A0A087XMS9_POEFO Loading...

Interleukin-12 subunit beta

AlphaFold DB , UniProt , Accession A0A087XMS9, Species POEFO (Poecilia formosa, Amazon molly), Gene IL12B, Length 323 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	52.6	Low	51.8	Low	201 Å²	201	116.1 Å²	116.1	99%	0.99	62%	0.624	S	S	*	*				0	-33.9	0	-111	170.1	68.9	0	0	114
2	Q	53.3	Low	51.4	Low	165 Å²	165	111.9 Å²	111.9	77%	0.771	61%	0.61	S	S	*	*	H	α-helix	trans	-71.4	-30.8	179.2	-83.9	157.5	-43.1	0	0	115.3	L5 L6	Q2-L5 PolarHBondContact O-N 2.04Å; Q2-L6 PolarHBondContact O-N 3.32Å
3	L	46.3	Very low	50.8	Low	139 Å²	139	112.8 Å²	112.8	73%	0.728	61%	0.613	S	S	*	*	H	α-helix	trans	-71.2	-32.3	-178.8	-133.7	85.9	0	0	0	113.3	L7	L3-L7 PolarHBondContact O-N 3.3Å
4	L	52.5	Low	49.8	Very low	129 Å²	129	112.4 Å²	112.4	68%	0.675	62%	0.621	S	S	*	*	H	α-helix	trans	-73	-33.6	177.2	-89.4	141.8	0	0	0	112	V8	L4-V8 VanDerWaalsContact O-CG2 3.27Å; L4-V8 WeakPolarHBondContact O-CG2 2.95Å; L4-V8 PolarHBondContact O-N 3.04Å
5	L	52.1	Low	49.1	Very low	110 Å²	110	116.7 Å²	116.7	58%	0.576	63%	0.631	S	S	*	*	H	α-helix	trans	-67.6	-38.7	174.9	-99.7	138.5	0	0	0	112.4	Q2 L9	Q2-L5 PolarHBondContact O-N 2.04Å; L5-L9 PolarHBondContact O-N 2.98Å; L5-L9 VanDerWaalsContact O-N 3.09Å
6	L	53	Low	48.5	Very low	118 Å²	118	114.3 Å²	114.3	62%	0.618	63%	0.632	S	S	*	*	H	α-helix	trans	-68.2	-37.8	177.2	-89.8	149.3	0	0	0	112.9	Q2 L9 S10	Q2-L6 PolarHBondContact O-N 3.32Å; L6-L9 PolarHBondContact O-N 3.33Å; L6-S10 PolarHBondContact O-N 2.79Å; L6-S10 PolarHBondContact O-OG 2.93Å
7	L	53.8	Low	47.9	Very low	111 Å²	111	115.8 Å²	115.8	58%	0.581	64%	0.639	S	S	*	*	H	α-helix	trans	-70.2	-34.6	177.4	-76.1	165.4	0	0	0	112.6	L3 S10 A11	L3-L7 PolarHBondContact O-N 3.3Å; L7-S10 WeakPolarHBondContact CA-OG 3.16Å; L7-S10 PolarHBondContact O-OG 2.88Å; L7-A11 WeakPolarHBondContact O-CB 3.14Å; L7-A11 PolarHBondContact O-N 3.25Å
8	V	55.3	Low	47.4	Very low	101 Å²	101	115.1 Å²	115.1	61%	0.612	64%	0.643	S	S	*	*	H	α-helix	trans	-71.9	-36.1	175.3	175.2	0	0	0	0	111.4	L4 A11 S12	L4-V8 VanDerWaalsContact O-CG2 3.27Å; L4-V8 WeakPolarHBondContact O-CG2 2.95Å; L4-V8 PolarHBondContact O-N 3.04Å; V8-A11 PolarHBondContact O-N 2.76Å; V8-S12 PolarHBondContact O-N 2.75Å; V8-S12 PolarHBondContact O-OG 3.05Å
9	L	51.4	Low	47.1	Very low	97 Å²	97	113.9 Å²	113.9	51%	0.508	64%	0.644	S	S	.	*	H	α-helix	trans	-66.1	-41.2	172.4	-87.2	153.8	0	0	0	112	L5 L6 S12 L13	L5-L9 PolarHBondContact O-N 2.98Å; L5-L9 VanDerWaalsContact O-N 3.09Å; L6-L9 PolarHBondContact O-N 3.33Å; L9-S12 WeakPolarHBondContact CA-OG 3.4Å; L9-S12 PolarHBondContact O-N 2.96Å; L9-S12 PolarHBondContact O-OG 3.14Å; L9-S12 VanDerWaalsContact O-OG 3.07Å; L9-L13 WeakPolarHBondContact O-CD1 3.48Å; L9-L13 PolarHBondContact O-N 3.18Å
10	S	51.1	Low	47.1	Very low	58 Å²	58	114.9 Å²	114.9	41%	0.406	65%	0.646	S	S	.	*	H	α-helix	trans	-68.9	-34.2	176.1	55.6	0	0	0	0	113.3	L6 L7 C14	L6-S10 PolarHBondContact O-N 2.79Å; L6-S10 PolarHBondContact O-OG 2.93Å; L7-S10 WeakPolarHBondContact CA-OG 3.16Å; L7-S10 PolarHBondContact O-OG 2.88Å; S10-C14 PolarHBondContact O-N 2.93Å; S10-C14 PolarHBondContact O-SG 2.85Å
11	A	48.9	Very low	47.4	Very low	48 Å²	48	114.9 Å²	114.9	40%	0.397	65%	0.65	S	S	.	*	H	α-helix	trans	-69.7	-37.5	175.9	0	0	0	0	0	111.7	L7 V8 C14 F15	L7-A11 WeakPolarHBondContact O-CB 3.14Å; L7-A11 PolarHBondContact O-N 3.25Å; V8-A11 PolarHBondContact O-N 2.76Å; A11-C14 PolarHBondContact O-N 2.91Å; A11-F15 WeakPolarHBondContact O-CD2 3.38Å
12	S	46.6	Very low	47.6	Very low	66 Å²	66	112.9 Å²	112.9	46%	0.462	64%	0.638	S	S	.	*	H	α-helix	trans	-73.6	-28.1	176.9	41.5	0	0	0	0	113.5	V8 L9 F15	V8-S12 PolarHBondContact O-N 2.75Å; V8-S12 PolarHBondContact O-OG 3.05Å; L9-S12 WeakPolarHBondContact CA-OG 3.4Å; L9-S12 PolarHBondContact O-N 2.96Å; L9-S12 PolarHBondContact O-OG 3.14Å; L9-S12 VanDerWaalsContact O-OG 3.07Å; S12-F15 PolarHBondContact O-N 2.84Å
13	L	43.2	Very low	48.2	Very low	123 Å²	123	107.5 Å²	107.5	64%	0.644	62%	0.618	S	S	*	*	H	α-helix	trans	-71.7	-28.4	170.6	-90.5	142.3	0	0	0	113.3	L9 F15 A16	L9-L13 WeakPolarHBondContact O-CD1 3.48Å; L9-L13 PolarHBondContact O-N 3.18Å; L13-F15 VanDerWaalsContact C-N 3.3Å; L13-F15 PolarHBondContact O-N 2.93Å; L13-A16 PolarHBondContact O-N 2.82Å
14	C	37.4	Very low	50.1	Low	107 Å²	107	108.8 Å²	108.8	72%	0.723	61%	0.613	S	S	*	*	H	α-helix	trans	-73.1	-18.1	174.5	-75.1	0	0	0	0	114	S10 A11	S10-C14 PolarHBondContact O-N 2.93Å; S10-C14 PolarHBondContact O-SG 2.85Å; A11-C14 PolarHBondContact O-N 2.91Å
15	F	38.7	Very low	52	Low	178 Å²	178	105.9 Å²	105.9	78%	0.781	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-2.2	176.3	-70.5	-69.7	0	0	0	114	A11 S12 L13	A11-F15 WeakPolarHBondContact O-CD2 3.38Å; S12-F15 PolarHBondContact O-N 2.84Å; L13-F15 VanDerWaalsContact C-N 3.3Å; L13-F15 PolarHBondContact O-N 2.93Å
16	A	40.3	Very low	54	Low	78 Å²	78	104.1 Å²	104.1	65%	0.645	59%	0.586	S	S	*	*	S	Bend	trans	-101	7.1	-175.3	0	0	0	0	0	114.7	L13	L13-A16 PolarHBondContact O-N 2.82Å
17	N	38.6	Very low	56	Low	140 Å²	140	103.3 Å²	103.3	75%	0.749	59%	0.586	S	S	*	*			trans	-130.6	38.4	-176.5	-145	29.9	0	0	0	114.3	S19	N17-S19 PolarHBondContact O-N 2.88Å
18	S	37.2	Very low	58	Low	102 Å²	102	98.9 Å²	98.9	71%	0.713	56%	0.563	S	S	*	*			trans	-77.9	84.5	151	59.2	0	0	0	0	107.2	I20	S18-I20 PolarHBondContact O-N 3.2Å
19	S	42.9	Very low	59.9	Low	94 Å²	94	96.8 Å²	96.8	66%	0.657	55%	0.547	S	S	*	.			trans	-54.9	105.6	167	51.8	0	0	0	0	107.4	N17 P21	N17-S19 PolarHBondContact O-N 2.88Å; S19-P21 VanDerWaalsContact O-N 3.17Å
20	I	47.3	Very low	61.9	Low	133 Å²	133	99.3 Å²	99.3	68%	0.682	56%	0.561	S	S	*	*			trans	-52.4	123.2	171.3	-62.3	170.8	0	0	0	105.5	S18 H22	S18-I20 PolarHBondContact O-N 3.2Å; I20-H22 PolarHBondContact O-N 3.3Å; I20-H22 PolarHBondContact O-ND1 3.45Å
21	P	53.3	Low	64	Low	114 Å²	114	99.6 Å²	99.6	74%	0.74	56%	0.558	S	S	*	*			trans	-52.9	111.2	178.6	-21.9	30.4	0	0	0	107.8	S19	S19-P21 VanDerWaalsContact O-N 3.17Å
22	H	56.1	Low	66.3	Low	160 Å²	160	97.5 Å²	97.5	74%	0.741	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-65.2	127.2	177.3	-77.3	21.9	0	0	0	106.9	I20 R24	I20-H22 PolarHBondContact O-N 3.3Å; I20-H22 PolarHBondContact O-ND1 3.45Å; H22-R24 PolarHBondContact O-N 3.3Å
23	P	66.4	Low	68.7	Low	51 Å²	51	95.3 Å²	95.3	33%	0.331	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-57.1	129.6	177	24.5	-33.8	0	0	0	108.9	I25 Q36 V45	P23-I25 PolarHBondContact O-N 3.48Å; P23-Q36 WeakPolarHBondContact CB-O 3.48Å; P23-V45 HydrophobicContact CB-CB 4.18Å; P23-V45 HydrophobicContact CB-CG1 3.69Å; P23-V45 HydrophobicContact CB-CG2 3.42Å; P23-V45 VanDerWaalsContact CB-CG2 3.42Å; P23-V45 HydrophobicContact CG-CB 4Å; P23-V45 HydrophobicContact CG-CG1 3.39Å; P23-V45 HydrophobicContact CG-CG2 3.59Å
24	R	86	Confident	71.2	Confident	166 Å²	166	89.5 Å²	89.5	63%	0.626	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-84.6	118.6	179.9	-65.4	-177	-162.2	159	7.1	109	H22 Q36	H22-R24 PolarHBondContact O-N 3.3Å; R24-Q36 HydrophobicContact CB-CB 4.25Å; R24-Q36 PolarHBondContact O-N 3.1Å
25	I	92.5	Very high	73.9	Confident	69 Å²	69	84.4 Å²	84.4	35%	0.354	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.9	174.2	-55.6	173.1	0	0	0	107.2	P23 V33 V34 V35 V45 E46 V47	P23-I25 PolarHBondContact O-N 3.48Å; I25-V33 HydrophobicContact CG2-CG1 3.31Å; I25-V34 WeakPolarHBondContact CA-O 2.84Å; I25-V35 HydrophobicContact CG1-CG2 4.47Å; I25-V45 HydrophobicContact CD1-CG1 4Å; I25-V45 HydrophobicContact CG1-CG1 4.31Å; I25-E46 WeakPolarHBondContact CD1-O 3.44Å; I25-V47 HydrophobicContact CD1-CB 4.47Å; I25-V47 HydrophobicContact CD1-CG1 4.43Å; I25-V47 HydrophobicContact CD1-CG2 4.05Å
26	H	94.3	Very high	76.4	Confident	73 Å²	73	77.7 Å²	77.7	34%	0.338	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	150	175.5	64.2	-83	0	0	0	111.6	V34	H26-V34 PolarHBondContact N-O 3.1Å; H26-V34 PolarHBondContact O-N 3.14Å
27	T	95.4	Very high	78.6	Confident	101 Å²	101	74.1 Å²	74.1	62%	0.62	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	127.5	174.7	-54.1	0	0	0	0	109.6	M29	T27-M29 VanDerWaalsContact CG2-O 3.25Å; T27-M29 WeakPolarHBondContact CG2-O 3.44Å
28	L	95.3	Very high	80.8	Confident	17 Å²	17	70.6 Å²	70.6	9%	0.089	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-41.5	177.3	176.9	63.4	0	0	0	111.9	A32 V34 L156 L157 Y199 L206	L28-A32 PolarHBondContact N-O 3.44Å; L28-V34 HydrophobicContact CB-CG2 3.79Å; L28-V34 HydrophobicContact CD2-CG2 4.03Å; L28-V34 HydrophobicContact CG-CG2 4.46Å; L28-L156 HydrophobicContact CD2-CD2 3.57Å; L28-L157 HydrophobicContact CD1-CD2 3.97Å; L28-L157 HydrophobicContact CG-CD2 4.06Å; L28-Y199 HydrophobicContact CD1-CD1 3.99Å; L28-Y199 HydrophobicContact CD1-CE1 3.64Å; L28-Y199 HydrophobicContact CD1-CE2 4.31Å; L28-Y199 HydrophobicContact CD1-CG 4.45Å; L28-Y199 HydrophobicContact CD2-CD1 4.01Å; L28-Y199 HydrophobicContact CD2-CE1 4.47Å; L28-Y199 HydrophobicContact CD2-CG 4.32Å; L28-L206 HydrophobicContact CD2-CD2 3.87Å
29	M	94.7	Very high	82.5	Confident	58 Å²	58	70.9 Å²	70.9	29%	0.286	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	177.2	174.6	64.6	174.1	75.9	0	0	108.7	T27 N31 A32 L156 L157	T27-M29 VanDerWaalsContact CG2-O 3.25Å; T27-M29 WeakPolarHBondContact CG2-O 3.44Å; M29-N31 PolarHBondContact O-N 2.95Å; M29-A32 HydrophobicContact CG-CB 3.57Å; M29-A32 PolarHBondContact O-N 2.89Å; M29-A32 VanDerWaalsContact O-O 3.1Å; M29-A32 HydrophobicContact SD-CB 4.42Å; M29-L156 HydrophobicContact CE-CD1 4.24Å; M29-L156 HydrophobicContact CE-CD2 4.28Å; M29-L156 HydrophobicContact CE-CG 3.72Å; M29-L156 WeakPolarHBondContact CE-O 3.28Å; M29-L157 HydrophobicContact CE-CB 3.53Å; M29-L157 HydrophobicContact CE-CD1 3.86Å; M29-L157 HydrophobicContact CE-CD2 3.84Å; M29-L157 HydrophobicContact CE-CG 3.93Å
30	D	94	Very high	83.8	Confident	149 Å²	149	69 Å²	69	80%	0.797	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	131.1	175.1	-64.3	-11.4	0	0	0	111.3	A32	D30-A32 PolarHBondContact O-N 2.88Å
31	N	95.1	Very high	84.9	Confident	64 Å²	64	71.3 Å²	71.3	34%	0.342	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	15.7	-177.7	-58	-36.3	0	0	0	115.5	M29 H103 T104 L105	M29-N31 PolarHBondContact O-N 2.95Å; N31-H103 WeakPolarHBondContact CB-O 3.42Å; N31-H103 PolarHBondContact OD1-O 2.89Å; N31-T104 CarbonylContact O-C 3.59Å; N31-T104 WeakPolarHBondContact O-CA 3.4Å; N31-L105 PolarHBondContact O-N 2.68Å
32	A	96.7	Very high	86	Confident	4 Å²	4	67.7 Å²	67.7	3%	0.033	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	121.9	174.7	0	0	0	0	0	112.8	L28 M29 D30 L105	L28-A32 PolarHBondContact N-O 3.44Å; M29-A32 HydrophobicContact CG-CB 3.57Å; M29-A32 PolarHBondContact O-N 2.89Å; M29-A32 VanDerWaalsContact O-O 3.1Å; M29-A32 HydrophobicContact SD-CB 4.42Å; D30-A32 PolarHBondContact O-N 2.88Å; A32-L105 WeakPolarHBondContact CA-O 3.36Å; A32-L105 HydrophobicContact CB-CB 4.44Å
33	V	96.8	Very high	87.3	Confident	21 Å²	21	60.9 Å²	60.9	13%	0.127	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.5	-177.7	175.1	0	0	0	0	109.9	I25 T104 L105 I106 L107	I25-V33 HydrophobicContact CG2-CG1 3.31Å; V33-T104 HydrophobicContact CB-CG2 4.38Å; V33-T104 HydrophobicContact CG2-CG2 3.93Å; V33-L105 PolarHBondContact N-O 3.25Å; V33-I106 WeakPolarHBondContact O-CA 3.36Å; V33-L107 PolarHBondContact O-N 2.95Å
34	V	96.1	Very high	88.4	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.006	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.3	178.3	-179.2	0	0	0	0	109.5	I25 H26 L28 L107 Q109 L206	I25-V34 WeakPolarHBondContact CA-O 2.84Å; H26-V34 PolarHBondContact N-O 3.1Å; H26-V34 PolarHBondContact O-N 3.14Å; L28-V34 HydrophobicContact CB-CG2 3.79Å; L28-V34 HydrophobicContact CD2-CG2 4.03Å; L28-V34 HydrophobicContact CG-CG2 4.46Å; V34-L107 WeakPolarHBondContact CA-O 3.31Å; V34-Q109 HydrophobicContact CG1-CB 3.74Å; V34-L206 HydrophobicContact CB-CD2 4.36Å; V34-L206 HydrophobicContact CG1-CD2 4.02Å; V34-L206 HydrophobicContact CG2-CD2 3.36Å
35	V	94.8	Very high	88.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115	173.3	-174.8	0	0	0	0	108.3	I25 V37 V45 V47 I106 L107 V108 Q109	I25-V35 HydrophobicContact CG1-CG2 4.47Å; V35-V37 HydrophobicContact CG1-CG1 3.8Å; V35-V45 HydrophobicContact CG1-CB 3.78Å; V35-V45 HydrophobicContact CG1-CG1 3.68Å; V35-V45 HydrophobicContact CG1-CG2 3.71Å; V35-V47 HydrophobicContact CG2-CG2 3.68Å; V35-I106 HydrophobicContact CG2-CG2 3.55Å; V35-L107 PolarHBondContact N-O 2.96Å; V35-V108 WeakPolarHBondContact O-CA 3.49Å; V35-Q109 PolarHBondContact O-N 2.89Å
36	Q	91	Very high	88.7	Confident	37 Å²	37	58.6 Å²	58.6	17%	0.173	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121	173.9	-68.7	-178.7	-25.9	0	0	109.8	P23 R24 Q109 D111	P23-Q36 WeakPolarHBondContact CB-O 3.48Å; R24-Q36 HydrophobicContact CB-CB 4.25Å; R24-Q36 PolarHBondContact O-N 3.1Å; Q36-Q109 WeakPolarHBondContact CA-O 3.48Å; Q36-Q109 HydrophobicContact CG-CB 4.44Å; Q36-D111 HydrophobicContact CB-CB 4.18Å
37	V	86.9	Confident	88.7	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.5	-178.7	-57.5	0	0	0	0	111.2	V35 V45 V108 Q109 L110 D111	V35-V37 HydrophobicContact CG1-CG1 3.8Å; V37-V45 HydrophobicContact CG1-CG2 3.72Å; V37-V108 HydrophobicContact CB-CG1 4.45Å; V37-V108 HydrophobicContact CG1-CG1 4.21Å; V37-V108 HydrophobicContact CG2-CG1 3.41Å; V37-V108 VanDerWaalsContact CG2-CG1 3.41Å; V37-Q109 PolarHBondContact N-O 2.94Å; V37-L110 HydrophobicContact CG2-CD2 4.19Å; V37-L110 WeakPolarHBondContact O-CA 3.38Å; V37-D111 PolarHBondContact O-N 3.36Å
38	P	83.3	Confident	88.7	Confident	66 Å²	66	54.8 Å²	54.8	43%	0.429	30%	0.303	S	S	.	.			trans	-64.6	152.8	170.7	28.1	-33.4	0	0	0	110.6	A40 D111	P38-A40 HydrophobicContact CB-CB 4.48Å; P38-A40 HydrophobicContact CG-CB 4.44Å; P38-A40 PolarHBondContact O-N 3.46Å; P38-D111 WeakPolarHBondContact CA-O 3.38Å
39	H	73.8	Confident	88.7	Confident	109 Å²	109	54.4 Å²	54.4	51%	0.505	30%	0.301	S	S	.	.	S	Bend	trans	-73.6	54.5	170.4	-171.1	-80.6	0	0	0	110.9	L110	H39-L110 HydrophobicContact CB-CD2 4.28Å
40	A	70.2	Confident	88.7	Confident	54 Å²	54	54.5 Å²	54.5	45%	0.446	31%	0.305	S	S	.	.			trans	-115.3	135.9	175	0	0	0	0	0	109	P38 S43	P38-A40 HydrophobicContact CB-CB 4.48Å; P38-A40 HydrophobicContact CG-CB 4.44Å; P38-A40 PolarHBondContact O-N 3.46Å; A40-S43 PolarHBondContact O-N 3.45Å
41	H	70.9	Confident	88.7	Confident	182 Å²	182	47.4 Å²	47.4	84%	0.843	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	138.3	173.1	-80.6	-69.2	0	0	0	110.5	E84	H41-E84 IonicContact ND1-OE1 3.75Å
42	G	75.1	Confident	88.5	Confident	37 Å²	37	45.1 Å²	45.1	38%	0.381	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	17.1	178	0	0	0	0	0	115.3	I44 E84	G42-I44 PolarHBondContact O-N 2.81Å; G42-E84 PolarHBondContact N-OE1 3.01Å
43	S	84	Confident	88.1	Confident	17 Å²	17	51.3 Å²	51.3	12%	0.119	29%	0.291	C	S	.	.			trans	-58.5	131.2	170.7	57.6	0	0	0	0	110.2	A40 K83 E84	A40-S43 PolarHBondContact O-N 3.45Å; S43-K83 CarbonylContact O-C 3.52Å; S43-K83 WeakPolarHBondContact O-CA 3.05Å; S43-E84 PolarHBondContact O-N 3.17Å
44	I	88.8	Confident	87.6	Confident	98 Å²	98	55.3 Å²	55.3	50%	0.503	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	130.7	178.4	-63.1	169.4	0	0	0	107.2	G42 L81 V82 K83	G42-I44 PolarHBondContact O-N 2.81Å; I44-L81 HydrophobicContact CG2-CB 4.29Å; I44-L81 HydrophobicContact CG2-CD2 4.14Å; I44-V82 WeakPolarHBondContact CA-O 3.5Å; I44-K83 HydrophobicContact CG1-CB 4.24Å; I44-K83 HydrophobicContact CG1-CD 4.46Å; I44-K83 HydrophobicContact CG1-CG 4.06Å
45	V	91.4	Very high	87.1	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.03	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.2	178.3	-176.5	0	0	0	0	109.4	P23 I25 V35 V37 V47 V82	P23-V45 HydrophobicContact CB-CB 4.18Å; P23-V45 HydrophobicContact CB-CG1 3.69Å; P23-V45 HydrophobicContact CB-CG2 3.42Å; P23-V45 VanDerWaalsContact CB-CG2 3.42Å; P23-V45 HydrophobicContact CG-CB 4Å; P23-V45 HydrophobicContact CG-CG1 3.39Å; P23-V45 HydrophobicContact CG-CG2 3.59Å; I25-V45 HydrophobicContact CD1-CG1 4Å; I25-V45 HydrophobicContact CG1-CG1 4.31Å; V35-V45 HydrophobicContact CG1-CB 3.78Å; V35-V45 HydrophobicContact CG1-CG1 3.68Å; V35-V45 HydrophobicContact CG1-CG2 3.71Å; V37-V45 HydrophobicContact CG1-CG2 3.72Å; V45-V47 HydrophobicContact CG1-CG2 4.16Å; V45-V82 PolarHBondContact N-O 2.83Å; V45-V82 PolarHBondContact O-N 3.06Å
46	E	93.8	Very high	86.4	Confident	136 Å²	136	64.4 Å²	64.4	64%	0.636	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	122.8	170.3	-52.7	-161.5	140.5	0	0	109	I25 T79 L81	I25-E46 WeakPolarHBondContact CD1-O 3.44Å; E46-T79 HydrophobicContact CB-CG2 3.77Å; E46-L81 HydrophobicContact CB-CD2 4.42Å; E46-L81 HydrophobicContact CG-CD2 3.66Å
47	V	94.9	Very high	86	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.012	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	115	178.6	-173.5	0	0	0	0	108.7	I25 V35 V45 L49 V80 V82 I106	I25-V47 HydrophobicContact CD1-CB 4.47Å; I25-V47 HydrophobicContact CD1-CG1 4.43Å; I25-V47 HydrophobicContact CD1-CG2 4.05Å; V35-V47 HydrophobicContact CG2-CG2 3.68Å; V45-V47 HydrophobicContact CG1-CG2 4.16Å; V47-L49 HydrophobicContact CG1-CD2 4.22Å; V47-V80 HydrophobicContact CB-CG2 4.08Å; V47-V80 PolarHBondContact N-O 3.27Å; V47-V80 PolarHBondContact O-N 3.41Å; V47-V82 HydrophobicContact CG2-CB 4.46Å; V47-V82 HydrophobicContact CG2-CG2 3.73Å; V47-I106 HydrophobicContact CB-CD1 4.11Å; V47-I106 HydrophobicContact CG1-CD1 3.92Å; V47-I106 HydrophobicContact CG2-CD1 4.45Å
48	P	94.9	Very high	85.6	Confident	92 Å²	92	74 Å²	74	60%	0.597	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	136.4	172.6	30.5	-32.9	0	0	0	109.7	I78	P48-I78 CarbonylContact C-O 3.58Å; P48-I78 WeakPolarHBondContact CA-O 3.32Å
49	L	95.2	Very high	85.7	Confident	9 Å²	9	76.6 Å²	76.6	5%	0.047	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	148	175.4	-60.1	-179.9	0	0	0	109.6	V47 W62 Q77 I78 V80 Y90 T104 I106	V47-L49 HydrophobicContact CG1-CD2 4.22Å; L49-W62 HydrophobicContact CB-CH2 3.88Å; L49-W62 HydrophobicContact CB-CZ2 4.29Å; L49-W62 HydrophobicContact CB-CZ3 4.3Å; L49-W62 HydrophobicContact CD1-CE3 4.47Å; L49-W62 HydrophobicContact CD1-CZ3 4.1Å; L49-Q77 WeakPolarHBondContact O-CA 3.47Å; L49-I78 HydrophobicContact CB-CG1 3.97Å; L49-I78 HydrophobicContact CD1-CD1 4.31Å; L49-I78 HydrophobicContact CD1-CG1 4.46Å; L49-I78 PolarHBondContact N-O 3.24Å; L49-I78 PolarHBondContact O-N 2.99Å; L49-V80 HydrophobicContact CD1-CG1 3.85Å; L49-V80 HydrophobicContact CD1-CG2 3.82Å; L49-V80 HydrophobicContact CG-CG2 4.16Å; L49-Y90 HydrophobicContact CD1-CD1 4.04Å; L49-Y90 HydrophobicContact CD1-CD2 4.21Å; L49-Y90 HydrophobicContact CD1-CG 3.67Å; L49-T104 HydrophobicContact CD2-CG2 3.78Å; L49-I106 HydrophobicContact CD1-CD1 4.35Å; L49-I106 HydrophobicContact CD2-CD1 4.01Å; L49-I106 HydrophobicContact CD2-CG1 4.37Å
50	T	94.3	Very high	86.6	Confident	59 Å²	59	71.4 Å²	71.4	36%	0.362	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	137.5	173.2	-173	0	0	0	0	108.9	N76	T50-N76 CarbonylContact C-O 3.54Å; T50-N76 WeakPolarHBondContact CA-O 3.45Å
51	C	93.9	Very high	87.7	Confident	1 Å²	1	71 Å²	71	1%	0.007	38%	0.383	C	S	.	.			trans	-74.4	-39.2	176.4	-175.1	0	0	0	0	110.5	Y55 V60 W62 N76 C92 N102	C51-Y55 HydrophobicContact CB-CD2 4.47Å; C51-V60 HydrophobicContact CB-CG2 3.98Å; C51-W62 HydrophobicContact CB-CH2 4.36Å; C51-W62 HydrophobicContact CB-CZ2 3.88Å; C51-N76 VanDerWaalsContact CB-OD1 3.29Å; C51-N76 WeakPolarHBondContact CB-OD1 3.43Å; C51-N76 PolarHBondContact N-O 2.03Å; C51-N76 PolarHBondContact N-OD1 3.31Å; C51-N76 VanDerWaalsContact N-OD1 3.16Å; C51-C92 WeakPolarHBondContact CA-SG 3.35Å; C51-C92 HydrophobicContact CB-CB 3.63Å; C51-C92 WeakPolarHBondContact CB-SG 3.26Å; C51-C92 WeakPolarHBondContact SG-CB 3.47Å; C51-C92 CovalentContact SG-SG 2.03Å; C51-C92 PolarHBondContact SG-SG 2.74Å; C51-N102 VanDerWaalsContact O-CB 3.22Å; C51-N102 WeakPolarHBondContact O-CB 3.5Å; C51-N102 PolarHBondContact O-ND2 3.44Å
52	G	91.5	Very high	88.9	Confident	16 Å²	16	62.8 Å²	62.8	17%	0.165	35%	0.345	C	S	.	.			trans	158.8	163.5	173.3	0	0	0	0	0	111.9	S54 Y55 N76	G52-S54 PolarHBondContact O-N 3.4Å; G52-Y55 PolarHBondContact O-N 3.04Å; G52-N76 PolarHBondContact N-OD1 2.79Å; G52-N76 VanDerWaalsContact N-OD1 3.13Å; G52-N76 PolarHBondContact O-ND2 2.97Å; G52-N76 PolarHBondContact O-OD1 3.18Å; G52-N76 VanDerWaalsContact O-OD1 3.08Å
53	D	88.1	Confident	89.9	Confident	134 Å²	134	62.6 Å²	62.6	72%	0.717	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-66.1	-26.7	-177.3	-63.8	-33	0	0	0	112.7	Y55	D53-Y55 PolarHBondContact O-N 2.97Å
54	S	86.9	Confident	90.4	Very high	105 Å²	105	64.3 Å²	64.3	73%	0.734	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-69.6	-13.3	179.5	-51.9	0	0	0	0	114.7	G52	G52-S54 PolarHBondContact O-N 3.4Å
55	Y	85.9	Confident	90.7	Very high	61 Å²	61	64.4 Å²	64.4	24%	0.239	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-116.2	22.3	-170.8	-53.6	-69.4	0	0	0	112.7	C51 G52 D53 D57 D58 V60 N76 L101	C51-Y55 HydrophobicContact CB-CD2 4.47Å; G52-Y55 PolarHBondContact O-N 3.04Å; D53-Y55 PolarHBondContact O-N 2.97Å; Y55-D57 PolarHBondContact O-N 2.89Å; Y55-D58 WeakPolarHBondContact CD1-OD2 3.32Å; Y55-D58 PolarHBondContact O-N 2.81Å; Y55-D58 VanDerWaalsContact O-N 3.13Å; Y55-V60 HydrophobicContact CG-CG1 4.46Å; Y55-N76 WeakPolarHBondContact O-CB 3.24Å; Y55-L101 HydrophobicContact CD1-CD1 4.02Å; Y55-L101 HydrophobicContact CD2-CD1 4.45Å; Y55-L101 HydrophobicContact CE1-CD1 3.87Å; Y55-L101 HydrophobicContact CE1-CD2 3.88Å; Y55-L101 HydrophobicContact CE1-CG 4.36Å; Y55-L101 HydrophobicContact CE2-CB 4.14Å; Y55-L101 HydrophobicContact CE2-CD1 4.31Å; Y55-L101 HydrophobicContact CG-CD1 4.32Å
56	Q	80.2	Confident	90.8	Very high	131 Å²	131	66.9 Å²	66.9	61%	0.612	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-36.1	-175.3	-83.5	-177.9	-9.4	0	0	114.1
57	D	80.8	Confident	90.7	Very high	163 Å²	163	67.5 Å²	67.5	87%	0.872	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	1.7	-177.9	-61.5	-45.9	0	0	0	113.1	Y55	Y55-D57 PolarHBondContact O-N 2.89Å
58	D	78.9	Confident	90.6	Very high	76 Å²	76	73.7 Å²	73.7	41%	0.406	40%	0.398	S	S	.	.	S	Bend	trans	-94.2	141.9	-175.7	-68.4	-39.9	0	0	0	112.6	Y55 V60	Y55-D58 WeakPolarHBondContact CD1-OD2 3.32Å; Y55-D58 PolarHBondContact O-N 2.81Å; Y55-D58 VanDerWaalsContact O-N 3.13Å; D58-V60 HydrophobicContact CB-CG1 4.25Å; D58-V60 PolarHBondContact O-N 3.23Å; D58-V60 VanDerWaalsContact O-N 3.09Å
59	E	85.9	Confident	90.4	Very high	121 Å²	121	71 Å²	71	57%	0.565	38%	0.378	S	S	*	.			trans	-81.8	84.4	172.4	-166.6	-179.6	176.7	0	0	110.1	F61 Q74	E59-F61 HydrophobicContact CG-CE2 4.34Å; E59-F61 WeakPolarHBondContact O-CD2 3.48Å; E59-F61 WeakPolarHBondContact O-CE2 3.31Å; E59-Q74 HydrophobicContact CG-CB 4.49Å; E59-Q74 VanDerWaalsContact OE1-CD 3.31Å; E59-Q74 PolarHBondContact OE1-NE2 2.81Å; E59-Q74 PolarHBondContact OE1-OE1 2.92Å
60	V	92.6	Very high	90.2	Very high	0 Å²	0	77.1 Å²	77.1	0%	0	42%	0.416	C	S	.	.			trans	-86.9	150.5	176.9	-57.9	0	0	0	0	112.1	C51 Y55 D58 Q74 G75 C92 H93 L101	C51-V60 HydrophobicContact CB-CG2 3.98Å; Y55-V60 HydrophobicContact CG-CG1 4.46Å; D58-V60 HydrophobicContact CB-CG1 4.25Å; D58-V60 PolarHBondContact O-N 3.23Å; D58-V60 VanDerWaalsContact O-N 3.09Å; V60-Q74 CarbonylContact O-C 3.51Å; V60-Q74 WeakPolarHBondContact O-CA 3.45Å; V60-G75 WeakPolarHBondContact CG2-O 3.4Å; V60-G75 PolarHBondContact O-N 3.06Å; V60-C92 HydrophobicContact CB-CB 4.45Å; V60-C92 HydrophobicContact CG2-CB 4.43Å; V60-H93 CarbonylContact C-O 3.44Å; V60-H93 WeakPolarHBondContact CA-O 3.48Å; V60-L101 HydrophobicContact CB-CD1 4.46Å; V60-L101 HydrophobicContact CG1-CD1 3.64Å
61	F	94.3	Very high	90	Very high	47 Å²	47	79.6 Å²	79.6	21%	0.206	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.1	-176.8	-66.6	-107.5	0	0	0	110.6	E59 Q74 C92 H93	E59-F61 HydrophobicContact CG-CE2 4.34Å; E59-F61 WeakPolarHBondContact O-CD2 3.48Å; E59-F61 WeakPolarHBondContact O-CE2 3.31Å; F61-Q74 HydrophobicContact CD1-CG 4.07Å; F61-Q74 HydrophobicContact CE1-CG 4.13Å; F61-C92 CarbonylContact O-C 3.51Å; F61-C92 WeakPolarHBondContact O-CA 3.12Å; F61-H93 PolarHBondContact N-O 3.21Å; F61-H93 PolarHBondContact O-N 3.28Å
