X6RL26_HUMAN Loading...

DDB1 and CUL4 associated factor 12

AlphaFold DB , UniProt , Accession X6RL26, Species HUMAN (Homo sapiens, Human), Gene DCAF12, Length 189 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	41.2	Very low	35.9	Very low	249 Å²	249	155.4 Å²	155.4	100%	1.227	82%	0.816	S	S	*	*				0	99.7	0	-84.3	168.7	149.1	0	0	107.8
2	Q	31.7	Very low	36.5	Very low	189 Å²	189	155.3 Å²	155.3	88%	0.883	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-87.3	143.6	174.2	-78.3	173.9	-20.9	0	0	109.1
3	P	33.1	Very low	37.1	Very low	126 Å²	126	156.6 Å²	156.6	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75.9	131.9	173.5	30.1	-29.7	0	0	0	110	S5	P3-S5 PolarHBondContact O-N 3.17Å
4	M	32.8	Very low	37.6	Very low	178 Å²	178	160.1 Å²	160.1	88%	0.877	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-68.3	118.8	171.2	-69.1	178.2	-134.2	0	0	109
5	S	31.7	Very low	38.3	Very low	114 Å²	114	165.5 Å²	165.5	80%	0.797	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-78.4	123.6	164.9	65.6	0	0	0	0	108.9	P3 G7	P3-S5 PolarHBondContact O-N 3.17Å; S5-G7 PolarHBondContact O-N 3.48Å; S5-G7 VanDerWaalsContact O-N 3.11Å
6	F	36	Very low	38.7	Very low	192 Å²	192	167.7 Å²	167.7	84%	0.842	83%	0.829	S	S	*	*			trans	-73.3	97.6	166.2	-85.7	-93.2	0	0	0	108.1	W8	F6-W8 PolarHBondContact O-N 3.24Å
7	G	30.6	Very low	39.4	Very low	68 Å²	68	172.2 Å²	172.2	70%	0.701	83%	0.834	S	S	*	*			trans	-75.5	110.4	170.6	0	0	0	0	0	110.2	S5 D9	S5-G7 PolarHBondContact O-N 3.48Å; S5-G7 VanDerWaalsContact O-N 3.11Å; G7-D9 PolarHBondContact O-N 3.36Å; G7-D9 VanDerWaalsContact O-N 3.08Å
8	W	37.8	Very low	39.7	Very low	221 Å²	221	171.4 Å²	171.4	84%	0.837	83%	0.834	S	S	*	*			trans	-71.5	94.1	163.6	-68.9	91.3	0	0	0	108.3	F6 H10	F6-W8 PolarHBondContact O-N 3.24Å; W8-H10 VanDerWaalsContact C-N 3.34Å; W8-H10 PolarHBondContact O-N 3.07Å
9	D	35.3	Very low	40	Very low	145 Å²	145	167.8 Å²	167.8	78%	0.775	83%	0.825	S	S	*	*			trans	-78.2	85.5	175.3	-161.3	5	0	0	0	109.4	G7 S11	G7-D9 PolarHBondContact O-N 3.36Å; G7-D9 VanDerWaalsContact O-N 3.08Å; D9-S11 PolarHBondContact O-N 3.04Å
10	H	42.8	Very low	40.8	Very low	155 Å²	155	165.8 Å²	165.8	72%	0.718	83%	0.825	S	S	*	*			trans	-74.2	58.9	166.1	-72.4	-64	0	0	0	110.4	W8 L12	W8-H10 VanDerWaalsContact C-N 3.34Å; W8-H10 PolarHBondContact O-N 3.07Å; H10-L12 PolarHBondContact O-N 3.16Å
11	S	41.8	Very low	41.8	Very low	72 Å²	72	164 Å²	164	50%	0.503	82%	0.823	S	S	.	*			trans	-73.5	73.2	164.5	174.9	0	0	0	0	108.8	D9 H13	D9-S11 PolarHBondContact O-N 3.04Å; S11-H13 PolarHBondContact O-N 2.97Å; S11-H13 PolarHBondContact O-ND1 3.02Å
12	L	43.4	Very low	42.5	Very low	155 Å²	155	161.8 Å²	161.8	81%	0.812	81%	0.807	S	S	*	*			trans	-59.1	106.4	165	-76.7	169.4	0	0	0	107	H10 K14	H10-L12 PolarHBondContact O-N 3.16Å; L12-K14 PolarHBondContact O-N 2.95Å
13	H	43.9	Very low	43.9	Very low	172 Å²	172	160.7 Å²	160.7	80%	0.796	79%	0.794	S	S	*	*			trans	-52.8	110.9	170.1	-77.2	49.5	0	0	0	107.4	S11 R15	S11-H13 PolarHBondContact O-N 2.97Å; S11-H13 PolarHBondContact O-ND1 3.02Å; H13-R15 PolarHBondContact O-N 2.95Å
14	K	43.8	Very low	45.8	Very low	206 Å²	206	157.8 Å²	157.8	90%	0.896	78%	0.777	S	S	*	*			trans	-51.7	107.1	176.5	-89.8	-179.6	177.9	172.6	0	107.5	L12 K16	L12-K14 PolarHBondContact O-N 2.95Å; K14-K16 PolarHBondContact O-N 3.46Å
15	R	48.3	Very low	47.8	Very low	240 Å²	240	155.2 Å²	155.2	91%	0.906	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-49.1	116.3	174.7	-130.7	176.5	178.8	179.3	-0.4	106.8	H13 R17	H13-R15 PolarHBondContact O-N 2.95Å; R15-R17 PolarHBondContact O-N 3.26Å
16	K	45.2	Very low	49.9	Very low	201 Å²	201	154.4 Å²	154.4	87%	0.874	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-52	119.9	173.2	-76.1	-177.8	177.5	178.2	0	106.7	K14 L18	K14-K16 PolarHBondContact O-N 3.46Å; K16-L18 PolarHBondContact O-N 3.4Å; K16-L18 VanDerWaalsContact O-N 3.07Å
17	R	49.7	Very low	51.4	Low	245 Å²	245	147.6 Å²	147.6	93%	0.925	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-54.3	119.3	176.3	-85.2	-178.4	168.6	180	-3.3	107.2	R15	R15-R17 PolarHBondContact O-N 3.26Å
18	L	46.3	Very low	53.3	Low	157 Å²	157	150.3 Å²	150.3	82%	0.822	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-54.9	142	168.4	-69.4	166.3	0	0	0	107.8	K16	K16-L18 PolarHBondContact O-N 3.4Å; K16-L18 VanDerWaalsContact O-N 3.07Å
19	P	45.2	Very low	55	Low	104 Å²	104	144.2 Å²	144.2	68%	0.675	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-53.7	147.1	174.9	22.2	-31.7	0	0	0	109.6	V21	P19-V21 PolarHBondContact O-N 3.33Å
20	P	56.3	Low	56.7	Low	127 Å²	127	141.1 Å²	141.1	83%	0.825	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-53.9	121.3	-179.8	21.3	-30.6	0	0	0	108.6	K22	P20-K22 PolarHBondContact O-N 3.04Å; P20-K22 VanDerWaalsContact O-N 3.16Å
21	V	60.9	Low	57.9	Low	128 Å²	128	134.6 Å²	134.6	78%	0.776	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-49.8	125.3	178.6	179.5	0	0	0	0	107.3	P19 R23	P19-V21 PolarHBondContact O-N 3.33Å; V21-R23 PolarHBondContact O-N 2.71Å
22	K	54.9	Low	59.2	Low	203 Å²	203	140 Å²	140	88%	0.883	66%	0.658	S	S	*	*			trans	-52.5	115.3	173.6	-70	-173.3	178.9	-178.9	0	107.2	P20 S24	P20-K22 PolarHBondContact O-N 3.04Å; P20-K22 VanDerWaalsContact O-N 3.16Å; K22-S24 PolarHBondContact O-N 3.35Å; K22-S24 VanDerWaalsContact O-N 3.17Å
23	R	61.5	Low	60.5	Low	165 Å²	165	138.8 Å²	138.8	62%	0.623	65%	0.648	S	S	*	*			trans	-64	118.4	-175.6	-68.7	-178.4	177.5	177.5	-2.3	108.4	V21 L25 E39	V21-R23 PolarHBondContact O-N 2.71Å; R23-L25 PolarHBondContact O-N 3.09Å; R23-E39 IonicContact CZ-OE1 3.28Å; R23-E39 VanDerWaalsContact CZ-OE1 3.28Å; R23-E39 IonicContact NE-OE1 3.67Å; R23-E39 IonicContact NH1-OE1 3.33Å; R23-E39 PolarHBondContact NH1-OE1 3.03Å; R23-E39 IonicContact NH2-OE1 3.59Å
24	S	74.4	Confident	61.6	Low	66 Å²	66	133.9 Å²	133.9	46%	0.462	63%	0.63	S	S	.	*			trans	-55.9	137.3	172.2	170	0	0	0	0	109.5	K22 V26 Y27 Y28	K22-S24 PolarHBondContact O-N 3.35Å; K22-S24 VanDerWaalsContact O-N 3.17Å; S24-V26 PolarHBondContact O-N 3.07Å; S24-V26 PolarHBondContact OG-N 2.68Å; S24-Y27 WeakPolarHBondContact O-CA 3.28Å; S24-Y27 VanDerWaalsContact O-CB 3.28Å; S24-Y27 WeakPolarHBondContact O-CB 3.44Å; S24-Y27 PolarHBondContact O-N 3.02Å; S24-Y28 PolarHBondContact O-N 3.29Å
25	L	74.4	Confident	62.7	Low	123 Å²	123	134.9 Å²	134.9	64%	0.644	63%	0.628	S	S	*	*	H	α-helix	trans	-56.2	-36.7	176	178.5	64.2	0	0	0	111.2	R23 Y27 Y28 L29	R23-L25 PolarHBondContact O-N 3.09Å; L25-Y27 VanDerWaalsContact C-N 3.28Å; L25-Y27 PolarHBondContact O-N 3.31Å; L25-Y28 PolarHBondContact O-N 3.08Å; L25-L29 HydrophobicContact CD1-CD1 4.31Å; L25-L29 HydrophobicContact CD1-CG 4.25Å; L25-L29 HydrophobicContact CG-CD1 4.02Å; L25-L29 HydrophobicContact CG-CG 4.39Å; L25-L29 WeakPolarHBondContact O-CG 3.34Å; L25-L29 PolarHBondContact O-N 2.9Å
26	V	74.9	Confident	63.3	Low	97 Å²	97	125.8 Å²	125.8	59%	0.588	60%	0.597	S	S	*	*	H	α-helix	trans	-58.2	-44.2	174.7	178.9	0	0	0	0	110.7	S24 L29 K30	S24-V26 PolarHBondContact O-N 3.07Å; S24-V26 PolarHBondContact OG-N 2.68Å; V26-L29 PolarHBondContact O-N 3.06Å; V26-K30 WeakPolarHBondContact O-CB 3.42Å; V26-K30 PolarHBondContact O-N 2.79Å
27	Y	68.1	Low	64	Low	49 Å²	49	125.4 Å²	125.4	19%	0.192	60%	0.599	C	S	.	*	H	α-helix	trans	-66.7	-40.8	180	-177.2	-78.7	0	0	0	111.4	S24 L25 N31 E39 Y42 L46	S24-Y27 WeakPolarHBondContact O-CA 3.28Å; S24-Y27 VanDerWaalsContact O-CB 3.28Å; S24-Y27 WeakPolarHBondContact O-CB 3.44Å; S24-Y27 PolarHBondContact O-N 3.02Å; L25-Y27 VanDerWaalsContact C-N 3.28Å; L25-Y27 PolarHBondContact O-N 3.31Å; Y27-N31 WeakPolarHBondContact CE1-ND2 3.31Å; Y27-N31 PolarHBondContact O-N 3.32Å; Y27-N31 VanDerWaalsContact O-N 3.09Å; Y27-E39 WeakPolarHBondContact CE1-OE2 2.98Å; Y27-E39 VanDerWaalsContact CZ-OE2 3.23Å; Y27-E39 PolarHBondContact OH-O 3.23Å; Y27-E39 PolarHBondContact OH-OE2 3.03Å; Y27-Y42 AromaticContact CD2-CD1 3.69Å; Y27-Y42 HydrophobicContact CD2-CD1 3.69Å; Y27-Y42 AromaticContact CD2-CE1 3.52Å; Y27-Y42 HydrophobicContact CD2-CE1 3.52Å; Y27-Y42 HydrophobicContact CE1-CD1 4.42Å; Y27-Y42 AromaticContact CE2-CD1 3.44Å; Y27-Y42 HydrophobicContact CE2-CD1 3.44Å; Y27-Y42 VanDerWaalsContact CE2-CD1 3.44Å; Y27-Y42 AromaticContact CE2-CE1 3.79Å; Y27-Y42 HydrophobicContact CE2-CE1 3.79Å; Y27-Y42 HydrophobicContact CG-CD1 4.28Å; Y27-Y42 HydrophobicContact CG-CE1 4.02Å; Y27-Y42 AromaticContact CZ-CD1 3.84Å; Y27-L46 HydrophobicContact CD2-CD1 4.29Å; Y27-L46 HydrophobicContact CE2-CD1 4.47Å
