact CH2-CZ3 3.55Å; W41-W229 HydrophobicContact CH2-CZ3 3.55Å; W41-W229 AromaticContact CZ3-CD2 3.63Å; W41-W229 HydrophobicContact CZ3-CD2 3.63Å; W41-W229 AromaticContact CZ3-CE2 3.99Å; W41-W229 AromaticContact CZ3-CE3 3.65Å; W41-W229 HydrophobicContact CZ3-CE3 3.65Å; W41-W229 HydrophobicContact CZ3-CG 4.11Å; W41-W229 HydrophobicContact CZ3-CH2 4.36Å; W41-W229 HydrophobicContact CZ3-CZ2 4.35Å; W41-W229 HydrophobicContact CZ3-CZ3 4.03Å; W43-W229 HydrophobicContact CH2-CB 3.42Å; W43-W229 VanDerWaalsContact CH2-CB 3.42Å; W43-W229 AromaticContact CH2-CD1 3.78Å; W43-W229 AromaticContact CH2-CG 3.72Å; W43-W229 HydrophobicContact CH2-CG 3.72Å; W43-W229 HydrophobicContact CZ2-CB 3.48Å; W43-W229 VanDerWaalsContact CZ2-CB 3.48Å; W43-W229 AromaticContact CZ2-CG 3.93Å; W43-W229 HydrophobicContact CZ2-CG 3.93Å; C142-W229 WeakPolarHBondContact CB-O 3.16Å; C142-W229 PolarHBondContact N-O 2.78Å; F157-W229 AromaticContact CD2-CH2 3.81Å; F157-W229 HydrophobicContact CD2-CH2 3.81Å; F157-W229 AromaticContact CD2-CZ3 3.82Å; F157-W229 HydrophobicContact CD2-CZ3 3.82Å; F157-W229 HydrophobicContact CE2-CH2 4.04Å; F157-W229 HydrophobicContact CE2-CZ3 4.43Å; N221-W229 HydrophobicContact CB-CE3 3.93Å; N221-W229 HydrophobicContact CB-CZ3 4.34Å; L223-W229 HydrophobicContact CB-CD2 4.37Å; L223-W229 HydrophobicContact CB-CE3 4.08Å; L223-W229 HydrophobicContact CB-CH2 3.97Å; L223-W229 HydrophobicContact CB-CZ2 4.25Å; L223-W229 HydrophobicContact CB-CZ3 3.86Å; L223-W229 HydrophobicContact CD1-CD2 4.06Å; L223-W229 HydrophobicContact CD1-CG 4.36Å; L223-W229 HydrophobicContact CD1-CZ2 4.1Å
230	Y	98.6	Very high	96.3	Very high	36 Å²	36	39.5 Å²	39.5	14%	0.141	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.5	-178.4	-70.5	-97.2	0	0	0	110.7	C142 L143 P144 C222 D226 R228 Q232	C142-Y230 HydrophobicContact CB-CD1 3.47Å; C142-Y230 VanDerWaalsContact CB-CD1 3.47Å; C142-Y230 HydrophobicContact CB-CD2 4.42Å; C142-Y230 HydrophobicContact CB-CE1 3.54Å; C142-Y230 HydrophobicContact CB-CE2 4.46Å; C142-Y230 HydrophobicContact CB-CG 3.96Å; C142-Y230 WeakPolarHBondContact O-CA 3.48Å; L143-Y230 WeakPolarHBondContact O-CD1 3.24Å; L143-Y230 WeakPolarHBondContact O-CE1 3.32Å; P144-Y230 HydrophobicContact CB-CD1 4.48Å; C222-Y230 PolarHBondContact N-O 3.5Å; C222-Y230 PolarHBondContact O-N 3.2Å; D226-Y230 PolarHBondContact OD2-OH 2.89Å; R228-Y230 HydrophobicContact CB-CE2 3.96Å; R228-Y230 PolarHBondContact NH2-OH 3.36Å; R228-Y230 WeakPolarHBondContact O-CD2 3.49Å; Y230-Q232 PolarHBondContact O-N 3.11Å
231	I	98.6	Very high	95.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	95.2	174.6	-50.3	-49.4	0	0	0	107.9	T62 A141 C142 P144 P219 N221 G233 T255	T62-I231 HydrophobicContact CG2-CD1 3.8Å; T62-I231 HydrophobicContact CG2-CG1 3.54Å; A141-I231 HydrophobicContact CB-CD1 3.52Å; A141-I231 HydrophobicContact CB-CG1 3.34Å; C142-I231 PolarHBondContact O-N 2.97Å; P144-I231 VanDerWaalsContact CD-O 3.27Å; P144-I231 WeakPolarHBondContact CD-O 3.34Å; P219-I231 HydrophobicContact CB-CD1 3.77Å; P219-I231 HydrophobicContact CB-CG2 4.18Å; N221-I231 WeakPolarHBondContact OD1-CD1 3.2Å; I231-G233 VanDerWaalsContact C-N 3.34Å; I231-G233 WeakPolarHBondContact CG2-O 3.15Å; I231-T255 HydrophobicContact CG2-CG2 4.28Å; I231-T255 WeakPolarHBondContact O-CB 3.49Å; I231-T255 WeakPolarHBondContact O-CG2 3.22Å; I231-T255 PolarHBondContact O-OG1 3.21Å