62	W	95.1	Very high	89.8	Confident	8 Å²	8	83.2 Å²	83.2	3%	0.03	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.5	-176	-70.6	86.9	0	0	0	113.7	L49 C51 M69 L73 G75 I78 S91 C92	L49-W62 HydrophobicContact CB-CH2 3.88Å; L49-W62 HydrophobicContact CB-CZ2 4.29Å; L49-W62 HydrophobicContact CB-CZ3 4.3Å; L49-W62 HydrophobicContact CD1-CE3 4.47Å; L49-W62 HydrophobicContact CD1-CZ3 4.1Å; C51-W62 HydrophobicContact CB-CH2 4.36Å; C51-W62 HydrophobicContact CB-CZ2 3.88Å; W62-M69 HydrophobicContact CB-SD 3.89Å; W62-L73 HydrophobicContact CB-CB 4.43Å; W62-L73 PolarHBondContact N-O 3.34Å; W62-G75 PolarHBondContact NE1-O 3.16Å; W62-I78 HydrophobicContact CB-CD1 3.89Å; W62-I78 HydrophobicContact CD2-CD1 3.45Å; W62-I78 VanDerWaalsContact CD2-CD1 3.45Å; W62-I78 HydrophobicContact CD2-CG1 4.01Å; W62-I78 HydrophobicContact CE3-CD1 4.04Å; W62-I78 HydrophobicContact CG-CD1 3.37Å; W62-I78 HydrophobicContact CG-CG1 4.2Å; W62-I78 HydrophobicContact CZ2-CD1 4.45Å; W62-I78 HydrophobicContact CZ2-CG1 4.13Å; W62-S91 WeakPolarHBondContact CA-O 3.48Å; W62-C92 HydrophobicContact CD2-CB 3.92Å; W62-C92 HydrophobicContact CE3-CB 4.02Å; W62-C92 HydrophobicContact CH2-CB 4.02Å; W62-C92 HydrophobicContact CZ2-CB 3.92Å; W62-C92 HydrophobicContact CZ3-CB 4.06Å
63	K	95.6	Very high	89.8	Confident	34 Å²	34	84.7 Å²	84.7	15%	0.148	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.4	174.1	-64.4	-177.4	-175.7	171.5	0	110.4	E67 Y90 S91 S96	K63-E67 CarbonylContact C-O 3.6Å; K63-E67 WeakPolarHBondContact CA-O 3.35Å; K63-E67 WeakPolarHBondContact CB-O 3.11Å; K63-Y90 CarbonylContact O-C 3.18Å; K63-Y90 WeakPolarHBondContact O-CA 3.21Å; K63-S91 PolarHBondContact N-O 3.44Å; K63-S91 PolarHBondContact O-N 3.43Å; K63-S96 WeakPolarHBondContact CE-O 3.44Å; K63-S96 PolarHBondContact NZ-O 3.45Å
64	K	95.4	Very high	89.9	Confident	53 Å²	53	82.7 Å²	82.7	23%	0.23	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.7	173	-177.5	-179.6	-178.6	167.4	0	109.7	G66 E67 M69 K86 A87 N89 Y90	K64-G66 PolarHBondContact O-N 2.68Å; K64-G66 VanDerWaalsContact O-N 3.17Å; K64-E67 PolarHBondContact N-O 2.89Å; K64-E67 PolarHBondContact O-N 2.77Å; K64-M69 HydrophobicContact CB-CG 4.18Å; K64-M69 HydrophobicContact CB-SD 4.48Å; K64-K86 PolarHBondContact NZ-O 2.76Å; K64-A87 WeakPolarHBondContact CE-O 3.28Å; K64-N89 CarbonylContact C-O 3.5Å; K64-N89 WeakPolarHBondContact CA-O 3.04Å; K64-Y90 HydrophobicContact CB-CD1 4.17Å; K64-Y90 HydrophobicContact CB-CE1 4Å; K64-Y90 HydrophobicContact CD-CE1 3.79Å; K64-Y90 WeakPolarHBondContact CE-OH 3.48Å; K64-Y90 HydrophobicContact CG-CD1 4.31Å; K64-Y90 HydrophobicContact CG-CE1 3.86Å; K64-Y90 PolarHBondContact NZ-OH 3.41Å; K64-Y90 VanDerWaalsContact NZ-OH 3.11Å
65	N	94.8	Very high	90.2	Very high	100 Å²	100	78.7 Å²	78.7	54%	0.535	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	33.6	-176.9	-57.4	-33.1	0	0	0	112.8	E67 G88 N89	N65-E67 VanDerWaalsContact C-N 3.3Å; N65-E67 PolarHBondContact O-N 2.88Å; N65-G88 WeakPolarHBondContact OD1-CA 3.31Å; N65-N89 PolarHBondContact N-O 2.96Å; N65-N89 PolarHBondContact OD1-N 3.02Å
66	G	92.7	Very high	90.5	Very high	56 Å²	56	76.4 Å²	76.4	58%	0.577	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	-8.7	-177.3	0	0	0	0	0	115.3	K64	K64-G66 PolarHBondContact O-N 2.68Å; K64-G66 VanDerWaalsContact O-N 3.17Å
67	E	93.2	Very high	91.1	Very high	149 Å²	149	77.4 Å²	77.4	70%	0.696	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	147.5	178.8	-62.5	-178.5	174.4	0	0	111.7	K63 K64 N65	K63-E67 CarbonylContact C-O 3.6Å; K63-E67 WeakPolarHBondContact CA-O 3.35Å; K63-E67 WeakPolarHBondContact CB-O 3.11Å; K64-E67 PolarHBondContact N-O 2.89Å; K64-E67 PolarHBondContact O-N 2.77Å; N65-E67 VanDerWaalsContact C-N 3.3Å; N65-E67 PolarHBondContact O-N 2.88Å
68	E	91.9	Very high	91.7	Very high	133 Å²	133	70.2 Å²	70.2	62%	0.621	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	140.1	174.1	-65.7	-173.1	167.1	0	0	111.1
69	M	91.4	Very high	92.5	Very high	35 Å²	35	70.4 Å²	70.4	17%	0.172	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-81.3	143.7	179.6	-61.9	-174.5	66	0	0	111.1	W62 K64 P71 A72 L73 V80 Y90	W62-M69 HydrophobicContact CB-SD 3.89Å; K64-M69 HydrophobicContact CB-CG 4.18Å; K64-M69 HydrophobicContact CB-SD 4.48Å; M69-P71 CarbonylContact C-O 3.59Å; M69-P71 VanDerWaalsContact C-O 3.28Å; M69-P71 CarbonylContact O-C 3.28Å; M69-A72 VanDerWaalsContact O-CA 3.29Å; M69-A72 WeakPolarHBondContact O-CA 3.4Å; M69-A72 PolarHBondContact O-N 3.05Å; M69-A72 VanDerWaalsContact O-N 3.14Å; M69-L73 HydrophobicContact CE-CD1 3.47Å; M69-L73 VanDerWaalsContact CE-CD1 3.47Å; M69-L73 HydrophobicContact CE-CG 4.22Å; M69-L73 HydrophobicContact SD-CD1 4.08Å; M69-L73 HydrophobicContact SD-CG 4.49Å; M69-V80 HydrophobicContact CE-CG1 4.08Å; M69-Y90 HydrophobicContact CE-CD1 4.3Å; M69-Y90 HydrophobicContact CE-CE1 3.93Å; M69-Y90 HydrophobicContact SD-CD1 4.13Å; M69-Y90 HydrophobicContact SD-CE1 4.32Å
70	T	89.8	Confident	93	Very high	138 Å²	138	64.8 Å²	64.8	85%	0.847	37%	0.365	S	S	*	.	S	Bend	trans	-123.6	113.9	174.8	57.1	0	0	0	0	110.4
71	P	90.8	Very high	93	Very high	110 Å²	110	69.8 Å²	69.8	71%	0.714	39%	0.391	S	S	*	.	S	Bend	cis	-65.1	157.9	-4.1	30.7	-36	0	0	0	112.3	M69 L73	M69-P71 CarbonylContact C-O 3.59Å; M69-P71 VanDerWaalsContact C-O 3.28Å; M69-P71 CarbonylContact O-C 3.28Å; P71-L73 PolarHBondContact O-N 2.86Å
72	A	90.3	Very high	92.9	Very high	77 Å²	77	67.5 Å²	67.5	64%	0.636	38%	0.381	S	S	*	.			trans	-61.5	133.6	175.1	0	0	0	0	0	109.6	M69	M69-A72 VanDerWaalsContact O-CA 3.29Å; M69-A72 WeakPolarHBondContact O-CA 3.4Å; M69-A72 PolarHBondContact O-N 3.05Å; M69-A72 VanDerWaalsContact O-N 3.14Å
73	L	91.2	Very high	92.7	Very high	48 Å²	48	72 Å²	72	25%	0.251	40%	0.4	S	S	.	.			trans	-109.3	131.8	175.4	-60.3	-176.3	0	0	0	109	W62 M69 P71 I78 V80	W62-L73 HydrophobicContact CB-CB 4.43Å; W62-L73 PolarHBondContact N-O 3.34Å; M69-L73 HydrophobicContact CE-CD1 3.47Å; M69-L73 VanDerWaalsContact CE-CD1 3.47Å; M69-L73 HydrophobicContact CE-CG 4.22Å; M69-L73 HydrophobicContact SD-CD1 4.08Å; M69-L73 HydrophobicContact SD-CG 4.49Å; P71-L73 PolarHBondContact O-N 2.86Å; L73-I78 HydrophobicContact CB-CD1 4.18Å; L73-I78 HydrophobicContact CB-CG2 4.24Å; L73-I78 HydrophobicContact CD1-CD1 3.83Å; L73-V80 HydrophobicContact CD1-CG1 4.13Å
74	Q	91.1	Very high	92.4	Very high	91 Å²	91	73 Å²	73	43%	0.425	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-132.1	157.8	-177	-63.5	175.3	-54.6	0	0	111.2	E59 V60 F61	E59-Q74 HydrophobicContact CG-CB 4.49Å; E59-Q74 VanDerWaalsContact OE1-CD 3.31Å; E59-Q74 PolarHBondContact OE1-NE2 2.81Å; E59-Q74 PolarHBondContact OE1-OE1 2.92Å; V60-Q74 CarbonylContact O-C 3.51Å; V60-Q74 WeakPolarHBondContact O-CA 3.45Å; F61-Q74 HydrophobicContact CD1-CG 4.07Å; F61-Q74 HydrophobicContact CE1-CG 4.13Å
75	G	91.3	Very high	92	Very high	21 Å²	21	73.2 Å²	73.2	22%	0.216	41%	0.408	C	S	.	.	S	Bend	trans	99.4	158	178.7	0	0	0	0	0	113.1	V60 W62 Q77	V60-G75 WeakPolarHBondContact CG2-O 3.4Å; V60-G75 PolarHBondContact O-N 3.06Å; W62-G75 PolarHBondContact NE1-O 3.16Å; G75-Q77 VanDerWaalsContact C-N 3.29Å; G75-Q77 PolarHBondContact O-N 2.95Å
76	N	92.6	Very high	91.8	Very high	13 Å²	13	74.9 Å²	74.9	7%	0.07	41%	0.411	C	S	.	.	S	Bend	trans	-58.5	-41.8	-174.7	-172.4	24.6	0	0	0	112.5	T50 C51 G52 Y55	T50-N76 CarbonylContact C-O 3.54Å; T50-N76 WeakPolarHBondContact CA-O 3.45Å; C51-N76 VanDerWaalsContact CB-OD1 3.29Å; C51-N76 WeakPolarHBondContact CB-OD1 3.43Å; C51-N76 PolarHBondContact N-O 2.03Å; C51-N76 PolarHBondContact N-OD1 3.31Å; C51-N76 VanDerWaalsContact N-OD1 3.16Å; G52-N76 PolarHBondContact N-OD1 2.79Å; G52-N76 VanDerWaalsContact N-OD1 3.13Å; G52-N76 PolarHBondContact O-ND2 2.97Å; G52-N76 PolarHBondContact O-OD1 3.18Å; G52-N76 VanDerWaalsContact O-OD1 3.08Å; Y55-N76 WeakPolarHBondContact O-CB 3.24Å
77	Q	93.5	Very high	91.9	Very high	152 Å²	152	72.6 Å²	72.6	71%	0.71	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	124	179.9	-66.8	-176.7	-18.2	0	0	110.4	L49 G75	L49-Q77 WeakPolarHBondContact O-CA 3.47Å; G75-Q77 VanDerWaalsContact C-N 3.29Å; G75-Q77 PolarHBondContact O-N 2.95Å
78	I	94.2	Very high	92	Very high	13 Å²	13	65.8 Å²	65.8	7%	0.067	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	160.3	174.9	65	161.1	0	0	0	110	P48 L49 W62 L73 V80	P48-I78 CarbonylContact C-O 3.58Å; P48-I78 WeakPolarHBondContact CA-O 3.32Å; L49-I78 HydrophobicContact CB-CG1 3.97Å; L49-I78 HydrophobicContact CD1-CD1 4.31Å; L49-I78 HydrophobicContact CD1-CG1 4.46Å; L49-I78 PolarHBondContact N-O 3.24Å; L49-I78 PolarHBondContact O-N 2.99Å; W62-I78 HydrophobicContact CB-CD1 3.89Å; W62-I78 HydrophobicContact CD2-CD1 3.45Å; W62-I78 VanDerWaalsContact CD2-CD1 3.45Å; W62-I78 HydrophobicContact CD2-CG1 4.01Å; W62-I78 HydrophobicContact CE3-CD1 4.04Å; W62-I78 HydrophobicContact CG-CD1 3.37Å; W62-I78 HydrophobicContact CG-CG1 4.2Å; W62-I78 HydrophobicContact CZ2-CD1 4.45Å; W62-I78 HydrophobicContact CZ2-CG1 4.13Å; L73-I78 HydrophobicContact CB-CD1 4.18Å; L73-I78 HydrophobicContact CB-CG2 4.24Å; L73-I78 HydrophobicContact CD1-CD1 3.83Å; I78-V80 HydrophobicContact CD1-CG1 3.65Å; I78-V80 HydrophobicContact CG1-CG1 4.33Å
79	T	95.1	Very high	92.3	Very high	80 Å²	80	62.1 Å²	62.1	49%	0.491	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.5	169.9	-60.1	0	0	0	0	108.9	E46	E46-T79 HydrophobicContact CB-CG2 3.77Å
80	V	95.3	Very high	92.5	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	145	178.1	-59.3	0	0	0	0	111.3	V47 L49 M69 L73 I78 Y90 I106	V47-V80 HydrophobicContact CB-CG2 4.08Å; V47-V80 PolarHBondContact N-O 3.27Å; V47-V80 PolarHBondContact O-N 3.41Å; L49-V80 HydrophobicContact CD1-CG1 3.85Å; L49-V80 HydrophobicContact CD1-CG2 3.82Å; L49-V80 HydrophobicContact CG-CG2 4.16Å; M69-V80 HydrophobicContact CE-CG1 4.08Å; L73-V80 HydrophobicContact CD1-CG1 4.13Å; I78-V80 HydrophobicContact CD1-CG1 3.65Å; I78-V80 HydrophobicContact CG1-CG1 4.33Å; V80-Y90 HydrophobicContact CB-CE1 4.03Å; V80-Y90 HydrophobicContact CG1-CD1 3.99Å; V80-Y90 HydrophobicContact CG1-CE1 3.8Å; V80-Y90 HydrophobicContact CG2-CE1 4.12Å; V80-Y90 HydrophobicContact CG2-CE2 4.4Å; V80-I106 HydrophobicContact CG2-CD1 3.68Å
81	L	93.3	Very high	92.8	Very high	104 Å²	104	54.5 Å²	54.5	55%	0.545	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	114.6	175.9	-60.6	-179.6	0	0	0	110.3	I44 E46	I44-L81 HydrophobicContact CG2-CB 4.29Å; I44-L81 HydrophobicContact CG2-CD2 4.14Å; E46-L81 HydrophobicContact CB-CD2 4.42Å; E46-L81 HydrophobicContact CG-CD2 3.66Å
82	V	93	Very high	93	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	108.1	172	179.9	0	0	0	0	108.5	I44 V45 V47 A87 I106 V108	I44-V82 WeakPolarHBondContact CA-O 3.5Å; V45-V82 PolarHBondContact N-O 2.83Å; V45-V82 PolarHBondContact O-N 3.06Å; V47-V82 HydrophobicContact CG2-CB 4.46Å; V47-V82 HydrophobicContact CG2-CG2 3.73Å; V82-A87 HydrophobicContact CG1-CB 3.91Å; V82-I106 HydrophobicContact CG2-CD1 4.19Å; V82-I106 HydrophobicContact CG2-CG2 4.08Å; V82-V108 HydrophobicContact CG1-CG2 3.94Å
83	K	90.5	Very high	93.2	Very high	101 Å²	101	46.4 Å²	46.4	44%	0.439	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.2	176.2	-177.2	172.5	-179.3	174.1	0	110.7	S43 I44 M85 K86	S43-K83 CarbonylContact O-C 3.52Å; S43-K83 WeakPolarHBondContact O-CA 3.05Å; I44-K83 HydrophobicContact CG1-CB 4.24Å; I44-K83 HydrophobicContact CG1-CD 4.46Å; I44-K83 HydrophobicContact CG1-CG 4.06Å; K83-M85 PolarHBondContact O-N 3.44Å; K83-K86 VanDerWaalsContact O-CB 3.24Å; K83-K86 WeakPolarHBondContact O-CB 3.13Å; K83-K86 PolarHBondContact O-N 2.72Å
84	E	88.1	Confident	93.2	Very high	57 Å²	57	48 Å²	48	27%	0.266	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	-120.2	179.8	-57.6	173.9	167.3	0	0	110.8	H41 G42 S43	H41-E84 IonicContact ND1-OE1 3.75Å; G42-E84 PolarHBondContact N-OE1 3.01Å; S43-E84 PolarHBondContact O-N 3.17Å
85	M	88.6	Confident	92.7	Very high	56 Å²	56	45.8 Å²	45.8	28%	0.276	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	8.8	178.3	-66.9	-71	160.5	0	0	113.2	K83 A87 V108 L110 S204 R205	K83-M85 PolarHBondContact O-N 3.44Å; M85-A87 VanDerWaalsContact C-N 3.29Å; M85-A87 PolarHBondContact O-N 2.83Å; M85-A87 VanDerWaalsContact O-N 3.1Å; M85-V108 HydrophobicContact CE-CG1 3.89Å; M85-V108 HydrophobicContact SD-CB 3.9Å; M85-V108 HydrophobicContact SD-CG1 3.7Å; M85-L110 HydrophobicContact CE-CD1 4.11Å; M85-L110 HydrophobicContact CE-CD2 3.24Å; M85-L110 HydrophobicContact CE-CG 3.48Å; M85-L110 VanDerWaalsContact CE-CG 3.48Å; M85-S204 WeakPolarHBondContact O-CB 3.4Å; M85-S204 PolarHBondContact O-OG 2.82Å; M85-R205 HydrophobicContact SD-CB 4.12Å; M85-R205 HydrophobicContact SD-CG 4.27Å
86	K	90.3	Very high	91.9	Very high	136 Å²	136	47.4 Å²	47.4	59%	0.591	25%	0.247	S	C	*	.			trans	-89.6	49.9	-172.1	-58.4	-173.2	178.7	-172.9	0	113.5	K64 K83	K64-K86 PolarHBondContact NZ-O 2.76Å; K83-K86 VanDerWaalsContact O-CB 3.24Å; K83-K86 WeakPolarHBondContact O-CB 3.13Å; K83-K86 PolarHBondContact O-N 2.72Å
87	A	94.8	Very high	91.2	Very high	7 Å²	7	51.9 Å²	51.9	6%	0.058	28%	0.279	C	S	.	.			trans	-84.6	-161.4	170	0	0	0	0	0	111.8	K64 V82 M85 I106 V108	K64-A87 WeakPolarHBondContact CE-O 3.28Å; V82-A87 HydrophobicContact CG1-CB 3.91Å; M85-A87 VanDerWaalsContact C-N 3.29Å; M85-A87 PolarHBondContact O-N 2.83Å; M85-A87 VanDerWaalsContact O-N 3.1Å; A87-I106 HydrophobicContact CB-CB 4.03Å; A87-I106 HydrophobicContact CB-CG2 3.88Å; A87-I106 WeakPolarHBondContact CB-O 3.34Å; A87-V108 HydrophobicContact CB-CG2 3.57Å
88	G	95.8	Very high	90.5	Very high	6 Å²	6	45.8 Å²	45.8	6%	0.062	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.9	-173.9	-177.1	0	0	0	0	0	113.2	N65 Y90 I106	N65-G88 WeakPolarHBondContact OD1-CA 3.31Å; G88-Y90 VanDerWaalsContact O-CD2 3.31Å; G88-Y90 WeakPolarHBondContact O-CD2 3.21Å; G88-Y90 WeakPolarHBondContact O-CE2 3.35Å; G88-I106 PolarHBondContact N-O 3.15Å; G88-I106 PolarHBondContact O-N 2.87Å
89	N	97.1	Very high	90.2	Very high	56 Å²	56	51.9 Å²	51.9	30%	0.299	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	120.3	174.5	-176.1	-30.7	0	0	0	109.5	K64 N65 H103 L105	K64-N89 CarbonylContact C-O 3.5Å; K64-N89 WeakPolarHBondContact CA-O 3.04Å; N65-N89 PolarHBondContact N-O 2.96Å; N65-N89 PolarHBondContact OD1-N 3.02Å; N89-H103 WeakPolarHBondContact OD1-CB 3.48Å; N89-L105 HydrophobicContact CB-CD1 4.18Å
90	Y	97	Very high	90.2	Very high	3 Å²	3	53.3 Å²	53.3	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.1	174.4	-65.2	-96.7	0	0	0	108.6	L49 K63 K64 M69 V80 G88 H103 T104 I106	L49-Y90 HydrophobicContact CD1-CD1 4.04Å; L49-Y90 HydrophobicContact CD1-CD2 4.21Å; L49-Y90 HydrophobicContact CD1-CG 3.67Å; K63-Y90 CarbonylContact O-C 3.18Å; K63-Y90 WeakPolarHBondContact O-CA 3.21Å; K64-Y90 HydrophobicContact CB-CD1 4.17Å; K64-Y90 HydrophobicContact CB-CE1 4Å; K64-Y90 HydrophobicContact CD-CE1 3.79Å; K64-Y90 WeakPolarHBondContact CE-OH 3.48Å; K64-Y90 HydrophobicContact CG-CD1 4.31Å; K64-Y90 HydrophobicContact CG-CE1 3.86Å; K64-Y90 PolarHBondContact NZ-OH 3.41Å; K64-Y90 VanDerWaalsContact NZ-OH 3.11Å; M69-Y90 HydrophobicContact CE-CD1 4.3Å; M69-Y90 HydrophobicContact CE-CE1 3.93Å; M69-Y90 HydrophobicContact SD-CD1 4.13Å; M69-Y90 HydrophobicContact SD-CE1 4.32Å; V80-Y90 HydrophobicContact CB-CE1 4.03Å; V80-Y90 HydrophobicContact CG1-CD1 3.99Å; V80-Y90 HydrophobicContact CG1-CE1 3.8Å; V80-Y90 HydrophobicContact CG2-CE1 4.12Å; V80-Y90 HydrophobicContact CG2-CE2 4.4Å; G88-Y90 VanDerWaalsContact O-CD2 3.31Å; G88-Y90 WeakPolarHBondContact O-CD2 3.21Å; G88-Y90 WeakPolarHBondContact O-CE2 3.35Å; Y90-H103 CarbonylContact O-C 3.53Å; Y90-H103 WeakPolarHBondContact O-CA 3.02Å; Y90-H103 WeakPolarHBondContact O-CB 3.26Å; Y90-T104 PolarHBondContact N-O 3.07Å; Y90-T104 PolarHBondContact O-N 2.96Å; Y90-I106 HydrophobicContact CD2-CB 4.45Å; Y90-I106 HydrophobicContact CD2-CD1 3.59Å; Y90-I106 HydrophobicContact CD2-CG1 3.8Å; Y90-I106 HydrophobicContact CE2-CB 4.22Å; Y90-I106 HydrophobicContact CE2-CD1 3.42Å; Y90-I106 VanDerWaalsContact CE2-CD1 3.42Å; Y90-I106 HydrophobicContact CE2-CG1 3.9Å
91	S	96.3	Very high	90.1	Very high	10 Å²	10	54.6 Å²	54.6	7%	0.07	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	141	-179.4	54.6	0	0	0	0	110.3	W62 K63 H93 N102	W62-S91 WeakPolarHBondContact CA-O 3.48Å; K63-S91 PolarHBondContact N-O 3.44Å; K63-S91 PolarHBondContact O-N 3.43Å; S91-H93 WeakPolarHBondContact CB-NE2 3.29Å; S91-H93 PolarHBondContact O-CD2 3.06Å; S91-H93 PolarHBondContact OG-NE2 2.89Å; S91-N102 CarbonylContact C-O 3.48Å; S91-N102 VanDerWaalsContact CA-O 3.32Å; S91-N102 WeakPolarHBondContact CA-O 3.25Å
92	C	94.9	Very high	90.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	146.2	175	59.3	0	0	0	0	110.9	C51 V60 F61 W62 L101 N102	C51-C92 WeakPolarHBondContact CA-SG 3.35Å; C51-C92 HydrophobicContact CB-CB 3.63Å; C51-C92 WeakPolarHBondContact CB-SG 3.26Å; C51-C92 WeakPolarHBondContact SG-CB 3.47Å; C51-C92 CovalentContact SG-SG 2.03Å; C51-C92 PolarHBondContact SG-SG 2.74Å; V60-C92 HydrophobicContact CB-CB 4.45Å; V60-C92 HydrophobicContact CG2-CB 4.43Å; F61-C92 CarbonylContact O-C 3.51Å; F61-C92 WeakPolarHBondContact O-CA 3.12Å; W62-C92 HydrophobicContact CD2-CB 3.92Å; W62-C92 HydrophobicContact CE3-CB 4.02Å; W62-C92 HydrophobicContact CH2-CB 4.02Å; W62-C92 HydrophobicContact CZ2-CB 3.92Å; W62-C92 HydrophobicContact CZ3-CB 4.06Å; C92-L101 WeakPolarHBondContact O-CB 2.99Å; C92-L101 PolarHBondContact O-N 3.46Å; C92-N102 PolarHBondContact N-O 3.2Å
93	H	94.6	Very high	90.4	Very high	18 Å²	18	54.1 Å²	54.1	8%	0.083	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.3	-171.6	-57.9	-102.4	0	0	0	110.4	V60 F61 S91 S95 E99	V60-H93 CarbonylContact C-O 3.44Å; V60-H93 WeakPolarHBondContact CA-O 3.48Å; F61-H93 PolarHBondContact N-O 3.21Å; F61-H93 PolarHBondContact O-N 3.28Å; S91-H93 WeakPolarHBondContact CB-NE2 3.29Å; S91-H93 PolarHBondContact O-CD2 3.06Å; S91-H93 PolarHBondContact OG-NE2 2.89Å; H93-S95 VanDerWaalsContact C-N 3.28Å; H93-S95 WeakPolarHBondContact CB-O 3.45Å; H93-S95 PolarHBondContact O-N 2.98Å; H93-E99 CarbonylContact C-O 3.58Å; H93-E99 WeakPolarHBondContact CA-O 3.34Å; H93-E99 WeakPolarHBondContact CB-O 3.31Å
94	L	89.8	Confident	90.7	Very high	82 Å²	82	50.1 Å²	50.1	43%	0.429	27%	0.269	S	S	.	.	S	Bend	trans	-66.9	-26.5	178.3	-75.3	171.6	0	0	0	114	E99 L101	L94-E99 HydrophobicContact CD1-CB 4.3Å; L94-E99 PolarHBondContact N-O 3.28Å; L94-L101 HydrophobicContact CD1-CD2 4.13Å; L94-L101 HydrophobicContact CD2-CD1 3.85Å; L94-L101 HydrophobicContact CD2-CD2 4.08Å; L94-L101 HydrophobicContact CD2-CG 4.44Å; L94-L101 HydrophobicContact CG-CD1 3.94Å; L94-L101 HydrophobicContact CG-CD2 3.68Å; L94-L101 HydrophobicContact CG-CG 4.06Å
95	S	81.9	Confident	91.2	Very high	44 Å²	44	49.1 Å²	49.1	31%	0.308	27%	0.265	S	S	.	.	S	Bend	trans	-150.9	171	174.3	71.3	0	0	0	0	109.7	H93 S97 G98	H93-S95 VanDerWaalsContact C-N 3.28Å; H93-S95 WeakPolarHBondContact CB-O 3.45Å; H93-S95 PolarHBondContact O-N 2.98Å; S95-S97 PolarHBondContact O-N 2.78Å; S95-G98 PolarHBondContact O-N 2.78Å; S95-G98 WeakPolarHBondContact OG-CA 3.39Å; S95-G98 PolarHBondContact OG-N 2.9Å
96	S	74.6	Confident	91.6	Very high	55 Å²	55	46.5 Å²	46.5	39%	0.385	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-35.5	179.5	56	0	0	0	0	113.3	K63	K63-S96 WeakPolarHBondContact CE-O 3.44Å; K63-S96 PolarHBondContact NZ-O 3.45Å
97	S	76.1	Confident	91.9	Very high	107 Å²	107	40 Å²	40	75%	0.748	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.3	8	172.9	59.2	0	0	0	0	113.9	S95	S95-S97 PolarHBondContact O-N 2.78Å
98	G	79.6	Confident	91.9	Very high	24 Å²	24	39.7 Å²	39.7	25%	0.247	22%	0.221	C	C	.	.	S	Bend	trans	-83.7	-171.4	-167.3	0	0	0	0	0	115.2	S95	S95-G98 PolarHBondContact O-N 2.78Å; S95-G98 WeakPolarHBondContact OG-CA 3.39Å; S95-G98 PolarHBondContact OG-N 2.9Å
99	E	88.8	Confident	91.8	Very high	141 Å²	141	40.5 Å²	40.5	66%	0.659	22%	0.224	S	C	*	.			trans	-69.4	141.8	-178.1	-172.3	176.1	-177.7	0	0	112.2	H93 L94	H93-E99 CarbonylContact C-O 3.58Å; H93-E99 WeakPolarHBondContact CA-O 3.34Å; H93-E99 WeakPolarHBondContact CB-O 3.31Å; L94-E99 HydrophobicContact CD1-CB 4.3Å; L94-E99 PolarHBondContact N-O 3.28Å
100	Y	94.1	Very high	91.4	Very high	110 Å²	110	38.3 Å²	38.3	43%	0.431	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	131.4	172.9	164.8	-87.2	0	0	0	110.8	N102 H103	Y100-N102 WeakPolarHBondContact CE2-O 3.25Å; Y100-N102 VanDerWaalsContact OH-C 3.29Å; Y100-N102 WeakPolarHBondContact OH-CA 3.14Å; Y100-H103 HydrophobicContact CE2-CB 4.09Å; Y100-H103 AromaticContact CZ-ND1 3.89Å; Y100-H103 PolarHBondContact OH-N 3.1Å; Y100-H103 PolarHBondContact OH-ND1 3.32Å
101	L	93.9	Very high	90.8	Very high	30 Å²	30	41.5 Å²	41.5	16%	0.157	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-55.6	-179.8	-62.6	178.4	0	0	0	112.1	Y55 V60 C92 L94	Y55-L101 HydrophobicContact CD1-CD1 4.02Å; Y55-L101 HydrophobicContact CD2-CD1 4.45Å; Y55-L101 HydrophobicContact CE1-CD1 3.87Å; Y55-L101 HydrophobicContact CE1-CD2 3.88Å; Y55-L101 HydrophobicContact CE1-CG 4.36Å; Y55-L101 HydrophobicContact CE2-CB 4.14Å; Y55-L101 HydrophobicContact CE2-CD1 4.31Å; Y55-L101 HydrophobicContact CG-CD1 4.32Å; V60-L101 HydrophobicContact CB-CD1 4.46Å; V60-L101 HydrophobicContact CG1-CD1 3.64Å; C92-L101 WeakPolarHBondContact O-CB 2.99Å; C92-L101 PolarHBondContact O-N 3.46Å; L94-L101 HydrophobicContact CD1-CD2 4.13Å; L94-L101 HydrophobicContact CD2-CD1 3.85Å; L94-L101 HydrophobicContact CD2-CD2 4.08Å; L94-L101 HydrophobicContact CD2-CG 4.44Å; L94-L101 HydrophobicContact CG-CD1 3.94Å; L94-L101 HydrophobicContact CG-CD2 3.68Å; L94-L101 HydrophobicContact CG-CG 4.06Å
102	N	95.2	Very high	90	Very high	42 Å²	42	45.1 Å²	45.1	23%	0.225	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	173.7	-177.4	-159.9	6.2	0	0	0	111	C51 S91 C92 Y100	C51-N102 VanDerWaalsContact O-CB 3.22Å; C51-N102 WeakPolarHBondContact O-CB 3.5Å; C51-N102 PolarHBondContact O-ND2 3.44Å; S91-N102 CarbonylContact C-O 3.48Å; S91-N102 VanDerWaalsContact CA-O 3.32Å; S91-N102 WeakPolarHBondContact CA-O 3.25Å; C92-N102 PolarHBondContact N-O 3.2Å; Y100-N102 WeakPolarHBondContact CE2-O 3.25Å; Y100-N102 VanDerWaalsContact OH-C 3.29Å; Y100-N102 WeakPolarHBondContact OH-CA 3.14Å
103	H	96.3	Very high	88.8	Confident	51 Å²	51	47.5 Å²	47.5	24%	0.236	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	165.2	172.3	71.6	-71.3	0	0	0	113.6	N31 N89 Y90 Y100	N31-H103 WeakPolarHBondContact CB-O 3.42Å; N31-H103 PolarHBondContact OD1-O 2.89Å; N89-H103 WeakPolarHBondContact OD1-CB 3.48Å; Y90-H103 CarbonylContact O-C 3.53Å; Y90-H103 WeakPolarHBondContact O-CA 3.02Å; Y90-H103 WeakPolarHBondContact O-CB 3.26Å; Y100-H103 HydrophobicContact CE2-CB 4.09Å; Y100-H103 AromaticContact CZ-ND1 3.89Å; Y100-H103 PolarHBondContact OH-N 3.1Å; Y100-H103 PolarHBondContact OH-ND1 3.32Å
104	T	97.6	Very high	87.7	Confident	17 Å²	17	51.9 Å²	51.9	10%	0.104	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	117.6	164.8	-59.5	0	0	0	0	108.6	N31 V33 L49 Y90 I106	N31-T104 CarbonylContact O-C 3.59Å; N31-T104 WeakPolarHBondContact O-CA 3.4Å; V33-T104 HydrophobicContact CB-CG2 4.38Å; V33-T104 HydrophobicContact CG2-CG2 3.93Å; L49-T104 HydrophobicContact CD2-CG2 3.78Å; Y90-T104 PolarHBondContact N-O 3.07Å; Y90-T104 PolarHBondContact O-N 2.96Å; T104-I106 HydrophobicContact CG2-CG1 4.37Å
105	L	97.4	Very high	87.2	Confident	37 Å²	37	54.9 Å²	54.9	19%	0.194	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	115	168.8	177.8	63.1	0	0	0	109.2	N31 A32 V33 N89 L107 L156	N31-L105 PolarHBondContact O-N 2.68Å; A32-L105 WeakPolarHBondContact CA-O 3.36Å; A32-L105 HydrophobicContact CB-CB 4.44Å; V33-L105 PolarHBondContact N-O 3.25Å; N89-L105 HydrophobicContact CB-CD1 4.18Å; L105-L107 HydrophobicContact CD1-CD2 4.4Å; L105-L107 HydrophobicContact CD2-CD1 4.22Å; L105-L107 HydrophobicContact CD2-CD2 4.26Å; L105-L107 HydrophobicContact CD2-CG 4.23Å; L105-L107 HydrophobicContact CG-CD2 4.26Å; L105-L107 HydrophobicContact CG-CG 4.09Å; L105-L156 HydrophobicContact CD2-CD1 4.23Å