28	Y	70.6	Confident	64.6	Low	126 Å²	126	119 Å²	119	49%	0.494	58%	0.583	S	S	.	*	H	α-helix	trans	-63.5	-46.6	174.9	176.4	-97.6	0	0	0	112.7	S24 L25 R32	S24-Y28 PolarHBondContact O-N 3.29Å; L25-Y28 PolarHBondContact O-N 3.08Å; Y28-R32 PolarHBondContact O-N 3.27Å
29	L	73.8	Confident	65.2	Low	92 Å²	92	114.6 Å²	114.6	48%	0.482	56%	0.558	S	S	.	*	H	α-helix	trans	-65.1	-42.2	-178.8	-69.9	173.3	0	0	0	111.8	L25 V26 R32 E33	L25-L29 HydrophobicContact CD1-CD1 4.31Å; L25-L29 HydrophobicContact CD1-CG 4.25Å; L25-L29 HydrophobicContact CG-CD1 4.02Å; L25-L29 HydrophobicContact CG-CG 4.39Å; L25-L29 WeakPolarHBondContact O-CG 3.34Å; L25-L29 PolarHBondContact O-N 2.9Å; V26-L29 PolarHBondContact O-N 3.06Å; L29-R32 WeakPolarHBondContact O-CB 3.18Å; L29-R32 PolarHBondContact O-N 3.42Å; L29-E33 PolarHBondContact O-N 3.14Å; L29-E33 VanDerWaalsContact O-N 3.08Å
30	K	71.3	Confident	66	Low	80 Å²	80	114.2 Å²	114.2	35%	0.348	55%	0.554	S	S	.	*	H	α-helix	trans	-71.8	-34.4	179.8	-76.9	-74.3	174.1	-162.2	0	113.4	V26 R32 E33 V34 Y42	V26-K30 WeakPolarHBondContact O-CB 3.42Å; V26-K30 PolarHBondContact O-N 2.79Å; K30-R32 PolarHBondContact O-N 3.14Å; K30-E33 VanDerWaalsContact CD-OE2 3.31Å; K30-E33 WeakPolarHBondContact CD-OE2 2.84Å; K30-E33 VanDerWaalsContact CE-OE2 3.31Å; K30-E33 WeakPolarHBondContact CE-OE2 3.31Å; K30-E33 IonicContact NZ-OE1 3.03Å; K30-E33 PolarHBondContact NZ-OE1 2.82Å; K30-E33 IonicContact NZ-OE2 2.71Å; K30-E33 PolarHBondContact NZ-OE2 3.5Å; K30-E33 PolarHBondContact O-N 2.65Å; K30-V34 WeakPolarHBondContact O-CG2 3.43Å; K30-V34 PolarHBondContact O-N 3.35Å; K30-V34 VanDerWaalsContact O-N 3.07Å; K30-Y42 HydrophobicContact CB-CE1 4.2Å; K30-Y42 HydrophobicContact CB-CE2 3.63Å; K30-Y42 WeakPolarHBondContact CB-OH 3.36Å; K30-Y42 WeakPolarHBondContact CG-OH 3Å
31	N	67.1	Low	66.6	Low	18 Å²	18	110.3 Å²	110.3	10%	0.096	53%	0.53	C	S	.	.	H	α-helix	trans	-56	-40.6	170.4	-87.9	-8.2	0	0	0	112	Y27 E39 Y42	Y27-N31 WeakPolarHBondContact CE1-ND2 3.31Å; Y27-N31 PolarHBondContact O-N 3.32Å; Y27-N31 VanDerWaalsContact O-N 3.09Å; N31-E39 PolarHBondContact ND2-OE1 2.87Å; N31-Y42 WeakPolarHBondContact OD1-CB 3.48Å; N31-Y42 WeakPolarHBondContact OD1-CD1 3.37Å
32	R	69.6	Low	67.1	Low	187 Å²	187	105 Å²	105	71%	0.706	50%	0.496	S	S	*	.	H	α-helix	trans	-70.9	-38.5	179.5	-166.9	177.4	173.3	-177	-3	112.3	Y28 L29 K30 R35	Y28-R32 PolarHBondContact O-N 3.27Å; L29-R32 WeakPolarHBondContact O-CB 3.18Å; L29-R32 PolarHBondContact O-N 3.42Å; K30-R32 PolarHBondContact O-N 3.14Å; R32-R35 PolarHBondContact O-N 3.34Å
33	E	70.8	Confident	68	Low	128 Å²	128	97.3 Å²	97.3	60%	0.598	47%	0.468	S	S	*	.	H	α-helix	trans	-65.7	-42	179.2	-168.3	-178.2	153	0	0	112.4	L29 K30 R35	L29-E33 PolarHBondContact O-N 3.14Å; L29-E33 VanDerWaalsContact O-N 3.08Å; K30-E33 VanDerWaalsContact CD-OE2 3.31Å; K30-E33 WeakPolarHBondContact CD-OE2 2.84Å; K30-E33 VanDerWaalsContact CE-OE2 3.31Å; K30-E33 WeakPolarHBondContact CE-OE2 3.31Å; K30-E33 IonicContact NZ-OE1 3.03Å; K30-E33 PolarHBondContact NZ-OE1 2.82Å; K30-E33 IonicContact NZ-OE2 2.71Å; K30-E33 PolarHBondContact NZ-OE2 3.5Å; K30-E33 PolarHBondContact O-N 2.65Å; E33-R35 PolarHBondContact O-N 2.86Å
34	V	67.1	Low	68.8	Low	70 Å²	70	98.7 Å²	98.7	42%	0.424	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	0.9	-177.6	-163.6	0	0	0	0	112.2	K30 L36	K30-V34 WeakPolarHBondContact O-CG2 3.43Å; K30-V34 PolarHBondContact O-N 3.35Å; K30-V34 VanDerWaalsContact O-N 3.07Å; V34-L36 HydrophobicContact CB-CD1 3.9Å; V34-L36 HydrophobicContact CB-CG 3.89Å; V34-L36 HydrophobicContact CG1-CD1 3.51Å; V34-L36 HydrophobicContact CG1-CD2 4.32Å; V34-L36 HydrophobicContact CG1-CG 3.59Å; V34-L36 PolarHBondContact O-N 3.18Å
35	R	65.9	Low	69.2	Low	227 Å²	227	99.3 Å²	99.3	86%	0.857	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	27.9	-175	-73.3	-177.7	173.4	-179.9	-1.3	113.4	R32 E33 Q37	R32-R35 PolarHBondContact O-N 3.34Å; E33-R35 PolarHBondContact O-N 2.86Å; R35-Q37 PolarHBondContact O-N 2.96Å
36	L	61.4	Low	69.6	Low	48 Å²	48	96.8 Å²	96.8	25%	0.251	46%	0.461	S	S	.	.			trans	-79.7	111.1	-179.1	-70.5	173.8	0	0	0	108.6	V34 N38 S41 Y42 V45	V34-L36 HydrophobicContact CB-CD1 3.9Å; V34-L36 HydrophobicContact CB-CG 3.89Å; V34-L36 HydrophobicContact CG1-CD1 3.51Å; V34-L36 HydrophobicContact CG1-CD2 4.32Å; V34-L36 HydrophobicContact CG1-CG 3.59Å; V34-L36 PolarHBondContact O-N 3.18Å; L36-N38 PolarHBondContact O-N 3.36Å; L36-N38 VanDerWaalsContact O-N 3.14Å; L36-S41 WeakPolarHBondContact CD2-OG 3.03Å; L36-Y42 HydrophobicContact CD1-CD2 4.44Å; L36-V45 HydrophobicContact CD1-CG2 4.38Å
37	Q	60.1	Low	70	Confident	193 Å²	193	98.3 Å²	98.3	90%	0.902	46%	0.461	S	S	*	.	S	Bend	trans	-65.9	-14.5	-176.4	-66.8	-175.9	-10.6	0	0	113.7	R35	R35-Q37 PolarHBondContact O-N 2.96Å
38	N	61.3	Low	70.9	Confident	110 Å²	110	97.5 Å²	97.5	59%	0.588	47%	0.468	S	S	*	.			trans	-129.8	129	-175.8	-79.1	-24.3	0	0	0	112.8	L36 T40 S41	L36-N38 PolarHBondContact O-N 3.36Å; L36-N38 VanDerWaalsContact O-N 3.14Å; N38-T40 PolarHBondContact O-N 3.18Å; N38-S41 VanDerWaalsContact O-CB 3.23Å; N38-S41 WeakPolarHBondContact O-CB 3.31Å; N38-S41 PolarHBondContact O-N 3.47Å
39	E	59.8	Low	71.7	Confident	66 Å²	66	98 Å²	98	31%	0.308	47%	0.469	S	S	.	.	H	α-helix	trans	-49.6	-36.3	174.2	-73.8	-82.2	152	0	0	114	R23 Y27 N31 S41 Y42 S43	R23-E39 IonicContact CZ-OE1 3.28Å; R23-E39 VanDerWaalsContact CZ-OE1 3.28Å; R23-E39 IonicContact NE-OE1 3.67Å; R23-E39 IonicContact NH1-OE1 3.33Å; R23-E39 PolarHBondContact NH1-OE1 3.03Å; R23-E39 IonicContact NH2-OE1 3.59Å; Y27-E39 WeakPolarHBondContact CE1-OE2 2.98Å; Y27-E39 VanDerWaalsContact CZ-OE2 3.23Å; Y27-E39 PolarHBondContact OH-O 3.23Å; Y27-E39 PolarHBondContact OH-OE2 3.03Å; N31-E39 PolarHBondContact ND2-OE1 2.87Å; E39-S41 PolarHBondContact O-N 3.35Å; E39-Y42 PolarHBondContact O-N 2.92Å; E39-S43 PolarHBondContact O-N 3.19Å
40	T	61.8	Low	72.4	Confident	96 Å²	96	95.8 Å²	95.8	59%	0.589	47%	0.465	S	S	*	.	H	α-helix	trans	-66.5	-25	177.2	44.7	0	0	0	0	113.3	N38 R44	N38-T40 PolarHBondContact O-N 3.18Å; T40-R44 VanDerWaalsContact O-CG 3.31Å; T40-R44 WeakPolarHBondContact O-CG 3.23Å; T40-R44 PolarHBondContact O-N 2.93Å
41	S	68.6	Low	73.3	Confident	45 Å²	45	94.8 Å²	94.8	32%	0.315	47%	0.471	S	S	.	.	H	α-helix	trans	-74.1	-43.7	179.1	-168.5	0	0	0	0	111.3	L36 N38 E39 R44 V45	L36-S41 WeakPolarHBondContact CD2-OG 3.03Å; N38-S41 VanDerWaalsContact O-CB 3.23Å; N38-S41 WeakPolarHBondContact O-CB 3.31Å; N38-S41 PolarHBondContact O-N 3.47Å; E39-S41 PolarHBondContact O-N 3.35Å; S41-R44 PolarHBondContact O-N 3.35Å; S41-V45 WeakPolarHBondContact O-CG2 3.22Å; S41-V45 PolarHBondContact O-N 2.93Å
42	Y	71.1	Confident	74.5	Confident	15 Å²	15	100.8 Å²	100.8	6%	0.059	50%	0.498	C	S	.	.	H	α-helix	trans	-72.3	-39.4	-178.2	-177.9	-112.3	0	0	0	113.3	Y27 K30 N31 L36 E39 R44 V45 L46	Y27-Y42 AromaticContact CD2-CD1 3.69Å; Y27-Y42 HydrophobicContact CD2-CD1 3.69Å; Y27-Y42 AromaticContact CD2-CE1 3.52Å; Y27-Y42 HydrophobicContact CD2-CE1 3.52Å; Y27-Y42 HydrophobicContact CE1-CD1 4.42Å; Y27-Y42 AromaticContact CE2-CD1 3.44Å; Y27-Y42 HydrophobicContact CE2-CD1 3.44Å; Y27-Y42 VanDerWaalsContact CE2-CD1 3.44Å; Y27-Y42 AromaticContact CE2-CE1 3.79Å; Y27-Y42 HydrophobicContact CE2-CE1 3.79Å; Y27-Y42 HydrophobicContact CG-CD1 4.28Å; Y27-Y42 HydrophobicContact CG-CE1 4.02Å; Y27-Y42 AromaticContact CZ-CD1 3.84Å; K30-Y42 HydrophobicContact CB-CE1 4.2Å; K30-Y42 HydrophobicContact CB-CE2 3.63Å; K30-Y42 WeakPolarHBondContact CB-OH 3.36Å; K30-Y42 WeakPolarHBondContact CG-OH 3Å; N31-Y42 WeakPolarHBondContact OD1-CB 3.48Å; N31-Y42 WeakPolarHBondContact OD1-CD1 3.37Å; L36-Y42 HydrophobicContact CD1-CD2 4.44Å; E39-Y42 PolarHBondContact O-N 2.92Å; Y42-R44 VanDerWaalsContact C-N 3.27Å; Y42-R44 PolarHBondContact O-N 3Å; Y42-V45 PolarHBondContact O-N 3.31Å; Y42-L46 HydrophobicContact CD1-CD1 3.83Å; Y42-L46 HydrophobicContact CD1-CG 4.28Å; Y42-L46 HydrophobicContact CE1-CD1 3.27Å; Y42-L46 HydrophobicContact CE1-CD2 4.48Å; Y42-L46 HydrophobicContact CE1-CG 3.85Å; Y42-L46 HydrophobicContact CE2-CD1 4.46Å; Y42-L46 HydrophobicContact CE2-CD2 4.39Å; Y42-L46 HydrophobicContact CE2-CG 4.14Å; Y42-L46 PolarHBondContact O-N 3.26Å