232	Q	98.6	Very high	95.1	Very high	7 Å²	7	45.2 Å²	45.2	3%	0.033	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-14.5	-177	-65.7	-77.5	9.8	0	0	112.5	P144 E148 L150 L220 C222 Y230 T255	P144-Q232 VanDerWaalsContact CB-OE1 3.31Å; E148-Q232 PolarHBondContact OE1-NE2 3.3Å; L150-Q232 HydrophobicContact CD1-CB 3.73Å; L150-Q232 HydrophobicContact CD1-CG 3.79Å; L150-Q232 HydrophobicContact CD2-CG 4.07Å; L150-Q232 HydrophobicContact CG-CB 4.45Å; L150-Q232 HydrophobicContact CG-CG 4.18Å; L220-Q232 PolarHBondContact O-N 2.93Å; C222-Q232 HydrophobicContact CB-CG 3.67Å; C222-Q232 WeakPolarHBondContact SG-CG 3.47Å; Y230-Q232 PolarHBondContact O-N 3.11Å; Q232-T255 PolarHBondContact O-N 2.98Å; Q232-T255 PolarHBondContact O-OG1 3.22Å
233	G	98.6	Very high	94.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.6	-177.8	0	0	0	0	0	112.8	L220 I231 T253	L220-G233 PolarHBondContact N-O 3.07Å; I231-G233 VanDerWaalsContact C-N 3.34Å; I231-G233 WeakPolarHBondContact CG2-O 3.15Å; G233-T253 VanDerWaalsContact CA-O 3.24Å; G233-T253 WeakPolarHBondContact CA-O 3.21Å
234	V	98.8	Very high	93.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123	166.6	178.2	0	0	0	0	107.8	L70 A72 S236 F252 T253 T255	L70-V234 HydrophobicContact CD1-CG2 4.2Å; L70-V234 HydrophobicContact CD2-CG2 3.63Å; L70-V234 HydrophobicContact CG-CG2 3.69Å; A72-V234 HydrophobicContact CB-CG1 4.07Å; V234-S236 PolarHBondContact O-N 2.98Å; V234-F252 CarbonylContact O-C 3.54Å; V234-F252 WeakPolarHBondContact O-CA 3.42Å; V234-F252 WeakPolarHBondContact O-CB 3.35Å; V234-T253 PolarHBondContact N-O 2.87Å; V234-T253 PolarHBondContact O-N 2.99Å; V234-T255 HydrophobicContact CG2-CG2 3.91Å
235	T	98.5	Very high	93.5	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	120.7	-174.8	-54	0	0	0	0	110.5	A211 D215 G217 G218 T250 F252	A211-T235 HydrophobicContact CB-CG2 3.88Å; D215-T235 HydrophobicContact CB-CG2 4.49Å; D215-T235 VanDerWaalsContact O-CB 3.32Å; D215-T235 WeakPolarHBondContact O-CB 3.17Å; D215-T235 PolarHBondContact O-OG1 2.96Å; G217-T235 PolarHBondContact N-O 3.48Å; G218-T235 PolarHBondContact O-N 3.21Å; G218-T235 PolarHBondContact O-OG1 2.8Å; T235-T250 HydrophobicContact CG2-CG2 4.08Å; T235-F252 VanDerWaalsContact CA-CD1 3.45Å; T235-F252 HydrophobicContact CG2-CE1 4.31Å; T235-F252 WeakPolarHBondContact OG1-CD1 3.37Å; T235-F252 WeakPolarHBondContact OG1-CE1 3.46Å
236	S	97.5	Very high	93.3	Very high	8 Å²	8	39.8 Å²	39.8	6%	0.056	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-65.7	-175.3	-179.4	0	0	0	0	111.3	H74 D122 V234 V251	H74-S236 PolarHBondContact CE1-O 3Å; D122-S236 WeakPolarHBondContact CB-OG 3.38Å; D122-S236 WeakPolarHBondContact OD2-CA 3.45Å; D122-S236 VanDerWaalsContact OD2-CB 3.28Å; D122-S236 WeakPolarHBondContact OD2-CB 3.29Å; D122-S236 PolarHBondContact OD2-OG 3.17Å; V234-S236 PolarHBondContact O-N 2.98Å; S236-V251 WeakPolarHBondContact CB-O 3.5Å; S236-V251 PolarHBondContact N-O 3.05Å
237	F	94.9	Very high	93.2	Very high	34 Å²	34	39.4 Å²	39.4	15%	0.149	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	162.7	-177.6	65.1	-92.5	0	0	0	113.7	V117 W193 T196 M201 V251	V117-F237 HydrophobicContact CG1-CB 4.27Å; V117-F237 HydrophobicContact CG1-CD1 3.61Å; V117-F237 HydrophobicContact CG1-CE1 4.28Å; V117-F237 HydrophobicContact CG1-CG 4.19Å; W193-F237 HydrophobicContact CD2-CE2 4.33Å; W193-F237 HydrophobicContact CE3-CE2 4.25Å; W193-F237 HydrophobicContact CH2-CD2 4.08Å; W193-F237 AromaticContact CH2-CE2 3.97Å; W193-F237 HydrophobicContact CH2-CE2 3.97Å; W193-F237 HydrophobicContact CZ2-CD2 4.26Å; W193-F237 HydrophobicContact CZ2-CE2 4.08Å; W193-F237 HydrophobicContact CZ3-CE2 4.08Å; T196-F237 HydrophobicContact CG2-CE2 4.17Å; T196-F237 HydrophobicContact CG2-CZ 3.96Å; M201-F237 HydrophobicContact CE-CE1 4.18Å; M201-F237 HydrophobicContact SD-CE1 4.24Å; M201-F237 HydrophobicContact SD-CZ 4.42Å; F237-V251 HydrophobicContact CD1-CB 4.1Å; F237-V251 HydrophobicContact CD1-CG1 4.27Å; F237-V251 HydrophobicContact CD2-CB 4.05Å; F237-V251 HydrophobicContact CD2-CG2 4.13Å; F237-V251 HydrophobicContact