106	I	97.7	Very high	87.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.1	172.1	-52	179.3	0	0	0	109	V33 V35 V47 L49 V80 V82 A87 G88 Y90 T104	V33-I106 WeakPolarHBondContact O-CA 3.36Å; V35-I106 HydrophobicContact CG2-CG2 3.55Å; V47-I106 HydrophobicContact CB-CD1 4.11Å; V47-I106 HydrophobicContact CG1-CD1 3.92Å; V47-I106 HydrophobicContact CG2-CD1 4.45Å; L49-I106 HydrophobicContact CD1-CD1 4.35Å; L49-I106 HydrophobicContact CD2-CD1 4.01Å; L49-I106 HydrophobicContact CD2-CG1 4.37Å; V80-I106 HydrophobicContact CG2-CD1 3.68Å; V82-I106 HydrophobicContact CG2-CD1 4.19Å; V82-I106 HydrophobicContact CG2-CG2 4.08Å; A87-I106 HydrophobicContact CB-CB 4.03Å; A87-I106 HydrophobicContact CB-CG2 3.88Å; A87-I106 WeakPolarHBondContact CB-O 3.34Å; G88-I106 PolarHBondContact N-O 3.15Å; G88-I106 PolarHBondContact O-N 2.87Å; Y90-I106 HydrophobicContact CD2-CB 4.45Å; Y90-I106 HydrophobicContact CD2-CD1 3.59Å; Y90-I106 HydrophobicContact CD2-CG1 3.8Å; Y90-I106 HydrophobicContact CE2-CB 4.22Å; Y90-I106 HydrophobicContact CE2-CD1 3.42Å; Y90-I106 VanDerWaalsContact CE2-CD1 3.42Å; Y90-I106 HydrophobicContact CE2-CG1 3.9Å; T104-I106 HydrophobicContact CG2-CG1 4.37Å
107	L	97.1	Very high	88.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	154.8	174.6	-65	168.7	0	0	0	110.8	V33 V34 V35 L105 L156 H201 S204 L206	V33-L107 PolarHBondContact O-N 2.95Å; V34-L107 WeakPolarHBondContact CA-O 3.31Å; V35-L107 PolarHBondContact N-O 2.96Å; L105-L107 HydrophobicContact CD1-CD2 4.4Å; L105-L107 HydrophobicContact CD2-CD1 4.22Å; L105-L107 HydrophobicContact CD2-CD2 4.26Å; L105-L107 HydrophobicContact CD2-CG 4.23Å; L105-L107 HydrophobicContact CG-CD2 4.26Å; L105-L107 HydrophobicContact CG-CG 4.09Å; L107-L156 HydrophobicContact CD1-CD2 3.2Å; L107-L156 HydrophobicContact CD1-CG 4.45Å; L107-H201 HydrophobicContact CD2-CB 4.2Å; L107-S204 CarbonylContact C-O 3.57Å; L107-S204 WeakPolarHBondContact CA-O 3.48Å; L107-L206 HydrophobicContact CB-CB 4.01Å; L107-L206 HydrophobicContact CB-CD2 4.37Å; L107-L206 HydrophobicContact CD1-CB 4.41Å; L107-L206 HydrophobicContact CD1-CD1 4.17Å; L107-L206 HydrophobicContact CD1-CD2 4.21Å
108	V	94.6	Very high	89.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.3	-177.8	-175.5	0	0	0	0	109.1	V35 V37 V82 M85 A87 S204 R205 L206	V35-V108 WeakPolarHBondContact O-CA 3.49Å; V37-V108 HydrophobicContact CB-CG1 4.45Å; V37-V108 HydrophobicContact CG1-CG1 4.21Å; V37-V108 HydrophobicContact CG2-CG1 3.41Å; V37-V108 VanDerWaalsContact CG2-CG1 3.41Å; V82-V108 HydrophobicContact CG1-CG2 3.94Å; M85-V108 HydrophobicContact CE-CG1 3.89Å; M85-V108 HydrophobicContact SD-CB 3.9Å; M85-V108 HydrophobicContact SD-CG1 3.7Å; A87-V108 HydrophobicContact CB-CG2 3.57Å; V108-S204 PolarHBondContact N-O 2.89Å; V108-R205 WeakPolarHBondContact O-CA 3.4Å; V108-L206 PolarHBondContact O-N 2.03Å
109	Q	93.3	Very high	90	Very high	24 Å²	24	49.2 Å²	49.2	11%	0.112	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.1	171.8	-171	175.9	9.3	0	0	109.2	V34 V35 Q36 V37 D113	V34-Q109 HydrophobicContact CG1-CB 3.74Å; V35-Q109 PolarHBondContact O-N 2.89Å; Q36-Q109 WeakPolarHBondContact CA-O 3.48Å; Q36-Q109 HydrophobicContact CG-CB 4.44Å; V37-Q109 PolarHBondContact N-O 2.94Å; Q109-D113 PolarHBondContact NE2-OD2 3.4Å
110	L	89.2	Confident	90.2	Very high	10 Å²	10	45.4 Å²	45.4	5%	0.052	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.5	174.5	-69.6	175.3	0	0	0	110.4	V37 H39 M85 D113	V37-L110 HydrophobicContact CG2-CD2 4.19Å; V37-L110 WeakPolarHBondContact O-CA 3.38Å; H39-L110 HydrophobicContact CB-CD2 4.28Å; M85-L110 HydrophobicContact CE-CD1 4.11Å; M85-L110 HydrophobicContact CE-CD2 3.24Å; M85-L110 HydrophobicContact CE-CG 3.48Å; M85-L110 VanDerWaalsContact CE-CG 3.48Å; L110-D113 WeakPolarHBondContact O-CA 3.49Å; L110-D113 WeakPolarHBondContact O-CB 3.35Å; L110-D113 PolarHBondContact O-N 3.11Å
111	D	84.2	Confident	90.1	Very high	69 Å²	69	44.3 Å²	44.3	37%	0.369	23%	0.228	S	C	.	.	S	Bend	trans	-132.7	115.7	172.8	-174.3	23.8	0	0	0	110.8	Q36 V37 P38	Q36-D111 HydrophobicContact CB-CB 4.18Å; V37-D111 PolarHBondContact O-N 3.36Å; P38-D111 WeakPolarHBondContact CA-O 3.38Å
112	P	79.6	Confident	89.5	Confident	87 Å²	87	49.9 Å²	49.9	57%	0.565	25%	0.25	S	S	*	.	S	Bend	cis	-69.9	143.6	-1.8	29.5	-34.8	0	0	0	112.4	N114	P112-N114 PolarHBondContact O-N 2.72Å
113	D	69.4	Low	88.7	Confident	49 Å²	49	49.8 Å²	49.8	26%	0.262	25%	0.253	S	S	.	.			trans	-78.6	58.2	179.4	-159.8	-3	0	0	0	111.6	Q109 L110 R115	Q109-D113 PolarHBondContact NE2-OD2 3.4Å; L110-D113 WeakPolarHBondContact O-CA 3.49Å; L110-D113 WeakPolarHBondContact O-CB 3.35Å; L110-D113 PolarHBondContact O-N 3.11Å; D113-R115 VanDerWaalsContact C-N 3.28Å; D113-R115 PolarHBondContact O-N 3.4Å
114	N	71.6	Confident	87.8	Confident	111 Å²	111	53.4 Å²	53.4	59%	0.594	28%	0.281	S	S	*	.			trans	-85.5	5.3	-172.4	66.5	0.2	0	0	0	114.3	P112	P112-N114 PolarHBondContact O-N 2.72Å
115	R	79.1	Confident	86.7	Confident	145 Å²	145	56.2 Å²	56.2	55%	0.547	31%	0.314	S	S	.	.			trans	-144.5	87.8	-176.4	-72.9	-179.4	177.9	-176.9	-3	110.2	D113 R205	D113-R115 VanDerWaalsContact C-N 3.28Å; D113-R115 PolarHBondContact O-N 3.4Å; R115-R205 PolarHBondContact O-NH2 2.92Å
116	T	87.4	Confident	85.9	Confident	52 Å²	52	59.3 Å²	59.3	32%	0.319	33%	0.327	S	S	.	.			trans	-75.5	131.7	165.6	51.2	0	0	0	0	109.8	H128 Y209	T116-H128 PolarHBondContact OG1-NE2 2.77Å; T116-Y209 HydrophobicContact CG2-CD1 4.34Å; T116-Y209 HydrophobicContact CG2-CE1 3.71Å
117	V	92.5	Very high	85.6	Confident	55 Å²	55	60.4 Å²	60.4	33%	0.333	34%	0.339	S	S	.	.			trans	-132	-6.6	-178.6	-55.1	0	0	0	0	113.6	T147 E207	V117-T147 WeakPolarHBondContact O-CG2 3.47Å; V117-T147 PolarHBondContact O-OG1 2.65Å; V117-E207 WeakPolarHBondContact CG2-OE1 3.41Å; V117-E207 PolarHBondContact N-OE1 2.88Å; V117-E207 PolarHBondContact N-OE2 3.2Å; V117-E207 VanDerWaalsContact N-OE2 3.09Å
118	I	95.4	Very high	85.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.346	C	S	.	.	S	Bend	trans	-79.5	-44.1	-179.2	-63.9	173.2	0	0	0	111.3	K146 T147 A153 M200 E207 Y209	I118-K146 CarbonylContact O-C 3.47Å; I118-K146 WeakPolarHBondContact O-CA 3.44Å; I118-T147 PolarHBondContact O-N 3.45Å; I118-T147 PolarHBondContact O-OG1 2.89Å; I118-A153 HydrophobicContact CG2-CB 3.48Å; I118-A153 VanDerWaalsContact CG2-CB 3.48Å; I118-M200 HydrophobicContact CB-CB 4.48Å; I118-M200 HydrophobicContact CD1-CB 4.11Å; I118-M200 HydrophobicContact CG2-CB 3.94Å; I118-M200 HydrophobicContact CG2-CE 3.56Å; I118-M200 HydrophobicContact CG2-CG 4.37Å; I118-E207 VanDerWaalsContact CB-OE2 3.25Å; I118-E207 WeakPolarHBondContact CB-OE2 3.44Å; I118-E207 HydrophobicContact CD1-CB 4.06Å; I118-E207 HydrophobicContact CD1-CG 3.81Å; I118-E207 HydrophobicContact CG1-CG 4.25Å; I118-E207 VanDerWaalsContact CG1-OE2 3.32Å; I118-E207 WeakPolarHBondContact CG1-OE2 3.07Å; I118-E207 PolarHBondContact N-OE2 2.91Å; I118-Y209 PolarHBondContact N-OH 3.45Å
119	L	95.4	Very high	85.6	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-105.7	144.7	-177.8	-57.9	-177	0	0	0	112.1	H128 W144 K145 K146 I198 M200 Y209	L119-H128 HydrophobicContact CB-CB 3.96Å; L119-H128 HydrophobicContact CD1-CB 4.17Å; L119-H128 PolarHBondContact O-CE1 2.9Å; L119-H128 PolarHBondContact O-ND1 3.39Å; L119-H128 VanDerWaalsContact O-ND1 3.12Å; L119-W144 HydrophobicContact CD1-CB 3.95Å; L119-W144 HydrophobicContact CD1-CG 4.15Å; L119-W144 HydrophobicContact CD2-CB 4.19Å; L119-W144 HydrophobicContact CD2-CG 4.08Å; L119-K145 CarbonylContact C-O 3.5Å; L119-K145 WeakPolarHBondContact CA-O 3.23Å; L119-K146 HydrophobicContact CD2-CG 4.18Å; L119-I198 HydrophobicContact CD1-CD1 3.59Å; L119-I198 HydrophobicContact CD1-CG1 4.46Å; L119-M200 HydrophobicContact CD1-CG 4.09Å; L119-M200 HydrophobicContact CD2-CE 3.9Å; L119-M200 HydrophobicContact CD2-CG 4.21Å; L119-M200 HydrophobicContact CD2-SD 4.28Å; L119-M200 HydrophobicContact CG-CG 4.2Å; L119-Y209 HydrophobicContact CB-CD1 4.41Å; L119-Y209 HydrophobicContact CB-CE1 3.74Å; L119-Y209 HydrophobicContact CB-CE2 4.24Å; L119-Y209 HydrophobicContact CD1-CD1 3.92Å; L119-Y209 HydrophobicContact CD1-CD2 3.52Å; L119-Y209 HydrophobicContact CD1-CE1 3.97Å; L119-Y209 HydrophobicContact CD1-CE2 3.62Å; L119-Y209 HydrophobicContact CD1-CG 3.66Å; L119-Y209 HydrophobicContact CG-CD1 4.48Å; L119-Y209 HydrophobicContact CG-CD2 4.09Å; L119-Y209 HydrophobicContact CG-CE1 4.03Å; L119-Y209 HydrophobicContact CG-CE2 3.64Å; L119-Y209 HydrophobicContact CG-CG 4.48Å; L119-Y209 PolarHBondContact N-OH 2.85Å
120	E	93.8	Very high	85.7	Confident	60 Å²	60	63.4 Å²	63.4	28%	0.28	35%	0.351	S	S	.	.			trans	-79.9	134.2	173.5	-66.4	179.8	-176.6	0	0	110.3	H128 K145 T147	E120-H128 PolarHBondContact O-ND1 3.07Å; E120-K145 HydrophobicContact CB-CB 4.42Å; E120-K145 PolarHBondContact N-O 2.94Å; E120-K145 IonicContact OE1-NZ 3.88Å; E120-K145 WeakPolarHBondContact OE2-CD 3.41Å; E120-K145 WeakPolarHBondContact OE2-CE 3.08Å; E120-K145 IonicContact OE2-NZ 3.57Å; E120-K145 PolarHBondContact OE2-NZ 3.09Å; E120-T147 HydrophobicContact CG-CG2 3.69Å
121	E	90.6	Very high	86	Confident	88 Å²	88	63.8 Å²	63.8	41%	0.411	35%	0.354	S	S	.	.			trans	-82.4	134.8	166.2	-161.7	-177.1	-174.9	0	0	109	S123 G125 G127 H128	E121-S123 VanDerWaalsContact C-N 3.3Å; E121-S123 PolarHBondContact O-N 3.01Å; E121-G125 PolarHBondContact OE1-N 3.07Å; E121-G127 WeakPolarHBondContact CG-O 3.37Å; E121-G127 PolarHBondContact OE1-N 3.46Å; E121-H128 PolarHBondContact N-ND1 2.79Å
122	K	81.6	Confident	86.6	Confident	146 Å²	146	63.1 Å²	63.1	64%	0.635	36%	0.355	S	S	*	.	S	Bend	trans	-62.6	-44.3	-179.2	-144.4	163.1	163.2	178.8	0	111.6	Q126 Y130	K122-Q126 HydrophobicContact CB-CB 4.42Å; K122-Y130 WeakPolarHBondContact CA-OH 3.38Å; K122-Y130 HydrophobicContact CB-CE1 3.6Å; K122-Y130 WeakPolarHBondContact CB-OH 3.39Å; K122-Y130 HydrophobicContact CD-CD1 3.89Å; K122-Y130 HydrophobicContact CD-CE1 3.4Å; K122-Y130 HydrophobicContact CG-CE1 4.04Å; K122-Y130 PolarHBondContact N-OH 2.99Å
123	S	79.4	Confident	87.3	Confident	40 Å²	40	59.1 Å²	59.1	28%	0.28	33%	0.329	S	S	.	.	S	Bend	trans	-167.9	150.1	-172.8	60.1	0	0	0	0	107.6	E121 G125 Q126	E121-S123 VanDerWaalsContact C-N 3.3Å; E121-S123 PolarHBondContact O-N 3.01Å; S123-G125 PolarHBondContact O-N 2.94Å; S123-G125 VanDerWaalsContact O-N 3.11Å; S123-Q126 PolarHBondContact O-N 3.04Å; S123-Q126 WeakPolarHBondContact OG-CB 3.27Å; S123-Q126 WeakPolarHBondContact OG-CG 3.38Å; S123-Q126 PolarHBondContact OG-OE1 2.58Å
124	P	77.4	Confident	88.5	Confident	128 Å²	128	61.2 Å²	61.2	83%	0.831	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	120.3	-179.8	-26.9	34.5	0	0	0	112
125	G	74.6	Confident	89.5	Confident	76 Å²	76	56.6 Å²	56.6	78%	0.784	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	-6.3	176.1	0	0	0	0	0	115.6	E121 S123	E121-G125 PolarHBondContact OE1-N 3.07Å; S123-G125 PolarHBondContact O-N 2.94Å; S123-G125 VanDerWaalsContact O-N 3.11Å
126	Q	80.6	Confident	90.2	Very high	102 Å²	102	50.6 Å²	50.6	48%	0.477	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-13.8	171.4	-73.8	-170	4.9	0	0	112.9	K122 S123	K122-Q126 HydrophobicContact CB-CB 4.42Å; S123-Q126 PolarHBondContact O-N 3.04Å; S123-Q126 WeakPolarHBondContact OG-CB 3.27Å; S123-Q126 WeakPolarHBondContact OG-CG 3.38Å; S123-Q126 PolarHBondContact OG-OE1 2.58Å
127	G	91.1	Very high	90.4	Very high	23 Å²	23	53.1 Å²	53.1	24%	0.237	30%	0.297	C	S	.	.			trans	72.4	-170.6	-179.4	0	0	0	0	0	113.4	E121 Y130	E121-G127 WeakPolarHBondContact CG-O 3.37Å; E121-G127 PolarHBondContact OE1-N 3.46Å; G127-Y130 PolarHBondContact O-OH 2.68Å
128	H	94.8	Very high	90.3	Very high	36 Å²	36	50.5 Å²	50.5	17%	0.167	28%	0.281	C	S	.	.	S	Bend	trans	-97.4	-18	-171.8	-59.9	-81.6	0	0	0	114.2	T116 L119 E120 E121 Y130 Y209	T116-H128 PolarHBondContact OG1-NE2 2.77Å; L119-H128 HydrophobicContact CB-CB 3.96Å; L119-H128 HydrophobicContact CD1-CB 4.17Å; L119-H128 PolarHBondContact O-CE1 2.9Å; L119-H128 PolarHBondContact O-ND1 3.39Å; L119-H128 VanDerWaalsContact O-ND1 3.12Å; E120-H128 PolarHBondContact O-ND1 3.07Å; E121-H128 PolarHBondContact N-ND1 2.79Å; H128-Y130 WeakPolarHBondContact O-CE2 3.33Å; H128-Y209 HydrophobicContact CB-CD1 3.67Å; H128-Y209 HydrophobicContact CB-CE1 3.98Å; H128-Y209 AromaticContact CD2-CD1 3.38Å; H128-Y209 WeakPolarHBondContact CD2-CD1 3.15Å; H128-Y209 AromaticContact CD2-CE1 3.42Å; H128-Y209 VanDerWaalsContact CD2-CE1 3.42Å; H128-Y209 WeakPolarHBondContact CD2-CE1 3.37Å; H128-Y209 AromaticContact CE1-CE1 3.98Å; H128-Y209 AromaticContact CG-CD1 3.55Å; H128-Y209 AromaticContact CG-CE1 3.5Å; H128-Y209 VanDerWaalsContact CG-CE1 3.5Å; H128-Y209 AromaticContact ND1-CE1 3.86Å; H128-Y209 AromaticContact NE2-CE1 3.73Å
129	I	96.3	Very high	90.3	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.9	-172.2	-58	167.8	0	0	0	109.2	C142 F196 I198 Y209 K211	I129-C142 HydrophobicContact CG2-CB 4.12Å; I129-F196 HydrophobicContact CD1-CD1 3.89Å; I129-F196 HydrophobicContact CD1-CE1 3.94Å; I129-F196 HydrophobicContact CG1-CE1 4.49Å; I129-F196 HydrophobicContact CG2-CD1 3.8Å; I129-F196 HydrophobicContact CG2-CE1 3.65Å; I129-I198 HydrophobicContact CD1-CD1 4.05Å; I129-I198 HydrophobicContact CD1-CG1 3.96Å; I129-I198 HydrophobicContact CG1-CD1 3.93Å; I129-I198 HydrophobicContact CG1-CG1 4.4Å; I129-Y209 WeakPolarHBondContact CD1-O 3.04Å; I129-K211 HydrophobicContact CB-CB 4.2Å; I129-K211 HydrophobicContact CB-CD 4.21Å; I129-K211 HydrophobicContact CD1-CB 4.2Å; I129-K211 HydrophobicContact CG2-CB 4.36Å; I129-K211 HydrophobicContact CG2-CD 4.14Å; I129-K211 WeakPolarHBondContact O-CD 3.46Å; I129-K211 WeakPolarHBondContact O-CE 3.25Å; I129-K211 PolarHBondContact O-NZ 2.88Å
130	Y	95.5	Very high	90.4	Very high	47 Å²	47	52.1 Å²	52.1	18%	0.184	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.3	177.3	-44.7	-74.5	0	0	0	109.5	K122 G127 H128 C142 T143	K122-Y130 WeakPolarHBondContact CA-OH 3.38Å; K122-Y130 HydrophobicContact CB-CE1 3.6Å; K122-Y130 WeakPolarHBondContact CB-OH 3.39Å; K122-Y130 HydrophobicContact CD-CD1 3.89Å; K122-Y130 HydrophobicContact CD-CE1 3.4Å; K122-Y130 HydrophobicContact CG-CE1 4.04Å; K122-Y130 PolarHBondContact N-OH 2.99Å; G127-Y130 PolarHBondContact O-OH 2.68Å; H128-Y130 WeakPolarHBondContact O-CE2 3.33Å; Y130-C142 CarbonylContact O-C 3.57Å; Y130-C142 VanDerWaalsContact O-CA 3.28Å; Y130-C142 WeakPolarHBondContact O-CA 3.41Å; Y130-T143 PolarHBondContact N-O 2.86Å; Y130-T143 PolarHBondContact O-N 3.4Å; Y130-T143 PolarHBondContact O-OG1 2.89Å
131	C	96	Very high	90.6	Very high	18 Å²	18	51.6 Å²	51.6	12%	0.122	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	146.5	177.8	-54.9	0	0	0	0	110.2	H141 C142 F213 I218	C131-H141 CarbonylContact C-O 3.55Å; C131-H141 WeakPolarHBondContact CA-O 3.43Å; C131-C142 HydrophobicContact CB-CB 4.16Å; C131-C142 WeakPolarHBondContact CB-SG 3.3Å; C131-C142 WeakPolarHBondContact SG-CB 3.31Å; C131-C142 CovalentContact SG-SG 2.05Å; C131-C142 PolarHBondContact SG-SG 2.88Å; C131-F213 HydrophobicContact CB-CE1 4.15Å; C131-F213 HydrophobicContact CB-CE2 4.48Å; C131-F213 HydrophobicContact CB-CZ 4.03Å; C131-F213 VanDerWaalsContact SG-CE1 3.59Å; C131-I218 HydrophobicContact CB-CD1 3.91Å; C131-I218 HydrophobicContact CB-CG2 4.38Å
132	S	95.8	Very high	91	Very high	55 Å²	55	47.4 Å²	47.4	39%	0.385	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	144.1	173	57	0	0	0	0	110.8	F140 H141 I218	S132-F140 WeakPolarHBondContact O-CA 3.26Å; S132-H141 PolarHBondContact N-O 2.87Å; S132-H141 PolarHBondContact O-N 3.39Å; S132-I218 WeakPolarHBondContact CA-O 3.07Å
133	A	95.7	Very high	91.7	Very high	3 Å²	3	42.9 Å²	42.9	3%	0.025	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-122.2	147.4	171.2	0	0	0	0	0	109	S139 F140 L215 I218 V219 R220	A133-S139 WeakPolarHBondContact CB-O 3.17Å; A133-F140 HydrophobicContact CB-CB 4.02Å; A133-L215 HydrophobicContact CB-CD1 3.58Å; A133-I218 HydrophobicContact CB-CD1 4.13Å; A133-I218 HydrophobicContact CB-CG1 4.18Å; A133-I218 PolarHBondContact N-O 3.38Å; A133-V219 HydrophobicContact CB-CG2 3.88Å; A133-V219 CarbonylContact O-C 3.57Å; A133-V219 WeakPolarHBondContact O-CA 3.02Å; A133-R220 PolarHBondContact O-N 3.45Å
134	Q	93.7	Very high	92.5	Very high	93 Å²	93	41.5 Å²	41.5	44%	0.435	24%	0.243	S	C	.	.	S	Bend	trans	-80.8	-25.4	176.2	-74	169.8	-17.9	0	0	112.2	E222	Q134-E222 HydrophobicContact CG-CG 4.18Å; Q134-E222 PolarHBondContact NE2-OE1 2.79Å
135	N	93.3	Very high	93.4	Very high	14 Å²	14	41.2 Å²	41.2	8%	0.075	23%	0.229	C	C	.	.	S	Bend	trans	-163.5	-175.7	-170.1	64.4	37.4	0	0	0	110.5	K137 V219 T242 E244	N135-K137 WeakPolarHBondContact OD1-CB 3.26Å; N135-K137 PolarHBondContact OD1-N 2.96Å; N135-V219 WeakPolarHBondContact O-CG2 3.4Å; N135-T242 WeakPolarHBondContact CB-O 3.35Å; N135-T242 PolarHBondContact ND2-O 3.03Å; N135-E244 HydrophobicContact CB-CG 3.92Å; N135-E244 WeakPolarHBondContact CB-OE1 3.34Å; N135-E244 PolarHBondContact ND2-OE1 3.13Å; N135-E244 PolarHBondContact OD1-OE1 3.13Å
136	Y	92.9	Very high	94.4	Very high	19 Å²	19	39.5 Å²	39.5	8%	0.075	20%	0.2	C	C	.	.	S	Bend	trans	-92.1	15.1	-174.4	-63.9	-85.3	0	0	0	114.7	G138 P186 R216 V219 W243 E244 F250 D299 T302	Y136-G138 PolarHBondContact O-N 2.89Å; Y136-G138 VanDerWaalsContact O-N 3.17Å; Y136-P186 WeakPolarHBondContact O-CG 3.17Å; Y136-R216 HydrophobicContact CE1-CB 3.9Å; Y136-V219 HydrophobicContact CD1-CG2 3.92Å; Y136-V219 HydrophobicContact CD2-CG1 4.36Å; Y136-V219 HydrophobicContact CE1-CB 4.27Å; Y136-V219 HydrophobicContact CE1-CG2 3.85Å; Y136-V219 HydrophobicContact CE2-CG1 3.92Å; Y136-V219 HydrophobicContact CE2-CG2 4.5Å; Y136-V219 HydrophobicContact CG-CG2 4.28Å; Y136-W243 AromaticContact CE2-CH2 3.88Å; Y136-W243 HydrophobicContact CE2-CH2 3.88Å; Y136-W243 HydrophobicContact CE2-CZ2 4.06Å; Y136-E244 HydrophobicContact CD2-CG 4.16Å; Y136-F250 AromaticContact CD2-CD1 3.6Å; Y136-F250 HydrophobicContact CD2-CD1 3.6Å; Y136-F250 AromaticContact CD2-CE1 3.71Å; Y136-F250 HydrophobicContact CD2-CE1 3.71Å; Y136-F250 AromaticContact CE2-CD1 3.95Å; Y136-F250 HydrophobicContact CE2-CD1 3.95Å; Y136-F250 HydrophobicContact CE2-CE1 4.37Å; Y136-F250 HydrophobicContact CG-CD1 4.43Å; Y136-F250 HydrophobicContact CG-CE1 4.1Å; Y136-D299 VanDerWaalsContact CE2-OD2 3.27Å; Y136-D299 WeakPolarHBondContact CE2-OD2 3.48Å; Y136-D299 VanDerWaalsContact OH-CG 3.22Å; Y136-D299 PolarHBondContact OH-OD2 3.09Å; Y136-T302 WeakPolarHBondContact OH-CG2 3.32Å
137	K	91.6	Very high	95.1	Very high	105 Å²	105	36 Å²	36	46%	0.457	19%	0.186	S	C	.	.	S	Bend	trans	-78.1	13.4	178.4	-74.8	162.8	179.3	152.2	0	114.7	N135 S139 Q181 P186 E244	N135-K137 WeakPolarHBondContact OD1-CB 3.26Å; N135-K137 PolarHBondContact OD1-N 2.96Å; K137-S139 PolarHBondContact O-N 2.85Å; K137-Q181 PolarHBondContact O-NE2 3.45Å; K137-P186 HydrophobicContact CG-CG 4.34Å; K137-E244 WeakPolarHBondContact CD-OE1 2.88Å; K137-E244 WeakPolarHBondContact CE-OE1 3.44Å; K137-E244 VanDerWaalsContact CE-OE2 3.28Å; K137-E244 WeakPolarHBondContact CE-OE2 3.45Å; K137-E244 WeakPolarHBondContact CG-OE1 3.41Å; K137-E244 IonicContact NZ-OE1 3.4Å; K137-E244 PolarHBondContact NZ-OE1 3.16Å; K137-E244 IonicContact NZ-OE2 3.5Å
138	G	91.9	Very high	95.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	76.5	-1.2	179.7	0	0	0	0	0	115.4	Y136 F140 D182	Y136-G138 PolarHBondContact O-N 2.89Å; Y136-G138 VanDerWaalsContact O-N 3.17Å; G138-F140 WeakPolarHBondContact O-CD1 3.48Å; G138-D182 PolarHBondContact O-N 2.83Å
139	S	95.4	Very high	95	Very high	36 Å²	36	48.2 Å²	48.2	25%	0.252	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126	175.4	-155.4	0	0	0	0	110.8	A133 K137 Q179 Q181	A133-S139 WeakPolarHBondContact CB-O 3.17Å; K137-S139 PolarHBondContact O-N 2.85Å; S139-Q179 PolarHBondContact OG-NE2 2.71Å; S139-Q181 PolarHBondContact OG-OE1 2.82Å
140	F	96.9	Very high	94.9	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.009	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151.8	178.4	64.2	-89	0	0	0	112.1	S132 A133 G138 I167 Q179 C180 D182 I194 F213 L215 I218	S132-F140 WeakPolarHBondContact O-CA 3.26Å; A133-F140 HydrophobicContact CB-CB 4.02Å; G138-F140 WeakPolarHBondContact O-CD1 3.48Å; F140-I167 HydrophobicContact CE1-CG2 4.17Å; F140-I167 HydrophobicContact CZ-CG2 4.19Å; F140-Q179 PolarHBondContact O-NE2 2.88Å; F140-C180 HydrophobicContact CD1-CB 4.21Å; F140-C180 HydrophobicContact CD2-CB 3.97Å; F140-C180 HydrophobicContact CE1-CB 3.71Å; F140-C180 HydrophobicContact CE2-CB 3.44Å; F140-C180 VanDerWaalsContact CE2-CB 3.44Å; F140-C180 HydrophobicContact CG-CB 4.33Å; F140-C180 HydrophobicContact CZ-CB 3.3Å; F140-C180 PolarHBondContact N-O 2.75Å; F140-C180 PolarHBondContact O-N 2.91Å; F140-D182 HydrophobicContact CE1-CB 4.32Å; F140-I194 HydrophobicContact CD1-CD1 4.29Å; F140-I194 HydrophobicContact CE1-CD1 3.81Å; F140-I194 HydrophobicContact CZ-CD1 4.29Å; F140-I194 HydrophobicContact CZ-CG2 4.04Å; F140-F213 HydrophobicContact CD2-CE2 4.4Å; F140-F213 HydrophobicContact CD2-CZ 4.04Å; F140-F213 HydrophobicContact CE2-CE2 4.45Å; F140-F213 AromaticContact CE2-CZ 3.82Å; F140-F213 HydrophobicContact CE2-CZ 3.82Å; F140-F213 HydrophobicContact CZ-CZ 4.33Å; F140-L215 HydrophobicContact CB-CD1 4.37Å; F140-L215 HydrophobicContact CD1-CD1 4.48Å; F140-I218 HydrophobicContact CB-CD1 3.77Å; F140-I218 HydrophobicContact CG-CD1 4.28Å
141	H	97.8	Very high	94.7	Very high	48 Å²	48	53 Å²	53	22%	0.222	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.5	178.1	-172.3	-120.9	0	0	0	109.5	C131 S132 T143 D172 V178 Q179	C131-H141 CarbonylContact C-O 3.55Å; C131-H141 WeakPolarHBondContact CA-O 3.43Å; S132-H141 PolarHBondContact N-O 2.87Å; S132-H141 PolarHBondContact O-N 3.39Å; H141-T143 WeakPolarHBondContact CE1-CG2 3.26Å; H141-T143 WeakPolarHBondContact ND1-CG2 3.33Å; H141-D172 IonicContact CD2-OD2 3.18Å; H141-D172 IonicContact CE1-OD2 2.65Å; H141-D172 PolarHBondContact CE1-OD2 3.3Å; H141-D172 IonicContact NE2-OD1 2.72Å; H141-D172 IonicContact NE2-OD2 3.53Å; H141-D172 PolarHBondContact NE2-OD2 3.42Å; H141-V178 WeakPolarHBondContact CA-O 3.27Å; H141-V178 VanDerWaalsContact CD2-C 3.44Å; H141-V178 PolarHBondContact CD2-O 2.86Å; H141-Q179 PolarHBondContact CD2-OE1 3.05Å
142	C	97.9	Very high	94.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136	174.9	-65.2	0	0	0	0	110.1	I129 Y130 C131 G177 V178 F196	I129-C142 HydrophobicContact CG2-CB 4.12Å; Y130-C142 CarbonylContact O-C 3.57Å; Y130-C142 VanDerWaalsContact O-CA 3.28Å; Y130-C142 WeakPolarHBondContact O-CA 3.41Å; C131-C142 HydrophobicContact CB-CB 4.16Å; C131-C142 WeakPolarHBondContact CB-SG 3.3Å; C131-C142 WeakPolarHBondContact SG-CB 3.31Å; C131-C142 CovalentContact SG-SG 2.05Å; C131-C142 PolarHBondContact SG-SG 2.88Å; C142-G177 CarbonylContact O-C 3.54Å; C142-G177 WeakPolarHBondContact O-CA 3.1Å; C142-V178 HydrophobicContact CB-CG1 4Å; C142-V178 PolarHBondContact N-O 2.78Å; C142-V178 PolarHBondContact O-N 2.89Å; C142-F196 HydrophobicContact CB-CD1 4.46Å; C142-F196 HydrophobicContact CB-CE1 3.9Å; C142-F196 HydrophobicContact CB-CE2 4.33Å; C142-F196 HydrophobicContact CB-CZ 3.85Å
143	T	97.6	Very high	94.6	Very high	51 Å²	51	53.7 Å²	53.7	31%	0.313	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	158.5	-178.4	56.4	0	0	0	0	111.2	Y130 H141 L176	Y130-T143 PolarHBondContact N-O 2.86Å; Y130-T143 PolarHBondContact O-N 3.4Å; Y130-T143 PolarHBondContact O-OG1 2.89Å; H141-T143 WeakPolarHBondContact CE1-CG2 3.26Å; H141-T143 WeakPolarHBondContact ND1-CG2 3.33Å; T143-L176 WeakPolarHBondContact CA-O 3.42Å
144	W	96.8	Very high	94.6	Very high	11 Å²	11	55.5 Å²	55.5	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	166.5	174.9	50	84.4	0	0	0	110.3	L119 V155 L171 G175 L176 V178 F196 I198	L119-W144 HydrophobicContact CD1-CB 3.95Å; L119-W144 HydrophobicContact CD1-CG 4.15Å; L119-W144 HydrophobicContact CD2-CB 4.19Å; L119-W144 HydrophobicContact CD2-CG 4.08Å; W144-V155 HydrophobicContact CH2-CG2 4.46Å; W144-V155 HydrophobicContact CZ2-CG2 3.58Å; W144-L171 HydrophobicContact CH2-CD1 3.99Å; W144-L171 HydrophobicContact CZ2-CD1 4Å; W144-G175 PolarHBondContact NE1-O 3.17Å; W144-L176 PolarHBondContact N-O 3.05Å; W144-L176 VanDerWaalsContact N-O 3.09Å; W144-V178 HydrophobicContact CH2-CB 4.07Å; W144-V178 HydrophobicContact CH2-CG1 4.06Å; W144-V178 HydrophobicContact CZ3-CB 4.38Å; W144-V178 HydrophobicContact CZ3-CG1 3.89Å; W144-F196 HydrophobicContact CZ3-CE1 4.42Å; W144-F196 HydrophobicContact CZ3-CZ 4.08Å; W144-I198 HydrophobicContact CB-CD1 4.39Å; W144-I198 HydrophobicContact CD2-CD1 3.57Å; W144-I198 HydrophobicContact CE3-CD1 3.54Å; W144-I198 HydrophobicContact CE3-CG2 4.42Å; W144-I198 HydrophobicContact CG-CD1 3.95Å; W144-I198 HydrophobicContact CH2-CG2 4.18Å; W144-I198 HydrophobicContact CZ3-CD1 4.1Å; W144-I198 HydrophobicContact CZ3-CG2 3.93Å