43	S	74.2	Confident	75.5	Confident	42 Å²	42	95.2 Å²	95.2	29%	0.294	48%	0.481	S	S	.	.	H	α-helix	trans	-57.5	-41.1	171.7	169.1	0	0	0	0	111.6	E39 L46 H47	E39-S43 PolarHBondContact O-N 3.19Å; S43-L46 PolarHBondContact O-N 3.08Å; S43-H47 WeakPolarHBondContact O-CB 3.26Å; S43-H47 PolarHBondContact O-CD2 2.92Å; S43-H47 PolarHBondContact O-N 3.26Å; S43-H47 PolarHBondContact OG-CD2 2.6Å; S43-H47 VanDerWaalsContact OG-CD2 3.32Å; S43-H47 PolarHBondContact OG-NE2 2.79Å
44	R	78.7	Confident	76.4	Confident	195 Å²	195	93.7 Å²	93.7	74%	0.736	48%	0.476	S	S	*	.	H	α-helix	trans	-64.2	-42.7	174.9	-75.9	176.5	-178.4	179.8	0.8	112.6	T40 S41 Y42 H47 G48	T40-R44 VanDerWaalsContact O-CG 3.31Å; T40-R44 WeakPolarHBondContact O-CG 3.23Å; T40-R44 PolarHBondContact O-N 2.93Å; S41-R44 PolarHBondContact O-N 3.35Å; Y42-R44 VanDerWaalsContact C-N 3.27Å; Y42-R44 PolarHBondContact O-N 3Å; R44-H47 PolarHBondContact O-N 3.31Å; R44-G48 PolarHBondContact O-N 3.42Å
45	V	82.3	Confident	77.4	Confident	79 Å²	79	94.8 Å²	94.8	48%	0.479	48%	0.484	S	S	.	.	H	α-helix	trans	-62.2	-44.4	175.9	172.8	0	0	0	0	110.9	L36 S41 Y42 G48 Y49	L36-V45 HydrophobicContact CD1-CG2 4.38Å; S41-V45 WeakPolarHBondContact O-CG2 3.22Å; S41-V45 PolarHBondContact O-N 2.93Å; Y42-V45 PolarHBondContact O-N 3.31Å; V45-G48 PolarHBondContact O-N 2.83Å; V45-Y49 WeakPolarHBondContact O-CB 3.46Å; V45-Y49 PolarHBondContact O-N 2.91Å
46	L	82.2	Confident	78.6	Confident	70 Å²	70	88 Å²	88	37%	0.366	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-43	175.5	-77.2	179.9	0	0	0	112.6	Y27 Y42 S43 G48 Y49 A50	Y27-L46 HydrophobicContact CD2-CD1 4.29Å; Y27-L46 HydrophobicContact CE2-CD1 4.47Å; Y42-L46 HydrophobicContact CD1-CD1 3.83Å; Y42-L46 HydrophobicContact CD1-CG 4.28Å; Y42-L46 HydrophobicContact CE1-CD1 3.27Å; Y42-L46 HydrophobicContact CE1-CD2 4.48Å; Y42-L46 HydrophobicContact CE1-CG 3.85Å; Y42-L46 HydrophobicContact CE2-CD1 4.46Å; Y42-L46 HydrophobicContact CE2-CD2 4.39Å; Y42-L46 HydrophobicContact CE2-CG 4.14Å; Y42-L46 PolarHBondContact O-N 3.26Å; S43-L46 PolarHBondContact O-N 3.08Å; L46-G48 VanDerWaalsContact C-N 3.34Å; L46-Y49 PolarHBondContact O-N 2.92Å; L46-A50 VanDerWaalsContact O-CB 3.24Å; L46-A50 WeakPolarHBondContact O-CB 3.45Å; L46-A50 PolarHBondContact O-N 2.87Å
47	H	84.6	Confident	80	Confident	129 Å²	129	91.7 Å²	91.7	60%	0.597	49%	0.491	S	S	*	.	H	α-helix	trans	-63.1	-41.4	175.1	-80	-61.9	0	0	0	111.6	S43 R44 A50 A51	S43-H47 WeakPolarHBondContact O-CB 3.26Å; S43-H47 PolarHBondContact O-CD2 2.92Å; S43-H47 PolarHBondContact O-N 3.26Å; S43-H47 PolarHBondContact OG-CD2 2.6Å; S43-H47 VanDerWaalsContact OG-CD2 3.32Å; S43-H47 PolarHBondContact OG-NE2 2.79Å; R44-H47 PolarHBondContact O-N 3.31Å; H47-A50 PolarHBondContact O-N 3.13Å; H47-A51 VanDerWaalsContact O-CB 3.24Å; H47-A51 WeakPolarHBondContact O-CB 3.2Å; H47-A51 PolarHBondContact O-N 3.27Å
48	G	87.3	Confident	81.3	Confident	32 Å²	32	88.9 Å²	88.9	33%	0.33	48%	0.482	S	S	.	.	H	α-helix	trans	-62.4	-46.2	175.2	0	0	0	0	0	112	R44 V45 L46 A51 Q52	R44-G48 PolarHBondContact O-N 3.42Å; V45-G48 PolarHBondContact O-N 2.83Å; L46-G48 VanDerWaalsContact C-N 3.34Å; G48-A51 PolarHBondContact O-N 3.39Å; G48-Q52 VanDerWaalsContact O-CG 3.31Å; G48-Q52 WeakPolarHBondContact O-CG 3.4Å; G48-Q52 PolarHBondContact O-N 2.7Å
49	Y	86.6	Confident	82.7	Confident	136 Å²	136	93 Å²	93	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-62.9	-47.8	175.5	-179.5	-98.9	0	0	0	111.8	V45 L46 A51 Q52 Q53	V45-Y49 WeakPolarHBondContact O-CB 3.46Å; V45-Y49 PolarHBondContact O-N 2.91Å; L46-Y49 PolarHBondContact O-N 2.92Å; Y49-A51 VanDerWaalsContact C-N 3.33Å; Y49-A51 PolarHBondContact O-N 3.43Å; Y49-Q52 WeakPolarHBondContact O-CB 3.31Å; Y49-Q52 PolarHBondContact O-N 2.83Å; Y49-Q52 VanDerWaalsContact O-N 3.13Å; Y49-Q53 HydrophobicContact CD1-CG 4.18Å; Y49-Q53 HydrophobicContact CE1-CG 3.73Å; Y49-Q53 HydrophobicContact CE2-CG 4.1Å; Y49-Q53 WeakPolarHBondContact O-CG 3.35Å; Y49-Q53 PolarHBondContact O-N 2.78Å
50	A	88.3	Confident	84.1	Confident	46 Å²	46	97.7 Å²	97.7	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-59.5	-42.8	176.6	0	0	0	0	0	111.6	L46 H47 Q52 Q53 L54	L46-A50 VanDerWaalsContact O-CB 3.24Å; L46-A50 WeakPolarHBondContact O-CB 3.45Å; L46-A50 PolarHBondContact O-N 2.87Å; H47-A50 PolarHBondContact O-N 3.13Å; A50-Q52 VanDerWaalsContact C-N 3.3Å; A50-Q52 PolarHBondContact O-N 2.91Å; A50-Q53 PolarHBondContact O-N 3.23Å; A50-L54 WeakPolarHBondContact O-CB 2.98Å; A50-L54 VanDerWaalsContact O-CG 3.3Å; A50-L54 WeakPolarHBondContact O-CG 3.4Å; A50-L54 PolarHBondContact O-N 2.59Å
51	A	90.9	Very high	85.4	Confident	59 Å²	59	100.1 Å²	100.1	49%	0.488	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-36.8	175.5	0	0	0	0	0	112.6	H47 G48 Y49 P55	H47-A51 VanDerWaalsContact O-CB 3.24Å; H47-A51 WeakPolarHBondContact O-CB 3.2Å; H47-A51 PolarHBondContact O-N 3.27Å; G48-A51 PolarHBondContact O-N 3.39Å; Y49-A51 VanDerWaalsContact C-N 3.33Å; Y49-A51 PolarHBondContact O-N 3.43Å; A51-P55 VanDerWaalsContact O-CD 3.22Å; A51-P55 WeakPolarHBondContact O-CD 3.49Å
52	Q	91.5	Very high	86.5	Confident	143 Å²	143	104.3 Å²	104.3	67%	0.668	53%	0.53	S	S	*	.	H	α-helix	trans	-69.9	-33.3	174.8	-72.6	171.4	-0.5	0	0	112.8	G48 Y49 A50	G48-Q52 VanDerWaalsContact O-CG 3.31Å; G48-Q52 WeakPolarHBondContact O-CG 3.4Å; G48-Q52 PolarHBondContact O-N 2.7Å; Y49-Q52 WeakPolarHBondContact O-CB 3.31Å; Y49-Q52 PolarHBondContact O-N 2.83Å; Y49-Q52 VanDerWaalsContact O-N 3.13Å; A50-Q52 VanDerWaalsContact C-N 3.3Å; A50-Q52 PolarHBondContact O-N 2.91Å
53	Q	91.9	Very high	87.3	Confident	71 Å²	71	106.8 Å²	106.8	33%	0.332	54%	0.541	S	S	.	.	H	α-helix	trans	-85.5	-23.8	178.8	-61.6	-52.3	-52.3	0	0	113.2	Y49 A50 S56 L57	Y49-Q53 HydrophobicContact CD1-CG 4.18Å; Y49-Q53 HydrophobicContact CE1-CG 3.73Å; Y49-Q53 HydrophobicContact CE2-CG 4.1Å; Y49-Q53 WeakPolarHBondContact O-CG 3.35Å; Y49-Q53 PolarHBondContact O-N 2.78Å; A50-Q53 PolarHBondContact O-N 3.23Å; Q53-S56 PolarHBondContact O-N 3.02Å; Q53-S56 VanDerWaalsContact O-N 3.09Å; Q53-S56 PolarHBondContact O-OG 3.32Å; Q53-L57 HydrophobicContact CB-CD1 4.39Å; Q53-L57 WeakPolarHBondContact O-CG 3.41Å; Q53-L57 PolarHBondContact O-N 2.82Å
54	L	88.6	Confident	88.1	Confident	96 Å²	96	112.7 Å²	112.7	50%	0.503	56%	0.563	S	S	.	*	H	α-helix	trans	-51.9	-47.8	-177.2	-91.8	168.5	0	0	0	113	A50 S56 L57 L58	A50-L54 WeakPolarHBondContact O-CB 2.98Å; A50-L54 VanDerWaalsContact O-CG 3.3Å; A50-L54 WeakPolarHBondContact O-CG 3.4Å; A50-L54 PolarHBondContact O-N 2.59Å; L54-S56 VanDerWaalsContact C-N 3.28Å; L54-S56 PolarHBondContact O-N 3.2Å; L54-L57 PolarHBondContact O-N 3.01Å; L54-L57 VanDerWaalsContact O-N 3.1Å; L54-L58 WeakPolarHBondContact O-CG 3.44Å; L54-L58 PolarHBondContact O-N 3.42Å; L54-L58 VanDerWaalsContact O-N 3.13Å
55	P	89.4	Confident	88.6	Confident	92 Å²	92	105.8 Å²	105.8	60%	0.597	54%	0.541	S	S	*	.	H	α-helix	trans	-58.4	-35.1	179.1	-26.4	35.1	0	0	0	114.4	A51	A51-P55 VanDerWaalsContact O-CD 3.22Å; A51-P55 WeakPolarHBondContact O-CD 3.49Å
56	S	90.5	Very high	89	Confident	86 Å²	86	105.6 Å²	105.6	60%	0.601	56%	0.555	S	S	*	*	H	α-helix	trans	-80.6	-18.1	179.9	63.5	0	0	0	0	113.2	Q53 L54	Q53-S56 PolarHBondContact O-N 3.02Å; Q53-S56 VanDerWaalsContact O-N 3.09Å; Q53-S56 PolarHBondContact O-OG 3.32Å; L54-S56 VanDerWaalsContact C-N 3.28Å; L54-S56 PolarHBondContact O-N 3.2Å
57	L	90.6	Very high	89.4	Confident	125 Å²	125	108.6 Å²	108.6	65%	0.654	58%	0.576	S	S	*	*	H	α-helix	trans	-86.9	-23.6	176	-65.9	174.1	0	0	0	112.9	Q53 L54 K59	Q53-L57 HydrophobicContact CB-CD1 4.39Å; Q53-L57 WeakPolarHBondContact O-CG 3.41Å; Q53-L57 PolarHBondContact O-N 2.82Å; L54-L57 PolarHBondContact O-N 3.01Å; L54-L57 VanDerWaalsContact O-N 3.1Å; L57-K59 PolarHBondContact O-N 2.9Å