CE1-CB 3.73Å; F237-V251 HydrophobicContact CE1-CG1 3.54Å; F237-V251 HydrophobicContact CE1-CG2 4.34Å; F237-V251 HydrophobicContact CE2-CB 3.67Å; F237-V251 HydrophobicContact CE2-CG1 4.21Å; F237-V251 HydrophobicContact CE2-CG2 3.46Å; F237-V251 VanDerWaalsContact CE2-CG2 3.46Å; F237-V251 HydrophobicContact CG-CB 4.26Å; F237-V251 HydrophobicContact CZ-CB 3.5Å; F237-V251 HydrophobicContact CZ-CG1 3.51Å; F237-V251 HydrophobicContact CZ-CG2 3.59Å; F237-V251 PolarHBondContact N-O 2.92Å; F237-V251 VanDerWaalsContact N-O 3.15Å; F237-V251 PolarHBondContact O-N 3.16Å
238	V	93.3	Very high	93.2	Very high	32 Å²	32	39.1 Å²	39.1	19%	0.194	22%	0.22	C	C	.	.			trans	-130.3	179.1	173.4	-65.5	0	0	0	0	109.3	A211 T250	A211-V238 HydrophobicContact CB-CG1 4.48Å; A211-V238 WeakPolarHBondContact O-CG1 3.21Å; V238-T250 HydrophobicContact CG1-CG2 3.87Å
239	S	89.9	Confident	93.1	Very high	16 Å²	16	35 Å²	35	11%	0.112	20%	0.204	C	C	.	.			trans	-62.3	141.1	172	173.9	0	0	0	0	111.5	A241 V242 E245	S239-A241 PolarHBondContact O-N 3.04Å; S239-A241 PolarHBondContact OG-N 3.26Å; S239-V242 WeakPolarHBondContact CB-O 3.29Å; S239-E245 WeakPolarHBondContact CB-OE2 3.38Å; S239-E245 PolarHBondContact OG-OE2 2.96Å
240	S	85.8	Confident	93	Very high	134 Å²	134	34.6 Å²	34.6	94%	0.937	20%	0.202	S	C	*	.	S	Bend	trans	-70.8	-18.9	176	57.5	0	0	0	0	113.1
241	A	84.4	Confident	92.9	Very high	64 Å²	64	32.9 Å²	32.9	53%	0.529	20%	0.196	S	C	.	.	S	Bend	trans	-80.3	-53.9	179.1	0	0	0	0	0	111.6	S239	S239-A241 PolarHBondContact O-N 3.04Å; S239-A241 PolarHBondContact OG-N 3.26Å
242	V	87.4	Confident	92.9	Very high	56 Å²	56	32.9 Å²	32.9	34%	0.339	20%	0.196	S	C	.	.			trans	-149.5	153.4	175.8	-65	0	0	0	0	110.2	T166 S239 N244 E245	T166-V242 HydrophobicContact CG2-CG1 4.33Å; T166-V242 VanDerWaalsContact OG1-CA 3.28Å; T166-V242 WeakPolarHBondContact OG1-CA 3.35Å; S239-V242 WeakPolarHBondContact CB-O 3.29Å; V242-N244 VanDerWaalsContact C-N 3.34Å; V242-N244 PolarHBondContact O-N 3.25Å; V242-E245 HydrophobicContact CG2-CB 3.67Å
243	C	84.4	Confident	92.9	Very high	6 Å²	6	32.6 Å²	32.6	4%	0.041	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-39.6	-177.2	-64.2	0	0	0	0	111.7	T166 S210 A211 C212	T166-C243 PolarHBondContact OG1-N 2.86Å; S210-C243 WeakPolarHBondContact CB-O 3.24Å; S210-C243 PolarHBondContact OG-O 3.36Å; A211-C243 VanDerWaalsContact O-CB 3.3Å; A211-C243 WeakPolarHBondContact O-CB 3.34Å; C212-C243 WeakPolarHBondContact CA-SG 3.38Å; C212-C243 HydrophobicContact CB-CB 4.07Å; C212-C243 WeakPolarHBondContact CB-SG 3.27Å; C212-C243 WeakPolarHBondContact SG-CB 3.21Å; C212-C243 CovalentContact SG-SG 2.03Å; C212-C243 PolarHBondContact SG-SG 3.19Å
244	N	84	Confident	92.9	Very high	63 Å²	63	33.7 Å²	33.7	34%	0.337	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	44.9	-174.3	64.4	-25.9	0	0	0	112.4	V208 V242 V246	V208-N244 WeakPolarHBondContact O-CB 3.23Å; V208-N244 PolarHBondContact O-ND2 2.93Å; V242-N244 VanDerWaalsContact C-N 3.34Å; V242-N244 PolarHBondContact O-N 3.25Å; N244-V246 PolarHBondContact O-N 3.39Å
245	E	88.6	Confident	92.9	Very high	60 Å²	60	33.7 Å²	33.7	28%	0.28	20%	0.199	S	C	.	.			trans	-68.1	127	176.3	-179.6	176.3	161.8	0	0	110.3	S239 V242 Q247 K248	S239-E245 WeakPolarHBondContact CB-OE2 3.38Å; S239-E245 PolarHBondContact OG-OE2 2.96Å; V242-E245 HydrophobicContact CG2-CB 3.67Å; E245-Q247 PolarHBondContact O-N 3.3Å; E245-K248 HydrophobicContact CB-CB 3.87Å; E245-K248 HydrophobicContact CB-CG 4.19Å; E245-K248 HydrophobicContact CG-CB 4.02Å; E245-K248 HydrophobicContact CG-CG 3.78Å; E245-K248 CarbonylContact O-C 3.54Å; E245-K248 WeakPolarHBondContact O-CA 3.31Å; E245-K248 PolarHBondContact O-N 3.48Å