145	K	96	Very high	94.8	Very high	123 Å²	123	52.3 Å²	52.3	54%	0.535	26%	0.264	S	S	.	.			trans	-123	129.5	175.8	-171.7	173.4	174	-138.9	0	109.8	L119 E120	L119-K145 CarbonylContact C-O 3.5Å; L119-K145 WeakPolarHBondContact CA-O 3.23Å; E120-K145 HydrophobicContact CB-CB 4.42Å; E120-K145 PolarHBondContact N-O 2.94Å; E120-K145 IonicContact OE1-NZ 3.88Å; E120-K145 WeakPolarHBondContact OE2-CD 3.41Å; E120-K145 WeakPolarHBondContact OE2-CE 3.08Å; E120-K145 IonicContact OE2-NZ 3.57Å; E120-K145 PolarHBondContact OE2-NZ 3.09Å
146	K	95.4	Very high	94.9	Very high	39 Å²	39	53.5 Å²	53.5	17%	0.17	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-78.3	146.4	176.1	-60	174.2	-169.2	172.3	0	109.7	I118 L119 A153 L176 M200	I118-K146 CarbonylContact O-C 3.47Å; I118-K146 WeakPolarHBondContact O-CA 3.44Å; L119-K146 HydrophobicContact CD2-CG 4.18Å; K146-A153 WeakPolarHBondContact CE-O 3.31Å; K146-A153 PolarHBondContact NZ-O 2.82Å; K146-L176 HydrophobicContact CD-CD2 4.13Å; K146-L176 HydrophobicContact CG-CD2 4.27Å; K146-M200 HydrophobicContact CD-CE 4.41Å; K146-M200 HydrophobicContact CG-CE 4.23Å
147	T	94.8	Very high	95.1	Very high	29 Å²	29	54.4 Å²	54.4	18%	0.178	28%	0.276	C	S	.	.			trans	-65.4	145.3	169.9	61.7	0	0	0	0	110	V117 I118 E120 H149 R150 S151	V117-T147 WeakPolarHBondContact O-CG2 3.47Å; V117-T147 PolarHBondContact O-OG1 2.65Å; I118-T147 PolarHBondContact O-N 3.45Å; I118-T147 PolarHBondContact O-OG1 2.89Å; E120-T147 HydrophobicContact CG-CG2 3.69Å; T147-H149 PolarHBondContact O-N 3.31Å; T147-H149 VanDerWaalsContact O-N 3.14Å; T147-R150 CarbonylContact O-C 3.55Å; T147-R150 PolarHBondContact O-N 3.18Å; T147-R150 WeakPolarHBondContact OG1-CB 3.23Å; T147-R150 WeakPolarHBondContact OG1-CG 3.46Å; T147-S151 PolarHBondContact O-N 2.78Å
148	H	92.3	Very high	95.4	Very high	154 Å²	154	51 Å²	51	71%	0.713	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-52.7	-38.5	179.9	178.4	-91.8	0	0	0	113.1	R150	H148-R150 PolarHBondContact O-N 2.76Å
149	H	91.4	Very high	95.6	Very high	161 Å²	161	54.8 Å²	54.8	75%	0.745	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-73.3	-12.1	179.2	-60.2	-64.1	0	0	0	114.3	T147	T147-H149 PolarHBondContact O-N 3.31Å; T147-H149 VanDerWaalsContact O-N 3.14Å
150	R	93.4	Very high	95.7	Very high	65 Å²	65	53.2 Å²	53.2	25%	0.245	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-125.1	32.5	-177.1	-59.1	-69.6	-173.1	154.4	0.3	111.2	T147 H148 H152 A153 S202	T147-R150 CarbonylContact O-C 3.55Å; T147-R150 PolarHBondContact O-N 3.18Å; T147-R150 WeakPolarHBondContact OG1-CB 3.23Å; T147-R150 WeakPolarHBondContact OG1-CG 3.46Å; H148-R150 PolarHBondContact O-N 2.76Å; R150-H152 PolarHBondContact O-N 3.06Å; R150-H152 VanDerWaalsContact O-N 3.17Å; R150-A153 HydrophobicContact CB-CB 4.32Å; R150-A153 WeakPolarHBondContact O-CB 3.39Å; R150-A153 PolarHBondContact O-N 2.89Å; R150-S202 VanDerWaalsContact CD-OG 3.27Å; R150-S202 WeakPolarHBondContact CD-OG 3.36Å; R150-S202 PolarHBondContact NH1-OG 2.99Å
151	S	93	Very high	95.6	Very high	87 Å²	87	56 Å²	56	61%	0.608	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.6	178.1	56.3	0	0	0	0	113.7	T147 A153	T147-S151 PolarHBondContact O-N 2.78Å; S151-A153 VanDerWaalsContact C-N 3.29Å; S151-A153 PolarHBondContact O-N 3.23Å
152	H	93.4	Very high	95.4	Very high	87 Å²	87	55 Å²	55	40%	0.403	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-6.2	176.2	67.1	-87.4	0	0	0	114.3	R150 S202 Y203	R150-H152 PolarHBondContact O-N 3.06Å; R150-H152 VanDerWaalsContact O-N 3.17Å; H152-S202 PolarHBondContact NE2-OG 3.32Å; H152-Y203 AromaticContact CD2-CE2 3.94Å; H152-Y203 AromaticContact CE1-CE2 3.5Å; H152-Y203 VanDerWaalsContact CE1-CE2 3.5Å; H152-Y203 WeakPolarHBondContact CE1-CE2 3.29Å; H152-Y203 AromaticContact NE2-CD2 3.49Å; H152-Y203 WeakPolarHBondContact NE2-CD2 3.42Å; H152-Y203 AromaticContact NE2-CE2 3.07Å; H152-Y203 WeakPolarHBondContact NE2-CE2 3.4Å; H152-Y203 AromaticContact NE2-CZ 3.65Å
153	A	96.1	Very high	95	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.008	30%	0.298	C	S	.	.			trans	-62.7	144.6	178.1	0	0	0	0	0	110.5	I118 K146 R150 S151 M200 H201	I118-A153 HydrophobicContact CG2-CB 3.48Å; I118-A153 VanDerWaalsContact CG2-CB 3.48Å; K146-A153 WeakPolarHBondContact CE-O 3.31Å; K146-A153 PolarHBondContact NZ-O 2.82Å; R150-A153 HydrophobicContact CB-CB 4.32Å; R150-A153 WeakPolarHBondContact O-CB 3.39Å; R150-A153 PolarHBondContact O-N 2.89Å; S151-A153 VanDerWaalsContact C-N 3.29Å; S151-A153 PolarHBondContact O-N 3.23Å; A153-M200 HydrophobicContact CB-CE 3.9Å; A153-H201 CarbonylContact C-O 3.57Å; A153-H201 VanDerWaalsContact CA-O 3.25Å; A153-H201 WeakPolarHBondContact CA-O 3.41Å; A153-H201 WeakPolarHBondContact CB-O 3.14Å
154	A	95.8	Very high	94.5	Very high	40 Å²	40	64.8 Å²	64.8	33%	0.331	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	157.1	-177	0	0	0	0	0	111	H201	A154-H201 PolarHBondContact N-O 2.9Å; A154-H201 PolarHBondContact O-CD2 3.23Å; A154-H201 VanDerWaalsContact O-CD2 3.28Å; A154-H201 PolarHBondContact O-N 3.46Å
155	V	97.2	Very high	94.3	Very high	27 Å²	27	69.5 Å²	69.5	16%	0.164	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	124.9	171.5	179.6	0	0	0	0	107.7	W144 V158 L171 M200	W144-V155 HydrophobicContact CH2-CG2 4.46Å; W144-V155 HydrophobicContact CZ2-CG2 3.58Å; V155-V158 HydrophobicContact CG1-CG2 3.76Å; V155-L171 HydrophobicContact CB-CD1 4.19Å; V155-L171 HydrophobicContact CB-CD2 4.06Å; V155-L171 HydrophobicContact CG1-CD1 4.16Å; V155-L171 HydrophobicContact CG1-CD2 4.46Å; V155-L171 HydrophobicContact CG2-CD1 3.89Å; V155-L171 HydrophobicContact CG2-CD2 4.37Å; V155-M200 HydrophobicContact CG2-SD 3.71Å
156	L	96.1	Very high	94.2	Very high	38 Å²	38	71.6 Å²	71.6	20%	0.199	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-46.9	172.9	-177.4	69.8	0	0	0	110.9	L28 M29 L105 L107 Y199 L206	L28-L156 HydrophobicContact CD2-CD2 3.57Å; M29-L156 HydrophobicContact CE-CD1 4.24Å; M29-L156 HydrophobicContact CE-CD2 4.28Å; M29-L156 HydrophobicContact CE-CG 3.72Å; M29-L156 WeakPolarHBondContact CE-O 3.28Å; L105-L156 HydrophobicContact CD2-CD1 4.23Å; L107-L156 HydrophobicContact CD1-CD2 3.2Å; L107-L156 HydrophobicContact CD1-CG 4.45Å; L156-Y199 WeakPolarHBondContact CB-O 3.45Å; L156-Y199 PolarHBondContact N-O 3.05Å; L156-L206 HydrophobicContact CD2-CD1 3.93Å
157	L	96.1	Very high	94.3	Very high	39 Å²	39	70 Å²	70	20%	0.204	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	141.9	-173.2	-173.1	56.5	0	0	0	110.6	L28 M29 K159 Y199	L28-L157 HydrophobicContact CD1-CD2 3.97Å; L28-L157 HydrophobicContact CG-CD2 4.06Å; M29-L157 HydrophobicContact CE-CB 3.53Å; M29-L157 HydrophobicContact CE-CD1 3.86Å; M29-L157 HydrophobicContact CE-CD2 3.84Å; M29-L157 HydrophobicContact CE-CG 3.93Å; L157-K159 HydrophobicContact CD2-CD 4.23Å; L157-K159 HydrophobicContact CD2-CG 4.23Å; L157-K159 HydrophobicContact CG-CG 4.21Å; L157-Y199 HydrophobicContact CB-CD2 3.83Å; L157-Y199 HydrophobicContact CB-CG 4.19Å; L157-Y199 HydrophobicContact CD2-CD2 4.07Å; L157-Y199 HydrophobicContact CD2-CE2 4.25Å; L157-Y199 HydrophobicContact CG-CD2 4.11Å; L157-Y199 PolarHBondContact N-O 3.35Å; L157-Y199 PolarHBondContact O-N 3.28Å
158	V	97.4	Very high	94.4	Very high	32 Å²	32	72.8 Å²	72.8	19%	0.194	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.7	167	-177.4	0	0	0	0	107.7	V155 C169 L171 V178 F196 I198	V155-V158 HydrophobicContact CG1-CG2 3.76Å; V158-C169 HydrophobicContact CG1-CB 4.24Å; V158-L171 HydrophobicContact CG2-CD1 4.46Å; V158-V178 HydrophobicContact CG1-CG2 4.33Å; V158-F196 HydrophobicContact CG1-CD2 4.34Å; V158-F196 HydrophobicContact CG1-CE2 3.5Å; V158-F196 HydrophobicContact CG1-CZ 4.01Å; V158-I198 HydrophobicContact CG1-CG2 4.35Å; V158-I198 HydrophobicContact CG2-CG2 4.2Å
159	K	97	Very high	94.6	Very high	80 Å²	80	67.1 Å²	67.1	35%	0.348	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.8	171	-73.6	-175.7	171.3	167	0	108.6	L157 T197 Y199	L157-K159 HydrophobicContact CD2-CD 4.23Å; L157-K159 HydrophobicContact CD2-CG 4.23Å; L157-K159 HydrophobicContact CG-CG 4.21Å; K159-T197 PolarHBondContact N-O 3.33Å; K159-T197 PolarHBondContact O-N 2.9Å; K159-Y199 HydrophobicContact CD-CE2 4.1Å; K159-Y199 HydrophobicContact CG-CE2 4.4Å
160	A	97.6	Very high	94.9	Very high	4 Å²	4	64.1 Å²	64.1	3%	0.033	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.9	172.8	0	0	0	0	0	107.9	I167 C169 Q195 F196	A160-I167 HydrophobicContact CB-CB 3.79Å; A160-I167 HydrophobicContact CB-CG2 4.26Å; A160-I167 PolarHBondContact O-N 3.32Å; A160-C169 VanDerWaalsContact CB-SG 3.52Å; A160-Q195 WeakPolarHBondContact CA-O 3.29Å; A160-F196 HydrophobicContact CB-CD2 4.06Å
161	H	95.6	Very high	95.1	Very high	60 Å²	60	64.6 Å²	64.6	28%	0.278	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	154.8	178.3	59.7	-94.3	0	0	0	112	D165 Q195	H161-D165 CarbonylContact C-O 3.52Å; H161-D165 WeakPolarHBondContact CA-O 3.21Å; H161-D165 VanDerWaalsContact CB-O 3.3Å; H161-D165 WeakPolarHBondContact CB-O 3.42Å; H161-Q195 PolarHBondContact CE1-OE1 3.37Å; H161-Q195 PolarHBondContact N-O 2.81Å; H161-Q195 WeakPolarHBondContact NE2-CB 3.11Å; H161-Q195 PolarHBondContact NE2-OE1 2.84Å; H161-Q195 PolarHBondContact O-N 2.05Å
162	R	93.6	Very high	95.3	Very high	26 Å²	26	62.8 Å²	62.8	10%	0.098	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	124.2	172.4	179.7	-171.9	-85.2	176.5	-11.5	108.3	M164 D165 I167 D182 D184 E190 H192 I194	R162-M164 PolarHBondContact O-N 3.32Å; R162-D165 PolarHBondContact N-O 3.27Å; R162-D165 WeakPolarHBondContact O-CB 3.1Å; R162-D165 PolarHBondContact O-N 2.87Å; R162-I167 HydrophobicContact CB-CD1 4.07Å; R162-D182 IonicContact CZ-OD2 3.79Å; R162-D182 IonicContact NE-OD2 3.83Å; R162-D182 PolarHBondContact NE-OD2 2.89Å; R162-D182 IonicContact NH1-OD2 2.69Å; R162-D182 PolarHBondContact NH1-OD2 2.82Å; R162-D182 IonicContact NH2-OD2 2.76Å; R162-D184 IonicContact CZ-OD2 3.39Å; R162-D184 IonicContact NH1-OD1 2.71Å; R162-D184 IonicContact NH1-OD2 2.84Å; R162-D184 PolarHBondContact NH1-OD2 2.98Å; R162-D184 IonicContact NH2-OD2 3.88Å; R162-D184 PolarHBondContact NH2-OD2 2.96Å; R162-E190 IonicContact CZ-OE2 2.72Å; R162-E190 IonicContact NH2-OE2 2.83Å; R162-E190 PolarHBondContact NH2-OE2 2.05Å; R162-H192 HydrophobicContact CG-CB 4.14Å; R162-I194 HydrophobicContact CB-CG1 4.43Å
163	N	88.6	Confident	95.3	Very high	83 Å²	83	64.2 Å²	64.2	44%	0.444	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	40.1	-179.2	-168.1	47.5	0	0	0	114.1	D165 H192	N163-D165 PolarHBondContact O-N 2.77Å; N163-H192 HydrophobicContact CB-CB 4.27Å; N163-H192 PolarHBondContact OD1-CE1 2.95Å
164	M	87.4	Confident	95.2	Very high	175 Å²	175	68.9 Å²	68.9	86%	0.862	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	-10	-174	-47.5	178.3	-65.9	0	0	116	R162	R162-M164 PolarHBondContact O-N 3.32Å
165	D	91.9	Very high	95.1	Very high	109 Å²	109	67.6 Å²	67.6	58%	0.583	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.6	174	-60.5	-45.7	0	0	0	109.9	H161 R162 N163	H161-D165 CarbonylContact C-O 3.52Å; H161-D165 WeakPolarHBondContact CA-O 3.21Å; H161-D165 VanDerWaalsContact CB-O 3.3Å; H161-D165 WeakPolarHBondContact CB-O 3.42Å; R162-D165 PolarHBondContact N-O 3.27Å; R162-D165 WeakPolarHBondContact O-CB 3.1Å; R162-D165 PolarHBondContact O-N 2.87Å; N163-D165 PolarHBondContact O-N 2.77Å
166	E	95.1	Very high	95	Very high	168 Å²	168	69.5 Å²	69.5	79%	0.785	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	134.2	178.1	-172.1	173.2	-167.8	0	0	110.8
167	I	96.6	Very high	95.1	Very high	6 Å²	6	67.7 Å²	67.7	3%	0.031	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-99.5	126.4	178.2	-63.8	169	0	0	0	108.2	F140 A160 R162 C169 C180 D182 I194	F140-I167 HydrophobicContact CE1-CG2 4.17Å; F140-I167 HydrophobicContact CZ-CG2 4.19Å; A160-I167 HydrophobicContact CB-CB 3.79Å; A160-I167 HydrophobicContact CB-CG2 4.26Å; A160-I167 PolarHBondContact O-N 3.32Å; R162-I167 HydrophobicContact CB-CD1 4.07Å; I167-C169 PolarHBondContact O-N 3.17Å; I167-C180 HydrophobicContact CG2-CB 4.08Å; I167-D182 HydrophobicContact CD1-CB 4.12Å; I167-D182 HydrophobicContact CG1-CB 4.23Å; I167-D182 HydrophobicContact CG2-CB 4.17Å; I167-I194 HydrophobicContact CD1-CB 4.47Å; I167-I194 HydrophobicContact CD1-CD1 4.39Å; I167-I194 HydrophobicContact CD1-CG1 4.02Å; I167-I194 HydrophobicContact CD1-CG2 3.81Å
168	S	96.3	Very high	95.2	Very high	87 Å²	87	65.9 Å²	65.9	61%	0.608	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	129.9	178.4	-170.4	0	0	0	0	110.7	C180 Q181	S168-C180 CarbonylContact O-C 3.57Å; S168-C180 VanDerWaalsContact O-CA 3.27Å; S168-C180 WeakPolarHBondContact O-CA 3.21Å; S168-Q181 PolarHBondContact O-N 2.76Å
169	C	97.4	Very high	95.2	Very high	35 Å²	35	68 Å²	68	24%	0.236	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.8	-178.1	-67.8	0	0	0	0	110.8	V158 A160 I167 V178 Q179 C180	V158-C169 HydrophobicContact CG1-CB 4.24Å; A160-C169 VanDerWaalsContact CB-SG 3.52Å; I167-C169 PolarHBondContact O-N 3.17Å; C169-V178 HydrophobicContact CB-CG2 3.67Å; C169-Q179 CarbonylContact C-O 3.57Å; C169-Q179 VanDerWaalsContact CA-O 3.3Å; C169-Q179 WeakPolarHBondContact CA-O 3.18Å; C169-C180 HydrophobicContact CB-CB 4.16Å; C169-C180 WeakPolarHBondContact CB-SG 3.49Å; C169-C180 WeakPolarHBondContact SG-CB 3.43Å; C169-C180 CovalentContact SG-SG 2.05Å; C169-C180 PolarHBondContact SG-SG 3.32Å
170	V	97.5	Very high	95.2	Very high	98 Å²	98	64.2 Å²	64.2	59%	0.594	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	121.5	179.7	-178.2	0	0	0	0	108.8	V178 Q179	V170-V178 WeakPolarHBondContact O-CA 3.44Å; V170-V178 VanDerWaalsContact O-CG2 3.23Å; V170-V178 WeakPolarHBondContact O-CG2 3.43Å; V170-Q179 PolarHBondContact N-O 2.81Å; V170-Q179 PolarHBondContact O-N 2.69Å
171	L	97.2	Very high	95.1	Very high	74 Å²	74	68.3 Å²	68.3	39%	0.387	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.1	-179.7	-168.8	73	0	0	0	110.6	W144 V155 V158 G177 V178	W144-L171 HydrophobicContact CH2-CD1 3.99Å; W144-L171 HydrophobicContact CZ2-CD1 4Å; V155-L171 HydrophobicContact CB-CD1 4.19Å; V155-L171 HydrophobicContact CB-CD2 4.06Å; V155-L171 HydrophobicContact CG1-CD1 4.16Å; V155-L171 HydrophobicContact CG1-CD2 4.46Å; V155-L171 HydrophobicContact CG2-CD1 3.89Å; V155-L171 HydrophobicContact CG2-CD2 4.37Å; V158-L171 HydrophobicContact CG2-CD1 4.46Å; L171-G177 VanDerWaalsContact CD1-O 3.31Å; L171-G177 WeakPolarHBondContact CD1-O 3.12Å; L171-V178 HydrophobicContact CD1-CB 4.44Å
172	D	97.3	Very high	94.9	Very high	49 Å²	49	66.2 Å²	66.2	26%	0.262	37%	0.369	S	S	.	.			trans	-65.9	151.5	173.6	-64.5	-22.8	0	0	0	110.8	H141 D174 G175 G177	H141-D172 IonicContact CD2-OD2 3.18Å; H141-D172 IonicContact CE1-OD2 2.65Å; H141-D172 PolarHBondContact CE1-OD2 3.3Å; H141-D172 IonicContact NE2-OD1 2.72Å; H141-D172 IonicContact NE2-OD2 3.53Å; H141-D172 PolarHBondContact NE2-OD2 3.42Å; D172-D174 WeakPolarHBondContact CB-OD1 3.47Å; D172-D174 PolarHBondContact O-N 2.9Å; D172-D174 VanDerWaalsContact O-N 3.1Å; D172-G175 PolarHBondContact O-N 2.89Å; D172-G177 WeakPolarHBondContact CB-O 3.28Å; D172-G177 VanDerWaalsContact CG-C 3.42Å; D172-G177 PolarHBondContact N-O 2.82Å; D172-G177 WeakPolarHBondContact OD2-CA 3.08Å
173	A	94.7	Very high	94.1	Very high	118 Å²	118	71.6 Å²	71.6	98%	0.975	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.3	-176.1	0	0	0	0	0	114
174	D	92.8	Very high	93.3	Very high	99 Å²	99	69.6 Å²	69.6	53%	0.529	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-8.4	177.5	65.3	4.7	0	0	0	113.7	D172 L176	D172-D174 WeakPolarHBondContact CB-OD1 3.47Å; D172-D174 PolarHBondContact O-N 2.9Å; D172-D174 VanDerWaalsContact O-N 3.1Å; D174-L176 VanDerWaalsContact C-N 3.26Å; D174-L176 HydrophobicContact CB-CD1 4.5Å; D174-L176 HydrophobicContact CB-CG 4.36Å; D174-L176 PolarHBondContact O-N 3.02Å; D174-L176 WeakPolarHBondContact OD1-CB 3.44Å; D174-L176 PolarHBondContact OD1-N 2.91Å
175	G	93.6	Very high	93	Very high	12 Å²	12	64.4 Å²	64.4	12%	0.124	37%	0.374	C	S	.	.	S	Bend	trans	64.2	25.7	-175.6	0	0	0	0	0	114.3	W144 D172	W144-G175 PolarHBondContact NE1-O 3.17Å; D172-G175 PolarHBondContact O-N 2.89Å
176	L	95.3	Very high	92.6	Very high	67 Å²	67	60.7 Å²	60.7	35%	0.351	36%	0.356	S	S	.	.	S	Bend	trans	-109	-7.2	178.2	-59.8	179.9	0	0	0	113.7	T143 W144 K146 D174	T143-L176 WeakPolarHBondContact CA-O 3.42Å; W144-L176 PolarHBondContact N-O 3.05Å; W144-L176 VanDerWaalsContact N-O 3.09Å; K146-L176 HydrophobicContact CD-CD2 4.13Å; K146-L176 HydrophobicContact CG-CD2 4.27Å; D174-L176 VanDerWaalsContact C-N 3.26Å; D174-L176 HydrophobicContact CB-CD1 4.5Å; D174-L176 HydrophobicContact CB-CG 4.36Å; D174-L176 PolarHBondContact O-N 3.02Å; D174-L176 WeakPolarHBondContact OD1-CB 3.44Å; D174-L176 PolarHBondContact OD1-N 2.91Å
177	G	97.5	Very high	92.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	177.1	172.9	0	0	0	0	0	112.9	C142 L171 D172	C142-G177 CarbonylContact O-C 3.54Å; C142-G177 WeakPolarHBondContact O-CA 3.1Å; L171-G177 VanDerWaalsContact CD1-O 3.31Å; L171-G177 WeakPolarHBondContact CD1-O 3.12Å; D172-G177 WeakPolarHBondContact CB-O 3.28Å; D172-G177 VanDerWaalsContact CG-C 3.42Å; D172-G177 PolarHBondContact N-O 2.82Å; D172-G177 WeakPolarHBondContact OD2-CA 3.08Å
178	V	98.2	Very high	91.6	Very high	1 Å²	1	64 Å²	64	1%	0.006	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	134.2	179.2	66.6	0	0	0	0	109.8	H141 C142 W144 V158 C169 V170 L171 F196	H141-V178 WeakPolarHBondContact CA-O 3.27Å; H141-V178 VanDerWaalsContact CD2-C 3.44Å; H141-V178 PolarHBondContact CD2-O 2.86Å; C142-V178 HydrophobicContact CB-CG1 4Å; C142-V178 PolarHBondContact N-O 2.78Å; C142-V178 PolarHBondContact O-N 2.89Å; W144-V178 HydrophobicContact CH2-CB 4.07Å; W144-V178 HydrophobicContact CH2-CG1 4.06Å; W144-V178 HydrophobicContact CZ3-CB 4.38Å; W144-V178 HydrophobicContact CZ3-CG1 3.89Å; V158-V178 HydrophobicContact CG1-CG2 4.33Å; C169-V178 HydrophobicContact CB-CG2 3.67Å; V170-V178 WeakPolarHBondContact O-CA 3.44Å; V170-V178 VanDerWaalsContact O-CG2 3.23Å; V170-V178 WeakPolarHBondContact O-CG2 3.43Å; L171-V178 HydrophobicContact CD1-CB 4.44Å; V178-F196 HydrophobicContact CG1-CE2 3.5Å; V178-F196 HydrophobicContact CG1-CZ 3.41Å; V178-F196 VanDerWaalsContact CG1-CZ 3.41Å
179	Q	98	Very high	91.1	Very high	77 Å²	77	67.3 Å²	67.3	36%	0.36	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.4	172.7	-173.9	63.7	30.4	0	0	109.6	S139 F140 H141 C169 V170	S139-Q179 PolarHBondContact OG-NE2 2.71Å; F140-Q179 PolarHBondContact O-NE2 2.88Å; H141-Q179 PolarHBondContact CD2-OE1 3.05Å; C169-Q179 CarbonylContact C-O 3.57Å; C169-Q179 VanDerWaalsContact CA-O 3.3Å; C169-Q179 WeakPolarHBondContact CA-O 3.18Å; V170-Q179 PolarHBondContact N-O 2.81Å; V170-Q179 PolarHBondContact O-N 2.69Å
180	C	97.8	Very high	90.8	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.007	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	151.1	178.8	-61.9	0	0	0	0	111.3	F140 I167 S168 C169	F140-C180 HydrophobicContact CD1-CB 4.21Å; F140-C180 HydrophobicContact CD2-CB 3.97Å; F140-C180 HydrophobicContact CE1-CB 3.71Å; F140-C180 HydrophobicContact CE2-CB 3.44Å; F140-C180 VanDerWaalsContact CE2-CB 3.44Å; F140-C180 HydrophobicContact CG-CB 4.33Å; F140-C180 HydrophobicContact CZ-CB 3.3Å; F140-C180 PolarHBondContact N-O 2.75Å; F140-C180 PolarHBondContact O-N 2.91Å; I167-C180 HydrophobicContact CG2-CB 4.08Å; S168-C180 CarbonylContact O-C 3.57Å; S168-C180 VanDerWaalsContact O-CA 3.27Å; S168-C180 WeakPolarHBondContact O-CA 3.21Å; C169-C180 HydrophobicContact CB-CB 4.16Å; C169-C180 WeakPolarHBondContact CB-SG 3.49Å; C169-C180 WeakPolarHBondContact SG-CB 3.43Å; C169-C180 CovalentContact SG-SG 2.05Å; C169-C180 PolarHBondContact SG-SG 3.32Å
181	Q	95.9	Very high	90.5	Very high	90 Å²	90	66.4 Å²	66.4	42%	0.421	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	106.1	177.3	-176.9	61.4	56	0	0	109.9	K137 S139 S168	K137-Q181 PolarHBondContact O-NE2 3.45Å; S139-Q181 PolarHBondContact OG-OE1 2.82Å; S168-Q181 PolarHBondContact O-N 2.76Å
182	D	91.3	Very high	90.3	Very high	15 Å²	15	66.7 Å²	66.7	8%	0.08	36%	0.362	C	S	.	.			trans	-87.4	148.1	170.7	-164.7	1.3	0	0	0	110.5	G138 F140 R162 I167 D184	G138-D182 PolarHBondContact O-N 2.83Å; F140-D182 HydrophobicContact CE1-CB 4.32Å; R162-D182 IonicContact CZ-OD2 3.79Å; R162-D182 IonicContact NE-OD2 3.83Å; R162-D182 PolarHBondContact NE-OD2 2.89Å; R162-D182 IonicContact NH1-OD2 2.69Å; R162-D182 PolarHBondContact NH1-OD2 2.82Å; R162-D182 IonicContact NH2-OD2 2.76Å; I167-D182 HydrophobicContact CD1-CB 4.12Å; I167-D182 HydrophobicContact CG1-CB 4.23Å; I167-D182 HydrophobicContact CG2-CB 4.17Å; D182-D184 PolarHBondContact O-N 2.88Å
183	V	75.1	Confident	90.2	Very high	140 Å²	140	68.2 Å²	68.2	85%	0.848	37%	0.368	S	S	*	.			trans	-90.9	92.3	174.8	-176.1	0	0	0	0	107
184	D	72.9	Confident	90.3	Very high	40 Å²	40	62.7 Å²	62.7	21%	0.214	32%	0.322	C	S	.	.			trans	-127.1	146.9	180	-152.3	0.1	0	0	0	113.5	R162 D182 P186	R162-D184 IonicContact CZ-OD2 3.39Å; R162-D184 IonicContact NH1-OD1 2.71Å; R162-D184 IonicContact NH1-OD2 2.84Å; R162-D184 PolarHBondContact NH1-OD2 2.98Å; R162-D184 IonicContact NH2-OD2 3.88Å; R162-D184 PolarHBondContact NH2-OD2 2.96Å; D182-D184 PolarHBondContact O-N 2.88Å; D184-P186 WeakPolarHBondContact O-CD 3.13Å
185	C	80.7	Confident	90.5	Very high	66 Å²	66	61.7 Å²	61.7	45%	0.446	31%	0.314	S	S	.	.			trans	-85.9	112.2	170.7	178	0	0	0	0	107.7	Y187 K188	C185-Y187 PolarHBondContact O-N 3.28Å; C185-K188 HydrophobicContact CB-CB 4.02Å; C185-K188 WeakPolarHBondContact O-CB 3.37Å; C185-K188 PolarHBondContact O-N 3.34Å
186	P	83.5	Confident	90.7	Very high	31 Å²	31	61.1 Å²	61.1	20%	0.201	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-20.4	-173.9	-28.1	36	0	0	0	115	Y136 K137 D184 F250	Y136-P186 WeakPolarHBondContact O-CG 3.17Å; K137-P186 HydrophobicContact CG-CG 4.34Å; D184-P186 WeakPolarHBondContact O-CD 3.13Å; P186-F250 HydrophobicContact CB-CE1 4.28Å; P186-F250 HydrophobicContact CB-CZ 3.69Å; P186-F250 WeakPolarHBondContact O-CE1 3.39Å; P186-F250 WeakPolarHBondContact O-CZ 3.47Å
187	Y	84.9	Confident	90.8	Very high	106 Å²	106	58.3 Å²	58.3	42%	0.416	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-15.4	-177.5	-61.3	-90.1	0	0	0	113.6	C185 K245 P246 Y249 F250	C185-Y187 PolarHBondContact O-N 3.28Å; Y187-K245 PolarHBondContact OH-O 2.93Å; Y187-P246 WeakPolarHBondContact OH-CD 3.46Å; Y187-Y249 AromaticContact CD1-CD1 3.73Å; Y187-Y249 HydrophobicContact CD1-CD1 3.73Å; Y187-Y249 HydrophobicContact CD1-CD2 4.44Å; Y187-Y249 AromaticContact CD1-CE1 3.64Å; Y187-Y249 HydrophobicContact CD1-CE1 3.64Å; Y187-Y249 HydrophobicContact CD1-CE2 4.38Å; Y187-Y249 HydrophobicContact CD1-CG 4.13Å; Y187-Y249 AromaticContact CD1-CZ 3.99Å; Y187-Y249 AromaticContact CE1-CD1 3.96Å; Y187-Y249 HydrophobicContact CE1-CD1 3.96Å; Y187-Y249 HydrophobicContact CE1-CE1 4.35Å; Y187-Y249 HydrophobicContact CE1-CG 4.16Å; Y187-Y249 HydrophobicContact CG-CE1 4.43Å; Y187-Y249 PolarHBondContact O-OH 2.89Å; Y187-Y249 VanDerWaalsContact O-OH 3.11Å; Y187-F250 HydrophobicContact CD1-CE2 4.14Å; Y187-F250 HydrophobicContact CD1-CZ 4.12Å; Y187-F250 AromaticContact CE1-CE2 3.64Å; Y187-F250 HydrophobicContact CE1-CE2 3.64Å; Y187-F250 HydrophobicContact CE1-CZ 4.08Å; Y187-F250 HydrophobicContact CE2-CE2 4.38Å; Y187-F250 HydrophobicContact CG-CZ 4.41Å; Y187-F250 AromaticContact CZ-CE2 3.77Å
188	K	86.7	Confident	90.7	Very high	139 Å²	139	58.3 Å²	58.3	60%	0.604	29%	0.294	S	S	*	.	S	Bend	trans	-81.9	138	-174.4	-171	-177.8	176.4	-172.1	0	109.6	C185 E190	C185-K188 HydrophobicContact CB-CB 4.02Å; C185-K188 WeakPolarHBondContact O-CB 3.37Å; C185-K188 PolarHBondContact O-N 3.34Å; K188-E190 PolarHBondContact O-N 2.86Å