58	L	87.9	Confident	89.7	Confident	134 Å²	134	103.4 Å²	103.4	70%	0.702	55%	0.553	S	S	*	*			trans	-69.5	115.2	177.3	-68.5	174.8	0	0	0	109.6	L54	L54-L58 WeakPolarHBondContact O-CG 3.44Å; L54-L58 PolarHBondContact O-N 3.42Å; L54-L58 VanDerWaalsContact O-N 3.13Å
59	K	89.6	Confident	89.9	Confident	196 Å²	196	105 Å²	105	85%	0.852	55%	0.554	S	S	*	*			trans	-102.7	121.4	168.7	-68.2	-172.8	178.1	-176.4	0	108.7	L57	L57-K59 PolarHBondContact O-N 2.9Å
60	E	89	Confident	90.3	Very high	165 Å²	165	105.5 Å²	105.5	77%	0.771	56%	0.558	S	S	*	*			trans	-67.2	139.5	173.4	-175.8	167.9	-169.5	0	0	110.3	E62	E60-E62 HydrophobicContact CG-CG 4.3Å
61	R	89.9	Confident	90.7	Very high	146 Å²	146	105.9 Å²	105.9	55%	0.551	56%	0.556	S	S	*	*			trans	-124	111.6	167.1	-179.8	-179.3	177.1	-163.8	-3.9	107.4	F63 V96 Q97 S99	R61-F63 HydrophobicContact CG-CE2 4.38Å; R61-F63 WeakPolarHBondContact O-CD2 3.3Å; R61-V96 PolarHBondContact NH1-O 3.23Å; R61-Q97 PolarHBondContact NH2-O 3.25Å; R61-S99 PolarHBondContact NH2-OG 2.81Å
62	E	90.7	Very high	91	Very high	134 Å²	134	107.2 Å²	107.2	63%	0.626	55%	0.551	S	S	*	*			trans	-76.9	145.7	179.3	-66.2	-176.2	-174.6	0	0	111.7	E60	E60-E62 HydrophobicContact CG-CG 4.3Å
63	F	89.1	Confident	91.3	Very high	67 Å²	67	101 Å²	101	29%	0.294	52%	0.524	S	S	.	.			trans	-117.2	121.4	173	-72.7	-100.7	0	0	0	109.3	R61 L65 V94 V96 S99	R61-F63 HydrophobicContact CG-CE2 4.38Å; R61-F63 WeakPolarHBondContact O-CD2 3.3Å; F63-L65 PolarHBondContact O-N 3.18Å; F63-V94 HydrophobicContact CD1-CG2 3.88Å; F63-V94 HydrophobicContact CE1-CG2 4.08Å; F63-V96 HydrophobicContact CZ-CB 4.15Å; F63-S99 VanDerWaalsContact CE1-OG 3.29Å; F63-S99 WeakPolarHBondContact CE1-OG 3.31Å
64	H	90.2	Very high	91.5	Very high	165 Å²	165	101.2 Å²	101.2	76%	0.764	53%	0.534	S	S	*	.			trans	-80.1	114.9	176.7	-60.5	-59.4	0	0	0	110.6	G66	H64-G66 VanDerWaalsContact C-N 3.3Å; H64-G66 PolarHBondContact O-N 3.41Å
65	L	88.9	Confident	92	Very high	50 Å²	50	99 Å²	99	26%	0.262	52%	0.52	S	S	.	.			trans	-84.7	-2.2	-176.4	-53.2	-178.9	0	0	0	113.9	F63 T67 L68 V71 F92 I101	F63-L65 PolarHBondContact O-N 3.18Å; L65-T67 PolarHBondContact O-N 3.47Å; L65-L68 HydrophobicContact CB-CB 4.04Å; L65-L68 WeakPolarHBondContact O-CB 3.39Å; L65-L68 PolarHBondContact O-N 2.8Å; L65-V71 HydrophobicContact CD1-CG2 3.76Å; L65-F92 HydrophobicContact CD2-CE2 4.24Å; L65-F92 HydrophobicContact CD2-CZ 3.86Å; L65-I101 HydrophobicContact CD2-CD1 3.96Å
66	G	90.4	Very high	92.4	Very high	75 Å²	75	100.8 Å²	100.8	77%	0.773	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	-116.2	-179.1	0	0	0	0	0	112.1	H64	H64-G66 VanDerWaalsContact C-N 3.3Å; H64-G66 PolarHBondContact O-N 3.41Å
67	T	91.1	Very high	92.8	Very high	134 Å²	134	98.1 Å²	98.1	82%	0.822	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.7	-178.2	57.2	0	0	0	0	114	L65	L65-T67 PolarHBondContact O-N 3.47Å
68	L	91.4	Very high	93.1	Very high	19 Å²	19	95.1 Å²	95.1	10%	0.099	48%	0.479	C	S	.	.			trans	-74.2	141.9	178.7	-63.8	171.3	0	0	0	110.8	L65 T90 F92 I101	L65-L68 HydrophobicContact CB-CB 4.04Å; L65-L68 WeakPolarHBondContact O-CB 3.39Å; L65-L68 PolarHBondContact O-N 2.8Å; L68-T90 HydrophobicContact CD2-CG2 3.64Å; L68-F92 HydrophobicContact CD1-CD1 3.73Å; L68-F92 HydrophobicContact CD1-CD2 4.39Å; L68-F92 HydrophobicContact CD1-CE1 3.9Å; L68-F92 HydrophobicContact CD1-CG 3.97Å; L68-F92 HydrophobicContact CD1-CZ 4.3Å; L68-I101 HydrophobicContact CD1-CG2 3.9Å
69	N	91.9	Very high	93.5	Very high	66 Å²	66	96.4 Å²	96.4	35%	0.353	48%	0.481	S	S	.	.			trans	-76.8	178.5	174.9	-150.1	-48.8	0	0	0	111.1	K87 C88	N69-K87 HydrophobicContact CB-CB 4.11Å; N69-C88 HydrophobicContact CB-CB 3.74Å; N69-C88 VanDerWaalsContact CB-SG 3.59Å; N69-C88 PolarHBondContact N-SG 2.8Å
70	K	94.4	Very high	93.8	Very high	146 Å²	146	91.1 Å²	91.1	64%	0.635	46%	0.456	S	S	*	.			trans	-50.2	138.5	-179.6	-58	-178	-177.8	-158.7	0	111.8	F72 T86 K87	K70-F72 HydrophobicContact CB-CE1 4.3Å; K70-T86 CarbonylContact O-C 3.52Å; K70-T86 WeakPolarHBondContact O-CA 3.29Å; K70-T86 WeakPolarHBondContact O-CB 3.44Å; K70-K87 PolarHBondContact O-N 2.92Å
71	V	96.6	Very high	94.2	Very high	55 Å²	55	86.8 Å²	86.8	33%	0.333	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	127.8	171.3	179.1	0	0	0	0	108.6	L65 A73 C84 G85 T86 F92	L65-V71 HydrophobicContact CD1-CG2 3.76Å; V71-A73 VanDerWaalsContact CG1-O 3.27Å; V71-A73 WeakPolarHBondContact CG1-O 3.24Å; V71-C84 HydrophobicContact CG1-CB 3.99Å; V71-C84 HydrophobicContact CG2-CB 4.2Å; V71-G85 WeakPolarHBondContact CA-O 3.33Å; V71-T86 HydrophobicContact CG2-CG2 4.44Å; V71-F92 HydrophobicContact CG2-CE1 4Å; V71-F92 HydrophobicContact CG2-CZ 3.83Å
72	F	96.7	Very high	94.6	Very high	87 Å²	87	80.5 Å²	80.5	38%	0.382	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-32.7	177.8	-77.3	-11.5	0	0	0	112.4	K70 G85 K87 C120 I122 H123	K70-F72 HydrophobicContact CB-CE1 4.3Å; F72-G85 PolarHBondContact N-O 3.08Å; F72-K87 HydrophobicContact CD2-CB 4.14Å; F72-K87 HydrophobicContact CE1-CB 4.08Å; F72-K87 HydrophobicContact CE2-CB 3.56Å; F72-K87 HydrophobicContact CE2-CD 4.4Å; F72-K87 HydrophobicContact CE2-CG 3.7Å; F72-K87 HydrophobicContact CZ-CB 3.54Å; F72-K87 HydrophobicContact CZ-CD 3.84Å; F72-K87 HydrophobicContact CZ-CG 3.62Å; F72-C120 WeakPolarHBondContact CE2-O 3.32Å; F72-I122 WeakPolarHBondContact CB-O 3.39Å; F72-H123 AromaticContact CD2-CE1 3.35Å; F72-H123 WeakPolarHBondContact CD2-CE1 3.38Å; F72-H123 AromaticContact CD2-ND1 3.77Å; F72-H123 AromaticContact CD2-NE2 3.89Å; F72-H123 AromaticContact CE2-CE1 3.55Å
73	A	97.6	Very high	95	Very high	12 Å²	12	74.1 Å²	74.1	10%	0.099	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	147.7	177.3	0	0	0	0	0	110.1	V71 C84 G85 I125	V71-A73 VanDerWaalsContact CG1-O 3.27Å; V71-A73 WeakPolarHBondContact CG1-O 3.24Å; A73-C84 CarbonylContact O-C 3.5Å; A73-C84 WeakPolarHBondContact O-CA 3.41Å; A73-G85 PolarHBondContact N-O 2.89Å; A73-G85 PolarHBondContact O-N 3.42Å; A73-I125 HydrophobicContact CB-CB 4.32Å; A73-I125 HydrophobicContact CB-CD1 3.99Å; A73-I125 HydrophobicContact CB-CG1 3.81Å
74	S	98	Very high	95.4	Very high	76 Å²	76	71.4 Å²	71.4	53%	0.531	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	146	176.4	60.8	0	0	0	0	111	V83	S74-V83 CarbonylContact C-O 3.58Å; S74-V83 WeakPolarHBondContact CA-O 3.4Å
75	Q	98.3	Very high	95.7	Very high	48 Å²	48	63.6 Å²	63.6	22%	0.224	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	138.3	177.7	-176.3	58	-62.4	0	0	111	L77 V82 V83 I125 E126 L127	Q75-L77 PolarHBondContact O-N 2.86Å; Q75-V82 WeakPolarHBondContact O-CA 3.42Å; Q75-V83 HydrophobicContact CB-CG1 3.94Å; Q75-V83 PolarHBondContact N-O 3.33Å; Q75-V83 VanDerWaalsContact O-CG1 3.32Å; Q75-V83 WeakPolarHBondContact O-CG1 3.48Å; Q75-V83 PolarHBondContact O-N 3.06Å; Q75-I125 HydrophobicContact CB-CB 4.38Å; Q75-I125 HydrophobicContact CB-CG2 3.68Å; Q75-I125 HydrophobicContact CG-CG2 4.5Å; Q75-E126 PolarHBondContact NE2-OE2 3.4Å; Q75-L127 HydrophobicContact CG-CD1 3.86Å; Q75-L127 HydrophobicContact CG-CG 3.79Å
76	W	98.3	Very high	96.1	Very high	131 Å²	131	61.2 Å²	61.2	50%	0.496	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	119.3	175.2	-76.9	97.9	0	0	0	110	V82 V96 L127	W76-V82 HydrophobicContact CD2-CG2 3.57Å; W76-V82 HydrophobicContact CE3-CG2 3.32Å; W76-V82 HydrophobicContact CG-CG2 4.34Å; W76-V82 HydrophobicContact CH2-CG2 3.77Å; W76-V82 HydrophobicContact CZ2-CG2 3.93Å; W76-V82 HydrophobicContact CZ3-CG2 3.45Å; W76-V82 VanDerWaalsContact CZ3-CG2 3.45Å; W76-V96 HydrophobicContact CH2-CB 4.46Å; W76-V96 HydrophobicContact CH2-CG1 3.8Å; W76-V96 HydrophobicContact CH2-CG2 4.09Å; W76-V96 HydrophobicContact CZ3-CG1 3.95Å; W76-V96 HydrophobicContact CZ3-CG2 4.15Å; W76-L127 WeakPolarHBondContact O-CD1 3.24Å