246	V	90.6	Very high	92.9	Very high	90 Å²	90	33.4 Å²	33.4	55%	0.545	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	134.8	178.1	174.1	0	0	0	0	109.6	N244 K248	N244-V246 PolarHBondContact O-N 3.39Å; V246-K248 PolarHBondContact O-N 3.46Å
247	Q	92.6	Very high	93	Very high	76 Å²	76	34.1 Å²	34.1	36%	0.355	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	10.7	-174.1	-58.5	171.8	-33.4	0	0	115.3	W192 G206 E245 P249	W192-Q247 WeakPolarHBondContact CA-O 3.28Å; W192-Q247 HydrophobicContact CD2-CB 3.98Å; W192-Q247 HydrophobicContact CD2-CG 4.4Å; W192-Q247 HydrophobicContact CE3-CB 4.49Å; W192-Q247 HydrophobicContact CG-CB 4.11Å; W192-Q247 HydrophobicContact CZ2-CB 4.49Å; W192-Q247 HydrophobicContact CZ2-CG 4.12Å; G206-Q247 PolarHBondContact O-N 2.79Å; E245-Q247 PolarHBondContact O-N 3.3Å; Q247-P249 WeakPolarHBondContact O-CD 3.16Å
248	K	94.9	Very high	93.1	Very high	38 Å²	38	33 Å²	33	17%	0.165	20%	0.199	C	C	.	.			trans	-122.3	68.1	170.5	-62.2	-67.9	-178.7	-82.5	0	109.1	D191 W192 W193 E245 V246	D191-K248 PolarHBondContact O-NZ 3.42Å; W192-K248 WeakPolarHBondContact O-CE 3.43Å; W192-K248 PolarHBondContact O-NZ 3.45Å; W193-K248 HydrophobicContact CD2-CD 3.77Å; W193-K248 HydrophobicContact CE3-CD 3.91Å; W193-K248 HydrophobicContact CG-CD 4.33Å; W193-K248 HydrophobicContact CH2-CB 4.49Å; W193-K248 HydrophobicContact CH2-CD 4.25Å; W193-K248 HydrophobicContact CZ2-CB 3.84Å; W193-K248 HydrophobicContact CZ2-CD 4.1Å; W193-K248 HydrophobicContact CZ2-CG 4.49Å; W193-K248 HydrophobicContact CZ3-CD 4.14Å; E245-K248 HydrophobicContact CB-CB 3.87Å; E245-K248 HydrophobicContact CB-CG 4.19Å; E245-K248 HydrophobicContact CG-CB 4.02Å; E245-K248 HydrophobicContact CG-CG 3.78Å; E245-K248 CarbonylContact O-C 3.54Å; E245-K248 WeakPolarHBondContact O-CA 3.31Å; E245-K248 PolarHBondContact O-N 3.48Å; V246-K248 PolarHBondContact O-N 3.46Å
249	P	95.8	Very high	93.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-55.5	156.6	178.2	26	-36.3	0	0	0	111.6	V182 W192 W193 C203 A204 Q247 V251	V182-P249 HydrophobicContact CB-CG 4.49Å; V182-P249 HydrophobicContact CG2-CB 4.23Å; V182-P249 HydrophobicContact CG2-CG 4.32Å; W192-P249 HydrophobicContact CE3-CG 4.09Å; W192-P249 HydrophobicContact CZ3-CG 4.03Å; W193-P249 PolarHBondContact NE1-O 3.18Å; C203-P249 HydrophobicContact CB-CB 4.17Å; C203-P249 HydrophobicContact CB-CG 3.75Å; A204-P249 VanDerWaalsContact O-CB 3.27Å; A204-P249 WeakPolarHBondContact O-CB 3.45Å; Q247-P249 WeakPolarHBondContact O-CD 3.16Å; P249-V251 PolarHBondContact O-N 3.46Å
250	T	96.2	Very high	93.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	134	168.7	-49.9	0	0	0	0	109.3	C203 A204 S210 A211 T235 V238 F252	C203-T250 WeakPolarHBondContact CA-O 3.26Å; A204-T250 PolarHBondContact N-O 3.36Å; A204-T250 PolarHBondContact O-N 2.96Å; S210-T250 PolarHBondContact OG-OG1 2.92Å; A211-T250 HydrophobicContact CB-CG2 3.62Å; A211-T250 PolarHBondContact N-OG1 3.15Å; A211-T250 VanDerWaalsContact N-OG1 3.08Å; T235-T250 HydrophobicContact CG2-CG2 4.08Å; V238-T250 HydrophobicContact CG1-CG2 3.87Å; T250-F252 HydrophobicContact CG2-CD2 4.14Å; T250-F252 HydrophobicContact CG2-CE1 4.06Å; T250-F252 HydrophobicContact CG2-CE2 3.49Å; T250-F252 VanDerWaalsContact CG2-CE2 3.49Å; T250-F252 HydrophobicContact CG2-CZ 3.42Å; T250-F252 VanDerWaalsContact CG2-CZ 3.42Å; T250-F252 WeakPolarHBondContact O-CE2 3.36Å