189	E	85.9	Confident	90.7	Very high	156 Å²	156	60.3 Å²	60.3	73%	0.729	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-67.7	127.8	171.5	-172.3	175.2	-176.8	0	0	110.5	T191	E189-T191 PolarHBondContact O-N 2.81Å
190	E	90.3	Very high	90.6	Very high	20 Å²	20	56.7 Å²	56.7	9%	0.093	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-70.9	117.5	176.4	-61.4	179.6	-100.4	0	0	110.7	R162 K188 Y214 L215 R216	R162-E190 IonicContact CZ-OE2 2.72Å; R162-E190 IonicContact NH2-OE2 2.83Å; R162-E190 PolarHBondContact NH2-OE2 2.05Å; K188-E190 PolarHBondContact O-N 2.86Å; E190-Y214 HydrophobicContact CB-CD1 3.68Å; E190-Y214 HydrophobicContact CB-CE1 4.25Å; E190-L215 VanDerWaalsContact CD-N 3.31Å; E190-L215 WeakPolarHBondContact OE1-CB 3.3Å; E190-L215 PolarHBondContact OE1-N 2.94Å; E190-L215 WeakPolarHBondContact OE2-CB 3.1Å; E190-L215 PolarHBondContact OE2-N 2.99Å; E190-R216 PolarHBondContact O-NH1 3.18Å; E190-R216 PolarHBondContact OE1-N 3.35Å
191	T	91.1	Very high	90.5	Very high	93 Å²	93	58.9 Å²	58.9	57%	0.571	30%	0.295	S	S	*	.			trans	-95.2	-20.2	177.2	60.2	0	0	0	0	113.1	E189	E189-T191 PolarHBondContact O-N 2.81Å
192	H	93.3	Very high	90.5	Very high	81 Å²	81	54.7 Å²	54.7	38%	0.375	28%	0.275	S	S	.	.	S	Bend	trans	-130.6	139.1	-176.3	-55.7	112.1	0	0	0	110.3	R162 N163	R162-H192 HydrophobicContact CG-CB 4.14Å; N163-H192 HydrophobicContact CB-CB 4.27Å; N163-H192 PolarHBondContact OD1-CE1 2.95Å
193	Q	94.9	Very high	90.6	Very high	81 Å²	81	62.2 Å²	62.2	38%	0.379	30%	0.304	S	S	.	.			trans	-72.1	147.6	173.5	-68.5	-176.9	-33.4	0	0	110.5	F213 Y214	Q193-F213 CarbonylContact C-O 3.53Å; Q193-F213 WeakPolarHBondContact CA-O 3.25Å; Q193-Y214 HydrophobicContact CG-CD1 3.98Å; Q193-Y214 HydrophobicContact CG-CD2 3.8Å; Q193-Y214 HydrophobicContact CG-CE1 3.67Å; Q193-Y214 HydrophobicContact CG-CE2 3.47Å; Q193-Y214 VanDerWaalsContact CG-CE2 3.47Å; Q193-Y214 HydrophobicContact CG-CG 4.05Å
194	I	96.3	Very high	91.5	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126.3	160.8	-63.4	169.7	0	0	0	106.7	F140 R162 I167 S212 F213	F140-I194 HydrophobicContact CD1-CD1 4.29Å; F140-I194 HydrophobicContact CE1-CD1 3.81Å; F140-I194 HydrophobicContact CZ-CD1 4.29Å; F140-I194 HydrophobicContact CZ-CG2 4.04Å; R162-I194 HydrophobicContact CB-CG1 4.43Å; I167-I194 HydrophobicContact CD1-CB 4.47Å; I167-I194 HydrophobicContact CD1-CD1 4.39Å; I167-I194 HydrophobicContact CD1-CG1 4.02Å; I167-I194 HydrophobicContact CD1-CG2 3.81Å; I194-S212 VanDerWaalsContact O-CA 3.29Å; I194-S212 WeakPolarHBondContact O-CA 3.39Å; I194-F213 HydrophobicContact CB-CD2 4.38Å; I194-F213 HydrophobicContact CB-CE2 4.01Å; I194-F213 HydrophobicContact CB-CZ 4.16Å; I194-F213 HydrophobicContact CD1-CE2 3.91Å; I194-F213 HydrophobicContact CG2-CE1 4.34Å; I194-F213 HydrophobicContact CG2-CE2 4.16Å; I194-F213 HydrophobicContact CG2-CZ 3.85Å; I194-F213 PolarHBondContact N-O 2.93Å; I194-F213 PolarHBondContact O-N 3.46Å
195	Q	97.1	Very high	92.5	Very high	78 Å²	78	56 Å²	56	36%	0.364	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.9	169.5	-177.4	177.2	-6.4	0	0	108.2	A160 H161 T210	A160-Q195 WeakPolarHBondContact CA-O 3.29Å; H161-Q195 PolarHBondContact CE1-OE1 3.37Å; H161-Q195 PolarHBondContact N-O 2.81Å; H161-Q195 WeakPolarHBondContact NE2-CB 3.11Å; H161-Q195 PolarHBondContact NE2-OE1 2.84Å; H161-Q195 PolarHBondContact O-N 2.05Å; Q195-T210 HydrophobicContact CG-CG2 3.85Å
196	F	97.4	Very high	93.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.1	-178.4	175	-95.5	0	0	0	109.4	I129 C142 W144 V158 A160 V178 I198 T210 K211 F213	I129-F196 HydrophobicContact CD1-CD1 3.89Å; I129-F196 HydrophobicContact CD1-CE1 3.94Å; I129-F196 HydrophobicContact CG1-CE1 4.49Å; I129-F196 HydrophobicContact CG2-CD1 3.8Å; I129-F196 HydrophobicContact CG2-CE1 3.65Å; C142-F196 HydrophobicContact CB-CD1 4.46Å; C142-F196 HydrophobicContact CB-CE1 3.9Å; C142-F196 HydrophobicContact CB-CE2 4.33Å; C142-F196 HydrophobicContact CB-CZ 3.85Å; W144-F196 HydrophobicContact CZ3-CE1 4.42Å; W144-F196 HydrophobicContact CZ3-CZ 4.08Å; V158-F196 HydrophobicContact CG1-CD2 4.34Å; V158-F196 HydrophobicContact CG1-CE2 3.5Å; V158-F196 HydrophobicContact CG1-CZ 4.01Å; A160-F196 HydrophobicContact CB-CD2 4.06Å; V178-F196 HydrophobicContact CG1-CE2 3.5Å; V178-F196 HydrophobicContact CG1-CZ 3.41Å; V178-F196 VanDerWaalsContact CG1-CZ 3.41Å; F196-I198 HydrophobicContact CD1-CG2 4.42Å; F196-I198 HydrophobicContact CE1-CG2 3.39Å; F196-I198 HydrophobicContact CE2-CG2 4.27Å; F196-I198 HydrophobicContact CZ-CG2 3.28Å; F196-T210 CarbonylContact O-C 3.53Å; F196-T210 VanDerWaalsContact O-CA 3.29Å; F196-T210 WeakPolarHBondContact O-CA 3.44Å; F196-K211 PolarHBondContact N-O 3.44Å; F196-K211 PolarHBondContact O-N 3.32Å; F196-F213 HydrophobicContact CB-CE1 3.98Å
197	T	97.1	Very high	93.8	Very high	9 Å²	9	51.4 Å²	51.4	6%	0.055	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.3	179.8	-58.2	0	0	0	0	110.6	K159 Y199 A208 Y209 T210	K159-T197 PolarHBondContact N-O 3.33Å; K159-T197 PolarHBondContact O-N 2.9Å; T197-Y199 HydrophobicContact CG2-CD2 4.11Å; T197-Y199 HydrophobicContact CG2-CE2 3.57Å; T197-A208 HydrophobicContact CG2-CB 4.4Å; T197-Y209 CarbonylContact C-O 3.53Å; T197-Y209 VanDerWaalsContact CA-O 3.23Å; T197-Y209 WeakPolarHBondContact CA-O 3.42Å; T197-T210 WeakPolarHBondContact CG2-OG1 3.39Å; T197-T210 WeakPolarHBondContact OG1-CG2 3.5Å; T197-T210 PolarHBondContact OG1-OG1 2.76Å
198	I	97.3	Very high	94.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.4	169.7	59.8	-178	0	0	0	110.2	L119 I129 W144 V158 F196 M200 A208 Y209	L119-I198 HydrophobicContact CD1-CD1 3.59Å; L119-I198 HydrophobicContact CD1-CG1 4.46Å; I129-I198 HydrophobicContact CD1-CD1 4.05Å; I129-I198 HydrophobicContact CD1-CG1 3.96Å; I129-I198 HydrophobicContact CG1-CD1 3.93Å; I129-I198 HydrophobicContact CG1-CG1 4.4Å; W144-I198 HydrophobicContact CB-CD1 4.39Å; W144-I198 HydrophobicContact CD2-CD1 3.57Å; W144-I198 HydrophobicContact CE3-CD1 3.54Å; W144-I198 HydrophobicContact CE3-CG2 4.42Å; W144-I198 HydrophobicContact CG-CD1 3.95Å; W144-I198 HydrophobicContact CH2-CG2 4.18Å; W144-I198 HydrophobicContact CZ3-CD1 4.1Å; W144-I198 HydrophobicContact CZ3-CG2 3.93Å; V158-I198 HydrophobicContact CG1-CG2 4.35Å; V158-I198 HydrophobicContact CG2-CG2 4.2Å; F196-I198 HydrophobicContact CD1-CG2 4.42Å; F196-I198 HydrophobicContact CE1-CG2 3.39Å; F196-I198 HydrophobicContact CE2-CG2 4.27Å; F196-I198 HydrophobicContact CZ-CG2 3.28Å; I198-M200 HydrophobicContact CD1-CG 4.42Å; I198-A208 WeakPolarHBondContact O-CA 3.23Å; I198-Y209 HydrophobicContact CG1-CD2 4.31Å; I198-Y209 HydrophobicContact CG1-CG 4.42Å; I198-Y209 PolarHBondContact N-O 3.14Å; I198-Y209 PolarHBondContact O-N 2.8Å
199	Y	97	Very high	94.7	Very high	43 Å²	43	41.3 Å²	41.3	17%	0.169	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	109.4	173	-66.2	-94.4	0	0	0	107.9	L28 L156 L157 K159 T197 L206 E207 A208	L28-Y199 HydrophobicContact CD1-CD1 3.99Å; L28-Y199 HydrophobicContact CD1-CE1 3.64Å; L28-Y199 HydrophobicContact CD1-CE2 4.31Å; L28-Y199 HydrophobicContact CD1-CG 4.45Å; L28-Y199 HydrophobicContact CD2-CD1 4.01Å; L28-Y199 HydrophobicContact CD2-CE1 4.47Å; L28-Y199 HydrophobicContact CD2-CG 4.32Å; L156-Y199 WeakPolarHBondContact CB-O 3.45Å; L156-Y199 PolarHBondContact N-O 3.05Å; L157-Y199 HydrophobicContact CB-CD2 3.83Å; L157-Y199 HydrophobicContact CB-CG 4.19Å; L157-Y199 HydrophobicContact CD2-CD2 4.07Å; L157-Y199 HydrophobicContact CD2-CE2 4.25Å; L157-Y199 HydrophobicContact CG-CD2 4.11Å; L157-Y199 PolarHBondContact N-O 3.35Å; L157-Y199 PolarHBondContact O-N 3.28Å; K159-Y199 HydrophobicContact CD-CE2 4.1Å; K159-Y199 HydrophobicContact CG-CE2 4.4Å; T197-Y199 HydrophobicContact CG2-CD2 4.11Å; T197-Y199 HydrophobicContact CG2-CE2 3.57Å; Y199-L206 HydrophobicContact CD1-CD1 4.31Å; Y199-L206 HydrophobicContact CD1-CD2 4.3Å; Y199-E207 WeakPolarHBondContact CA-O 3.29Å; Y199-A208 HydrophobicContact CD1-CB 3.88Å; Y199-A208 HydrophobicContact CE1-CB 3.77Å
200	M	96.4	Very high	95.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.2	178.5	-71.9	-70.3	-59.4	0	0	109	I118 L119 K146 A153 V155 I198 L206 E207 Y209	I118-M200 HydrophobicContact CB-CB 4.48Å; I118-M200 HydrophobicContact CD1-CB 4.11Å; I118-M200 HydrophobicContact CG2-CB 3.94Å; I118-M200 HydrophobicContact CG2-CE 3.56Å; I118-M200 HydrophobicContact CG2-CG 4.37Å; L119-M200 HydrophobicContact CD1-CG 4.09Å; L119-M200 HydrophobicContact CD2-CE 3.9Å; L119-M200 HydrophobicContact CD2-CG 4.21Å; L119-M200 HydrophobicContact CD2-SD 4.28Å; L119-M200 HydrophobicContact CG-CG 4.2Å; K146-M200 HydrophobicContact CD-CE 4.41Å; K146-M200 HydrophobicContact CG-CE 4.23Å; A153-M200 HydrophobicContact CB-CE 3.9Å; V155-M200 HydrophobicContact CG2-SD 3.71Å; I198-M200 HydrophobicContact CD1-CG 4.42Å; M200-L206 WeakPolarHBondContact O-CA 3.46Å; M200-L206 WeakPolarHBondContact O-CD1 3.39Å; M200-E207 PolarHBondContact N-O 2.91Å; M200-E207 PolarHBondContact O-N 2.78Å; M200-Y209 HydrophobicContact CB-CD2 4.42Å; M200-Y209 HydrophobicContact CB-CE2 4.1Å; M200-Y209 HydrophobicContact CG-CD2 4.12Å; M200-Y209 HydrophobicContact CG-CE2 4.08Å
201	H	95.6	Very high	95.4	Very high	47 Å²	47	39.3 Å²	39.3	22%	0.218	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.1	172.8	80.4	102.2	0	0	0	112.3	L107 A153 A154 Y203 R205 L206	L107-H201 HydrophobicContact CD2-CB 4.2Å; A153-H201 CarbonylContact C-O 3.57Å; A153-H201 VanDerWaalsContact CA-O 3.25Å; A153-H201 WeakPolarHBondContact CA-O 3.41Å; A153-H201 WeakPolarHBondContact CB-O 3.14Å; A154-H201 PolarHBondContact N-O 2.9Å; A154-H201 PolarHBondContact O-CD2 3.23Å; A154-H201 VanDerWaalsContact O-CD2 3.28Å; A154-H201 PolarHBondContact O-N 3.46Å; H201-Y203 PolarHBondContact ND1-O 3.06Å; H201-R205 CarbonylContact C-O 3.5Å; H201-R205 WeakPolarHBondContact CA-O 3.5Å; H201-L206 HydrophobicContact CB-CD1 4.33Å
202	S	94.8	Very high	95.6	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	108.2	173.5	173.4	0	0	0	0	108.2	R150 H152 S204 R205	R150-S202 VanDerWaalsContact CD-OG 3.27Å; R150-S202 WeakPolarHBondContact CD-OG 3.36Å; R150-S202 PolarHBondContact NH1-OG 2.99Å; H152-S202 PolarHBondContact NE2-OG 3.32Å; S202-S204 PolarHBondContact O-N 2.93Å; S202-R205 PolarHBondContact N-O 2.86Å; S202-R205 WeakPolarHBondContact O-CB 3.42Å; S202-R205 PolarHBondContact O-N 3.38Å
203	Y	93.3	Very high	95.7	Very high	173 Å²	173	33.9 Å²	33.9	68%	0.678	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	-121.4	-160.6	-53.9	-80.8	0	0	0	109.7	H152 H201	H152-Y203 AromaticContact CD2-CE2 3.94Å; H152-Y203 AromaticContact CE1-CE2 3.5Å; H152-Y203 VanDerWaalsContact CE1-CE2 3.5Å; H152-Y203 WeakPolarHBondContact CE1-CE2 3.29Å; H152-Y203 AromaticContact NE2-CD2 3.49Å; H152-Y203 WeakPolarHBondContact NE2-CD2 3.42Å; H152-Y203 AromaticContact NE2-CE2 3.07Å; H152-Y203 WeakPolarHBondContact NE2-CE2 3.4Å; H152-Y203 AromaticContact NE2-CZ 3.65Å; H201-Y203 PolarHBondContact ND1-O 3.06Å
204	S	94.1	Very high	95.7	Very high	18 Å²	18	32.3 Å²	32.3	13%	0.126	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-14.7	176.5	44.6	0	0	0	0	114.1	M85 L107 V108 S202	M85-S204 WeakPolarHBondContact O-CB 3.4Å; M85-S204 PolarHBondContact O-OG 2.82Å; L107-S204 CarbonylContact C-O 3.57Å; L107-S204 WeakPolarHBondContact CA-O 3.48Å; V108-S204 PolarHBondContact N-O 2.89Å; S202-S204 PolarHBondContact O-N 2.93Å
205	R	94.4	Very high	95.5	Very high	31 Å²	31	32.3 Å²	32.3	12%	0.117	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.8	-178.7	179	175.4	174.1	117.8	2	109.6	M85 V108 R115 H201 S202 E207	M85-R205 HydrophobicContact SD-CB 4.12Å; M85-R205 HydrophobicContact SD-CG 4.27Å; V108-R205 WeakPolarHBondContact O-CA 3.4Å; R115-R205 PolarHBondContact O-NH2 2.92Å; H201-R205 CarbonylContact C-O 3.5Å; H201-R205 WeakPolarHBondContact CA-O 3.5Å; S202-R205 PolarHBondContact N-O 2.86Å; S202-R205 WeakPolarHBondContact O-CB 3.42Å; S202-R205 PolarHBondContact O-N 3.38Å; R205-E207 HydrophobicContact CG-CG 4.47Å; R205-E207 IonicContact CZ-OE1 3.13Å; R205-E207 IonicContact NE-OE1 2.73Å; R205-E207 PolarHBondContact NE-OE1 2.75Å; R205-E207 IonicContact NH2-OE1 2.68Å; R205-E207 PolarHBondContact NH2-OE1 2.9Å
206	L	95.9	Very high	95.3	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136	173.7	-178.8	67	0	0	0	110.1	L28 V34 L107 V108 L156 Y199 M200 H201	L28-L206 HydrophobicContact CD2-CD2 3.87Å; V34-L206 HydrophobicContact CB-CD2 4.36Å; V34-L206 HydrophobicContact CG1-CD2 4.02Å; V34-L206 HydrophobicContact CG2-CD2 3.36Å; L107-L206 HydrophobicContact CB-CB 4.01Å; L107-L206 HydrophobicContact CB-CD2 4.37Å; L107-L206 HydrophobicContact CD1-CB 4.41Å; L107-L206 HydrophobicContact CD1-CD1 4.17Å; L107-L206 HydrophobicContact CD1-CD2 4.21Å; V108-L206 PolarHBondContact O-N 2.03Å; L156-L206 HydrophobicContact CD2-CD1 3.93Å; Y199-L206 HydrophobicContact CD1-CD1 4.31Å; Y199-L206 HydrophobicContact CD1-CD2 4.3Å; M200-L206 WeakPolarHBondContact O-CA 3.46Å; M200-L206 WeakPolarHBondContact O-CD1 3.39Å; H201-L206 HydrophobicContact CB-CD1 4.33Å
207	E	95.8	Very high	95.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.1	170.9	-63.6	179.7	178.7	0	0	109.2	V117 I118 Y199 M200 R205 Y209	V117-E207 WeakPolarHBondContact CG2-OE1 3.41Å; V117-E207 PolarHBondContact N-OE1 2.88Å; V117-E207 PolarHBondContact N-OE2 3.2Å; V117-E207 VanDerWaalsContact N-OE2 3.09Å; I118-E207 VanDerWaalsContact CB-OE2 3.25Å; I118-E207 WeakPolarHBondContact CB-OE2 3.44Å; I118-E207 HydrophobicContact CD1-CB 4.06Å; I118-E207 HydrophobicContact CD1-CG 3.81Å; I118-E207 HydrophobicContact CG1-CG 4.25Å; I118-E207 VanDerWaalsContact CG1-OE2 3.32Å; I118-E207 WeakPolarHBondContact CG1-OE2 3.07Å; I118-E207 PolarHBondContact N-OE2 2.91Å; Y199-E207 WeakPolarHBondContact CA-O 3.29Å; M200-E207 PolarHBondContact N-O 2.91Å; M200-E207 PolarHBondContact O-N 2.78Å; R205-E207 HydrophobicContact CG-CG 4.47Å; R205-E207 IonicContact CZ-OE1 3.13Å; R205-E207 IonicContact NE-OE1 2.73Å; R205-E207 PolarHBondContact NE-OE1 2.75Å; R205-E207 IonicContact NH2-OE1 2.68Å; R205-E207 PolarHBondContact NH2-OE1 2.9Å; E207-Y209 HydrophobicContact CB-CD2 4.35Å; E207-Y209 HydrophobicContact CB-CE2 3.59Å; E207-Y209 VanDerWaalsContact OE2-CZ 3.3Å; E207-Y209 PolarHBondContact OE2-OH 2.89Å
208	A	95.1	Very high	95	Very high	26 Å²	26	36.6 Å²	36.6	22%	0.215	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.4	176.9	0	0	0	0	0	109.6	T197 I198 Y199	T197-A208 HydrophobicContact CG2-CB 4.4Å; I198-A208 WeakPolarHBondContact O-CA 3.23Å; Y199-A208 HydrophobicContact CD1-CB 3.88Å; Y199-A208 HydrophobicContact CE1-CB 3.77Å
209	Y	95.4	Very high	94.9	Very high	8 Å²	8	36.6 Å²	36.6	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.9	178.6	-62.2	-94.7	0	0	0	108.8	T116 I118 L119 H128 I129 T197 I198 M200 E207	T116-Y209 HydrophobicContact CG2-CD1 4.34Å; T116-Y209 HydrophobicContact CG2-CE1 3.71Å; I118-Y209 PolarHBondContact N-OH 3.45Å; L119-Y209 HydrophobicContact CB-CD1 4.41Å; L119-Y209 HydrophobicContact CB-CE1 3.74Å; L119-Y209 HydrophobicContact CB-CE2 4.24Å; L119-Y209 HydrophobicContact CD1-CD1 3.92Å; L119-Y209 HydrophobicContact CD1-CD2 3.52Å; L119-Y209 HydrophobicContact CD1-CE1 3.97Å; L119-Y209 HydrophobicContact CD1-CE2 3.62Å; L119-Y209 HydrophobicContact CD1-CG 3.66Å; L119-Y209 HydrophobicContact CG-CD1 4.48Å; L119-Y209 HydrophobicContact CG-CD2 4.09Å; L119-Y209 HydrophobicContact CG-CE1 4.03Å; L119-Y209 HydrophobicContact CG-CE2 3.64Å; L119-Y209 HydrophobicContact CG-CG 4.48Å; L119-Y209 PolarHBondContact N-OH 2.85Å; H128-Y209 HydrophobicContact CB-CD1 3.67Å; H128-Y209 HydrophobicContact CB-CE1 3.98Å; H128-Y209 AromaticContact CD2-CD1 3.38Å; H128-Y209 WeakPolarHBondContact CD2-CD1 3.15Å; H128-Y209 AromaticContact CD2-CE1 3.42Å; H128-Y209 VanDerWaalsContact CD2-CE1 3.42Å; H128-Y209 WeakPolarHBondContact CD2-CE1 3.37Å; H128-Y209 AromaticContact CE1-CE1 3.98Å; H128-Y209 AromaticContact CG-CD1 3.55Å; H128-Y209 AromaticContact CG-CE1 3.5Å; H128-Y209 VanDerWaalsContact CG-CE1 3.5Å; H128-Y209 AromaticContact ND1-CE1 3.86Å; H128-Y209 AromaticContact NE2-CE1 3.73Å; I129-Y209 WeakPolarHBondContact CD1-O 3.04Å; T197-Y209 CarbonylContact C-O 3.53Å; T197-Y209 VanDerWaalsContact CA-O 3.23Å; T197-Y209 WeakPolarHBondContact CA-O 3.42Å; I198-Y209 HydrophobicContact CG1-CD2 4.31Å; I198-Y209 HydrophobicContact CG1-CG 4.42Å; I198-Y209 PolarHBondContact N-O 3.14Å; I198-Y209 PolarHBondContact O-N 2.8Å; M200-Y209 HydrophobicContact CB-CD2 4.42Å; M200-Y209 HydrophobicContact CB-CE2 4.1Å; M200-Y209 HydrophobicContact CG-CD2 4.12Å; M200-Y209 HydrophobicContact CG-CE2 4.08Å; E207-Y209 HydrophobicContact CB-CD2 4.35Å; E207-Y209 HydrophobicContact CB-CE2 3.59Å; E207-Y209 VanDerWaalsContact OE2-CZ 3.3Å; E207-Y209 PolarHBondContact OE2-OH 2.89Å
210	T	95.1	Very high	94.9	Very high	77 Å²	77	39.5 Å²	39.5	47%	0.472	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.5	-178.1	-59	0	0	0	0	110.7	Q195 F196 T197	Q195-T210 HydrophobicContact CG-CG2 3.85Å; F196-T210 CarbonylContact O-C 3.53Å; F196-T210 VanDerWaalsContact O-CA 3.29Å; F196-T210 WeakPolarHBondContact O-CA 3.44Å; T197-T210 WeakPolarHBondContact CG2-OG1 3.39Å; T197-T210 WeakPolarHBondContact OG1-CG2 3.5Å; T197-T210 PolarHBondContact OG1-OG1 2.76Å
211	K	95.7	Very high	94.9	Very high	56 Å²	56	39.6 Å²	39.6	24%	0.243	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.2	169.9	-164.9	-170.1	-171.5	79.6	0	108.8	I129 F196 F213	I129-K211 HydrophobicContact CB-CB 4.2Å; I129-K211 HydrophobicContact CB-CD 4.21Å; I129-K211 HydrophobicContact CD1-CB 4.2Å; I129-K211 HydrophobicContact CG2-CB 4.36Å; I129-K211 HydrophobicContact CG2-CD 4.14Å; I129-K211 WeakPolarHBondContact O-CD 3.46Å; I129-K211 WeakPolarHBondContact O-CE 3.25Å; I129-K211 PolarHBondContact O-NZ 2.88Å; F196-K211 PolarHBondContact N-O 3.44Å; F196-K211 PolarHBondContact O-N 3.32Å; K211-F213 HydrophobicContact CB-CD1 4.43Å; K211-F213 HydrophobicContact CD-CD1 3.89Å; K211-F213 HydrophobicContact CD-CE1 4.29Å; K211-F213 HydrophobicContact CG-CD1 4.01Å
212	S	95.7	Very high	94.8	Very high	58 Å²	58	40.9 Å²	40.9	41%	0.406	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.6	170.9	-55.2	0	0	0	0	109.4	I194	I194-S212 VanDerWaalsContact O-CA 3.29Å; I194-S212 WeakPolarHBondContact O-CA 3.39Å
213	F	94.9	Very high	94.8	Very high	3 Å²	3	44.8 Å²	44.8	1%	0.013	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	157.7	-179.3	55.5	-88.4	0	0	0	111.2	C131 F140 Q193 I194 F196 K211 E217 I218	C131-F213 HydrophobicContact CB-CE1 4.15Å; C131-F213 HydrophobicContact CB-CE2 4.48Å; C131-F213 HydrophobicContact CB-CZ 4.03Å; C131-F213 VanDerWaalsContact SG-CE1 3.59Å; F140-F213 HydrophobicContact CD2-CE2 4.4Å; F140-F213 HydrophobicContact CD2-CZ 4.04Å; F140-F213 HydrophobicContact CE2-CE2 4.45Å; F140-F213 AromaticContact CE2-CZ 3.82Å; F140-F213 HydrophobicContact CE2-CZ 3.82Å; F140-F213 HydrophobicContact CZ-CZ 4.33Å; Q193-F213 CarbonylContact C-O 3.53Å; Q193-F213 WeakPolarHBondContact CA-O 3.25Å; I194-F213 HydrophobicContact CB-CD2 4.38Å; I194-F213 HydrophobicContact CB-CE2 4.01Å; I194-F213 HydrophobicContact CB-CZ 4.16Å; I194-F213 HydrophobicContact CD1-CE2 3.91Å; I194-F213 HydrophobicContact CG2-CE1 4.34Å; I194-F213 HydrophobicContact CG2-CE2 4.16Å; I194-F213 HydrophobicContact CG2-CZ 3.85Å; I194-F213 PolarHBondContact N-O 2.93Å; I194-F213 PolarHBondContact O-N 3.46Å; F196-F213 HydrophobicContact CB-CE1 3.98Å; K211-F213 HydrophobicContact CB-CD1 4.43Å; K211-F213 HydrophobicContact CD-CD1 3.89Å; K211-F213 HydrophobicContact CD-CE1 4.29Å; K211-F213 HydrophobicContact CG-CD1 4.01Å; F213-E217 WeakPolarHBondContact CA-OE2 3.16Å; F213-I218 HydrophobicContact CB-CG2 4.25Å; F213-I218 HydrophobicContact CD2-CD1 3.76Å; F213-I218 HydrophobicContact CD2-CG1 4.04Å; F213-I218 HydrophobicContact CD2-CG2 3.92Å; F213-I218 HydrophobicContact CE2-CD1 3.41Å; F213-I218 VanDerWaalsContact CE2-CD1 3.41Å; F213-I218 HydrophobicContact CE2-CG1 4.19Å; F213-I218 HydrophobicContact CG-CG2 4.15Å; F213-I218 HydrophobicContact CZ-CD1 4.22Å
214	Y	94.3	Very high	95	Very high	47 Å²	47	36.9 Å²	36.9	18%	0.184	18%	0.182	C	C	.	.			trans	-89.7	152	160.8	-62.6	-79.7	0	0	0	110	E190 Q193 R216 E217	E190-Y214 HydrophobicContact CB-CD1 3.68Å; E190-Y214 HydrophobicContact CB-CE1 4.25Å; Q193-Y214 HydrophobicContact CG-CD1 3.98Å; Q193-Y214 HydrophobicContact CG-CD2 3.8Å; Q193-Y214 HydrophobicContact CG-CE1 3.67Å; Q193-Y214 HydrophobicContact CG-CE2 3.47Å; Q193-Y214 VanDerWaalsContact CG-CE2 3.47Å; Q193-Y214 HydrophobicContact CG-CG 4.05Å; Y214-R216 VanDerWaalsContact C-N 3.25Å; Y214-R216 PolarHBondContact O-N 2.88Å; Y214-E217 HydrophobicContact CD2-CG 4.49Å; Y214-E217 WeakPolarHBondContact CD2-OE1 3.32Å; Y214-E217 PolarHBondContact N-OE2 2.87Å; Y214-E217 WeakPolarHBondContact O-CB 3.43Å; Y214-E217 PolarHBondContact O-N 2.88Å
215	L	93.5	Very high	95.1	Very high	1 Å²	1	38 Å²	38	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-57.3	-43.4	175.4	-170.2	64.3	0	0	0	110.2	A133 F140 E190 E217 I218 V219	A133-L215 HydrophobicContact CB-CD1 3.58Å; F140-L215 HydrophobicContact CB-CD1 4.37Å; F140-L215 HydrophobicContact CD1-CD1 4.48Å; E190-L215 VanDerWaalsContact CD-N 3.31Å; E190-L215 WeakPolarHBondContact OE1-CB 3.3Å; E190-L215 PolarHBondContact OE1-N 2.94Å; E190-L215 WeakPolarHBondContact OE2-CB 3.1Å; E190-L215 PolarHBondContact OE2-N 2.99Å; L215-E217 PolarHBondContact O-N 3.29Å; L215-I218 HydrophobicContact CD1-CD1 4.17Å; L215-I218 HydrophobicContact CD1-CG1 4.21Å; L215-I218 VanDerWaalsContact O-CG1 3.26Å; L215-I218 WeakPolarHBondContact O-CG1 3.16Å; L215-I218 PolarHBondContact O-N 2.88Å; L215-V219 HydrophobicContact CD1-CG2 4.46Å; L215-V219 HydrophobicContact CG-CG2 3.99Å; L215-V219 WeakPolarHBondContact O-CG2 3.5Å; L215-V219 PolarHBondContact O-N 2.46Å
216	R	92.5	Very high	95.2	Very high	70 Å²	70	41.6 Å²	41.6	26%	0.264	21%	0.21	S	C	.	.	H	α-helix	trans	-55.6	-20.4	175.5	69.2	-178.4	176.7	-123.5	-5.5	115.7	Y136 E190 Y214 T302	Y136-R216 HydrophobicContact CE1-CB 3.9Å; E190-R216 PolarHBondContact O-NH1 3.18Å; E190-R216 PolarHBondContact OE1-N 3.35Å; Y214-R216 VanDerWaalsContact C-N 3.25Å; Y214-R216 PolarHBondContact O-N 2.88Å; R216-T302 HydrophobicContact CB-CG2 3.98Å
217	E	93.9	Very high	95.2	Very high	95 Å²	95	42.9 Å²	42.9	44%	0.444	22%	0.217	S	C	.	.	H	α-helix	trans	-85.1	-20.2	178.4	-64.8	171.6	159.9	0	0	112.4	F213 Y214 L215 P305	F213-E217 WeakPolarHBondContact CA-OE2 3.16Å; Y214-E217 HydrophobicContact CD2-CG 4.49Å; Y214-E217 WeakPolarHBondContact CD2-OE1 3.32Å; Y214-E217 PolarHBondContact N-OE2 2.87Å; Y214-E217 WeakPolarHBondContact O-CB 3.43Å; Y214-E217 PolarHBondContact O-N 2.88Å; L215-E217 PolarHBondContact O-N 3.29Å; E217-P305 VanDerWaalsContact O-CD 3.29Å; E217-P305 WeakPolarHBondContact O-CD 3.4Å
218	I	94.9	Very high	95.1	Very high	12 Å²	12	47 Å²	47	6%	0.062	24%	0.236	C	C	.	.	H	α-helix	trans	-115.1	-6.5	-174.7	67.2	157.7	0	0	0	113.4	C131 S132 A133 F140 F213 L215 R220	C131-I218 HydrophobicContact CB-CD1 3.91Å; C131-I218 HydrophobicContact CB-CG2 4.38Å; S132-I218 WeakPolarHBondContact CA-O 3.07Å; A133-I218 HydrophobicContact CB-CD1 4.13Å; A133-I218 HydrophobicContact CB-CG1 4.18Å; A133-I218 PolarHBondContact N-O 3.38Å; F140-I218 HydrophobicContact CB-CD1 3.77Å; F140-I218 HydrophobicContact CG-CD1 4.28Å; F213-I218 HydrophobicContact CB-CG2 4.25Å; F213-I218 HydrophobicContact CD2-CD1 3.76Å; F213-I218 HydrophobicContact CD2-CG1 4.04Å; F213-I218 HydrophobicContact CD2-CG2 3.92Å; F213-I218 HydrophobicContact CE2-CD1 3.41Å; F213-I218 VanDerWaalsContact CE2-CD1 3.41Å; F213-I218 HydrophobicContact CE2-CG1 4.19Å; F213-I218 HydrophobicContact CG-CG2 4.15Å; F213-I218 HydrophobicContact CZ-CD1 4.22Å; L215-I218 HydrophobicContact CD1-CD1 4.17Å; L215-I218 HydrophobicContact CD1-CG1 4.21Å; L215-I218 VanDerWaalsContact O-CG1 3.26Å; L215-I218 WeakPolarHBondContact O-CG1 3.16Å; L215-I218 PolarHBondContact O-N 2.88Å; I218-R220 PolarHBondContact O-N 3.43Å