77	L	98	Very high	96.3	Very high	29 Å²	29	62 Å²	62	15%	0.152	31%	0.306	C	S	.	.	S	Bend	trans	-79.6	-37.5	172.8	-63.6	-177.6	0	0	0	111.1	Q75 Q81 V83 V93 L127 L149 L152	Q75-L77 PolarHBondContact O-N 2.86Å; L77-Q81 HydrophobicContact CB-CB 4.37Å; L77-Q81 PolarHBondContact N-O 3.34Å; L77-V83 HydrophobicContact CD1-CB 4.03Å; L77-V83 HydrophobicContact CD1-CG1 4.46Å; L77-V83 HydrophobicContact CD2-CB 4.08Å; L77-V83 HydrophobicContact CD2-CG1 3.6Å; L77-V83 HydrophobicContact CG-CB 3.98Å; L77-V83 HydrophobicContact CG-CG1 3.91Å; L77-V93 HydrophobicContact CD1-CG1 4.36Å; L77-V93 HydrophobicContact CD1-CG2 3.85Å; L77-L127 HydrophobicContact CD2-CD2 4.15Å; L77-L149 HydrophobicContact CD2-CD2 3.9Å; L77-L152 HydrophobicContact CD1-CD1 4.19Å
78	N	96.3	Very high	96.3	Very high	62 Å²	62	58.3 Å²	58.3	33%	0.332	29%	0.285	S	S	.	.	S	Bend	trans	-158.5	-166.9	177.8	57.4	56.6	0	0	0	109.7	R80 Q81	N78-R80 PolarHBondContact O-N 2.84Å; N78-R80 VanDerWaalsContact O-N 3.13Å; N78-R80 WeakPolarHBondContact OD1-CA 3.46Å; N78-R80 PolarHBondContact OD1-N 3.37Å; N78-Q81 PolarHBondContact N-O 2.85Å; N78-Q81 PolarHBondContact ND2-OE1 3.39Å; N78-Q81 PolarHBondContact OD1-N 3.01Å
79	H	96.5	Very high	96.4	Very high	161 Å²	161	58.8 Å²	58.8	75%	0.745	29%	0.288	S	S	*	.	S	Bend	trans	-69.2	-5.2	-178.3	64.9	-85.9	0	0	0	114.8
80	R	96.3	Very high	96.5	Very high	85 Å²	85	57 Å²	57	32%	0.321	28%	0.28	S	S	.	.	S	Bend	trans	-131.1	-29.7	-171.9	-179.8	168.3	170.7	178.6	-16.4	113.6	N78 D95 V96 Q97	N78-R80 PolarHBondContact O-N 2.84Å; N78-R80 VanDerWaalsContact O-N 3.13Å; N78-R80 WeakPolarHBondContact OD1-CA 3.46Å; N78-R80 PolarHBondContact OD1-N 3.37Å; R80-D95 IonicContact CZ-OD1 3.76Å; R80-D95 IonicContact CZ-OD2 3.13Å; R80-D95 IonicContact NE-OD1 3.14Å; R80-D95 PolarHBondContact NE-OD1 2.85Å; R80-D95 VanDerWaalsContact NE-OD1 3.14Å; R80-D95 IonicContact NE-OD2 2.65Å; R80-D95 PolarHBondContact NE-OD2 3.13Å; R80-D95 IonicContact NH2-OD1 3.55Å; R80-D95 IonicContact NH2-OD2 2.79Å; R80-D95 PolarHBondContact NH2-OD2 3.41Å; R80-V96 VanDerWaalsContact O-CG2 3.31Å; R80-V96 WeakPolarHBondContact O-CG2 3.46Å; R80-V96 PolarHBondContact O-N 3.13Å; R80-Q97 HydrophobicContact CG-CG 4.28Å
81	Q	97.8	Very high	96.6	Very high	74 Å²	74	50.1 Å²	50.1	35%	0.346	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.3	-174.1	-68.5	175.1	-41.2	0	0	111.5	L77 N78 V93 V94	L77-Q81 HydrophobicContact CB-CB 4.37Å; L77-Q81 PolarHBondContact N-O 3.34Å; N78-Q81 PolarHBondContact N-O 2.85Å; N78-Q81 PolarHBondContact ND2-OE1 3.39Å; N78-Q81 PolarHBondContact OD1-N 3.01Å; Q81-V93 HydrophobicContact CB-CG1 3.81Å; Q81-V93 HydrophobicContact CG-CG1 4.06Å; Q81-V94 WeakPolarHBondContact CA-O 3.41Å
82	V	98.1	Very high	96.6	Very high	15 Å²	15	47.5 Å²	47.5	9%	0.091	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.1	173.4	-176.6	0	0	0	0	107.9	Q75 W76 V93 V94 V96	Q75-V82 WeakPolarHBondContact O-CA 3.42Å; W76-V82 HydrophobicContact CD2-CG2 3.57Å; W76-V82 HydrophobicContact CE3-CG2 3.32Å; W76-V82 HydrophobicContact CG-CG2 4.34Å; W76-V82 HydrophobicContact CH2-CG2 3.77Å; W76-V82 HydrophobicContact CZ2-CG2 3.93Å; W76-V82 HydrophobicContact CZ3-CG2 3.45Å; W76-V82 VanDerWaalsContact CZ3-CG2 3.45Å; V82-V93 CarbonylContact O-C 3.54Å; V82-V93 WeakPolarHBondContact O-CA 3.11Å; V82-V94 HydrophobicContact CB-CG1 3.89Å; V82-V94 PolarHBondContact N-O 3.23Å; V82-V94 PolarHBondContact O-N 2.99Å; V82-V96 HydrophobicContact CG2-CG1 3.83Å
83	V	98.5	Very high	96.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	139.9	167.7	61	0	0	0	0	109.3	S74 Q75 L77 L91 F92 V93 I125 L134	S74-V83 CarbonylContact C-O 3.58Å; S74-V83 WeakPolarHBondContact CA-O 3.4Å; Q75-V83 HydrophobicContact CB-CG1 3.94Å; Q75-V83 PolarHBondContact N-O 3.33Å; Q75-V83 VanDerWaalsContact O-CG1 3.32Å; Q75-V83 WeakPolarHBondContact O-CG1 3.48Å; Q75-V83 PolarHBondContact O-N 3.06Å; L77-V83 HydrophobicContact CD1-CB 4.03Å; L77-V83 HydrophobicContact CD1-CG1 4.46Å; L77-V83 HydrophobicContact CD2-CB 4.08Å; L77-V83 HydrophobicContact CD2-CG1 3.6Å; L77-V83 HydrophobicContact CG-CB 3.98Å; L77-V83 HydrophobicContact CG-CG1 3.91Å; V83-L91 HydrophobicContact CG2-CD1 3.45Å; V83-L91 VanDerWaalsContact CG2-CD1 3.45Å; V83-L91 HydrophobicContact CG2-CD2 4.5Å; V83-L91 HydrophobicContact CG2-CG 3.94Å; V83-F92 CarbonylContact C-O 3.6Å; V83-F92 WeakPolarHBondContact CA-O 3.38Å; V83-V93 HydrophobicContact CB-CG2 4.22Å; V83-V93 HydrophobicContact CG2-CG2 4.32Å; V83-I125 HydrophobicContact CG1-CG2 3.81Å; V83-L134 HydrophobicContact CG1-CD1 4.22Å; V83-L134 HydrophobicContact CG1-CD2 4.2Å; V83-L134 HydrophobicContact CG2-CD2 4.11Å
84	C	98.2	Very high	96.7	Very high	10 Å²	10	43.8 Å²	43.8	7%	0.068	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.6	-173.1	-66.1	0	0	0	0	110.2	V71 A73 L91 F92	V71-C84 HydrophobicContact CG1-CB 3.99Å; V71-C84 HydrophobicContact CG2-CB 4.2Å; A73-C84 CarbonylContact O-C 3.5Å; A73-C84 WeakPolarHBondContact O-CA 3.41Å; C84-L91 WeakPolarHBondContact O-CA 3.36Å; C84-F92 HydrophobicContact CB-CD1 3.86Å; C84-F92 HydrophobicContact CB-CD2 4.11Å; C84-F92 HydrophobicContact CB-CE1 3.39Å; C84-F92 HydrophobicContact CB-CE2 3.68Å; C84-F92 HydrophobicContact CB-CG 4.22Å; C84-F92 HydrophobicContact CB-CZ 3.3Å; C84-F92 PolarHBondContact N-O 3.36Å; C84-F92 PolarHBondContact O-N 2.93Å
85	G	97.3	Very high	96.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134.8	173.1	0	0	0	0	0	110.5	V71 F72 A73 I125	V71-G85 WeakPolarHBondContact CA-O 3.33Å; F72-G85 PolarHBondContact N-O 3.08Å; A73-G85 PolarHBondContact N-O 2.89Å; A73-G85 PolarHBondContact O-N 3.42Å; G85-I125 VanDerWaalsContact N-CD1 3.32Å
86	T	96.1	Very high	96.4	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	163.8	-172.8	67.5	0	0	0	0	114	K70 V71 C88 N89 T90 F92 G121 I122	K70-T86 CarbonylContact O-C 3.52Å; K70-T86 WeakPolarHBondContact O-CA 3.29Å; K70-T86 WeakPolarHBondContact O-CB 3.44Å; V71-T86 HydrophobicContact CG2-CG2 4.44Å; T86-C88 PolarHBondContact O-N 2.84Å; T86-C88 PolarHBondContact OG1-N 3.03Å; T86-C88 PolarHBondContact OG1-SG 3.5Å; T86-N89 PolarHBondContact O-N 3.43Å; T86-N89 VanDerWaalsContact O-N 3.14Å; T86-T90 PolarHBondContact N-O 2.9Å; T86-T90 WeakPolarHBondContact OG1-CB 3.29Å; T86-T90 PolarHBondContact OG1-N 2.97Å; T86-T90 PolarHBondContact OG1-O 2.84Å; T86-F92 HydrophobicContact CG2-CD1 3.86Å; T86-F92 HydrophobicContact CG2-CE1 3.44Å; T86-F92 VanDerWaalsContact CG2-CE1 3.44Å; T86-G121 CarbonylContact O-C 3.55Å; T86-G121 WeakPolarHBondContact O-CA 3.47Å; T86-I122 PolarHBondContact O-N 2.87Å
87	K	94.4	Very high	96.3	Very high	92 Å²	92	39.1 Å²	39.1	40%	0.4	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.6	169.6	-176.5	178.3	179.5	-177.6	0	113.4	N69 K70 F72 N89 G121	N69-K87 HydrophobicContact CB-CB 4.11Å; K70-K87 PolarHBondContact O-N 2.92Å; F72-K87 HydrophobicContact CD2-CB 4.14Å; F72-K87 HydrophobicContact CE1-CB 4.08Å; F72-K87 HydrophobicContact CE2-CB 3.56Å; F72-K87 HydrophobicContact CE2-CD 4.4Å; F72-K87 HydrophobicContact CE2-CG 3.7Å; F72-K87 HydrophobicContact CZ-CB 3.54Å; F72-K87 HydrophobicContact CZ-CD 3.84Å; F72-K87 HydrophobicContact CZ-CG 3.62Å; K87-N89 PolarHBondContact O-N 2.73Å; K87-G121 WeakPolarHBondContact O-CA 3.4Å; K87-G121 PolarHBondContact O-N 2.86Å
88	C	91.8	Very high	96.1	Very high	56 Å²	56	41.5 Å²	41.5	38%	0.378	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	25.7	179.3	62.9	0	0	0	0	113	N69 T86 T90	N69-C88 HydrophobicContact CB-CB 3.74Å; N69-C88 VanDerWaalsContact CB-SG 3.59Å; N69-C88 PolarHBondContact N-SG 2.8Å; T86-C88 PolarHBondContact O-N 2.84Å; T86-C88 PolarHBondContact OG1-N 3.03Å; T86-C88 PolarHBondContact OG1-SG 3.5Å; C88-T90 VanDerWaalsContact C-N 3.29Å; C88-T90 PolarHBondContact O-N 2.87Å; C88-T90 PolarHBondContact O-OG1 3.38Å; C88-T90 PolarHBondContact SG-OG1 3.07Å
89	N	92.6	Very high	96	Very high	30 Å²	30	40.9 Å²	40.9	16%	0.16	21%	0.211	C	C	.	.	S	Bend	trans	53	42	179.4	-149.1	38.2	0	0	0	114	T86 K87 I122 G138 D139	T86-N89 PolarHBondContact O-N 3.43Å; T86-N89 VanDerWaalsContact O-N 3.14Å; K87-N89 PolarHBondContact O-N 2.73Å; N89-I122 WeakPolarHBondContact OD1-CG1 3.36Å; N89-G138 PolarHBondContact ND2-O 2.85Å; N89-D139 WeakPolarHBondContact ND2-CA 3.38Å; N89-D139 PolarHBondContact ND2-O 3Å