251	V	97.8	Very high	94.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.2	176.3	-175.8	0	0	0	0	109.4	W193 M201 S236 F237 P249	W193-V251 HydrophobicContact CD2-CG2 4.39Å; W193-V251 HydrophobicContact CG-CG2 4.33Å; W193-V251 HydrophobicContact CZ2-CG2 4.42Å; M201-V251 HydrophobicContact CB-CG1 3.86Å; M201-V251 HydrophobicContact CG-CG1 4.08Å; M201-V251 HydrophobicContact SD-CG1 3.71Å; S236-V251 WeakPolarHBondContact CB-O 3.5Å; S236-V251 PolarHBondContact N-O 3.05Å; F237-V251 HydrophobicContact CD1-CB 4.1Å; F237-V251 HydrophobicContact CD1-CG1 4.27Å; F237-V251 HydrophobicContact CD2-CB 4.05Å; F237-V251 HydrophobicContact CD2-CG2 4.13Å; F237-V251 HydrophobicContact CE1-CB 3.73Å; F237-V251 HydrophobicContact CE1-CG1 3.54Å; F237-V251 HydrophobicContact CE1-CG2 4.34Å; F237-V251 HydrophobicContact CE2-CB 3.67Å; F237-V251 HydrophobicContact CE2-CG1 4.21Å; F237-V251 HydrophobicContact CE2-CG2 3.46Å; F237-V251 VanDerWaalsContact CE2-CG2 3.46Å; F237-V251 HydrophobicContact CG-CB 4.26Å; F237-V251 HydrophobicContact CZ-CB 3.5Å; F237-V251 HydrophobicContact CZ-CG1 3.51Å; F237-V251 HydrophobicContact CZ-CG2 3.59Å; F237-V251 PolarHBondContact N-O 2.92Å; F237-V251 VanDerWaalsContact N-O 3.15Å; F237-V251 PolarHBondContact O-N 3.16Å; P249-V251 PolarHBondContact O-N 3.46Å
252	F	98.6	Very high	94.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149.3	178.8	-52.1	-106.3	0	0	0	109.6	I158 L179 M201 V202 A204 L220 V234 T235 T250 R254	I158-F252 HydrophobicContact CG2-CE1 3.71Å; I158-F252 HydrophobicContact CG2-CZ 3.54Å; L179-F252 HydrophobicContact CD1-CZ 4.19Å; M201-F252 CarbonylContact C-O 3.4Å; M201-F252 WeakPolarHBondContact CA-O 3.41Å; M201-F252 WeakPolarHBondContact CB-O 3.09Å; V202-F252 HydrophobicContact CG1-CB 3.69Å; V202-F252 HydrophobicContact CG1-CD2 4.36Å; V202-F252 HydrophobicContact CG1-CG 4.34Å; V202-F252 PolarHBondContact N-O 2.03Å; V202-F252 PolarHBondContact O-N 2.94Å; A204-F252 HydrophobicContact CB-CE2 3.88Å; L220-F252 HydrophobicContact CB-CD1 3.76Å; L220-F252 HydrophobicContact CB-CE1 3.82Å; L220-F252 HydrophobicContact CB-CG 4.27Å; L220-F252 HydrophobicContact CB-CZ 4.36Å; L220-F252 HydrophobicContact CD1-CE1 4.21Å; L220-F252 HydrophobicContact CD1-CE2 4.22Å; L220-F252 HydrophobicContact CD1-CZ 3.94Å; L220-F252 HydrophobicContact CD2-CD2 4.1Å; L220-F252 HydrophobicContact CD2-CE2 4.28Å; L220-F252 HydrophobicContact CD2-CG 4.26Å; L220-F252 HydrophobicContact CG-CE1 4.47Å; V234-F252 CarbonylContact O-C 3.54Å; V234-F252 WeakPolarHBondContact O-CA 3.42Å; V234-F252 WeakPolarHBondContact O-CB 3.35Å; T235-F252 VanDerWaalsContact CA-CD1 3.45Å; T235-F252 HydrophobicContact CG2-CE1 4.31Å; T235-F252 WeakPolarHBondContact OG1-CD1 3.37Å; T235-F252 WeakPolarHBondContact OG1-CE1 3.46Å; T250-F252 HydrophobicContact CG2-CD2 4.14Å; T250-F252 HydrophobicContact CG2-CE1 4.06Å; T250-F252 HydrophobicContact CG2-CE2 3.49Å; T250-F252 VanDerWaalsContact CG2-CE2 3.49Å; T250-F252 HydrophobicContact CG2-CZ 3.42Å; T250-F252 VanDerWaalsContact CG2-CZ 3.42Å; T250-F252 WeakPolarHBondContact O-CE2 3.36Å; F252-R254 PolarHBondContact O-N 3.38Å
253	T	98.8	Very high	95.1	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	122.7	164.3	-62.6	0	0	0	0	109.1	D122 L123 G233 V234 T255 F258	D122-T253 PolarHBondContact O-OG1 3.04Å; L123-T253 HydrophobicContact CB-CG2 4.25Å; L123-T253 HydrophobicContact CD2-CG2 4.06Å; G233-T253 VanDerWaalsContact CA-O 3.24Å; G233-T253 WeakPolarHBondContact CA-O 3.21Å; V234-T253 PolarHBondContact N-O 2.87Å; V234-T253 PolarHBondContact O-N 2.99Å; T253-T255 PolarHBondContact O-N 3.17Å; T253-F258 HydrophobicContact CG2-CD2 3.8Å; T253-F258 HydrophobicContact CG2-CE2 3.4Å; T253-F258 HydrophobicContact CG2-CZ 4.08Å