219	V	95.2	Very high	95	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-66.1	119.7	176.2	169.3	0	0	0	0	110.3	A133 N135 Y136 L215 W243 P305	A133-V219 HydrophobicContact CB-CG2 3.88Å; A133-V219 CarbonylContact O-C 3.57Å; A133-V219 WeakPolarHBondContact O-CA 3.02Å; N135-V219 WeakPolarHBondContact O-CG2 3.4Å; Y136-V219 HydrophobicContact CD1-CG2 3.92Å; Y136-V219 HydrophobicContact CD2-CG1 4.36Å; Y136-V219 HydrophobicContact CE1-CB 4.27Å; Y136-V219 HydrophobicContact CE1-CG2 3.85Å; Y136-V219 HydrophobicContact CE2-CG1 3.92Å; Y136-V219 HydrophobicContact CE2-CG2 4.5Å; Y136-V219 HydrophobicContact CG-CG2 4.28Å; L215-V219 HydrophobicContact CD1-CG2 4.46Å; L215-V219 HydrophobicContact CG-CG2 3.99Å; L215-V219 WeakPolarHBondContact O-CG2 3.5Å; L215-V219 PolarHBondContact O-N 2.46Å; V219-W243 HydrophobicContact CG1-CH2 3.49Å; V219-W243 VanDerWaalsContact CG1-CH2 3.49Å; V219-W243 HydrophobicContact CG1-CZ3 3.39Å; V219-P305 VanDerWaalsContact O-CD 3.23Å; V219-P305 WeakPolarHBondContact O-CD 3.47Å; V219-P305 WeakPolarHBondContact O-CG 3.49Å
220	R	95.8	Very high	94.7	Very high	104 Å²	104	48.9 Å²	48.9	39%	0.392	25%	0.247	S	C	.	.			trans	-126.5	112.9	-178.1	-167.5	179.9	-177.4	-172.1	-3.9	108.8	A133 I218 P305 W306	A133-R220 PolarHBondContact O-N 3.45Å; I218-R220 PolarHBondContact O-N 3.43Å; R220-P305 HydrophobicContact CB-CB 4.32Å; R220-P305 HydrophobicContact CB-CG 3.61Å; R220-P305 HydrophobicContact CG-CB 4.12Å; R220-P305 HydrophobicContact CG-CG 3.96Å; R220-W306 PolarHBondContact NE-O 3.38Å; R220-W306 PolarHBondContact NH2-O 3.22Å
221	P	96.3	Very high	93.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	25%	0.249	C	C	.	.			trans	-58.9	150.9	173.8	-16.7	26.7	0	0	0	111.2	P240 W243 L252 A297 S307	P221-P240 HydrophobicContact CB-CG 4.49Å; P221-W243 HydrophobicContact CB-CE3 3.86Å; P221-W243 HydrophobicContact CB-CZ3 3.96Å; P221-W243 HydrophobicContact CG-CE3 3.92Å; P221-W243 HydrophobicContact CG-CH2 3.97Å; P221-W243 HydrophobicContact CG-CZ3 3.54Å; P221-L252 HydrophobicContact CB-CD1 4.39Å; P221-L252 HydrophobicContact CB-CD2 4.31Å; P221-L252 HydrophobicContact CG-CD2 3.59Å; P221-A297 HydrophobicContact CB-CB 4.29Å; P221-A297 HydrophobicContact CG-CB 4.34Å; P221-S307 WeakPolarHBondContact O-CA 3.36Å; P221-S307 WeakPolarHBondContact O-CB 3.39Å
222	E	95.1	Very high	92.9	Very high	74 Å²	74	47.1 Å²	47.1	35%	0.346	25%	0.248	S	C	.	.			trans	-72.5	178.8	170.6	-68.3	-168.2	141.3	0	0	112.3	Q134 P240 T242 S307	Q134-E222 HydrophobicContact CG-CG 4.18Å; Q134-E222 PolarHBondContact NE2-OE1 2.79Å; E222-P240 HydrophobicContact CB-CB 4.05Å; E222-P240 HydrophobicContact CB-CG 4.39Å; E222-P240 WeakPolarHBondContact O-CG 3Å; E222-T242 VanDerWaalsContact CD-OG1 3.25Å; E222-T242 WeakPolarHBondContact CG-OG1 3.14Å; E222-T242 WeakPolarHBondContact OE2-CB 3.34Å; E222-T242 WeakPolarHBondContact OE2-CG2 3.45Å; E222-T242 PolarHBondContact OE2-OG1 3.09Å; E222-S307 WeakPolarHBondContact O-CB 3.37Å
223	N	94.6	Very high	92.3	Very high	84 Å²	84	48.5 Å²	48.5	45%	0.449	25%	0.248	S	C	.	.			trans	-61.3	150.8	174	-68.6	-29.5	0	0	0	111.4	P225 P308	N223-P225 VanDerWaalsContact O-CD 3.31Å; N223-P225 WeakPolarHBondContact O-CD 3.42Å; N223-P308 WeakPolarHBondContact OD1-CB 3.24Å; N223-P308 WeakPolarHBondContact OD1-CD 3.5Å; N223-P308 VanDerWaalsContact OD1-CG 3.25Å; N223-P308 WeakPolarHBondContact OD1-CG 3.44Å; N223-P308 PolarHBondContact OD1-O 3.12Å
224	L	96.8	Very high	92.3	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.042	26%	0.259	C	S	.	.			trans	-83.6	115.9	-174.9	-63	168.6	0	0	0	110.1	W237 D238 P240 F254 V295 A297 S310	L224-W237 HydrophobicContact CB-CB 4.3Å; L224-W237 HydrophobicContact CB-CG 4.43Å; L224-W237 HydrophobicContact CD1-CG 4.29Å; L224-D238 WeakPolarHBondContact CD2-O 3.49Å; L224-P240 HydrophobicContact CD2-CG 4.18Å; L224-F254 HydrophobicContact CD1-CD1 3.78Å; L224-F254 HydrophobicContact CD1-CE1 4.07Å; L224-F254 HydrophobicContact CD2-CD1 4.25Å; L224-F254 HydrophobicContact CD2-CE1 3.7Å; L224-V295 HydrophobicContact CD1-CB 4.28Å; L224-V295 HydrophobicContact CD1-CG1 3.88Å; L224-V295 HydrophobicContact CD1-CG2 3.63Å; L224-A297 HydrophobicContact CD1-CB 4.36Å; L224-A297 HydrophobicContact CD2-CB 3.94Å; L224-A297 HydrophobicContact CG-CB 4.44Å; L224-S310 PolarHBondContact N-OG 3.49Å
225	P	96.5	Very high	92.3	Very high	40 Å²	40	48.1 Å²	48.1	26%	0.26	25%	0.25	S	S	.	.	S	Bend	trans	-73.7	167.1	179.5	28.3	-31.6	0	0	0	111.9	N223 L227 D238	N223-P225 VanDerWaalsContact O-CD 3.31Å; N223-P225 WeakPolarHBondContact O-CD 3.42Å; P225-L227 PolarHBondContact O-N 3.11Å; P225-L227 VanDerWaalsContact O-N 3.14Å; P225-D238 WeakPolarHBondContact CD-O 3.2Å; P225-D238 HydrophobicContact CG-CB 4.02Å; P225-D238 PolarHBondContact O-N 2.97Å
226	N	95.9	Very high	92.5	Very high	107 Å²	107	49.3 Å²	49.3	57%	0.572	26%	0.259	S	S	*	.	S	Bend	trans	54.6	33.3	172.6	-58.1	-33.5	0	0	0	114.7	H228 D238	N226-H228 PolarHBondContact O-N 2.83Å; N226-H228 PolarHBondContact O-ND1 2.78Å; N226-D238 HydrophobicContact CB-CB 4.49Å; N226-D238 WeakPolarHBondContact CB-OD2 3.37Å; N226-D238 PolarHBondContact ND2-OD2 3.34Å
227	L	96.6	Very high	92.8	Very high	29 Å²	29	46.1 Å²	46.1	15%	0.152	25%	0.247	C	C	.	.			trans	-66.7	114	173.8	178.9	60.8	0	0	0	110.5	P225 F235 S236 W237 F293 V295	P225-L227 PolarHBondContact O-N 3.11Å; P225-L227 VanDerWaalsContact O-N 3.14Å; L227-F235 HydrophobicContact CD1-CD1 4.33Å; L227-S236 WeakPolarHBondContact CA-O 3.46Å; L227-W237 HydrophobicContact CB-CB 4.49Å; L227-W237 HydrophobicContact CD1-CB 4.2Å; L227-W237 HydrophobicContact CD1-CE3 4.03Å; L227-F293 HydrophobicContact CD1-CD1 4.03Å; L227-F293 HydrophobicContact CD1-CE1 3.88Å; L227-F293 HydrophobicContact CD2-CD1 4.34Å; L227-V295 HydrophobicContact CD1-CG1 4.09Å; L227-V295 HydrophobicContact CD2-CG1 4.06Å
228	H	94.2	Very high	92.9	Very high	86 Å²	86	44.9 Å²	44.9	40%	0.398	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	170.9	-179.6	66.1	-79.3	0	0	0	111.4	N226 F235 S236	N226-H228 PolarHBondContact O-N 2.83Å; N226-H228 PolarHBondContact O-ND1 2.78Å; H228-F235 CarbonylContact O-C 3.55Å; H228-F235 VanDerWaalsContact O-CA 3.31Å; H228-F235 WeakPolarHBondContact O-CA 3.41Å; H228-S236 PolarHBondContact N-O 2.68Å; H228-S236 PolarHBondContact ND1-O 2.86Å; H228-S236 PolarHBondContact O-N 3.09Å
229	I	92.6	Very high	93	Very high	21 Å²	21	45.2 Å²	45.2	11%	0.108	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.8	179	-169.7	178.6	0	0	0	110.7	G232 V234 F235 Y312 V314 I318	I229-G232 WeakPolarHBondContact CD1-O 3.37Å; I229-V234 CarbonylContact C-O 3.55Å; I229-V234 WeakPolarHBondContact CA-O 3.22Å; I229-F235 HydrophobicContact CB-CD1 4.1Å; I229-F235 HydrophobicContact CB-CE1 3.94Å; I229-F235 HydrophobicContact CB-CZ 4.3Å; I229-F235 HydrophobicContact CD1-CD2 4.41Å; I229-F235 HydrophobicContact CD1-CE1 4Å; I229-F235 HydrophobicContact CD1-CE2 3.69Å; I229-F235 HydrophobicContact CD1-CZ 3.47Å; I229-F235 VanDerWaalsContact CD1-CZ 3.47Å; I229-F235 HydrophobicContact CG1-CD1 4.39Å; I229-F235 HydrophobicContact CG1-CD2 4.35Å; I229-F235 HydrophobicContact CG1-CE1 4.16Å; I229-F235 HydrophobicContact CG1-CE2 4.11Å; I229-F235 HydrophobicContact CG1-CG 4.49Å; I229-F235 HydrophobicContact CG1-CZ 4.03Å; I229-Y312 HydrophobicContact CB-CE1 4.48Å; I229-Y312 HydrophobicContact CG2-CE1 3.74Å; I229-V314 HydrophobicContact CD1-CG2 4.21Å; I229-I318 HydrophobicContact CD1-CD1 4.46Å; I229-I318 HydrophobicContact CG2-CD1 3.4Å; I229-I318 VanDerWaalsContact CG2-CD1 3.4Å; I229-I318 HydrophobicContact CG2-CG2 4.48Å
230	S	88.6	Confident	93.1	Very high	53 Å²	53	45.4 Å²	45.4	37%	0.371	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	140.6	175.6	-67.1	0	0	0	0	109.9	G232 Q233 V234	S230-G232 PolarHBondContact O-N 2.95Å; S230-Q233 PolarHBondContact O-N 3.17Å; S230-V234 PolarHBondContact N-O 3.47Å; S230-V234 PolarHBondContact O-N 3.29Å
231	C	77.1	Confident	93.1	Very high	76 Å²	76	46.6 Å²	46.6	51%	0.514	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	29.2	-177.5	-65.8	0	0	0	0	115.9	Q233 C321	C231-Q233 PolarHBondContact O-N 3.05Å; C231-C321 WeakPolarHBondContact CA-SG 3.38Å; C231-C321 HydrophobicContact CB-CB 3.97Å; C231-C321 WeakPolarHBondContact CB-SG 3.27Å; C231-C321 WeakPolarHBondContact SG-CB 3.42Å; C231-C321 CovalentContact SG-SG 2.04Å; C231-C321 PolarHBondContact SG-SG 3.32Å
232	G	75.4	Confident	92.9	Very high	20 Å²	20	48.5 Å²	48.5	21%	0.206	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	3.5	176.5	0	0	0	0	0	115.5	I229 S230	I229-G232 WeakPolarHBondContact CD1-O 3.37Å; S230-G232 PolarHBondContact O-N 2.95Å
233	Q	84.1	Confident	92.9	Very high	87 Å²	87	45.2 Å²	45.2	41%	0.407	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.4	-25.4	-174.4	-67.3	-177.1	-38.2	0	0	114.2	S230 C231 E283 V284	S230-Q233 PolarHBondContact O-N 3.17Å; C231-Q233 PolarHBondContact O-N 3.05Å; Q233-E283 HydrophobicContact CB-CG 4.41Å; Q233-E283 WeakPolarHBondContact O-CA 3.25Å; Q233-V284 PolarHBondContact O-N 2.77Å
234	V	93.6	Very high	92.9	Very high	42 Å²	42	41.8 Å²	41.8	26%	0.255	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	111.5	-177.2	-176.6	0	0	0	0	109.8	I229 S230 K281 E283	I229-V234 CarbonylContact C-O 3.55Å; I229-V234 WeakPolarHBondContact CA-O 3.22Å; S230-V234 PolarHBondContact N-O 3.47Å; S230-V234 PolarHBondContact O-N 3.29Å; V234-K281 HydrophobicContact CG1-CB 4.49Å; V234-E283 HydrophobicContact CG2-CB 4.38Å; V234-E283 HydrophobicContact CG2-CG 4.17Å
235	F	95.9	Very high	92.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	144.9	172.6	-69.8	-94.7	0	0	0	110.2	L227 H228 I229 W237 K281 F282 V284 Y291 F293 Y312 V314	L227-F235 HydrophobicContact CD1-CD1 4.33Å; H228-F235 CarbonylContact O-C 3.55Å; H228-F235 VanDerWaalsContact O-CA 3.31Å; H228-F235 WeakPolarHBondContact O-CA 3.41Å; I229-F235 HydrophobicContact CB-CD1 4.1Å; I229-F235 HydrophobicContact CB-CE1 3.94Å; I229-F235 HydrophobicContact CB-CZ 4.3Å; I229-F235 HydrophobicContact CD1-CD2 4.41Å; I229-F235 HydrophobicContact CD1-CE1 4Å; I229-F235 HydrophobicContact CD1-CE2 3.69Å; I229-F235 HydrophobicContact CD1-CZ 3.47Å; I229-F235 VanDerWaalsContact CD1-CZ 3.47Å; I229-F235 HydrophobicContact CG1-CD1 4.39Å; I229-F235 HydrophobicContact CG1-CD2 4.35Å; I229-F235 HydrophobicContact CG1-CE1 4.16Å; I229-F235 HydrophobicContact CG1-CE2 4.11Å; I229-F235 HydrophobicContact CG1-CG 4.49Å; I229-F235 HydrophobicContact CG1-CZ 4.03Å; F235-W237 HydrophobicContact CB-CZ3 4.22Å; F235-K281 CarbonylContact O-C 3.38Å; F235-K281 WeakPolarHBondContact O-CA 3.34Å; F235-K281 WeakPolarHBondContact O-CB 3.44Å; F235-F282 PolarHBondContact N-O 2.78Å; F235-F282 PolarHBondContact O-N 2.93Å; F235-V284 HydrophobicContact CD2-CB 4.28Å; F235-V284 HydrophobicContact CD2-CG2 3.59Å; F235-V284 HydrophobicContact CE2-CB 4Å; F235-V284 HydrophobicContact CE2-CG2 3.61Å; F235-Y291 HydrophobicContact CE2-CE2 4.01Å; F235-Y291 AromaticContact CZ-CE2 3.77Å; F235-Y291 HydrophobicContact CZ-CE2 3.77Å; F235-F293 HydrophobicContact CB-CD1 4.12Å; F235-F293 HydrophobicContact CB-CE1 3.74Å; F235-F293 HydrophobicContact CB-CE2 4.19Å; F235-F293 HydrophobicContact CB-CG 4.49Å; F235-F293 HydrophobicContact CB-CZ 3.78Å; F235-F293 HydrophobicContact CD1-CB 3.92Å; F235-F293 AromaticContact CD1-CD1 3.47Å; F235-F293 HydrophobicContact CD1-CD1 3.47Å; F235-F293 VanDerWaalsContact CD1-CD1 3.47Å; F235-F293 HydrophobicContact CD1-CD2 4.24Å; F235-F293 HydrophobicContact CD1-CE1 4Å; F235-F293 AromaticContact CD1-CG 3.61Å; F235-F293 HydrophobicContact CD1-CG 3.61Å; F235-F293 HydrophobicContact CD2-CD1 4.42Å; F235-F293 AromaticContact CD2-CD2 3.78Å; F235-F293 HydrophobicContact CD2-CD2 3.78Å; F235-F293 HydrophobicContact CD2-CE2 4.04Å; F235-F293 AromaticContact CD2-CG 3.98Å; F235-F293 HydrophobicContact CD2-CG 3.98Å; F235-F293 HydrophobicContact CD2-CZ 4.46Å; F235-F293 HydrophobicContact CE1-CB 3.45Å; F235-F293 VanDerWaalsContact CE1-CB 3.45Å; F235-F293 AromaticContact CE1-CD1 3.95Å; F235-F293 HydrophobicContact CE1-CD1 3.95Å; F235-F293 HydrophobicContact CE1-CD2 4.41Å; F235-F293 AromaticContact CE1-CG 3.69Å; F235-F293 HydrophobicContact CE1-CG 3.69Å; F235-F293 HydrophobicContact CE2-CB 4.11Å; F235-F293 AromaticContact CE2-CD2 3.98Å; F235-F293 HydrophobicContact CE2-CD2 3.98Å; F235-F293 HydrophobicContact CE2-CG 4.07Å; F235-F293 HydrophobicContact CG-CB 4.41Å; F235-F293 AromaticContact CG-CD1 3.73Å; F235-F293 HydrophobicContact CG-CD1 3.73Å; F235-F293 AromaticContact CG-CD2 3.9Å; F235-F293 HydrophobicContact CG-CD2 3.9Å; F235-F293 AromaticContact CG-CE1 3.87Å; F235-F293 HydrophobicContact CG-CE1 3.87Å; F235-F293 HydrophobicContact CG-CE2 4.05Å; F235-F293 AromaticContact CG-CG 3.74Å; F235-F293 HydrophobicContact CG-CG 3.74Å; F235-F293 HydrophobicContact CG-CZ 4.03Å; F235-F293 HydrophobicContact CZ-CB 3.54Å; F235-F293 HydrophobicContact CZ-CD2 4.27Å; F235-F293 AromaticContact CZ-CG 3.9Å; F235-F293 HydrophobicContact CZ-CG 3.9Å; F235-Y312 AromaticContact CE1-CD1 3.8Å; F235-Y312 HydrophobicContact CE1-CD1 3.8Å; F235-Y312 HydrophobicContact CE1-CG 4.09Å; F235-V314 HydrophobicContact CE1-CG2 4.28Å; F235-V314 HydrophobicContact CZ-CG2 3.69Å
236	S	97.4	Very high	92.6	Very high	26 Å²	26	48.1 Å²	48.1	18%	0.182	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	146.6	175.1	-61.6	0	0	0	0	110.1	L227 H228 T280	L227-S236 WeakPolarHBondContact CA-O 3.46Å; H228-S236 PolarHBondContact N-O 2.68Å; H228-S236 PolarHBondContact ND1-O 2.86Å; H228-S236 PolarHBondContact O-N 3.09Å; S236-T280 VanDerWaalsContact CA-O 3.31Å; S236-T280 WeakPolarHBondContact CA-O 3.46Å
237	W	97.8	Very high	92.4	Very high	3 Å²	3	47.9 Å²	47.9	1%	0.011	26%	0.256	C	S	.	.			trans	-146.9	170.2	-178.3	56.4	88.1	0	0	0	110.1	L224 L227 F235 F254 V256 T277 E279 T280 F282 F293 V295	L224-W237 HydrophobicContact CB-CB 4.3Å; L224-W237 HydrophobicContact CB-CG 4.43Å; L224-W237 HydrophobicContact CD1-CG 4.29Å; L227-W237 HydrophobicContact CB-CB 4.49Å; L227-W237 HydrophobicContact CD1-CB 4.2Å; L227-W237 HydrophobicContact CD1-CE3 4.03Å; F235-W237 HydrophobicContact CB-CZ3 4.22Å; W237-F254 AromaticContact CD1-CE1 3.99Å; W237-F254 AromaticContact CE2-CG 3.95Å; W237-F254 HydrophobicContact CZ2-CB 3.82Å; W237-F254 HydrophobicContact CZ2-CD1 4.35Å; W237-F254 AromaticContact CZ2-CD2 3.99Å; W237-F254 HydrophobicContact CZ2-CD2 3.99Å; W237-F254 AromaticContact CZ2-CG 3.78Å; W237-F254 HydrophobicContact CZ2-CG 3.78Å; W237-F254 AromaticContact NE1-CD1 3.32Å; W237-F254 VanDerWaalsContact NE1-CD1 3.32Å; W237-F254 AromaticContact NE1-CD2 3.78Å; W237-F254 AromaticContact NE1-CE1 3.35Å; W237-F254 AromaticContact NE1-CE2 3.82Å; W237-F254 AromaticContact NE1-CG 3.54Å; W237-F254 AromaticContact NE1-CZ 3.61Å; W237-V256 HydrophobicContact CH2-CG1 3.74Å; W237-V256 HydrophobicContact CZ2-CG1 4.39Å; W237-V256 HydrophobicContact CZ3-CG1 4.4Å; W237-T277 HydrophobicContact CH2-CG2 4.35Å; W237-T277 HydrophobicContact CZ2-CG2 4.26Å; W237-E279 WeakPolarHBondContact CZ2-O 3.48Å; W237-T280 PolarHBondContact N-O 2.73Å; W237-T280 VanDerWaalsContact O-CB 3.28Å; W237-T280 WeakPolarHBondContact O-CB 3.45Å; W237-F282 HydrophobicContact CH2-CB 3.79Å; W237-F282 HydrophobicContact CZ3-CB 4Å; W237-F293 HydrophobicContact CE3-CE1 4.27Å; W237-F293 HydrophobicContact CE3-CZ 4.5Å; W237-F293 HydrophobicContact CH2-CZ 4.36Å; W237-F293 AromaticContact CZ3-CE1 3.96Å; W237-F293 HydrophobicContact CZ3-CE1 3.96Å; W237-F293 AromaticContact CZ3-CZ 3.74Å; W237-F293 HydrophobicContact CZ3-CZ 3.74Å; W237-V295 HydrophobicContact CD2-CG1 4.36Å; W237-V295 HydrophobicContact CD2-CG2 4.14Å; W237-V295 HydrophobicContact CE3-CG1 4.33Å; W237-V295 HydrophobicContact CE3-CG2 4.36Å; W237-V295 HydrophobicContact CH2-CG2 4.02Å; W237-V295 HydrophobicContact CZ2-CG2 3.78Å; W237-V295 HydrophobicContact CZ3-CG2 4.31Å
238	D	97.6	Very high	92.1	Very high	68 Å²	68	52.5 Å²	52.5	36%	0.364	29%	0.286	S	S	.	.			trans	-109.1	162.5	174.9	-75.2	-38.1	0	0	0	111.8	L224 P225 N226	L224-D238 WeakPolarHBondContact CD2-O 3.49Å; P225-D238 WeakPolarHBondContact CD-O 3.2Å; P225-D238 HydrophobicContact CG-CB 4.02Å; P225-D238 PolarHBondContact O-N 2.97Å; N226-D238 HydrophobicContact CB-CB 4.49Å; N226-D238 WeakPolarHBondContact CB-OD2 3.37Å; N226-D238 PolarHBondContact ND2-OD2 3.34Å
239	Y	97	Very high	92.1	Very high	20 Å²	20	54.1 Å²	54.1	8%	0.078	29%	0.289	C	S	.	.			trans	-67.6	148.3	164.5	-83.8	-127.5	0	0	0	109.2	W243 R247 L252 F254 T280	Y239-W243 AromaticContact CD1-CD1 3.79Å; Y239-W243 HydrophobicContact CD1-CG 4.47Å; Y239-R247 HydrophobicContact CD1-CB 4.42Å; Y239-R247 HydrophobicContact CD1-CG 3.83Å; Y239-R247 HydrophobicContact CE1-CB 4.12Å; Y239-R247 HydrophobicContact CE1-CG 4.04Å; Y239-R247 HydrophobicContact CG-CG 4.33Å; Y239-L252 HydrophobicContact CD1-CB 4.42Å; Y239-L252 HydrophobicContact CD1-CD1 3.54Å; Y239-L252 HydrophobicContact CD1-CG 3.96Å; Y239-L252 HydrophobicContact CE1-CB 3.67Å; Y239-L252 HydrophobicContact CE1-CD1 3.66Å; Y239-L252 HydrophobicContact CE1-CG 3.55Å; Y239-L252 HydrophobicContact CG-CD1 4.18Å; Y239-L252 PolarHBondContact OH-N 3.2Å; Y239-L252 PolarHBondContact OH-O 3.23Å; Y239-F254 AromaticContact CD2-CZ 3.92Å; Y239-F254 HydrophobicContact CD2-CZ 3.92Å; Y239-F254 AromaticContact CE2-CE2 3.98Å; Y239-F254 HydrophobicContact CE2-CE2 3.98Å; Y239-F254 AromaticContact CE2-CZ 3.48Å; Y239-F254 HydrophobicContact CE2-CZ 3.48Å; Y239-F254 VanDerWaalsContact CE2-CZ 3.48Å; Y239-F254 AromaticContact CZ-CZ 3.94Å; Y239-T280 HydrophobicContact CD2-CG2 3.75Å; Y239-T280 HydrophobicContact CE2-CG2 3.6Å
240	P	96.3	Very high	92.2	Very high	4 Å²	4	53.5 Å²	53.5	3%	0.026	29%	0.286	C	S	.	.			trans	-61.1	142	173.6	-18	31.8	0	0	0	111.3	P221 E222 L224 T242 W243	P221-P240 HydrophobicContact CB-CG 4.49Å; E222-P240 HydrophobicContact CB-CB 4.05Å; E222-P240 HydrophobicContact CB-CG 4.39Å; E222-P240 WeakPolarHBondContact O-CG 3Å; L224-P240 HydrophobicContact CD2-CG 4.18Å; P240-T242 PolarHBondContact O-N 3.08Å; P240-W243 HydrophobicContact CB-CB 4.43Å; P240-W243 VanDerWaalsContact O-CB 3.32Å; P240-W243 WeakPolarHBondContact O-CB 3.32Å; P240-W243 PolarHBondContact O-N 3.26Å; P240-W243 VanDerWaalsContact O-N 3.1Å
241	D	94.9	Very high	92.5	Very high	130 Å²	130	51.9 Å²	51.9	70%	0.695	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-27.2	179.2	-73.1	-37.4	0	0	0	112.9	W243	D241-W243 VanDerWaalsContact C-N 3.27Å; D241-W243 PolarHBondContact O-N 3.29Å
242	T	93.6	Very high	93.5	Very high	40 Å²	40	48.3 Å²	48.3	25%	0.245	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-14.6	176	48.8	0	0	0	0	113.6	N135 E222 P240	N135-T242 WeakPolarHBondContact CB-O 3.35Å; N135-T242 PolarHBondContact ND2-O 3.03Å; E222-T242 VanDerWaalsContact CD-OG1 3.25Å; E222-T242 WeakPolarHBondContact CG-OG1 3.14Å; E222-T242 WeakPolarHBondContact OE2-CB 3.34Å; E222-T242 WeakPolarHBondContact OE2-CG2 3.45Å; E222-T242 PolarHBondContact OE2-OG1 3.09Å; P240-T242 PolarHBondContact O-N 3.08Å
243	W	95.3	Very high	94.5	Very high	5 Å²	5	48.9 Å²	48.9	2%	0.019	25%	0.248	C	C	.	.	S	Bend	trans	-73.5	149.9	-178.8	-168.1	-105.5	0	0	0	112.5	Y136 V219 P221 Y239 P240 D241 F250 L252 D299	Y136-W243 AromaticContact CE2-CH2 3.88Å; Y136-W243 HydrophobicContact CE2-CH2 3.88Å; Y136-W243 HydrophobicContact CE2-CZ2 4.06Å; V219-W243 HydrophobicContact CG1-CH2 3.49Å; V219-W243 VanDerWaalsContact CG1-CH2 3.49Å; V219-W243 HydrophobicContact CG1-CZ3 3.39Å; P221-W243 HydrophobicContact CB-CE3 3.86Å; P221-W243 HydrophobicContact CB-CZ3 3.96Å; P221-W243 HydrophobicContact CG-CE3 3.92Å; P221-W243 HydrophobicContact CG-CH2 3.97Å; P221-W243 HydrophobicContact CG-CZ3 3.54Å; Y239-W243 AromaticContact CD1-CD1 3.79Å; Y239-W243 HydrophobicContact CD1-CG 4.47Å; P240-W243 HydrophobicContact CB-CB 4.43Å; P240-W243 VanDerWaalsContact O-CB 3.32Å; P240-W243 WeakPolarHBondContact O-CB 3.32Å; P240-W243 PolarHBondContact O-N 3.26Å; P240-W243 VanDerWaalsContact O-N 3.1Å; D241-W243 VanDerWaalsContact C-N 3.27Å; D241-W243 PolarHBondContact O-N 3.29Å; W243-F250 PolarHBondContact NE1-O 3.21Å; W243-L252 HydrophobicContact CD2-CD1 4.12Å; W243-L252 HydrophobicContact CD2-CD2 3.93Å; W243-L252 HydrophobicContact CD2-CG 4.22Å; W243-L252 HydrophobicContact CE3-CD2 4.34Å; W243-L252 HydrophobicContact CG-CD1 4.06Å; W243-L252 HydrophobicContact CG-CG 4.43Å; W243-L252 HydrophobicContact CH2-CD2 3.81Å; W243-L252 HydrophobicContact CZ2-CD2 3.33Å; W243-L252 HydrophobicContact CZ2-CG 4.17Å; W243-L252 HydrophobicContact CZ3-CD2 4.29Å; W243-D299 HydrophobicContact CH2-CB 4.06Å; W243-D299 HydrophobicContact CZ2-CB 4.2Å
244	E	93.4	Very high	95.2	Very high	12 Å²	12	44.8 Å²	44.8	6%	0.056	23%	0.228	C	C	.	.			trans	-65.9	150.1	-176.8	-74.8	-42.5	120.6	0	0	113.8	N135 Y136 K137 F250	N135-E244 HydrophobicContact CB-CG 3.92Å; N135-E244 WeakPolarHBondContact CB-OE1 3.34Å; N135-E244 PolarHBondContact ND2-OE1 3.13Å; N135-E244 PolarHBondContact OD1-OE1 3.13Å; Y136-E244 HydrophobicContact CD2-CG 4.16Å; K137-E244 WeakPolarHBondContact CD-OE1 2.88Å; K137-E244 WeakPolarHBondContact CE-OE1 3.44Å; K137-E244 VanDerWaalsContact CE-OE2 3.28Å; K137-E244 WeakPolarHBondContact CE-OE2 3.45Å; K137-E244 WeakPolarHBondContact CG-OE1 3.41Å; K137-E244 IonicContact NZ-OE1 3.4Å; K137-E244 PolarHBondContact NZ-OE1 3.16Å; K137-E244 IonicContact NZ-OE2 3.5Å; E244-F250 HydrophobicContact CB-CB 3.84Å; E244-F250 HydrophobicContact CB-CD1 3.71Å; E244-F250 HydrophobicContact CB-CD2 3.36Å; E244-F250 HydrophobicContact CB-CE1 4.06Å; E244-F250 HydrophobicContact CB-CE2 3.73Å; E244-F250 HydrophobicContact CB-CG 3.34Å; E244-F250 HydrophobicContact CB-CZ 4.06Å; E244-F250 HydrophobicContact CG-CD1 4.29Å; E244-F250 HydrophobicContact CG-CD2 4.43Å; E244-F250 HydrophobicContact CG-CE1 4.26Å; E244-F250 HydrophobicContact CG-CE2 4.4Å; E244-F250 HydrophobicContact CG-CG 4.37Å; E244-F250 HydrophobicContact CG-CZ 4.33Å
245	K	92.4	Very high	95.3	Very high	124 Å²	124	44.2 Å²	44.2	54%	0.539	22%	0.223	S	C	.	.	S	Bend	trans	-120.9	146.6	178.5	-65.8	177.8	-174.7	172.9	0	109.3	Y187	Y187-K245 PolarHBondContact OH-O 2.93Å
246	P	94.3	Very high	95.4	Very high	57 Å²	57	44.2 Å²	44.2	37%	0.37	22%	0.223	S	C	.	.			cis	-80.1	149	3.2	33.4	-35.3	0	0	0	112.6	Y187 T248 Y249 F250	Y187-P246 WeakPolarHBondContact OH-CD 3.46Å; P246-T248 PolarHBondContact O-N 2.84Å; P246-Y249 PolarHBondContact O-N 3.18Å; P246-F250 PolarHBondContact O-N 2.83Å
247	R	91.9	Very high	95.3	Very high	103 Å²	103	44 Å²	44	39%	0.389	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.5	-179.6	-61.4	176.4	-176.1	170.7	-2.3	113.2	Y239 Y249 F250 S251	Y239-R247 HydrophobicContact CD1-CB 4.42Å; Y239-R247 HydrophobicContact CD1-CG 3.83Å; Y239-R247 HydrophobicContact CE1-CB 4.12Å; Y239-R247 HydrophobicContact CE1-CG 4.04Å; Y239-R247 HydrophobicContact CG-CG 4.33Å; R247-Y249 VanDerWaalsContact C-N 3.26Å; R247-F250 CarbonylContact O-C 3.58Å; R247-S251 WeakPolarHBondContact O-CA 3.4Å; R247-S251 PolarHBondContact O-N 2.92Å; R247-S251 PolarHBondContact O-OG 3.02Å
248	T	91.6	Very high	95.1	Very high	126 Å²	126	43.8 Å²	43.8	77%	0.773	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-26.2	172.3	51	0	0	0	0	112.7	P246 S251	P246-T248 PolarHBondContact O-N 2.84Å; T248-S251 PolarHBondContact O-OG 3.11Å
249	Y	92.7	Very high	95	Very high	120 Å²	120	40.6 Å²	40.6	47%	0.471	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-55.5	174.9	-168.7	-92.3	0	0	0	110.3	Y187 P246 R247 S251 F301	Y187-Y249 AromaticContact CD1-CD1 3.73Å; Y187-Y249 HydrophobicContact CD1-CD1 3.73Å; Y187-Y249 HydrophobicContact CD1-CD2 4.44Å; Y187-Y249 AromaticContact CD1-CE1 3.64Å; Y187-Y249 HydrophobicContact CD1-CE1 3.64Å; Y187-Y249 HydrophobicContact CD1-CE2 4.38Å; Y187-Y249 HydrophobicContact CD1-CG 4.13Å; Y187-Y249 AromaticContact CD1-CZ 3.99Å; Y187-Y249 AromaticContact CE1-CD1 3.96Å; Y187-Y249 HydrophobicContact CE1-CD1 3.96Å; Y187-Y249 HydrophobicContact CE1-CE1 4.35Å; Y187-Y249 HydrophobicContact CE1-CG 4.16Å; Y187-Y249 HydrophobicContact CG-CE1 4.43Å; Y187-Y249 PolarHBondContact O-OH 2.89Å; Y187-Y249 VanDerWaalsContact O-OH 3.11Å; P246-Y249 PolarHBondContact O-N 3.18Å; R247-Y249 VanDerWaalsContact C-N 3.26Å; Y249-S251 VanDerWaalsContact C-N 3.25Å; Y249-S251 PolarHBondContact O-N 2.89Å; Y249-F301 WeakPolarHBondContact O-CE2 3.33Å