90	T	94.3	Very high	95.9	Very high	29 Å²	29	38.9 Å²	38.9	18%	0.178	20%	0.202	C	C	.	.			trans	-113.3	130.5	176.3	-51.9	0	0	0	0	110	L68 T86 C88 K103	L68-T90 HydrophobicContact CD2-CG2 3.64Å; T86-T90 PolarHBondContact N-O 2.9Å; T86-T90 WeakPolarHBondContact OG1-CB 3.29Å; T86-T90 PolarHBondContact OG1-N 2.97Å; T86-T90 PolarHBondContact OG1-O 2.84Å; C88-T90 VanDerWaalsContact C-N 3.29Å; C88-T90 PolarHBondContact O-N 2.87Å; C88-T90 PolarHBondContact O-OG1 3.38Å; C88-T90 PolarHBondContact SG-OG1 3.07Å; T90-K103 HydrophobicContact CG2-CD 4.36Å; T90-K103 HydrophobicContact CG2-CG 4.36Å
91	L	96.7	Very high	95.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.4	168.4	-170.2	67.3	0	0	0	107.9	V83 C84 I104 I106 I122 I125 T136 Y147	V83-L91 HydrophobicContact CG2-CD1 3.45Å; V83-L91 VanDerWaalsContact CG2-CD1 3.45Å; V83-L91 HydrophobicContact CG2-CD2 4.5Å; V83-L91 HydrophobicContact CG2-CG 3.94Å; C84-L91 WeakPolarHBondContact O-CA 3.36Å; L91-I104 HydrophobicContact CB-CB 4.17Å; L91-I104 HydrophobicContact CD2-CB 4Å; L91-I104 HydrophobicContact CD2-CG2 3.87Å; L91-I104 HydrophobicContact CG-CB 4.03Å; L91-I104 HydrophobicContact CG-CG1 4.4Å; L91-I104 HydrophobicContact CG-CG2 4.46Å; L91-I104 PolarHBondContact O-N 3.01Å; L91-I106 HydrophobicContact CB-CD1 3.42Å; L91-I106 VanDerWaalsContact CB-CD1 3.42Å; L91-I122 HydrophobicContact CB-CD1 3.9Å; L91-I122 HydrophobicContact CD1-CD1 4.26Å; L91-I125 HydrophobicContact CD1-CD1 3.82Å; L91-T136 HydrophobicContact CD1-CG2 4.06Å; L91-T136 HydrophobicContact CD2-CG2 4.12Å; L91-Y147 HydrophobicContact CD2-CD2 4.4Å; L91-Y147 HydrophobicContact CD2-CE1 4.28Å; L91-Y147 HydrophobicContact CD2-CE2 3.8Å
92	F	97.4	Very high	95.8	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	156.6	175.7	71.8	-89.6	0	0	0	111	L65 L68 V71 V83 C84 T86 V94 I101 T102	L65-F92 HydrophobicContact CD2-CE2 4.24Å; L65-F92 HydrophobicContact CD2-CZ 3.86Å; L68-F92 HydrophobicContact CD1-CD1 3.73Å; L68-F92 HydrophobicContact CD1-CD2 4.39Å; L68-F92 HydrophobicContact CD1-CE1 3.9Å; L68-F92 HydrophobicContact CD1-CG 3.97Å; L68-F92 HydrophobicContact CD1-CZ 4.3Å; V71-F92 HydrophobicContact CG2-CE1 4Å; V71-F92 HydrophobicContact CG2-CZ 3.83Å; V83-F92 CarbonylContact C-O 3.6Å; V83-F92 WeakPolarHBondContact CA-O 3.38Å; C84-F92 HydrophobicContact CB-CD1 3.86Å; C84-F92 HydrophobicContact CB-CD2 4.11Å; C84-F92 HydrophobicContact CB-CE1 3.39Å; C84-F92 HydrophobicContact CB-CE2 3.68Å; C84-F92 HydrophobicContact CB-CG 4.22Å; C84-F92 HydrophobicContact CB-CZ 3.3Å; C84-F92 PolarHBondContact N-O 3.36Å; C84-F92 PolarHBondContact O-N 2.93Å; T86-F92 HydrophobicContact CG2-CD1 3.86Å; T86-F92 HydrophobicContact CG2-CE1 3.44Å; T86-F92 VanDerWaalsContact CG2-CE1 3.44Å; F92-V94 HydrophobicContact CD2-CB 4.46Å; F92-V94 HydrophobicContact CE2-CB 4.11Å; F92-V94 HydrophobicContact CE2-CG1 4.44Å; F92-I101 HydrophobicContact CB-CG2 4.1Å; F92-I101 HydrophobicContact CD2-CG1 4.42Å; F92-I101 HydrophobicContact CD2-CG2 3.61Å; F92-I101 HydrophobicContact CE2-CD1 4.46Å; F92-I101 HydrophobicContact CE2-CG1 4.38Å; F92-I101 HydrophobicContact CE2-CG2 4.27Å; F92-I101 HydrophobicContact CG-CG2 4.04Å; F92-T102 CarbonylContact C-O 3.52Å; F92-T102 WeakPolarHBondContact CA-O 3.37Å; F92-T102 WeakPolarHBondContact CB-O 3.38Å
93	V	97.9	Very high	95.7	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.055	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.9	170.5	176.2	0	0	0	0	108.7	L77 Q81 V82 V83 I101 T102 I104 L152	L77-V93 HydrophobicContact CD1-CG1 4.36Å; L77-V93 HydrophobicContact CD1-CG2 3.85Å; Q81-V93 HydrophobicContact CB-CG1 3.81Å; Q81-V93 HydrophobicContact CG-CG1 4.06Å; V82-V93 CarbonylContact O-C 3.54Å; V82-V93 WeakPolarHBondContact O-CA 3.11Å; V83-V93 HydrophobicContact CB-CG2 4.22Å; V83-V93 HydrophobicContact CG2-CG2 4.32Å; V93-I101 CarbonylContact O-C 3.5Å; V93-I101 WeakPolarHBondContact O-CA 3.38Å; V93-T102 PolarHBondContact N-O 2.97Å; V93-T102 PolarHBondContact O-N 3.36Å; V93-I104 HydrophobicContact CG2-CD1 4.02Å; V93-I104 HydrophobicContact CG2-CG1 4.03Å; V93-L152 HydrophobicContact CG2-CD1 3.52Å
94	V	97.3	Very high	95.6	Very high	12 Å²	12	43.5 Å²	43.5	7%	0.073	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.5	168.4	62	0	0	0	0	110.1	F63 Q81 V82 F92 Q100 I101	F63-V94 HydrophobicContact CD1-CG2 3.88Å; F63-V94 HydrophobicContact CE1-CG2 4.08Å; Q81-V94 WeakPolarHBondContact CA-O 3.41Å; V82-V94 HydrophobicContact CB-CG1 3.89Å; V82-V94 PolarHBondContact N-O 3.23Å; V82-V94 PolarHBondContact O-N 2.99Å; F92-V94 HydrophobicContact CD2-CB 4.46Å; F92-V94 HydrophobicContact CE2-CB 4.11Å; F92-V94 HydrophobicContact CE2-CG1 4.44Å; V94-Q100 WeakPolarHBondContact CA-O 3.38Å; V94-I101 HydrophobicContact CB-CG1 4.35Å; V94-I101 HydrophobicContact CG2-CG1 4.17Å
95	D	96.3	Very high	95.2	Very high	11 Å²	11	47.9 Å²	47.9	6%	0.059	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	113.4	167.5	-177.3	-59.2	0	0	0	109.1	R80 Q97 T98 S99 Q100	R80-D95 IonicContact CZ-OD1 3.76Å; R80-D95 IonicContact CZ-OD2 3.13Å; R80-D95 IonicContact NE-OD1 3.14Å; R80-D95 PolarHBondContact NE-OD1 2.85Å; R80-D95 VanDerWaalsContact NE-OD1 3.14Å; R80-D95 IonicContact NE-OD2 2.65Å; R80-D95 PolarHBondContact NE-OD2 3.13Å; R80-D95 IonicContact NH2-OD1 3.55Å; R80-D95 IonicContact NH2-OD2 2.79Å; R80-D95 PolarHBondContact NH2-OD2 3.41Å; D95-Q97 PolarHBondContact O-N 3.1Å; D95-Q97 PolarHBondContact OD1-N 3.2Å; D95-Q97 VanDerWaalsContact OD1-N 3.08Å; D95-T98 VanDerWaalsContact CB-OG1 3.26Å; D95-T98 WeakPolarHBondContact CB-OG1 3.49Å; D95-T98 PolarHBondContact OD1-N 3.09Å; D95-T98 PolarHBondContact OD1-OG1 3.46Å; D95-S99 WeakPolarHBondContact O-CA 3.4Å; D95-S99 PolarHBondContact O-N 3.22Å; D95-Q100 HydrophobicContact CB-CB 4.3Å; D95-Q100 PolarHBondContact N-O 3.22Å
96	V	95.3	Very high	95	Very high	32 Å²	32	49.6 Å²	49.6	19%	0.194	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-16	-171	-56.1	0	0	0	0	113.7	R61 F63 W76 R80 V82	R61-V96 PolarHBondContact NH1-O 3.23Å; F63-V96 HydrophobicContact CZ-CB 4.15Å; W76-V96 HydrophobicContact CH2-CB 4.46Å; W76-V96 HydrophobicContact CH2-CG1 3.8Å; W76-V96 HydrophobicContact CH2-CG2 4.09Å; W76-V96 HydrophobicContact CZ3-CG1 3.95Å; W76-V96 HydrophobicContact CZ3-CG2 4.15Å; R80-V96 VanDerWaalsContact O-CG2 3.31Å; R80-V96 WeakPolarHBondContact O-CG2 3.46Å; R80-V96 PolarHBondContact O-N 3.13Å; V82-V96 HydrophobicContact CG2-CG1 3.83Å
97	Q	94.9	Very high	94.7	Very high	114 Å²	114	50.6 Å²	50.6	53%	0.533	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-52.3	176.4	-68.2	-177.5	-3.1	0	0	110.1	R61 R80 D95	R61-Q97 PolarHBondContact NH2-O 3.25Å; R80-Q97 HydrophobicContact CG-CG 4.28Å; D95-Q97 PolarHBondContact O-N 3.1Å; D95-Q97 PolarHBondContact OD1-N 3.2Å; D95-Q97 VanDerWaalsContact OD1-N 3.08Å
98	T	94.9	Very high	94.4	Very high	78 Å²	78	53.5 Å²	53.5	48%	0.479	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-11.9	-173.9	60.6	0	0	0	0	114.1	D95 Q100	D95-T98 VanDerWaalsContact CB-OG1 3.26Å; D95-T98 WeakPolarHBondContact CB-OG1 3.49Å; D95-T98 PolarHBondContact OD1-N 3.09Å; D95-T98 PolarHBondContact OD1-OG1 3.46Å; T98-Q100 PolarHBondContact O-N 2.86Å; T98-Q100 WeakPolarHBondContact OG1-CB 3.32Å; T98-Q100 PolarHBondContact OG1-N 3.24Å
99	S	93.4	Very high	94	Very high	49 Å²	49	52.1 Å²	52.1	34%	0.343	28%	0.275	S	S	.	.			trans	59.5	16.7	-170.3	-59.6	0	0	0	0	113.8	R61 F63 D95	R61-S99 PolarHBondContact NH2-OG 2.81Å; F63-S99 VanDerWaalsContact CE1-OG 3.29Å; F63-S99 WeakPolarHBondContact CE1-OG 3.31Å; D95-S99 WeakPolarHBondContact O-CA 3.4Å; D95-S99 PolarHBondContact O-N 3.22Å
100	Q	94.9	Very high	93.3	Very high	120 Å²	120	60.7 Å²	60.7	56%	0.561	30%	0.304	S	S	*	.			trans	-70.6	131.1	176.9	-172.9	-177.1	15.5	0	0	110.4	V94 D95 T98	V94-Q100 WeakPolarHBondContact CA-O 3.38Å; D95-Q100 HydrophobicContact CB-CB 4.3Å; D95-Q100 PolarHBondContact N-O 3.22Å; T98-Q100 PolarHBondContact O-N 2.86Å; T98-Q100 WeakPolarHBondContact OG1-CB 3.32Å; T98-Q100 PolarHBondContact OG1-N 3.24Å