254	R	98.7	Very high	95.6	Very high	23 Å²	23	37.3 Å²	37.3	9%	0.087	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	103.7	-177.5	-179.9	173.6	72.2	106.9	3.1	110.2	E147 E148 T199 T200 V202 F252 S256 A257 F258	E147-R254 PolarHBondContact O-NH1 2.59Å; E147-R254 IonicContact OE2-CZ 3.67Å; E147-R254 IonicContact OE2-NH1 3.83Å; E147-R254 PolarHBondContact OE2-NH1 3.48Å; E147-R254 IonicContact OE2-NH2 3.59Å; E147-R254 PolarHBondContact OE2-NH2 2.9Å; E148-R254 PolarHBondContact O-NH1 2.71Å; T199-R254 PolarHBondContact O-NE 2.81Å; T199-R254 PolarHBondContact O-NH2 3.15Å; T200-R254 WeakPolarHBondContact O-CB 3.49Å; T200-R254 PolarHBondContact O-N 2.74Å; V202-R254 HydrophobicContact CB-CB 4.4Å; F252-R254 PolarHBondContact O-N 3.38Å; R254-S256 VanDerWaalsContact CG-OG 3.22Å; R254-S256 WeakPolarHBondContact CG-OG 3.32Å; R254-S256 PolarHBondContact NH1-OG 3.05Å; R254-S256 PolarHBondContact O-N 3.02Å; R254-A257 WeakPolarHBondContact O-CB 3.26Å; R254-A257 PolarHBondContact O-N 2.74Å; R254-F258 VanDerWaalsContact O-CD2 3.29Å; R254-F258 WeakPolarHBondContact O-CD2 3.35Å
255	T	98.6	Very high	96.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-58.6	-32.5	-173.9	53.9	0	0	0	0	113.8	L70 P144 I231 Q232 V234 T253 A257 F258	L70-T255 HydrophobicContact CD2-CG2 3.91Å; P144-T255 WeakPolarHBondContact CD-OG1 3.37Å; P144-T255 WeakPolarHBondContact CG-OG1 3.35Å; I231-T255 HydrophobicContact CG2-CG2 4.28Å; I231-T255 WeakPolarHBondContact O-CB 3.49Å; I231-T255 WeakPolarHBondContact O-CG2 3.22Å; I231-T255 PolarHBondContact O-OG1 3.21Å; Q232-T255 PolarHBondContact O-N 2.98Å; Q232-T255 PolarHBondContact O-OG1 3.22Å; V234-T255 HydrophobicContact CG2-CG2 3.91Å; T253-T255 PolarHBondContact O-N 3.17Å; T255-A257 PolarHBondContact O-N 2.78Å; T255-F258 PolarHBondContact O-N 3.48Å
256	S	98.5	Very high	96.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-64.1	-22.1	177.1	58.3	0	0	0	0	113.9	Q145 E147 E148 R254 F258	Q145-S256 WeakPolarHBondContact O-CB 3.39Å; E147-S256 PolarHBondContact N-O 2.98Å; E148-S256 WeakPolarHBondContact O-CB 3.39Å; E148-S256 PolarHBondContact O-OG 2.92Å; R254-S256 VanDerWaalsContact CG-OG 3.22Å; R254-S256 WeakPolarHBondContact CG-OG 3.32Å; R254-S256 PolarHBondContact NH1-OG 3.05Å; R254-S256 PolarHBondContact O-N 3.02Å; S256-F258 VanDerWaalsContact C-N 3.29Å
257	A	98.5	Very high	96	Very high	23 Å²	23	35.9 Å²	35.9	19%	0.19	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-79.4	-11.3	174.6	0	0	0	0	0	113.3	T200 R254 T255	T200-A257 HydrophobicContact CG2-CB 4.2Å; R254-A257 WeakPolarHBondContact O-CB 3.26Å; R254-A257 PolarHBondContact O-N 2.74Å; T255-A257 PolarHBondContact O-N 2.78Å
258	F	98.4	Very high	94.9	Very high	11 Å²	11	34.1 Å²	34.1	5%	0.048	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-117.9	16.3	-175.1	-64.1	-87.5	0	0	0	112.4	H109 N121 L123 T200 T253 R254 T255 S256 E260 W261 L262	H109-F258 AromaticContact CD2-CD1 3.83Å; H109-F258 AromaticContact NE2-CD1 3.61Å; H109-F258 AromaticContact NE2-CE1 3.73Å; N121-F258 HydrophobicContact CB-CE1 4.35Å; N121-F258 HydrophobicContact CB-CZ 4.47Å; N121-F258 WeakPolarHBondContact OD1-CE1 3.41Å; N121-F258 VanDerWaalsContact OD1-CZ 3.22Å; N121-F258 WeakPolarHBondContact OD1-CZ 3.32Å; L123-F258 HydrophobicContact CD1-CB 3.77Å; L123-F258 HydrophobicContact CD1-CD1 4.1Å; L123-F258 HydrophobicContact CD1-CD2 4.23Å; L123-F258 HydrophobicContact CD1-CG 3.77Å; L123-F258 HydrophobicContact CD2-CD1 3.69Å; L123-F258 HydrophobicContact CD2-CD2 4.35Å; L123-F258 HydrophobicContact CD2-CE1 3.69Å; L123-F258 HydrophobicContact CD2-CE2 4.37Å; L123-F258 HydrophobicContact CD2-CG 4.04Å; L123-F258 HydrophobicContact CD2-CZ 4.05Å; T200-F258 HydrophobicContact CG2-CZ 4.39Å; T253-F258 HydrophobicContact CG2-CD2 3.8Å; T253-F258 HydrophobicContact CG2-CE2 3.4Å; T253-F258 HydrophobicContact CG2-CZ 4.08Å; R254-F258 VanDerWaalsContact O-CD2 3.29Å; R254-F258 WeakPolarHBondContact O-CD2 3.35Å; T255-F258 PolarHBondContact O-N 3.48Å; S256-F258 VanDerWaalsContact C-N 3.29Å; F258-E260 VanDerWaalsContact C-N 3.26Å; F258-E260 PolarHBondContact O-N 3.23Å; F258-W261 PolarHBondContact O-N 3.32Å; F258-L262 HydrophobicContact CB-CD1 4.36Å; F258-L262 HydrophobicContact CB-CG 4.37Å; F258-L262 WeakPolarHBondContact O-CB 3.16Å; F258-L262 VanDerWaalsContact O-CG 3.24Å; F258-L262 WeakPolarHBondContact O-CG 3.1Å; F258-L262 PolarHBondContact O-N 3.25Å