250	F	94.4	Very high	94.7	Very high	7 Å²	7	44.2 Å²	44.2	3%	0.031	22%	0.218	C	C	.	.	S	Bend	trans	-86.4	66.7	176.3	-57.5	-79.5	0	0	0	110.4	Y136 P186 Y187 W243 E244 P246 R247	Y136-F250 AromaticContact CD2-CD1 3.6Å; Y136-F250 HydrophobicContact CD2-CD1 3.6Å; Y136-F250 AromaticContact CD2-CE1 3.71Å; Y136-F250 HydrophobicContact CD2-CE1 3.71Å; Y136-F250 AromaticContact CE2-CD1 3.95Å; Y136-F250 HydrophobicContact CE2-CD1 3.95Å; Y136-F250 HydrophobicContact CE2-CE1 4.37Å; Y136-F250 HydrophobicContact CG-CD1 4.43Å; Y136-F250 HydrophobicContact CG-CE1 4.1Å; P186-F250 HydrophobicContact CB-CE1 4.28Å; P186-F250 HydrophobicContact CB-CZ 3.69Å; P186-F250 WeakPolarHBondContact O-CE1 3.39Å; P186-F250 WeakPolarHBondContact O-CZ 3.47Å; Y187-F250 HydrophobicContact CD1-CE2 4.14Å; Y187-F250 HydrophobicContact CD1-CZ 4.12Å; Y187-F250 AromaticContact CE1-CE2 3.64Å; Y187-F250 HydrophobicContact CE1-CE2 3.64Å; Y187-F250 HydrophobicContact CE1-CZ 4.08Å; Y187-F250 HydrophobicContact CE2-CE2 4.38Å; Y187-F250 HydrophobicContact CG-CZ 4.41Å; Y187-F250 AromaticContact CZ-CE2 3.77Å; W243-F250 PolarHBondContact NE1-O 3.21Å; E244-F250 HydrophobicContact CB-CB 3.84Å; E244-F250 HydrophobicContact CB-CD1 3.71Å; E244-F250 HydrophobicContact CB-CD2 3.36Å; E244-F250 HydrophobicContact CB-CE1 4.06Å; E244-F250 HydrophobicContact CB-CE2 3.73Å; E244-F250 HydrophobicContact CB-CG 3.34Å; E244-F250 HydrophobicContact CB-CZ 4.06Å; E244-F250 HydrophobicContact CG-CD1 4.29Å; E244-F250 HydrophobicContact CG-CD2 4.43Å; E244-F250 HydrophobicContact CG-CE1 4.26Å; E244-F250 HydrophobicContact CG-CE2 4.4Å; E244-F250 HydrophobicContact CG-CG 4.37Å; E244-F250 HydrophobicContact CG-CZ 4.33Å; P246-F250 PolarHBondContact O-N 2.83Å; R247-F250 CarbonylContact O-C 3.58Å
251	S	95.9	Very high	94.4	Very high	19 Å²	19	47.2 Å²	47.2	13%	0.133	23%	0.234	C	C	.	.			trans	-75.9	134.1	-177.2	-62.2	0	0	0	0	111.2	R247 T248 Y249 K300	R247-S251 WeakPolarHBondContact O-CA 3.4Å; R247-S251 PolarHBondContact O-N 2.92Å; R247-S251 PolarHBondContact O-OG 3.02Å; T248-S251 PolarHBondContact O-OG 3.11Å; Y249-S251 VanDerWaalsContact C-N 3.25Å; Y249-S251 PolarHBondContact O-N 2.89Å; S251-K300 VanDerWaalsContact O-CB 3.25Å; S251-K300 WeakPolarHBondContact O-CB 3.2Å; S251-K300 PolarHBondContact O-N 2.95Å
252	L	97.3	Very high	94	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	147.7	168.9	-64.1	175.5	0	0	0	109.5	P221 Y239 W243 F254 A297 Q298	P221-L252 HydrophobicContact CB-CD1 4.39Å; P221-L252 HydrophobicContact CB-CD2 4.31Å; P221-L252 HydrophobicContact CG-CD2 3.59Å; Y239-L252 HydrophobicContact CD1-CB 4.42Å; Y239-L252 HydrophobicContact CD1-CD1 3.54Å; Y239-L252 HydrophobicContact CD1-CG 3.96Å; Y239-L252 HydrophobicContact CE1-CB 3.67Å; Y239-L252 HydrophobicContact CE1-CD1 3.66Å; Y239-L252 HydrophobicContact CE1-CG 3.55Å; Y239-L252 HydrophobicContact CG-CD1 4.18Å; Y239-L252 PolarHBondContact OH-N 3.2Å; Y239-L252 PolarHBondContact OH-O 3.23Å; W243-L252 HydrophobicContact CD2-CD1 4.12Å; W243-L252 HydrophobicContact CD2-CD2 3.93Å; W243-L252 HydrophobicContact CD2-CG 4.22Å; W243-L252 HydrophobicContact CE3-CD2 4.34Å; W243-L252 HydrophobicContact CG-CD1 4.06Å; W243-L252 HydrophobicContact CG-CG 4.43Å; W243-L252 HydrophobicContact CH2-CD2 3.81Å; W243-L252 HydrophobicContact CZ2-CD2 3.33Å; W243-L252 HydrophobicContact CZ2-CG 4.17Å; W243-L252 HydrophobicContact CZ3-CD2 4.29Å; L252-F254 HydrophobicContact CB-CE1 4.15Å; L252-F254 HydrophobicContact CB-CZ 3.97Å; L252-F254 HydrophobicContact CD1-CE1 4.45Å; L252-A297 HydrophobicContact CB-CB 4.44Å; L252-A297 HydrophobicContact CD1-CB 3.99Å; L252-Q298 WeakPolarHBondContact CA-O 3.42Å; L252-Q298 WeakPolarHBondContact CD2-O 3.38Å
253	H	97.3	Very high	93.9	Very high	33 Å²	33	45.8 Å²	45.8	15%	0.153	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	160	156.4	64.5	-170.8	0	0	0	110.3	I276 E278 A297 Q298 W306	H253-I276 HydrophobicContact CB-CG2 4.04Å; H253-E278 HydrophobicContact CB-CG 4.44Å; H253-A297 WeakPolarHBondContact O-CA 3.42Å; H253-Q298 PolarHBondContact CD2-O 3.49Å; H253-Q298 PolarHBondContact N-O 3.36Å; H253-Q298 PolarHBondContact NE2-OE1 2.79Å; H253-Q298 PolarHBondContact O-N 2.91Å; H253-W306 AromaticContact CD2-CH2 3.73Å; H253-W306 AromaticContact NE2-CH2 3.69Å
254	F	97.9	Very high	93.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.3	-171.6	-54.1	-75.6	0	0	0	109.9	L224 W237 Y239 L252 I276 T277 E279 T280 V295 R296 A297	L224-F254 HydrophobicContact CD1-CD1 3.78Å; L224-F254 HydrophobicContact CD1-CE1 4.07Å; L224-F254 HydrophobicContact CD2-CD1 4.25Å; L224-F254 HydrophobicContact CD2-CE1 3.7Å; W237-F254 AromaticContact CD1-CE1 3.99Å; W237-F254 AromaticContact CE2-CG 3.95Å; W237-F254 HydrophobicContact CZ2-CB 3.82Å; W237-F254 HydrophobicContact CZ2-CD1 4.35Å; W237-F254 AromaticContact CZ2-CD2 3.99Å; W237-F254 HydrophobicContact CZ2-CD2 3.99Å; W237-F254 AromaticContact CZ2-CG 3.78Å; W237-F254 HydrophobicContact CZ2-CG 3.78Å; W237-F254 AromaticContact NE1-CD1 3.32Å; W237-F254 VanDerWaalsContact NE1-CD1 3.32Å; W237-F254 AromaticContact NE1-CD2 3.78Å; W237-F254 AromaticContact NE1-CE1 3.35Å; W237-F254 AromaticContact NE1-CE2 3.82Å; W237-F254 AromaticContact NE1-CG 3.54Å; W237-F254 AromaticContact NE1-CZ 3.61Å; Y239-F254 AromaticContact CD2-CZ 3.92Å; Y239-F254 HydrophobicContact CD2-CZ 3.92Å; Y239-F254 AromaticContact CE2-CE2 3.98Å; Y239-F254 HydrophobicContact CE2-CE2 3.98Å; Y239-F254 AromaticContact CE2-CZ 3.48Å; Y239-F254 HydrophobicContact CE2-CZ 3.48Å; Y239-F254 VanDerWaalsContact CE2-CZ 3.48Å; Y239-F254 AromaticContact CZ-CZ 3.94Å; L252-F254 HydrophobicContact CB-CE1 4.15Å; L252-F254 HydrophobicContact CB-CZ 3.97Å; L252-F254 HydrophobicContact CD1-CE1 4.45Å; F254-I276 CarbonylContact O-C 3.54Å; F254-I276 VanDerWaalsContact O-CA 3.26Å; F254-I276 WeakPolarHBondContact O-CA 3.29Å; F254-T277 HydrophobicContact CB-CG2 4Å; F254-T277 PolarHBondContact N-O 2.79Å; F254-T277 PolarHBondContact O-N 3.44Å; F254-E279 WeakPolarHBondContact CD2-O 3.32Å; F254-T280 HydrophobicContact CE2-CG2 3.91Å; F254-T280 HydrophobicContact CZ-CG2 3.99Å; F254-V295 HydrophobicContact CB-CG2 4.11Å; F254-R296 CarbonylContact C-O 3.5Å; F254-R296 VanDerWaalsContact CA-O 3.29Å; F254-R296 WeakPolarHBondContact CA-O 3.05Å; F254-A297 HydrophobicContact CD1-CB 3.75Å; F254-A297 HydrophobicContact CE1-CB 3.77Å
255	Q	97.3	Very high	93.7	Very high	31 Å²	31	47.9 Å²	47.9	15%	0.145	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123	166.8	-174.6	176.4	62.9	0	0	109.1	P274 K275 I276 V295 R296 W306 W309	Q255-P274 HydrophobicContact CG-CB 4.04Å; Q255-K275 CarbonylContact C-O 3.6Å; Q255-K275 WeakPolarHBondContact CA-O 3.33Å; Q255-I276 HydrophobicContact CB-CD1 3.64Å; Q255-I276 HydrophobicContact CG-CD1 3.84Å; Q255-V295 WeakPolarHBondContact O-CA 3.48Å; Q255-R296 HydrophobicContact CB-CG 4.11Å; Q255-R296 PolarHBondContact N-O 3.28Å; Q255-R296 PolarHBondContact O-N 2.87Å; Q255-W306 HydrophobicContact CB-CE3 4.21Å; Q255-W306 HydrophobicContact CB-CH2 3.66Å; Q255-W306 HydrophobicContact CB-CZ2 4.27Å; Q255-W306 HydrophobicContact CB-CZ3 3.61Å; Q255-W309 HydrophobicContact CG-CH2 4.23Å
256	V	97	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	144.2	174.5	-59.2	0	0	0	0	110.1	W237 P274 K275 T277 F282 F293 C294 V295	W237-V256 HydrophobicContact CH2-CG1 3.74Å; W237-V256 HydrophobicContact CZ2-CG1 4.39Å; W237-V256 HydrophobicContact CZ3-CG1 4.4Å; V256-P274 CarbonylContact O-C 3.52Å; V256-P274 VanDerWaalsContact O-CA 3.25Å; V256-P274 WeakPolarHBondContact O-CA 3.36Å; V256-K275 HydrophobicContact CG2-CB 3.89Å; V256-K275 PolarHBondContact N-O 2.77Å; V256-K275 PolarHBondContact O-N 2.82Å; V256-T277 HydrophobicContact CG1-CG2 4.38Å; V256-F282 HydrophobicContact CB-CD1 4.49Å; V256-F282 HydrophobicContact CB-CG 4.46Å; V256-F282 HydrophobicContact CG1-CB 4.25Å; V256-F282 HydrophobicContact CG1-CG 4.25Å; V256-F282 HydrophobicContact CG2-CD1 3.94Å; V256-F282 HydrophobicContact CG2-CD2 3.77Å; V256-F282 HydrophobicContact CG2-CE1 3.94Å; V256-F282 HydrophobicContact CG2-CE2 3.77Å; V256-F282 HydrophobicContact CG2-CG 3.87Å; V256-F282 HydrophobicContact CG2-CZ 3.88Å; V256-F293 HydrophobicContact CB-CE2 4.07Å; V256-F293 HydrophobicContact CB-CZ 4.04Å; V256-F293 HydrophobicContact CG1-CE2 4.22Å; V256-F293 HydrophobicContact CG1-CZ 3.71Å; V256-C294 CarbonylContact C-O 3.53Å; V256-C294 VanDerWaalsContact CA-O 3.31Å; V256-C294 WeakPolarHBondContact CA-O 3.2Å; V256-V295 HydrophobicContact CG1-CB 4.2Å; V256-V295 HydrophobicContact CG1-CG2 3.82Å
257	K	95.3	Very high	93.5	Very high	20 Å²	20	47.6 Å²	47.6	9%	0.087	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	163.9	165.7	68.8	176.8	-176.8	173.1	0	110.5	C265 T267 I270 P274 C294 W309	K257-C265 WeakPolarHBondContact CE-O 3.25Å; K257-C265 PolarHBondContact NZ-O 2.65Å; K257-T267 PolarHBondContact NZ-O 3.04Å; K257-T267 VanDerWaalsContact NZ-O 3.07Å; K257-I270 HydrophobicContact CD-CG2 4.16Å; K257-P274 HydrophobicContact CB-CB 4.47Å; K257-P274 HydrophobicContact CB-CG 4.35Å; K257-P274 HydrophobicContact CD-CG 4.45Å; K257-C294 HydrophobicContact CG-CB 3.83Å; K257-C294 PolarHBondContact N-O 3.21Å; K257-C294 WeakPolarHBondContact O-CB 3.33Å; K257-C294 PolarHBondContact O-N 2.85Å; K257-W309 HydrophobicContact CD-CH2 3.9Å; K257-W309 HydrophobicContact CD-CZ2 4.16Å; K257-W309 HydrophobicContact CG-CH2 3.89Å; K257-W309 HydrophobicContact CG-CZ3 4.09Å
258	V	94.6	Very high	93.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.4	176.8	-177.5	0	0	0	0	109.3	L271 L272 V284 I286 Y291 V292 F293	V258-L271 HydrophobicContact CB-CB 4.42Å; V258-L271 HydrophobicContact CG1-CB 4.14Å; V258-L271 HydrophobicContact CG1-CD1 4.31Å; V258-L271 PolarHBondContact O-N 2.86Å; V258-L272 HydrophobicContact CB-CB 3.76Å; V258-L272 HydrophobicContact CG2-CB 3.95Å; V258-L272 HydrophobicContact CG2-CD2 3.96Å; V258-L272 PolarHBondContact O-N 2.98Å; V258-V284 HydrophobicContact CG2-CG1 3.96Å; V258-V284 HydrophobicContact CG2-CG2 4.17Å; V258-I286 HydrophobicContact CG1-CD1 3.75Å; V258-Y291 HydrophobicContact CG1-CD2 3.48Å; V258-Y291 VanDerWaalsContact CG1-CD2 3.48Å; V258-Y291 HydrophobicContact CG1-CE2 4.29Å; V258-Y291 HydrophobicContact CG1-CG 3.83Å; V258-V292 WeakPolarHBondContact CA-O 3.31Å; V258-F293 HydrophobicContact CG2-CD2 4.13Å
259	V	94.3	Very high	92.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	164.9	178.9	-56.1	0	0	0	0	110.6	Q263 T267 I270 Y291 V292	V259-Q263 HydrophobicContact CB-CB 4.38Å; V259-Q263 HydrophobicContact CG2-CB 4.14Å; V259-T267 HydrophobicContact CB-CG2 3.81Å; V259-T267 HydrophobicContact CG1-CG2 3.61Å; V259-T267 HydrophobicContact CG2-CG2 4.44Å; V259-I270 HydrophobicContact CG1-CG2 4.24Å; V259-Y291 WeakPolarHBondContact O-CA 3.19Å; V259-Y291 WeakPolarHBondContact O-CB 3.46Å; V259-V292 HydrophobicContact CG2-CB 3.73Å; V259-V292 HydrophobicContact CG2-CG1 4.37Å; V259-V292 HydrophobicContact CG2-CG2 4.5Å; V259-V292 PolarHBondContact N-O 3.14Å; V259-V292 PolarHBondContact O-N 2.89Å
260	Q	90.8	Very high	92.7	Very high	96 Å²	96	48.6 Å²	48.6	45%	0.449	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	151.4	177.9	-67.4	-177.2	2.6	0	0	111.8	G262 Q263 L271	Q260-G262 PolarHBondContact O-N 3.39Å; Q260-Q263 HydrophobicContact CB-CG 3.93Å; Q260-Q263 VanDerWaalsContact O-CB 3.32Å; Q260-Q263 WeakPolarHBondContact O-CB 3.27Å; Q260-Q263 PolarHBondContact O-N 2.79Å; Q260-Q263 VanDerWaalsContact O-N 3.1Å; Q260-L271 HydrophobicContact CG-CD1 4.11Å; Q260-L271 HydrophobicContact CG-CD2 3.77Å; Q260-L271 HydrophobicContact CG-CG 3.85Å
261	N	89.8	Confident	92.3	Very high	68 Å²	68	51.5 Å²	51.5	36%	0.364	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	137.6	175.8	-172.1	40.4	0	0	0	111.5	Q263 K290	N261-Q263 VanDerWaalsContact C-N 3.26Å; N261-Q263 PolarHBondContact O-N 2.52Å; N261-K290 HydrophobicContact CB-CB 4.01Å
262	G	86.8	Confident	91.8	Very high	68 Å²	68	52.1 Å²	52.1	70%	0.701	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	5	-176.5	0	0	0	0	0	114.9	Q260	Q260-G262 PolarHBondContact O-N 3.39Å
263	Q	91.6	Very high	91.3	Very high	71 Å²	71	58.1 Å²	58.1	33%	0.332	30%	0.302	S	S	.	.			trans	-97.8	148.4	170.9	-60.4	-64.9	-64.9	0	0	111.1	V259 Q260 N261 T267	V259-Q263 HydrophobicContact CB-CB 4.38Å; V259-Q263 HydrophobicContact CG2-CB 4.14Å; Q260-Q263 HydrophobicContact CB-CG 3.93Å; Q260-Q263 VanDerWaalsContact O-CB 3.32Å; Q260-Q263 WeakPolarHBondContact O-CB 3.27Å; Q260-Q263 PolarHBondContact O-N 2.79Å; Q260-Q263 VanDerWaalsContact O-N 3.1Å; N261-Q263 VanDerWaalsContact C-N 3.26Å; N261-Q263 PolarHBondContact O-N 2.52Å; Q263-T267 HydrophobicContact CB-CG2 3.89Å; Q263-T267 HydrophobicContact CG-CG2 4.49Å
264	S	92.5	Very high	91.1	Very high	61 Å²	61	59.2 Å²	59.2	43%	0.427	31%	0.312	S	S	.	.			trans	-76.5	149.9	170.8	175.9	0	0	0	0	111.2	H266 T267	S264-H266 PolarHBondContact O-N 3.33Å; S264-H266 PolarHBondContact OG-N 3.05Å; S264-H266 PolarHBondContact OG-ND1 3.49Å; S264-T267 WeakPolarHBondContact O-CB 3.48Å; S264-T267 VanDerWaalsContact O-CG2 3.26Å; S264-T267 WeakPolarHBondContact O-CG2 3.32Å; S264-T267 PolarHBondContact O-N 3.1Å
265	C	92.3	Very high	90.9	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.007	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-6.7	170.5	-64.6	0	0	0	0	114.9	K257 C294 W309 E311	K257-C265 WeakPolarHBondContact CE-O 3.25Å; K257-C265 PolarHBondContact NZ-O 2.65Å; C265-C294 WeakPolarHBondContact CA-SG 3.36Å; C265-C294 HydrophobicContact CB-CB 3.72Å; C265-C294 WeakPolarHBondContact CB-SG 3.13Å; C265-C294 WeakPolarHBondContact SG-CB 3.47Å; C265-C294 CovalentContact SG-SG 2.03Å; C265-C294 PolarHBondContact SG-SG 2.8Å; C265-W309 HydrophobicContact CB-CB 3.68Å; C265-W309 HydrophobicContact CB-CD2 3.91Å; C265-W309 HydrophobicContact CB-CE3 4.46Å; C265-W309 HydrophobicContact CB-CG 3.55Å; C265-W309 PolarHBondContact O-NE1 3.07Å; C265-E311 VanDerWaalsContact SG-CB 3.55Å; C265-E311 PolarHBondContact SG-OE2 3.03Å
266	H	91.1	Very high	90.9	Very high	148 Å²	148	67.1 Å²	67.1	69%	0.685	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.8	170.9	-60.6	93	0	0	0	113.9	S264 W309	S264-H266 PolarHBondContact O-N 3.33Å; S264-H266 PolarHBondContact OG-N 3.05Å; S264-H266 PolarHBondContact OG-ND1 3.49Å; H266-W309 AromaticContact NE2-CD1 3.69Å
267	T	90.4	Very high	90.9	Very high	27 Å²	27	68.3 Å²	68.3	17%	0.166	36%	0.357	C	S	.	.			trans	-70.6	152.1	-179.1	-161.3	0	0	0	0	112.9	K257 V259 Q263 S264 K269	K257-T267 PolarHBondContact NZ-O 3.04Å; K257-T267 VanDerWaalsContact NZ-O 3.07Å; V259-T267 HydrophobicContact CB-CG2 3.81Å; V259-T267 HydrophobicContact CG1-CG2 3.61Å; V259-T267 HydrophobicContact CG2-CG2 4.44Å; Q263-T267 HydrophobicContact CB-CG2 3.89Å; Q263-T267 HydrophobicContact CG-CG2 4.49Å; S264-T267 WeakPolarHBondContact O-CB 3.48Å; S264-T267 VanDerWaalsContact O-CG2 3.26Å; S264-T267 WeakPolarHBondContact O-CG2 3.32Å; S264-T267 PolarHBondContact O-N 3.1Å; T267-K269 HydrophobicContact CG2-CB 4.23Å; T267-K269 PolarHBondContact OG1-N 2.79Å
268	E	85.8	Confident	91	Very high	182 Å²	182	72.9 Å²	72.9	85%	0.85	38%	0.378	S	S	*	.	S	Bend	trans	-87.1	-11.7	167.9	-63.6	-178.9	176.6	0	0	112.2	I270	E268-I270 VanDerWaalsContact C-N 3.27Å; E268-I270 PolarHBondContact O-N 2.93Å
269	K	85.4	Confident	91	Very high	136 Å²	136	78 Å²	78	59%	0.591	40%	0.402	S	S	*	.			trans	-76.1	77.5	176.7	-65.5	-177.5	-178.5	177.5	0	111.2	T267	T267-K269 HydrophobicContact CG2-CB 4.23Å; T267-K269 PolarHBondContact OG1-N 2.79Å
270	I	89	Confident	91.2	Very high	52 Å²	52	80.6 Å²	80.6	27%	0.267	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	143.1	-176.6	56.3	-169.2	0	0	0	112.4	K257 V259 E268 E273	K257-I270 HydrophobicContact CD-CG2 4.16Å; V259-I270 HydrophobicContact CG1-CG2 4.24Å; E268-I270 VanDerWaalsContact C-N 3.27Å; E268-I270 PolarHBondContact O-N 2.93Å; I270-E273 VanDerWaalsContact CD1-CD 3.41Å; I270-E273 VanDerWaalsContact CD1-OE1 3.26Å; I270-E273 WeakPolarHBondContact CD1-OE1 3.38Å; I270-E273 WeakPolarHBondContact CD1-OE2 3.38Å
271	L	85.3	Confident	91.4	Very high	67 Å²	67	81.4 Å²	81.4	35%	0.351	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-25	168.7	-68.5	179.5	0	0	0	111.8	V258 Q260 I286	V258-L271 HydrophobicContact CB-CB 4.42Å; V258-L271 HydrophobicContact CG1-CB 4.14Å; V258-L271 HydrophobicContact CG1-CD1 4.31Å; V258-L271 PolarHBondContact O-N 2.86Å; Q260-L271 HydrophobicContact CG-CD1 4.11Å; Q260-L271 HydrophobicContact CG-CD2 3.77Å; Q260-L271 HydrophobicContact CG-CG 3.85Å; L271-I286 HydrophobicContact CD1-CD1 4.4Å
272	L	86.9	Confident	91.7	Very high	32 Å²	32	79.7 Å²	79.7	17%	0.168	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	128.7	174.9	-175.9	73.6	0	0	0	108	V258 F282	V258-L272 HydrophobicContact CB-CB 3.76Å; V258-L272 HydrophobicContact CG2-CB 3.95Å; V258-L272 HydrophobicContact CG2-CD2 3.96Å; V258-L272 PolarHBondContact O-N 2.98Å; L272-F282 HydrophobicContact CD2-CE1 3.87Å; L272-F282 HydrophobicContact CD2-CZ 4.21Å
273	E	86.2	Confident	92.1	Very high	128 Å²	128	81.9 Å²	81.9	60%	0.598	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.9	145.2	174.2	-68.7	-57.4	144.9	0	0	111.7	I270 K275	I270-E273 VanDerWaalsContact CD1-CD 3.41Å; I270-E273 VanDerWaalsContact CD1-OE1 3.26Å; I270-E273 WeakPolarHBondContact CD1-OE1 3.38Å; I270-E273 WeakPolarHBondContact CD1-OE2 3.38Å; E273-K275 PolarHBondContact O-N 2.92Å
274	P	92.3	Very high	92.1	Very high	56 Å²	56	78.6 Å²	78.6	36%	0.364	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	127.5	176.7	-22.7	33	0	0	0	111.6	Q255 V256 K257	Q255-P274 HydrophobicContact CG-CB 4.04Å; V256-P274 CarbonylContact O-C 3.52Å; V256-P274 VanDerWaalsContact O-CA 3.25Å; V256-P274 WeakPolarHBondContact O-CA 3.36Å; K257-P274 HydrophobicContact CB-CB 4.47Å; K257-P274 HydrophobicContact CB-CG 4.35Å; K257-P274 HydrophobicContact CD-CG 4.45Å
275	K	95.3	Very high	91.8	Very high	104 Å²	104	82 Å²	82	45%	0.452	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	146	175.8	-69	-179.4	-179.5	-174.5	0	110.4	Q255 V256 E273 F282	Q255-K275 CarbonylContact C-O 3.6Å; Q255-K275 WeakPolarHBondContact CA-O 3.33Å; V256-K275 HydrophobicContact CG2-CB 3.89Å; V256-K275 PolarHBondContact N-O 2.77Å; V256-K275 PolarHBondContact O-N 2.82Å; E273-K275 PolarHBondContact O-N 2.92Å; K275-F282 HydrophobicContact CB-CE2 4.4Å; K275-F282 HydrophobicContact CD-CE2 4.06Å; K275-F282 HydrophobicContact CD-CZ 3.75Å
276	I	96.8	Very high	91.4	Very high	92 Å²	92	83.7 Å²	83.7	47%	0.472	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.9	172.9	-53.8	-57.6	0	0	0	108.9	H253 F254 Q255 W306	H253-I276 HydrophobicContact CB-CG2 4.04Å; F254-I276 CarbonylContact O-C 3.54Å; F254-I276 VanDerWaalsContact O-CA 3.26Å; F254-I276 WeakPolarHBondContact O-CA 3.29Å; Q255-I276 HydrophobicContact CB-CD1 3.64Å; Q255-I276 HydrophobicContact CG-CD1 3.84Å; I276-W306 HydrophobicContact CD1-CH2 3.81Å; I276-W306 HydrophobicContact CD1-CZ2 4.14Å
277	T	96.9	Very high	90.9	Very high	26 Å²	26	86.9 Å²	86.9	16%	0.16	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.3	173.9	-177.7	0	0	0	0	110	W237 F254 V256 E279 F282	W237-T277 HydrophobicContact CH2-CG2 4.35Å; W237-T277 HydrophobicContact CZ2-CG2 4.26Å; F254-T277 HydrophobicContact CB-CG2 4Å; F254-T277 PolarHBondContact N-O 2.79Å; F254-T277 PolarHBondContact O-N 3.44Å; V256-T277 HydrophobicContact CG1-CG2 4.38Å; T277-E279 PolarHBondContact OG1-N 3.43Å; T277-E279 VanDerWaalsContact OG1-N 3.16Å; T277-F282 HydrophobicContact CG2-CD2 4.44Å
278	E	96.3	Very high	90.5	Very high	115 Å²	115	88 Å²	88	54%	0.537	43%	0.429	S	S	.	.	S	Bend	trans	-96.8	-13.3	172.1	-58.6	-174.9	-170.6	0	0	111.7	H253 K300	H253-E278 HydrophobicContact CB-CG 4.44Å; E278-K300 WeakPolarHBondContact OE1-CE 3.46Å; E278-K300 IonicContact OE1-NZ 3.27Å; E278-K300 PolarHBondContact OE1-NZ 2.88Å; E278-K300 IonicContact OE2-NZ 3.8Å; E278-K300 PolarHBondContact OE2-NZ 3.17Å
279	E	96.4	Very high	90.3	Very high	109 Å²	109	85.8 Å²	85.8	51%	0.509	42%	0.417	S	S	.	.	S	Bend	trans	-79.3	146.6	176.9	-61.2	-170.8	-168	0	0	110.9	W237 F254 T277 K281	W237-E279 WeakPolarHBondContact CZ2-O 3.48Å; F254-E279 WeakPolarHBondContact CD2-O 3.32Å; T277-E279 PolarHBondContact OG1-N 3.43Å; T277-E279 VanDerWaalsContact OG1-N 3.16Å; E279-K281 HydrophobicContact CB-CG 4.16Å; E279-K281 PolarHBondContact O-N 2.83Å; E279-K281 VanDerWaalsContact O-N 3.14Å; E279-K281 WeakPolarHBondContact OE2-CE 3.13Å; E279-K281 WeakPolarHBondContact OE2-CG 3.03Å; E279-K281 IonicContact OE2-NZ 3.93Å
280	T	96.7	Very high	90.5	Very high	54 Å²	54	84.4 Å²	84.4	33%	0.331	41%	0.411	S	S	.	.	S	Bend	trans	-82.5	21.8	173.9	58.9	0	0	0	0	113	S236 W237 Y239 F254	S236-T280 VanDerWaalsContact CA-O 3.31Å; S236-T280 WeakPolarHBondContact CA-O 3.46Å; W237-T280 PolarHBondContact N-O 2.73Å; W237-T280 VanDerWaalsContact O-CB 3.28Å; W237-T280 WeakPolarHBondContact O-CB 3.45Å; Y239-T280 HydrophobicContact CD2-CG2 3.75Å; Y239-T280 HydrophobicContact CE2-CG2 3.6Å; F254-T280 HydrophobicContact CE2-CG2 3.91Å; F254-T280 HydrophobicContact CZ-CG2 3.99Å
281	K	96.4	Very high	90.6	Very high	112 Å²	112	82.4 Å²	82.4	49%	0.487	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	150.4	177.5	63.4	-179.6	-179.2	-179.8	0	110.5	V234 F235 E279	V234-K281 HydrophobicContact CG1-CB 4.49Å; F235-K281 CarbonylContact O-C 3.38Å; F235-K281 WeakPolarHBondContact O-CA 3.34Å; F235-K281 WeakPolarHBondContact O-CB 3.44Å; E279-K281 HydrophobicContact CB-CG 4.16Å; E279-K281 PolarHBondContact O-N 2.83Å; E279-K281 VanDerWaalsContact O-N 3.14Å; E279-K281 WeakPolarHBondContact OE2-CE 3.13Å; E279-K281 WeakPolarHBondContact OE2-CG 3.03Å; E279-K281 IonicContact OE2-NZ 3.93Å
282	F	96.3	Very high	91	Very high	32 Å²	32	79.4 Å²	79.4	14%	0.14	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	128.7	177.6	-171.8	-92.2	0	0	0	111.6	F235 W237 V256 L272 K275 T277 V284 F293	F235-F282 PolarHBondContact N-O 2.78Å; F235-F282 PolarHBondContact O-N 2.93Å; W237-F282 HydrophobicContact CH2-CB 3.79Å; W237-F282 HydrophobicContact CZ3-CB 4Å; V256-F282 HydrophobicContact CB-CD1 4.49Å; V256-F282 HydrophobicContact CB-CG 4.46Å; V256-F282 HydrophobicContact CG1-CB 4.25Å; V256-F282 HydrophobicContact CG1-CG 4.25Å; V256-F282 HydrophobicContact CG2-CD1 3.94Å; V256-F282 HydrophobicContact CG2-CD2 3.77Å; V256-F282 HydrophobicContact CG2-CE1 3.94Å; V256-F282 HydrophobicContact CG2-CE2 3.77Å; V256-F282 HydrophobicContact CG2-CG 3.87Å; V256-F282 HydrophobicContact CG2-CZ 3.88Å; L272-F282 HydrophobicContact CD2-CE1 3.87Å; L272-F282 HydrophobicContact CD2-CZ 4.21Å; K275-F282 HydrophobicContact CB-CE2 4.4Å; K275-F282 HydrophobicContact CD-CE2 4.06Å; K275-F282 HydrophobicContact CD-CZ 3.75Å; T277-F282 HydrophobicContact CG2-CD2 4.44Å; F282-V284 HydrophobicContact CD1-CG2 3.85Å; F282-V284 HydrophobicContact CE1-CG2 4.05Å; F282-F293 HydrophobicContact CB-CZ 4.39Å; F282-F293 HydrophobicContact CD1-CE2 4.02Å
283	E	94.6	Very high	91.4	Very high	115 Å²	115	77.9 Å²	77.9	54%	0.537	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	124.7	176.8	-170.2	-177.7	159.7	0	0	111.1	Q233 V234	Q233-E283 HydrophobicContact CB-CG 4.41Å; Q233-E283 WeakPolarHBondContact O-CA 3.25Å; V234-E283 HydrophobicContact CG2-CB 4.38Å; V234-E283 HydrophobicContact CG2-CG 4.17Å
284	V	91.1	Very high	91.9	Very high	2 Å²	2	71.8 Å²	71.8	1%	0.012	35%	0.348	C	S	.	.			trans	-101.5	110.4	178.6	178.4	0	0	0	0	109.7	Q233 F235 V258 F282 I286 Y291 F293	Q233-V284 PolarHBondContact O-N 2.77Å; F235-V284 HydrophobicContact CD2-CB 4.28Å; F235-V284 HydrophobicContact CD2-CG2 3.59Å; F235-V284 HydrophobicContact CE2-CB 4Å; F235-V284 HydrophobicContact CE2-CG2 3.61Å; V258-V284 HydrophobicContact CG2-CG1 3.96Å; V258-V284 HydrophobicContact CG2-CG2 4.17Å; F282-V284 HydrophobicContact CD1-CG2 3.85Å; F282-V284 HydrophobicContact CE1-CG2 4.05Å; V284-I286 HydrophobicContact CG1-CB 4.4Å; V284-I286 HydrophobicContact CG1-CD1 4.1Å; V284-I286 HydrophobicContact CG1-CG1 3.85Å; V284-I286 HydrophobicContact CG1-CG2 3.9Å; V284-Y291 HydrophobicContact CG1-CE2 4.17Å; V284-F293 HydrophobicContact CG2-CD2 3.69Å; V284-F293 HydrophobicContact CG2-CE2 3.82Å
285	N	86.3	Confident	92.2	Very high	133 Å²	133	69.1 Å²	69.1	71%	0.711	33%	0.33	S	S	*	.			trans	-105.6	85.9	174.2	-165.7	-20.4	0	0	0	110.5