101	I	95.8	Very high	92.1	Very high	53 Å²	53	66.5 Å²	66.5	27%	0.272	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.8	176.3	-66.7	173.7	0	0	0	109.3	L65 L68 F92 V93 V94	L65-I101 HydrophobicContact CD2-CD1 3.96Å; L68-I101 HydrophobicContact CD1-CG2 3.9Å; F92-I101 HydrophobicContact CB-CG2 4.1Å; F92-I101 HydrophobicContact CD2-CG1 4.42Å; F92-I101 HydrophobicContact CD2-CG2 3.61Å; F92-I101 HydrophobicContact CE2-CD1 4.46Å; F92-I101 HydrophobicContact CE2-CG1 4.38Å; F92-I101 HydrophobicContact CE2-CG2 4.27Å; F92-I101 HydrophobicContact CG-CG2 4.04Å; V93-I101 CarbonylContact O-C 3.5Å; V93-I101 WeakPolarHBondContact O-CA 3.38Å; V94-I101 HydrophobicContact CB-CG1 4.35Å; V94-I101 HydrophobicContact CG2-CG1 4.17Å
102	T	95.9	Very high	90.5	Very high	71 Å²	71	72.3 Å²	72.3	44%	0.436	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.4	175.9	-55.2	0	0	0	0	109.3	F92 V93	F92-T102 CarbonylContact C-O 3.52Å; F92-T102 WeakPolarHBondContact CA-O 3.37Å; F92-T102 WeakPolarHBondContact CB-O 3.38Å; V93-T102 PolarHBondContact N-O 2.97Å; V93-T102 PolarHBondContact O-N 3.36Å
103	K	95.9	Very high	88.5	Confident	127 Å²	127	74.5 Å²	74.5	55%	0.552	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	138.6	176.7	-64.1	-175.4	-175.3	-173.7	0	110.2	T90	T90-K103 HydrophobicContact CG2-CD 4.36Å; T90-K103 HydrophobicContact CG2-CG 4.36Å
104	I	96.1	Very high	86.3	Confident	20 Å²	20	77.7 Å²	77.7	10%	0.103	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.2	177.4	-52.9	-56.9	0	0	0	108.2	L91 V93 I106 Y147 L152	L91-I104 HydrophobicContact CB-CB 4.17Å; L91-I104 HydrophobicContact CD2-CB 4Å; L91-I104 HydrophobicContact CD2-CG2 3.87Å; L91-I104 HydrophobicContact CG-CB 4.03Å; L91-I104 HydrophobicContact CG-CG1 4.4Å; L91-I104 HydrophobicContact CG-CG2 4.46Å; L91-I104 PolarHBondContact O-N 3.01Å; V93-I104 HydrophobicContact CG2-CD1 4.02Å; V93-I104 HydrophobicContact CG2-CG1 4.03Å; I104-I106 PolarHBondContact O-N 3.39Å; I104-Y147 HydrophobicContact CG2-CD1 4.27Å; I104-Y147 HydrophobicContact CG2-CE1 3.93Å; I104-L152 HydrophobicContact CD1-CB 4.33Å; I104-L152 HydrophobicContact CD1-CD1 3.52Å; I104-L152 HydrophobicContact CG1-CD1 3.91Å; I104-L152 HydrophobicContact CG2-CB 4.11Å
105	P	91.4	Very high	84.2	Confident	102 Å²	102	80.2 Å²	80.2	66%	0.662	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-58.9	131.4	176.6	-22.8	33.5	0	0	0	111.2	Y147	P105-Y147 VanDerWaalsContact O-CE1 3.3Å; P105-Y147 WeakPolarHBondContact O-CE1 3.22Å; P105-Y147 PolarHBondContact O-OH 3.4Å
106	I	91.3	Very high	82	Confident	36 Å²	36	86 Å²	86	19%	0.185	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-81.7	134.3	175.3	-61	-66.1	0	0	0	109.7	L91 I104 I122 D139	L91-I106 HydrophobicContact CB-CD1 3.42Å; L91-I106 VanDerWaalsContact CB-CD1 3.42Å; I104-I106 PolarHBondContact O-N 3.39Å; I106-I122 HydrophobicContact CD1-CD1 3.73Å; I106-D139 VanDerWaalsContact CG2-CA 3.44Å; I106-D139 HydrophobicContact CG2-CB 3.71Å
107	L	90.1	Very high	80	Confident	20 Å²	20	89.6 Å²	89.6	11%	0.105	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-74	136.2	173.1	-74.8	73.7	0	0	0	110.6	D139 A145 Y147 P154 C156 V157	L107-D139 WeakPolarHBondContact O-CB 3.45Å; L107-D139 PolarHBondContact O-N 3.38Å; L107-A145 HydrophobicContact CB-CB 4.15Å; L107-A145 HydrophobicContact CD1-CB 4.46Å; L107-Y147 HydrophobicContact CD1-CD1 3.72Å; L107-Y147 HydrophobicContact CD1-CE1 3.05Å; L107-Y147 HydrophobicContact CD1-CE2 3.94Å; L107-Y147 HydrophobicContact CD1-CG 4.4Å; L107-Y147 VanDerWaalsContact CD1-OH 3.32Å; L107-Y147 WeakPolarHBondContact CD1-OH 3.31Å; L107-Y147 PolarHBondContact N-OH 3.11Å; L107-P154 HydrophobicContact CD1-CB 3.65Å; L107-P154 HydrophobicContact CD2-CB 3.75Å; L107-P154 HydrophobicContact CG-CB 3.69Å; L107-C156 WeakPolarHBondContact CD2-O 3.3Å; L107-V157 HydrophobicContact CB-CG2 3.44Å; L107-V157 VanDerWaalsContact CB-CG2 3.44Å; L107-V157 HydrophobicContact CD2-CG2 3.71Å; L107-V157 HydrophobicContact CG-CG2 4.19Å
108	K	88	Confident	78.2	Confident	153 Å²	153	93.5 Å²	93.5	67%	0.665	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-99.6	151.8	177	-59.1	-175.2	174.2	-176	0	110.4	D139	K108-D139 HydrophobicContact CB-CB 4.44Å; K108-D139 HydrophobicContact CG-CB 3.99Å
109	D	83.8	Confident	76.8	Confident	28 Å²	28	91.8 Å²	91.8	15%	0.15	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-61.5	161.3	173	-63.6	0	0	0	0	111.4	N140 S143 D159	D109-N140 WeakPolarHBondContact OD2-CB 3.39Å; D109-N140 PolarHBondContact OD2-ND2 3.25Å; D109-S143 WeakPolarHBondContact OD1-CB 3.22Å; D109-S143 PolarHBondContact OD1-OG 3.47Å; D109-S143 PolarHBondContact OD2-OG 3.39Å; D109-D159 HydrophobicContact CB-CB 4.26Å
110	R	78.6	Confident	76.3	Confident	209 Å²	209	89.7 Å²	89.7	79%	0.789	49%	0.493	S	S	*	.	S	Bend	trans	-62.2	-45.2	-178.9	-72.9	174.4	166.3	-179.7	-0.2	112.5	D159	R110-D159 WeakPolarHBondContact CB-OD2 3.38Å; R110-D159 WeakPolarHBondContact CG-OD2 3.35Å; R110-D159 PolarHBondContact N-OD2 2.88Å
111	E	68.9	Low	76.1	Confident	151 Å²	151	84.2 Å²	84.2	71%	0.706	47%	0.468	S	S	*	.	S	Bend	trans	-108.1	136.3	172.1	-66.3	-61.5	138.4	0	0	107.9	G113	E111-G113 PolarHBondContact O-N 2.8Å
112	P	62.4	Low	76.2	Confident	123 Å²	123	81.8 Å²	81.8	80%	0.799	46%	0.456	S	S	*	.			trans	-69.6	72.8	167.6	29.1	-31.3	0	0	0	108.3	G114	P112-G114 PolarHBondContact O-N 2.83Å
113	G	56.2	Low	76.2	Confident	47 Å²	47	80.8 Å²	80.8	49%	0.485	45%	0.446	S	S	.	.			trans	-51.6	134.5	168.1	0	0	0	0	0	107.4	E111 V115	E111-G113 PolarHBondContact O-N 2.8Å; G113-V115 PolarHBondContact O-N 2.93Å
114	G	50.6	Low	76.3	Confident	75 Å²	75	75.2 Å²	75.2	77%	0.773	42%	0.424	S	S	*	.			trans	-65.2	37.6	-171.2	0	0	0	0	0	115.6	P112 T116	P112-G114 PolarHBondContact O-N 2.83Å; G114-T116 VanDerWaalsContact C-N 3.27Å; G114-T116 PolarHBondContact O-N 3.48Å
115	V	53.1	Low	76.4	Confident	65 Å²	65	74.7 Å²	74.7	39%	0.394	42%	0.421	S	S	.	.			trans	-76	84	173.6	-160.7	0	0	0	0	107.5	G113 Q117	G113-V115 PolarHBondContact O-N 2.93Å; V115-Q117 HydrophobicContact CG1-CB 3.87Å; V115-Q117 HydrophobicContact CG1-CG 3.84Å; V115-Q117 PolarHBondContact O-N 3.39Å
116	T	49.9	Very low	76.7	Confident	134 Å²	134	73.3 Å²	73.3	82%	0.822	41%	0.406	S	S	*	.			trans	-71.7	18.7	169.2	51.4	0	0	0	0	112.5	G114 Q118	G114-T116 VanDerWaalsContact C-N 3.27Å; G114-T116 PolarHBondContact O-N 3.48Å; T116-Q118 VanDerWaalsContact C-N 3.33Å; T116-Q118 PolarHBondContact O-N 2.87Å
117	Q	54.3	Low	77.1	Confident	106 Å²	106	72.4 Å²	72.4	50%	0.495	40%	0.401	S	S	.	.			trans	-77.8	86.2	-178.8	-64.5	-161.1	7	0	0	110.5	V115 G119	V115-Q117 HydrophobicContact CG1-CB 3.87Å; V115-Q117 HydrophobicContact CG1-CG 3.84Å; V115-Q117 PolarHBondContact O-N 3.39Å; Q117-G119 PolarHBondContact O-N 2.76Å
118	Q	57.2	Low	77.5	Confident	196 Å²	196	71.6 Å²	71.6	92%	0.916	40%	0.397	S	S	*	.			trans	-61.6	114.1	161.6	-68.8	-175.5	-16.7	0	0	109.3	T116	T116-Q118 VanDerWaalsContact C-N 3.33Å; T116-Q118 PolarHBondContact O-N 2.87Å
119	G	66.1	Low	78	Confident	43 Å²	43	68.3 Å²	68.3	44%	0.443	39%	0.391	S	S	.	.			trans	108.9	34	146.3	0	0	0	0	0	119.1	Q117	Q117-G119 PolarHBondContact O-N 2.76Å
120	C	81	Confident	78.6	Confident	5 Å²	5	69.5 Å²	69.5	3%	0.034	40%	0.402	C	S	.	.			trans	-69	-51.1	158.1	-178.2	0	0	0	0	110.9	F72 H123 P141 W165	F72-C120 WeakPolarHBondContact CE2-O 3.32Å; C120-H123 PolarHBondContact O-NE2 2.9Å; C120-H123 PolarHBondContact SG-CD2 2.9Å; C120-H123 PolarHBondContact SG-NE2 2.87Å; C120-P141 HydrophobicContact CB-CB 3.62Å; C120-P141 HydrophobicContact CB-CG 4.01Å; C120-W165 HydrophobicContact CB-CD2 3.43Å; C120-W165 VanDerWaalsContact CB-CD2 3.43Å; C120-W165 VanDerWaalsContact CB-CE2 3.5Å; C120-W165 HydrophobicContact CB-CE3 3.64Å; C120-W165 HydrophobicContact CB-CG 3.88Å; C120-W165 HydrophobicContact CB-CH2 3.98Å; C120-W165 HydrophobicContact CB-CZ2 3.8Å; C120-W165 HydrophobicContact CB-CZ3 3.9Å
121	G	92.5	Very high	79.6	Confident	5 Å²	5	67 Å²	67	5%	0.052	39%	0.392	C	S	.	.			trans	81.5	-176.4	-170.6	0	0	0	0	0	112.8	T86 K87 H123	T86-G121 CarbonylContact O-C 3.55Å; T86-G121 WeakPolarHBondContact O-CA 3.47Å; K87-G121 WeakPolarHBondContact O-CA 3.4Å; K87-G121 PolarHBondContact O-N 2.86Å; G121-H123 PolarHBondContact O-CD2 2.82Å