259	T	96.3	Very high	92.9	Very high	21 Å²	21	40.9 Å²	40.9	13%	0.129	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-33.8	-175.3	49.9	0	0	0	0	113.4	A146 N263	A146-T259 WeakPolarHBondContact CA-OG1 3.09Å; A146-T259 HydrophobicContact CB-CG2 4.25Å; A146-T259 WeakPolarHBondContact CB-OG1 3.24Å; T259-N263 VanDerWaalsContact O-CB 3.23Å; T259-N263 WeakPolarHBondContact O-CB 3.22Å; T259-N263 PolarHBondContact O-N 3.5Å; T259-N263 PolarHBondContact O-ND2 3.15Å
260	E	96.1	Very high	92.7	Very high	146 Å²	146	42.9 Å²	42.9	68%	0.682	23%	0.234	S	C	*	.	H	α-helix	trans	-61.9	-58.1	176	-177	171	-163.9	0	0	110.4	F258 L262 N263 E264	F258-E260 VanDerWaalsContact C-N 3.26Å; F258-E260 PolarHBondContact O-N 3.23Å; E260-L262 VanDerWaalsContact C-N 3.35Å; E260-L262 PolarHBondContact O-N 3.28Å; E260-N263 PolarHBondContact O-N 3.37Å; E260-E264 WeakPolarHBondContact O-CG 3.19Å; E260-E264 PolarHBondContact O-N 2.85Å
261	W	97.6	Very high	92.6	Very high	24 Å²	24	45.2 Å²	45.2	9%	0.091	25%	0.246	C	C	.	.	H	α-helix	trans	-56.9	-45.3	177	178.9	83.6	0	0	0	112.5	V107 H109 L123 L125 F258 N263 E264 Q265	V107-W261 HydrophobicContact CG1-CZ2 4.01Å; H109-W261 HydrophobicContact CB-CZ2 4.19Å; H109-W261 AromaticContact CD2-CD1 3.85Å; H109-W261 AromaticContact CD2-CD2 3.56Å; H109-W261 AromaticContact CD2-CE2 3.68Å; H109-W261 AromaticContact CD2-CG 3.68Å; H109-W261 AromaticContact CD2-NE1 3.84Å; H109-W261 AromaticContact NE2-CG 3.95Å; L123-W261 HydrophobicContact CD1-CE3 3.75Å; L123-W261 HydrophobicContact CD1-CH2 4.44Å; L123-W261 HydrophobicContact CD1-CZ3 3.5Å; L123-W261 VanDerWaalsContact CD1-CZ3 3.5Å; L123-W261 HydrophobicContact CG-CE3 4.3Å; L123-W261 HydrophobicContact CG-CH2 4.26Å; L123-W261 HydrophobicContact CG-CZ3 3.78Å; L125-W261 HydrophobicContact CB-CH2 4.27Å; L125-W261 HydrophobicContact CD1-CE3 4.42Å; L125-W261 HydrophobicContact CD1-CH2 3.9Å; L125-W261 HydrophobicContact CD1-CZ3 3.8Å; L125-W261 HydrophobicContact CG-CH2 3.83Å; L125-W261 HydrophobicContact CG-CZ3 3.87Å; F258-W261 PolarHBondContact O-N 3.32Å; W261-N263 PolarHBondContact O-N 3.18Å; W261-E264 PolarHBondContact O-N 3.44Å; W261-Q265 HydrophobicContact CD2-CG 4.22Å; W261-Q265 HydrophobicContact CZ2-CG 4.12Å; W261-Q265 WeakPolarHBondContact O-CG 3.49Å; W261-Q265 PolarHBondContact O-N 3.23Å
262	L	97.2	Very high	92.3	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-58.1	-49.3	177.3	-72.5	171	0	0	0	110.8	L70 L123 L125 L143 F258 E260 E264 Q265 L266	L70-L262 HydrophobicContact CD1-CD2 3.95Å; L123-L262 HydrophobicContact CD1-CD2 4.37Å; L125-L262 HydrophobicContact CD1-CD2 4.1Å; L125-L262 HydrophobicContact CD2-CD2 4.16Å; L125-L262 HydrophobicContact CG-CD2 4.28Å; L143-L262 HydrophobicContact CD1-CD1 4.16Å; L143-L262 HydrophobicContact CD2-CD1 4.3Å; F258-L262 HydrophobicContact CB-CD1 4.36Å; F258-L262 HydrophobicContact CB-CG 4.37Å; F258-L262 WeakPolarHBondContact O-CB 3.16Å; F258-L262 VanDerWaalsContact O-CG 3.24Å; F258-L262 WeakPolarHBondContact O-CG 3.1Å; F258-L262 PolarHBondContact O-N 3.25Å; E260-L262 VanDerWaalsContact C-N 3.35Å; E260-L262 PolarHBondContact O-N 3.28Å; L262-E264 PolarHBondContact O-N 3.05Å; L262-Q265 PolarHBondContact O-N 2.93Å; L262-L266 WeakPolarHBondContact O-CB 3.25Å; L262-L266 WeakPolarHBondContact O-CG 3.25Å; L262-L266 PolarHBondContact O-N 3.35Å