286	I	84.8	Confident	92.3	Very high	36 Å²	36	66.8 Å²	66.8	19%	0.185	32%	0.319	C	S	.	.			trans	-128.6	149.6	176.4	68.1	173.3	0	0	0	111.3	V258 L271 V284 Y291	V258-I286 HydrophobicContact CG1-CD1 3.75Å; L271-I286 HydrophobicContact CD1-CD1 4.4Å; V284-I286 HydrophobicContact CG1-CB 4.4Å; V284-I286 HydrophobicContact CG1-CD1 4.1Å; V284-I286 HydrophobicContact CG1-CG1 3.85Å; V284-I286 HydrophobicContact CG1-CG2 3.9Å; I286-Y291 HydrophobicContact CD1-CD1 3.27Å; I286-Y291 HydrophobicContact CD1-CD2 3.97Å; I286-Y291 HydrophobicContact CD1-CE1 3.61Å; I286-Y291 HydrophobicContact CD1-CE2 4.24Å; I286-Y291 HydrophobicContact CD1-CG 3.46Å; I286-Y291 VanDerWaalsContact CD1-CG 3.46Å; I286-Y291 HydrophobicContact CG1-CD1 4.06Å; I286-Y291 HydrophobicContact CG1-CE1 3.95Å
287	K	80.5	Confident	92.3	Very high	214 Å²	214	62.4 Å²	62.4	93%	0.93	30%	0.296	S	S	*	.	S	Bend	trans	-72.9	-28.8	179.6	-64.7	-177.3	-179.4	178.6	0	113.1	K289	K287-K289 PolarHBondContact O-N 2.95Å
288	S	81.3	Confident	92.3	Very high	51 Å²	51	62.4 Å²	62.4	36%	0.357	30%	0.295	S	S	.	.			trans	-68.3	131.7	179.5	-175.4	0	0	0	0	109.8	K290 Y291	S288-K290 PolarHBondContact OG-N 2.91Å; S288-K290 PolarHBondContact OG-O 3.29Å; S288-Y291 WeakPolarHBondContact O-CD1 3.49Å
289	K	81.5	Confident	92.3	Very high	136 Å²	136	57.2 Å²	57.2	59%	0.591	27%	0.271	S	S	*	.	S	Bend	trans	-96.7	7.1	175.2	-41.5	-155.1	-155.3	-177.8	0	113.5	K287 K316	K287-K289 PolarHBondContact O-N 2.95Å; K289-K316 HydrophobicContact CB-CD 3.79Å; K289-K316 HydrophobicContact CB-CG 3.2Å; K289-K316 HydrophobicContact CD-CD 3.88Å; K289-K316 HydrophobicContact CD-CG 3.93Å; K289-K316 HydrophobicContact CG-CD 4.23Å; K289-K316 VanDerWaalsContact CG-CE 3.43Å; K289-K316 HydrophobicContact CG-CG 4.09Å; K289-K316 WeakPolarHBondContact O-CG 3.38Å; K289-K316 PolarHBondContact O-N 3.23Å
290	K	89	Confident	92.3	Very high	107 Å²	107	55.3 Å²	55.3	47%	0.465	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	118	171.8	-64.9	-170.4	179	-174.7	0	109.3	N261 S288 V314	N261-K290 HydrophobicContact CB-CB 4.01Å; S288-K290 PolarHBondContact OG-N 2.91Å; S288-K290 PolarHBondContact OG-O 3.29Å; K290-V314 VanDerWaalsContact CA-O 3.26Å; K290-V314 WeakPolarHBondContact CA-O 3.4Å
291	Y	92.3	Very high	92.1	Very high	9 Å²	9	59.1 Å²	59.1	4%	0.035	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	167.5	-176.1	59.1	-93.1	0	0	0	110.4	F235 V258 V259 V284 I286 S288 F293 V314	F235-Y291 HydrophobicContact CE2-CE2 4.01Å; F235-Y291 AromaticContact CZ-CE2 3.77Å; F235-Y291 HydrophobicContact CZ-CE2 3.77Å; V258-Y291 HydrophobicContact CG1-CD2 3.48Å; V258-Y291 VanDerWaalsContact CG1-CD2 3.48Å; V258-Y291 HydrophobicContact CG1-CE2 4.29Å; V258-Y291 HydrophobicContact CG1-CG 3.83Å; V259-Y291 WeakPolarHBondContact O-CA 3.19Å; V259-Y291 WeakPolarHBondContact O-CB 3.46Å; V284-Y291 HydrophobicContact CG1-CE2 4.17Å; I286-Y291 HydrophobicContact CD1-CD1 3.27Å; I286-Y291 HydrophobicContact CD1-CD2 3.97Å; I286-Y291 HydrophobicContact CD1-CE1 3.61Å; I286-Y291 HydrophobicContact CD1-CE2 4.24Å; I286-Y291 HydrophobicContact CD1-CG 3.46Å; I286-Y291 VanDerWaalsContact CD1-CG 3.46Å; I286-Y291 HydrophobicContact CG1-CD1 4.06Å; I286-Y291 HydrophobicContact CG1-CE1 3.95Å; S288-Y291 WeakPolarHBondContact O-CD1 3.49Å; Y291-F293 HydrophobicContact CE2-CB 4.47Å; Y291-V314 HydrophobicContact CD1-CB 4.12Å; Y291-V314 HydrophobicContact CD1-CG1 4.35Å; Y291-V314 HydrophobicContact CD2-CB 4.21Å; Y291-V314 HydrophobicContact CD2-CG2 4.05Å; Y291-V314 HydrophobicContact CE1-CB 3.94Å; Y291-V314 HydrophobicContact CE1-CG1 3.88Å; Y291-V314 HydrophobicContact CE1-CG2 4.17Å; Y291-V314 HydrophobicContact CE2-CB 4.04Å; Y291-V314 HydrophobicContact CE2-CG2 3.53Å; Y291-V314 HydrophobicContact CG-CB 4.27Å; Y291-V314 PolarHBondContact N-O 3.45Å; Y291-V314 PolarHBondContact O-N 3Å
292	V	94	Very high	91.8	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.024	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.8	170.9	-177.8	0	0	0	0	108.3	V258 V259 E311 Y312 T313	V258-V292 WeakPolarHBondContact CA-O 3.31Å; V259-V292 HydrophobicContact CG2-CB 3.73Å; V259-V292 HydrophobicContact CG2-CG1 4.37Å; V259-V292 HydrophobicContact CG2-CG2 4.5Å; V259-V292 PolarHBondContact N-O 3.14Å; V259-V292 PolarHBondContact O-N 2.89Å; V292-E311 HydrophobicContact CG1-CB 3.97Å; V292-Y312 WeakPolarHBondContact CA-O 3.37Å; V292-T313 HydrophobicContact CG2-CG2 4.43Å
293	F	95.1	Very high	91.3	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.7	170.8	178.5	-97.4	0	0	0	109.1	L227 F235 W237 V256 V258 F282 V284 Y291 V295 E311 Y312	L227-F293 HydrophobicContact CD1-CD1 4.03Å; L227-F293 HydrophobicContact CD1-CE1 3.88Å; L227-F293 HydrophobicContact CD2-CD1 4.34Å; F235-F293 HydrophobicContact CB-CD1 4.12Å; F235-F293 HydrophobicContact CB-CE1 3.74Å; F235-F293 HydrophobicContact CB-CE2 4.19Å; F235-F293 HydrophobicContact CB-CG 4.49Å; F235-F293 HydrophobicContact CB-CZ 3.78Å; F235-F293 HydrophobicContact CD1-CB 3.92Å; F235-F293 AromaticContact CD1-CD1 3.47Å; F235-F293 HydrophobicContact CD1-CD1 3.47Å; F235-F293 VanDerWaalsContact CD1-CD1 3.47Å; F235-F293 HydrophobicContact CD1-CD2 4.24Å; F235-F293 HydrophobicContact CD1-CE1 4Å; F235-F293 AromaticContact CD1-CG 3.61Å; F235-F293 HydrophobicContact CD1-CG 3.61Å; F235-F293 HydrophobicContact CD2-CD1 4.42Å; F235-F293 AromaticContact CD2-CD2 3.78Å; F235-F293 HydrophobicContact CD2-CD2 3.78Å; F235-F293 HydrophobicContact CD2-CE2 4.04Å; F235-F293 AromaticContact CD2-CG 3.98Å; F235-F293 HydrophobicContact CD2-CG 3.98Å; F235-F293 HydrophobicContact CD2-CZ 4.46Å; F235-F293 HydrophobicContact CE1-CB 3.45Å; F235-F293 VanDerWaalsContact CE1-CB 3.45Å; F235-F293 AromaticContact CE1-CD1 3.95Å; F235-F293 HydrophobicContact CE1-CD1 3.95Å; F235-F293 HydrophobicContact CE1-CD2 4.41Å; F235-F293 AromaticContact CE1-CG 3.69Å; F235-F293 HydrophobicContact CE1-CG 3.69Å; F235-F293 HydrophobicContact CE2-CB 4.11Å; F235-F293 AromaticContact CE2-CD2 3.98Å; F235-F293 HydrophobicContact CE2-CD2 3.98Å; F235-F293 HydrophobicContact CE2-CG 4.07Å; F235-F293 HydrophobicContact CG-CB 4.41Å; F235-F293 AromaticContact CG-CD1 3.73Å; F235-F293 HydrophobicContact CG-CD1 3.73Å; F235-F293 AromaticContact CG-CD2 3.9Å; F235-F293 HydrophobicContact CG-CD2 3.9Å; F235-F293 AromaticContact CG-CE1 3.87Å; F235-F293 HydrophobicContact CG-CE1 3.87Å; F235-F293 HydrophobicContact CG-CE2 4.05Å; F235-F293 AromaticContact CG-CG 3.74Å; F235-F293 HydrophobicContact CG-CG 3.74Å; F235-F293 HydrophobicContact CG-CZ 4.03Å; F235-F293 HydrophobicContact CZ-CB 3.54Å; F235-F293 HydrophobicContact CZ-CD2 4.27Å; F235-F293 AromaticContact CZ-CG 3.9Å; F235-F293 HydrophobicContact CZ-CG 3.9Å; W237-F293 HydrophobicContact CE3-CE1 4.27Å; W237-F293 HydrophobicContact CE3-CZ 4.5Å; W237-F293 HydrophobicContact CH2-CZ 4.36Å; W237-F293 AromaticContact CZ3-CE1 3.96Å; W237-F293 HydrophobicContact CZ3-CE1 3.96Å; W237-F293 AromaticContact CZ3-CZ 3.74Å; W237-F293 HydrophobicContact CZ3-CZ 3.74Å; V256-F293 HydrophobicContact CB-CE2 4.07Å; V256-F293 HydrophobicContact CB-CZ 4.04Å; V256-F293 HydrophobicContact CG1-CE2 4.22Å; V256-F293 HydrophobicContact CG1-CZ 3.71Å; V258-F293 HydrophobicContact CG2-CD2 4.13Å; F282-F293 HydrophobicContact CB-CZ 4.39Å; F282-F293 HydrophobicContact CD1-CE2 4.02Å; V284-F293 HydrophobicContact CG2-CD2 3.69Å; V284-F293 HydrophobicContact CG2-CE2 3.82Å; Y291-F293 HydrophobicContact CE2-CB 4.47Å; F293-V295 HydrophobicContact CE1-CB 3.77Å; F293-V295 HydrophobicContact CE1-CG1 3.86Å; F293-V295 HydrophobicContact CZ-CB 4.23Å; F293-E311 CarbonylContact O-C 3.56Å; F293-E311 VanDerWaalsContact O-CA 3.24Å; F293-E311 WeakPolarHBondContact O-CA 3.34Å; F293-Y312 PolarHBondContact N-O 3.22Å; F293-Y312 PolarHBondContact O-N 2.91Å
294	C	96.5	Very high	91.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.5	-177.9	-56.8	0	0	0	0	109.2	V256 K257 C265 W309 S310	V256-C294 CarbonylContact C-O 3.53Å; V256-C294 VanDerWaalsContact CA-O 3.31Å; V256-C294 WeakPolarHBondContact CA-O 3.2Å; K257-C294 HydrophobicContact CG-CB 3.83Å; K257-C294 PolarHBondContact N-O 3.21Å; K257-C294 WeakPolarHBondContact O-CB 3.33Å; K257-C294 PolarHBondContact O-N 2.85Å; C265-C294 WeakPolarHBondContact CA-SG 3.36Å; C265-C294 HydrophobicContact CB-CB 3.72Å; C265-C294 WeakPolarHBondContact CB-SG 3.13Å; C265-C294 WeakPolarHBondContact SG-CB 3.47Å; C265-C294 CovalentContact SG-SG 2.03Å; C265-C294 PolarHBondContact SG-SG 2.8Å; C294-W309 HydrophobicContact CB-CD2 4.33Å; C294-W309 HydrophobicContact CB-CE3 3.61Å; C294-W309 HydrophobicContact CB-CZ3 3.85Å; C294-S310 WeakPolarHBondContact CA-O 3.35Å
295	V	97.9	Very high	91.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.7	174.1	61.7	0	0	0	0	111.1	L224 L227 W237 F254 Q255 V256 F293 S310	L224-V295 HydrophobicContact CD1-CB 4.28Å; L224-V295 HydrophobicContact CD1-CG1 3.88Å; L224-V295 HydrophobicContact CD1-CG2 3.63Å; L227-V295 HydrophobicContact CD1-CG1 4.09Å; L227-V295 HydrophobicContact CD2-CG1 4.06Å; W237-V295 HydrophobicContact CD2-CG1 4.36Å; W237-V295 HydrophobicContact CD2-CG2 4.14Å; W237-V295 HydrophobicContact CE3-CG1 4.33Å; W237-V295 HydrophobicContact CE3-CG2 4.36Å; W237-V295 HydrophobicContact CH2-CG2 4.02Å; W237-V295 HydrophobicContact CZ2-CG2 3.78Å; W237-V295 HydrophobicContact CZ3-CG2 4.31Å; F254-V295 HydrophobicContact CB-CG2 4.11Å; Q255-V295 WeakPolarHBondContact O-CA 3.48Å; V256-V295 HydrophobicContact CG1-CB 4.2Å; V256-V295 HydrophobicContact CG1-CG2 3.82Å; F293-V295 HydrophobicContact CE1-CB 3.77Å; F293-V295 HydrophobicContact CE1-CG1 3.86Å; F293-V295 HydrophobicContact CZ-CB 4.23Å; V295-S310 PolarHBondContact N-O 3.09Å; V295-S310 PolarHBondContact O-N 2.7Å
296	R	97.5	Very high	91.8	Very high	55 Å²	55	56 Å²	56	21%	0.208	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	159.7	173.4	62.1	178.9	-174.4	168.1	0.6	110.2	F254 Q255 W306 S307 W309	F254-R296 CarbonylContact C-O 3.5Å; F254-R296 VanDerWaalsContact CA-O 3.29Å; F254-R296 WeakPolarHBondContact CA-O 3.05Å; Q255-R296 HydrophobicContact CB-CG 4.11Å; Q255-R296 PolarHBondContact N-O 3.28Å; Q255-R296 PolarHBondContact O-N 2.87Å; R296-W306 HydrophobicContact CB-CE3 4.45Å; R296-W306 HydrophobicContact CG-CD2 4.3Å; R296-W306 HydrophobicContact CG-CE3 3.64Å; R296-W306 HydrophobicContact CG-CZ3 4.28Å; R296-S307 WeakPolarHBondContact CA-OG 3.41Å; R296-S307 WeakPolarHBondContact CB-OG 3.29Å; R296-W309 HydrophobicContact CB-CD2 4.27Å; R296-W309 HydrophobicContact CB-CE3 3.89Å; R296-W309 HydrophobicContact CB-CZ3 4.21Å; R296-W309 HydrophobicContact CG-CD2 4.13Å; R296-W309 HydrophobicContact CG-CE3 3.74Å; R296-W309 HydrophobicContact CG-CH2 3.82Å; R296-W309 HydrophobicContact CG-CZ2 4.2Å; R296-W309 HydrophobicContact CG-CZ3 3.59Å; R296-W309 VanDerWaalsContact NE-CZ2 3.31Å
297	A	97.6	Very high	92.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	155.7	-176.8	0	0	0	0	0	112.8	P221 L224 L252 H253 F254 W306 S307	P221-A297 HydrophobicContact CB-CB 4.29Å; P221-A297 HydrophobicContact CG-CB 4.34Å; L224-A297 HydrophobicContact CD1-CB 4.36Å; L224-A297 HydrophobicContact CD2-CB 3.94Å; L224-A297 HydrophobicContact CG-CB 4.44Å; L252-A297 HydrophobicContact CB-CB 4.44Å; L252-A297 HydrophobicContact CD1-CB 3.99Å; H253-A297 WeakPolarHBondContact O-CA 3.42Å; F254-A297 HydrophobicContact CD1-CB 3.75Å; F254-A297 HydrophobicContact CE1-CB 3.77Å; A297-W306 VanDerWaalsContact C-CE3 3.47Å; A297-W306 CarbonylContact O-C 3.43Å; A297-W306 WeakPolarHBondContact O-CA 3.36Å; A297-S307 PolarHBondContact N-OG 3.06Å; A297-S307 PolarHBondContact O-N 3.42Å
298	Q	97.1	Very high	93.1	Very high	27 Å²	27	46.5 Å²	46.5	13%	0.126	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	151.1	170.5	179.9	-169.5	45.4	0	0	107.1	L252 H253 K300 G304 W306	L252-Q298 WeakPolarHBondContact CA-O 3.42Å; L252-Q298 WeakPolarHBondContact CD2-O 3.38Å; H253-Q298 PolarHBondContact CD2-O 3.49Å; H253-Q298 PolarHBondContact N-O 3.36Å; H253-Q298 PolarHBondContact NE2-OE1 2.79Å; H253-Q298 PolarHBondContact O-N 2.91Å; Q298-K300 PolarHBondContact O-N 2.86Å; Q298-G304 WeakPolarHBondContact CG-O 3.34Å; Q298-G304 PolarHBondContact NE2-O 3.44Å; Q298-W306 HydrophobicContact CB-CD2 3.67Å; Q298-W306 HydrophobicContact CB-CE3 3.46Å; Q298-W306 VanDerWaalsContact CB-CE3 3.46Å; Q298-W306 HydrophobicContact CB-CG 4.31Å; Q298-W306 HydrophobicContact CB-CH2 3.87Å; Q298-W306 HydrophobicContact CB-CZ2 4.1Å; Q298-W306 HydrophobicContact CB-CZ3 3.56Å; Q298-W306 HydrophobicContact CG-CD2 4.38Å
299	D	96.3	Very high	93.8	Very high	6 Å²	6	45.7 Å²	45.7	3%	0.032	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	133.8	169.1	-174	-63.6	0	0	0	110.3	Y136 W243 F301 T302	Y136-D299 VanDerWaalsContact CE2-OD2 3.27Å; Y136-D299 WeakPolarHBondContact CE2-OD2 3.48Å; Y136-D299 VanDerWaalsContact OH-CG 3.22Å; Y136-D299 PolarHBondContact OH-OD2 3.09Å; W243-D299 HydrophobicContact CH2-CB 4.06Å; W243-D299 HydrophobicContact CZ2-CB 4.2Å; D299-F301 PolarHBondContact OD1-N 2.77Å; D299-T302 VanDerWaalsContact CB-OG1 3.31Å; D299-T302 WeakPolarHBondContact CB-OG1 3.37Å; D299-T302 PolarHBondContact OD1-N 3.47Å; D299-T302 PolarHBondContact OD1-OG1 3.45Å
300	K	95.4	Very high	94.5	Very high	69 Å²	69	39.8 Å²	39.8	30%	0.3	19%	0.188	S	C	.	.	S	Bend	trans	-70.4	-33.2	-175.1	178.1	179	174.1	176.7	0	113	S251 E278 Q298	S251-K300 VanDerWaalsContact O-CB 3.25Å; S251-K300 WeakPolarHBondContact O-CB 3.2Å; S251-K300 PolarHBondContact O-N 2.95Å; E278-K300 WeakPolarHBondContact OE1-CE 3.46Å; E278-K300 IonicContact OE1-NZ 3.27Å; E278-K300 PolarHBondContact OE1-NZ 2.88Å; E278-K300 IonicContact OE2-NZ 3.8Å; E278-K300 PolarHBondContact OE2-NZ 3.17Å; Q298-K300 PolarHBondContact O-N 2.86Å
301	F	92.7	Very high	94.8	Very high	134 Å²	134	39.9 Å²	39.9	59%	0.588	19%	0.19	S	C	*	.	S	Bend	trans	-101.4	-12.1	-168.5	-57.3	-63.4	0	0	0	113	Y249 D299	Y249-F301 WeakPolarHBondContact O-CE2 3.33Å; D299-F301 PolarHBondContact OD1-N 2.77Å
302	T	89.9	Confident	94.9	Very high	30 Å²	30	43.1 Å²	43.1	18%	0.184	20%	0.203	C	C	.	.	S	Bend	trans	-116.3	162.3	179.2	75.4	0	0	0	0	110.8	Y136 R216 D299 G304	Y136-T302 WeakPolarHBondContact OH-CG2 3.32Å; R216-T302 HydrophobicContact CB-CG2 3.98Å; D299-T302 VanDerWaalsContact CB-OG1 3.31Å; D299-T302 WeakPolarHBondContact CB-OG1 3.37Å; D299-T302 PolarHBondContact OD1-N 3.47Å; D299-T302 PolarHBondContact OD1-OG1 3.45Å; T302-G304 PolarHBondContact O-N 3.04Å; T302-G304 PolarHBondContact OG1-N 3.47Å
303	Q	86.9	Confident	94.9	Very high	197 Å²	197	45.9 Å²	45.9	92%	0.921	22%	0.22	S	C	*	.			trans	-94	29.2	172.6	-60.6	-175.1	21.2	0	0	111.3
304	G	90.5	Very high	94.7	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.021	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-61.7	169.6	179.1	0	0	0	0	0	113	Q298 T302	Q298-G304 WeakPolarHBondContact CG-O 3.34Å; Q298-G304 PolarHBondContact NE2-O 3.44Å; T302-G304 PolarHBondContact O-N 3.04Å; T302-G304 PolarHBondContact OG1-N 3.47Å
305	P	94.8	Very high	94.1	Very high	46 Å²	46	50.5 Å²	50.5	30%	0.299	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-65.2	147.5	-179.1	26	-37.8	0	0	0	114.2	E217 V219 R220	E217-P305 VanDerWaalsContact O-CD 3.29Å; E217-P305 WeakPolarHBondContact O-CD 3.4Å; V219-P305 VanDerWaalsContact O-CD 3.23Å; V219-P305 WeakPolarHBondContact O-CD 3.47Å; V219-P305 WeakPolarHBondContact O-CG 3.49Å; R220-P305 HydrophobicContact CB-CB 4.32Å; R220-P305 HydrophobicContact CB-CG 3.61Å; R220-P305 HydrophobicContact CG-CB 4.12Å; R220-P305 HydrophobicContact CG-CG 3.96Å
306	W	96.2	Very high	92.5	Very high	52 Å²	52	56.2 Å²	56.2	20%	0.197	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-68.6	142.3	168.3	-72.4	92.9	0	0	0	111.9	R220 H253 Q255 I276 R296 A297 Q298	R220-W306 PolarHBondContact NE-O 3.38Å; R220-W306 PolarHBondContact NH2-O 3.22Å; H253-W306 AromaticContact CD2-CH2 3.73Å; H253-W306 AromaticContact NE2-CH2 3.69Å; Q255-W306 HydrophobicContact CB-CE3 4.21Å; Q255-W306 HydrophobicContact CB-CH2 3.66Å; Q255-W306 HydrophobicContact CB-CZ2 4.27Å; Q255-W306 HydrophobicContact CB-CZ3 3.61Å; I276-W306 HydrophobicContact CD1-CH2 3.81Å; I276-W306 HydrophobicContact CD1-CZ2 4.14Å; R296-W306 HydrophobicContact CB-CE3 4.45Å; R296-W306 HydrophobicContact CG-CD2 4.3Å; R296-W306 HydrophobicContact CG-CE3 3.64Å; R296-W306 HydrophobicContact CG-CZ3 4.28Å; A297-W306 VanDerWaalsContact C-CE3 3.47Å; A297-W306 CarbonylContact O-C 3.43Å; A297-W306 WeakPolarHBondContact O-CA 3.36Å; Q298-W306 HydrophobicContact CB-CD2 3.67Å; Q298-W306 HydrophobicContact CB-CE3 3.46Å; Q298-W306 VanDerWaalsContact CB-CE3 3.46Å; Q298-W306 HydrophobicContact CB-CG 4.31Å; Q298-W306 HydrophobicContact CB-CH2 3.87Å; Q298-W306 HydrophobicContact CB-CZ2 4.1Å; Q298-W306 HydrophobicContact CB-CZ3 3.56Å; Q298-W306 HydrophobicContact CG-CD2 4.38Å
307	S	96.6	Very high	90.6	Very high	2 Å²	2	61 Å²	61	1%	0.014	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-57	161.6	167.5	80.2	0	0	0	0	111.1	P221 E222 R296 A297	P221-S307 WeakPolarHBondContact O-CA 3.36Å; P221-S307 WeakPolarHBondContact O-CB 3.39Å; E222-S307 WeakPolarHBondContact O-CB 3.37Å; R296-S307 WeakPolarHBondContact CA-OG 3.41Å; R296-S307 WeakPolarHBondContact CB-OG 3.29Å; A297-S307 PolarHBondContact N-OG 3.06Å; A297-S307 PolarHBondContact O-N 3.42Å
308	P	95.9	Very high	88.7	Confident	50 Å²	50	64.5 Å²	64.5	33%	0.325	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-60.9	160.9	164.6	-5	19.6	0	0	0	110.8	N223	N223-P308 WeakPolarHBondContact OD1-CB 3.24Å; N223-P308 WeakPolarHBondContact OD1-CD 3.5Å; N223-P308 VanDerWaalsContact OD1-CG 3.25Å; N223-P308 WeakPolarHBondContact OD1-CG 3.44Å; N223-P308 PolarHBondContact OD1-O 3.12Å
309	W	96.2	Very high	86.3	Confident	33 Å²	33	71.1 Å²	71.1	13%	0.125	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-72.2	131.4	178.5	-69.9	105	0	0	0	110.6	Q255 K257 C265 H266 C294 R296	Q255-W309 HydrophobicContact CG-CH2 4.23Å; K257-W309 HydrophobicContact CD-CH2 3.9Å; K257-W309 HydrophobicContact CD-CZ2 4.16Å; K257-W309 HydrophobicContact CG-CH2 3.89Å; K257-W309 HydrophobicContact CG-CZ3 4.09Å; C265-W309 HydrophobicContact CB-CB 3.68Å; C265-W309 HydrophobicContact CB-CD2 3.91Å; C265-W309 HydrophobicContact CB-CE3 4.46Å; C265-W309 HydrophobicContact CB-CG 3.55Å; C265-W309 PolarHBondContact O-NE1 3.07Å; H266-W309 AromaticContact NE2-CD1 3.69Å; C294-W309 HydrophobicContact CB-CD2 4.33Å; C294-W309 HydrophobicContact CB-CE3 3.61Å; C294-W309 HydrophobicContact CB-CZ3 3.85Å; R296-W309 HydrophobicContact CB-CD2 4.27Å; R296-W309 HydrophobicContact CB-CE3 3.89Å; R296-W309 HydrophobicContact CB-CZ3 4.21Å; R296-W309 HydrophobicContact CG-CD2 4.13Å; R296-W309 HydrophobicContact CG-CE3 3.74Å; R296-W309 HydrophobicContact CG-CH2 3.82Å; R296-W309 HydrophobicContact CG-CZ2 4.2Å; R296-W309 HydrophobicContact CG-CZ3 3.59Å; R296-W309 VanDerWaalsContact NE-CZ2 3.31Å
310	S	96.9	Very high	83.9	Confident	13 Å²	13	77.8 Å²	77.8	9%	0.091	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.3	161.1	-53.4	0	0	0	0	108.2	L224 C294 V295	L224-S310 PolarHBondContact N-OG 3.49Å; C294-S310 WeakPolarHBondContact CA-O 3.35Å; V295-S310 PolarHBondContact N-O 3.09Å; V295-S310 PolarHBondContact O-N 2.7Å
311	E	95.8	Very high	81.7	Confident	109 Å²	109	78 Å²	78	51%	0.509	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	147.6	-170.5	66.5	-178.6	-151.2	0	0	113.3	C265 V292 F293	C265-E311 VanDerWaalsContact SG-CB 3.55Å; C265-E311 PolarHBondContact SG-OE2 3.03Å; V292-E311 HydrophobicContact CG1-CB 3.97Å; F293-E311 CarbonylContact O-C 3.56Å; F293-E311 VanDerWaalsContact O-CA 3.24Å; F293-E311 WeakPolarHBondContact O-CA 3.34Å
312	Y	94.3	Very high	79.7	Confident	76 Å²	76	80 Å²	80	30%	0.298	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	123.3	175.9	-170.2	-79.8	0	0	0	110.3	I229 F235 V292 F293 V314 I318	I229-Y312 HydrophobicContact CB-CE1 4.48Å; I229-Y312 HydrophobicContact CG2-CE1 3.74Å; F235-Y312 AromaticContact CE1-CD1 3.8Å; F235-Y312 HydrophobicContact CE1-CD1 3.8Å; F235-Y312 HydrophobicContact CE1-CG 4.09Å; V292-Y312 WeakPolarHBondContact CA-O 3.37Å; F293-Y312 PolarHBondContact N-O 3.22Å; F293-Y312 PolarHBondContact O-N 2.91Å; Y312-V314 HydrophobicContact CD1-CG2 3.99Å; Y312-V314 HydrophobicContact CE1-CG2 4.19Å; Y312-I318 HydrophobicContact CE1-CD1 4.43Å
313	T	93.1	Very high	77.2	Confident	63 Å²	63	87.7 Å²	87.7	39%	0.387	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119.2	179	-60.9	0	0	0	0	110.7	V292 N315	V292-T313 HydrophobicContact CG2-CG2 4.43Å; T313-N315 WeakPolarHBondContact CG2-ND2 3.03Å
314	V	89.8	Confident	76.7	Confident	11 Å²	11	82.2 Å²	82.2	7%	0.067	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	116.2	172.1	-178.5	0	0	0	0	109.2	I229 F235 K290 Y291 Y312	I229-V314 HydrophobicContact CD1-CG2 4.21Å; F235-V314 HydrophobicContact CE1-CG2 4.28Å; F235-V314 HydrophobicContact CZ-CG2 3.69Å; K290-V314 VanDerWaalsContact CA-O 3.26Å; K290-V314 WeakPolarHBondContact CA-O 3.4Å; Y291-V314 HydrophobicContact CD1-CB 4.12Å; Y291-V314 HydrophobicContact CD1-CG1 4.35Å; Y291-V314 HydrophobicContact CD2-CB 4.21Å; Y291-V314 HydrophobicContact CD2-CG2 4.05Å; Y291-V314 HydrophobicContact CE1-CB 3.94Å; Y291-V314 HydrophobicContact CE1-CG1 3.88Å; Y291-V314 HydrophobicContact CE1-CG2 4.17Å; Y291-V314 HydrophobicContact CE2-CB 4.04Å; Y291-V314 HydrophobicContact CE2-CG2 3.53Å; Y291-V314 HydrophobicContact CG-CB 4.27Å; Y291-V314 PolarHBondContact N-O 3.45Å; Y291-V314 PolarHBondContact O-N 3Å; Y312-V314 HydrophobicContact CD1-CG2 3.99Å; Y312-V314 HydrophobicContact CE1-CG2 4.19Å
315	N	84.3	Confident	76	Confident	86 Å²	86	86.4 Å²	86.4	46%	0.46	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.8	168.9	-69.6	-53.6	0	0	0	107.2	T313 N317	T313-N315 WeakPolarHBondContact CG2-ND2 3.03Å; N315-N317 PolarHBondContact O-N 3.3Å
316	K	64.3	Low	74.9	Confident	120 Å²	120	88.7 Å²	88.7	52%	0.522	47%	0.469	S	S	.	.	S	Bend	trans	-31.3	105.2	177.1	-83	-169.7	-169	-177.8	0	111.9	K289	K289-K316 HydrophobicContact CB-CD 3.79Å; K289-K316 HydrophobicContact CB-CG 3.2Å; K289-K316 HydrophobicContact CD-CD 3.88Å; K289-K316 HydrophobicContact CD-CG 3.93Å; K289-K316 HydrophobicContact CG-CD 4.23Å; K289-K316 VanDerWaalsContact CG-CE 3.43Å; K289-K316 HydrophobicContact CG-CG 4.09Å; K289-K316 WeakPolarHBondContact O-CG 3.38Å; K289-K316 PolarHBondContact O-N 3.23Å
317	N	58.8	Low	73.7	Confident	155 Å²	155	90.8 Å²	90.8	83%	0.829	49%	0.485	S	S	*	.			trans	168.7	44.9	151.2	-82.2	-9.3	0	0	0	110.8	N315	N315-N317 PolarHBondContact O-N 3.3Å
318	I	56.5	Low	72.3	Confident	73 Å²	73	96.4 Å²	96.4	37%	0.374	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-103.5	125.9	174.3	-54.5	-175.3	0	0	0	108.7	I229 Y312	I229-I318 HydrophobicContact CD1-CD1 4.46Å; I229-I318 HydrophobicContact CG2-CD1 3.4Å; I229-I318 VanDerWaalsContact CG2-CD1 3.4Å; I229-I318 HydrophobicContact CG2-CG2 4.48Å; Y312-I318 HydrophobicContact CE1-CD1 4.43Å
319	M	47.7	Very low	70.7	Confident	166 Å²	166	99.5 Å²	99.5	82%	0.818	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-72	163.6	-149.2	-57.2	-172.7	-163.6	0	0	115.2	C321	M319-C321 PolarHBondContact O-N 3.46Å
320	N	45.4	Very low	68.9	Low	146 Å²	146	104.2 Å²	104.2	78%	0.781	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-50	122.6	167.2	-71.7	-19	0	0	0	110.6
321	C	49.7	Very low	66.7	Low	74 Å²	74	111.2 Å²	111.2	50%	0.5	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-78.6	120.2	160.1	-86.2	0	0	0	0	108.6	C231 M319	C231-C321 WeakPolarHBondContact CA-SG 3.38Å; C231-C321 HydrophobicContact CB-CB 3.97Å; C231-C321 WeakPolarHBondContact CB-SG 3.27Å; C231-C321 WeakPolarHBondContact SG-CB 3.42Å; C231-C321 CovalentContact SG-SG 2.04Å; C231-C321 PolarHBondContact SG-SG 3.32Å; M319-C321 PolarHBondContact O-N 3.46Å
322	H	49.7	Very low	64.3	Low	177 Å²	177	111.4 Å²	111.4	82%	0.819	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-75.2	122.3	165.4	-76.1	-71.4	0	0	0	107.9
323	S	38	Very low	61.6	Low	190 Å²	190	114.6 Å²	114.6	100%	1.329	63%	0.626	S	S	*	*			trans	-61.4	0	175.6	51.1	0	0	0	0	113.3

Retrieved 323 of 323 residues in 220.3 ms (Link to these results)

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