263	N	94.9	Very high	91.9	Very high	94 Å²	94	50.5 Å²	50.5	50%	0.503	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-42.6	-179.2	-73.4	-29.3	0	0	0	112.2	T259 E260 W261 Q265 L266 V267	T259-N263 VanDerWaalsContact O-CB 3.23Å; T259-N263 WeakPolarHBondContact O-CB 3.22Å; T259-N263 PolarHBondContact O-N 3.5Å; T259-N263 PolarHBondContact O-ND2 3.15Å; E260-N263 PolarHBondContact O-N 3.37Å; W261-N263 PolarHBondContact O-N 3.18Å; N263-Q265 PolarHBondContact O-N 3.08Å; N263-L266 PolarHBondContact O-N 2.81Å; N263-V267 VanDerWaalsContact O-CG2 3.31Å; N263-V267 WeakPolarHBondContact O-CG2 3.29Å; N263-V267 PolarHBondContact O-N 3.26Å; N263-V267 VanDerWaalsContact O-N 3.15Å
264	E	95	Very high	91.5	Very high	111 Å²	111	53.6 Å²	53.6	52%	0.519	29%	0.292	S	S	.	.	H	α-helix	trans	-57.2	-48.3	176.1	-73.4	-179.8	168.5	0	0	111.7	E260 W261 L262 S268	E260-E264 WeakPolarHBondContact O-CG 3.19Å; E260-E264 PolarHBondContact O-N 2.85Å; W261-E264 PolarHBondContact O-N 3.44Å; L262-E264 PolarHBondContact O-N 3.05Å; E264-S268 WeakPolarHBondContact O-CB 3.22Å; E264-S268 PolarHBondContact O-N 3.06Å; E264-S268 VanDerWaalsContact O-N 3.15Å
265	Q	94.8	Very high	91	Very high	30 Å²	30	55.6 Å²	55.6	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-70	-42.1	-178.9	-63	-43.9	-57.4	0	0	112.2	W68 V107 L125 W261 L262 N263 V267 S268	W68-Q265 WeakPolarHBondContact CZ2-O 3.4Å; V107-Q265 HydrophobicContact CG1-CG 4.22Å; L125-Q265 HydrophobicContact CD1-CB 3.38Å; L125-Q265 HydrophobicContact CD1-CG 3.99Å; W261-Q265 HydrophobicContact CD2-CG 4.22Å; W261-Q265 HydrophobicContact CZ2-CG 4.12Å; W261-Q265 WeakPolarHBondContact O-CG 3.49Å; W261-Q265 PolarHBondContact O-N 3.23Å; L262-Q265 PolarHBondContact O-N 2.93Å; N263-Q265 PolarHBondContact O-N 3.08Å; Q265-V267 VanDerWaalsContact C-N 3.28Å; Q265-V267 PolarHBondContact O-N 3.14Å; Q265-S268 PolarHBondContact O-N 3.3Å; Q265-S268 VanDerWaalsContact O-N 3.16Å; Q265-S268 PolarHBondContact O-OG 3.25Å
266	L	90.6	Very high	90.5	Very high	35 Å²	35	59.5 Å²	59.5	18%	0.183	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-32.1	-177.7	-70.4	175.2	0	0	0	112.9	V64 A65 W68 L125 L143 L262 N263	V64-L266 HydrophobicContact CG2-CD2 4.24Å; A65-L266 HydrophobicContact CB-CD2 4.15Å; W68-L266 HydrophobicContact CB-CD2 3.34Å; W68-L266 HydrophobicContact CD2-CD2 3.96Å; W68-L266 HydrophobicContact CG-CD2 3.36Å; W68-L266 PolarHBondContact NE1-O 2.98Å; L125-L266 HydrophobicContact CD2-CD2 4.4Å; L143-L266 HydrophobicContact CD1-CD1 3.98Å; L262-L266 WeakPolarHBondContact O-CB 3.25Å; L262-L266 WeakPolarHBondContact O-CG 3.25Å; L262-L266 PolarHBondContact O-N 3.35Å; N263-L266 PolarHBondContact O-N 2.81Å
267	V	86.5	Confident	89.8	Confident	118 Å²	118	64.1 Å²	64.1	72%	0.715	35%	0.353	S	S	*	.	H	α-helix	trans	-85.3	-21.8	177.2	179.9	0	0	0	0	112.1	N263 Q265 T269	N263-V267 VanDerWaalsContact O-CG2 3.31Å; N263-V267 WeakPolarHBondContact O-CG2 3.29Å; N263-V267 PolarHBondContact O-N 3.26Å; N263-V267 VanDerWaalsContact O-N 3.15Å; Q265-V267 VanDerWaalsContact C-N 3.28Å; Q265-V267 PolarHBondContact O-N 3.14Å; V267-T269 PolarHBondContact O-N 3.01Å
268	S	70.2	Confident	89.1	Confident	39 Å²	39	67.5 Å²	67.5	27%	0.273	37%	0.366	S	S	.	.			trans	-65.6	107.3	178.4	75.6	0	0	0	0	111.9	K127 E264 Q265	K127-S268 PolarHBondContact NZ-O 2.99Å; E264-S268 WeakPolarHBondContact O-CB 3.22Å; E264-S268 PolarHBondContact O-N 3.06Å; E264-S268 VanDerWaalsContact O-N 3.15Å; Q265-S268 PolarHBondContact O-N 3.3Å; Q265-S268 VanDerWaalsContact O-N 3.16Å; Q265-S268 PolarHBondContact O-OG 3.25Å
269	T	51.8	Low	88.3	Confident	180 Å²	180	72.6 Å²	72.6	100%	1.104	40%	0.395	S	S	*	.			trans	-71.5	0	179.5	47.8	0	0	0	0	112.7	K127 V267	K127-T269 PolarHBondContact NZ-OXT 2.73Å; V267-T269 PolarHBondContact O-N 3.01Å

Retrieved 269 of 269 residues in 538.2 ms (Link to these results)

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