122	I	96.2	Very high	81	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	38%	0.378	C	S	.	.			trans	-96.6	108.9	-174.4	-57.5	172	0	0	0	109.3	F72 T86 N89 L91 I106 I125	F72-I122 WeakPolarHBondContact CB-O 3.39Å; T86-I122 PolarHBondContact O-N 2.87Å; N89-I122 WeakPolarHBondContact OD1-CG1 3.36Å; L91-I122 HydrophobicContact CB-CD1 3.9Å; L91-I122 HydrophobicContact CD1-CD1 4.26Å; I106-I122 HydrophobicContact CD1-CD1 3.73Å; I122-I125 HydrophobicContact CG2-CD1 4.2Å; I122-I125 HydrophobicContact CG2-CG1 3.89Å
123	H	96.8	Very high	82.7	Confident	50 Å²	50	58.2 Å²	58.2	23%	0.231	35%	0.346	C	S	.	.			trans	-95.6	-17.9	-175.8	-71.9	-78.6	0	0	0	115.3	F72 C120 G121 F167	F72-H123 AromaticContact CD2-CE1 3.35Å; F72-H123 WeakPolarHBondContact CD2-CE1 3.38Å; F72-H123 AromaticContact CD2-ND1 3.77Å; F72-H123 AromaticContact CD2-NE2 3.89Å; F72-H123 AromaticContact CE2-CE1 3.55Å; C120-H123 PolarHBondContact O-NE2 2.9Å; C120-H123 PolarHBondContact SG-CD2 2.9Å; C120-H123 PolarHBondContact SG-NE2 2.87Å; G121-H123 PolarHBondContact O-CD2 2.82Å; H123-F167 HydrophobicContact CB-CD1 4.12Å; H123-F167 HydrophobicContact CB-CE1 4.46Å; H123-F167 AromaticContact CD2-CE1 3.9Å; H123-F167 AromaticContact CE1-CE1 3.87Å; H123-F167 AromaticContact CG-CD1 3.95Å; H123-F167 AromaticContact CG-CE1 3.8Å; H123-F167 AromaticContact ND1-CE1 3.79Å; H123-F167 AromaticContact NE2-CE1 3.94Å
124	A	97	Very high	84.7	Confident	10 Å²	10	56 Å²	56	8%	0.083	32%	0.323	C	S	.	.			trans	-137.3	137.1	-177.3	0	0	0	0	0	110.3	T136 I169	A124-T136 WeakPolarHBondContact O-CA 3.44Å; A124-I169 HydrophobicContact CB-CB 4.12Å; A124-I169 HydrophobicContact CB-CD1 3.71Å; A124-I169 HydrophobicContact CB-CG1 3.7Å
125	I	98.4	Very high	87	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.046	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	119.8	176.2	-63.8	-178.6	0	0	0	107	A73 Q75 V83 G85 L91 I122 L134 A135 T136	A73-I125 HydrophobicContact CB-CB 4.32Å; A73-I125 HydrophobicContact CB-CD1 3.99Å; A73-I125 HydrophobicContact CB-CG1 3.81Å; Q75-I125 HydrophobicContact CB-CB 4.38Å; Q75-I125 HydrophobicContact CB-CG2 3.68Å; Q75-I125 HydrophobicContact CG-CG2 4.5Å; V83-I125 HydrophobicContact CG1-CG2 3.81Å; G85-I125 VanDerWaalsContact N-CD1 3.32Å; L91-I125 HydrophobicContact CD1-CD1 3.82Å; I122-I125 HydrophobicContact CG2-CD1 4.2Å; I122-I125 HydrophobicContact CG2-CG1 3.89Å; I125-L134 HydrophobicContact CG2-CD1 3.49Å; I125-L134 VanDerWaalsContact CG2-CD1 3.49Å; I125-L134 HydrophobicContact CG2-CG 4.35Å; I125-A135 CarbonylContact C-O 3.53Å; I125-A135 WeakPolarHBondContact CA-O 3.43Å; I125-T136 HydrophobicContact CG1-CG2 4.01Å; I125-T136 HydrophobicContact CG2-CG2 4.22Å
126	E	98.6	Very high	89.1	Confident	73 Å²	73	49.3 Å²	49.3	34%	0.341	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	144.9	-179.9	-82.9	-58.4	167.6	0	0	114.1	Q75 A135 I169 W171	Q75-E126 PolarHBondContact NE2-OE2 3.4Å; E126-A135 PolarHBondContact N-O 3.18Å; E126-A135 PolarHBondContact O-N 3.46Å; E126-I169 HydrophobicContact CB-CB 4.43Å; E126-I169 HydrophobicContact CB-CG2 4.18Å; E126-I169 VanDerWaalsContact CG-O 3.31Å; E126-I169 WeakPolarHBondContact CG-O 3.32Å; E126-W171 PolarHBondContact O-NE1 2.69Å
127	L	98.6	Very high	91.2	Very high	18 Å²	18	43.3 Å²	43.3	9%	0.094	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	141	176.5	-65.3	172.1	0	0	0	110.1	Q75 W76 L77 R131 L134 L149	Q75-L127 HydrophobicContact CG-CD1 3.86Å; Q75-L127 HydrophobicContact CG-CG 3.79Å; W76-L127 WeakPolarHBondContact O-CD1 3.24Å; L77-L127 HydrophobicContact CD2-CD2 4.15Å; L127-R131 VanDerWaalsContact CD1-NH1 3.32Å; L127-L134 HydrophobicContact CD2-CB 4.38Å; L127-L134 HydrophobicContact CD2-CD1 3.69Å; L127-L134 HydrophobicContact CG-CD1 4.35Å; L127-L149 HydrophobicContact CD2-CD1 3.29Å
128	N	98.6	Very high	92.9	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.011	21%	0.209	C	C	.	.			trans	-68.8	161.3	168.6	78.7	-22.5	0	0	0	111.1	S130 R131 T132 L133 W171 D174	N128-S130 VanDerWaalsContact C-N 3.31Å; N128-S130 PolarHBondContact ND2-OG 2.98Å; N128-S130 PolarHBondContact O-N 3.07Å; N128-R131 WeakPolarHBondContact O-CA 3.18Å; N128-R131 PolarHBondContact O-N 2.91Å; N128-R131 WeakPolarHBondContact OD1-CA 3.31Å; N128-R131 PolarHBondContact OD1-N 2.77Å; N128-T132 PolarHBondContact ND2-OG1 3.39Å; N128-T132 PolarHBondContact OD1-N 3.23Å; N128-L133 HydrophobicContact CB-CB 4.22Å; N128-L133 PolarHBondContact N-O 3.03Å; N128-L133 VanDerWaalsContact N-O 3.07Å; N128-L133 PolarHBondContact OD1-N 3.28Å; N128-L133 PolarHBondContact OD1-O 3.17Å; N128-W171 HydrophobicContact CB-CD2 3.47Å; N128-W171 VanDerWaalsContact CB-CD2 3.47Å; N128-W171 HydrophobicContact CB-CE3 3.6Å; N128-W171 HydrophobicContact CB-CG 3.92Å; N128-W171 HydrophobicContact CB-CH2 4.13Å; N128-W171 HydrophobicContact CB-CZ2 4Å; N128-W171 HydrophobicContact CB-CZ3 3.94Å; N128-D174 PolarHBondContact ND2-O 3.25Å; N128-D174 PolarHBondContact ND2-OD1 3.38Å
129	P	98.4	Very high	94.5	Very high	84 Å²	84	32.6 Å²	32.6	55%	0.545	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-41.1	-175.7	-29.9	37.1	0	0	0	114.9	R131 S173	P129-R131 VanDerWaalsContact C-N 3.25Å; P129-R131 PolarHBondContact O-N 3.24Å; P129-S173 WeakPolarHBondContact CD-O 3.44Å
130	S	98.1	Very high	95.7	Very high	54 Å²	54	31.7 Å²	31.7	38%	0.378	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-7.7	177.2	60.7	0	0	0	0	114	N128 T132 D174	N128-S130 VanDerWaalsContact C-N 3.31Å; N128-S130 PolarHBondContact ND2-OG 2.98Å; N128-S130 PolarHBondContact O-N 3.07Å; S130-T132 PolarHBondContact O-N 3.41Å; S130-T132 PolarHBondContact OG-OG1 3.46Å; S130-D174 WeakPolarHBondContact CA-OD1 3.2Å; S130-D174 VanDerWaalsContact CB-CG 3.5Å; S130-D174 WeakPolarHBondContact CB-OD1 3.4Å; S130-D174 PolarHBondContact N-OD1 2.9Å; S130-D174 PolarHBondContact OG-OD1 2.85Å
131	R	98.1	Very high	96.1	Very high	156 Å²	156	32 Å²	32	59%	0.589	17%	0.171	S	C	*	.	S	Bend	trans	58.2	32.9	-177.4	-56.2	174.8	169.7	-89.1	-7.4	113.2	L127 N128 P129 L149	L127-R131 VanDerWaalsContact CD1-NH1 3.32Å; N128-R131 WeakPolarHBondContact O-CA 3.18Å; N128-R131 PolarHBondContact O-N 2.91Å; N128-R131 WeakPolarHBondContact OD1-CA 3.31Å; N128-R131 PolarHBondContact OD1-N 2.77Å; P129-R131 VanDerWaalsContact C-N 3.25Å; P129-R131 PolarHBondContact O-N 3.24Å; R131-L149 WeakPolarHBondContact O-CD1 3.3Å
132	T	98.3	Very high	96.2	Very high	64 Å²	64	32.6 Å²	32.6	39%	0.393	17%	0.173	S	C	.	.	S	Bend	trans	-99.6	-17.8	176.4	56.6	0	0	0	0	112.4	N128 S130 L149	N128-T132 PolarHBondContact ND2-OG1 3.39Å; N128-T132 PolarHBondContact OD1-N 3.23Å; S130-T132 PolarHBondContact O-N 3.41Å; S130-T132 PolarHBondContact OG-OG1 3.46Å; T132-L149 PolarHBondContact O-N 3.14Å
133	L	98.5	Very high	96.1	Very high	26 Å²	26	32.6 Å²	32.6	14%	0.136	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	148.6	179	-59.9	175.2	0	0	0	111.3	N128 I146 Y147 V155 W171	N128-L133 HydrophobicContact CB-CB 4.22Å; N128-L133 PolarHBondContact N-O 3.03Å; N128-L133 VanDerWaalsContact N-O 3.07Å; N128-L133 PolarHBondContact OD1-N 3.28Å; N128-L133 PolarHBondContact OD1-O 3.17Å; L133-I146 HydrophobicContact CB-CG2 4.28Å; L133-I146 HydrophobicContact CD1-CG2 4.34Å; L133-I146 HydrophobicContact CD2-CG2 4.07Å; L133-I146 HydrophobicContact CG-CG2 4.47Å; L133-Y147 CarbonylContact C-O 3.56Å; L133-Y147 VanDerWaalsContact CA-O 3.31Å; L133-Y147 WeakPolarHBondContact CA-O 3.37Å; L133-V155 HydrophobicContact CD2-CG2 4.23Å; L133-W171 HydrophobicContact CB-CH2 3.85Å; L133-W171 HydrophobicContact CB-CZ2 3.98Å; L133-W171 HydrophobicContact CD1-CH2 3.83Å; L133-W171 HydrophobicContact CD1-CZ3 4.24Å
134	L	98.6	Very high	96	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.4	172.2	178.5	71.2	0	0	0	108.5	V83 I125 L127 T136 I146 Y147 L149 L152	V83-L134 HydrophobicContact CG1-CD1 4.22Å; V83-L134 HydrophobicContact CG1-CD2 4.2Å; V83-L134 HydrophobicContact CG2-CD2 4.11Å; I125-L134 HydrophobicContact CG2-CD1 3.49Å; I125-L134 VanDerWaalsContact CG2-CD1 3.49Å; I125-L134 HydrophobicContact CG2-CG 4.35Å; L127-L134 HydrophobicContact CD2-CB 4.38Å; L127-L134 HydrophobicContact CD2-CD1 3.69Å; L127-L134 HydrophobicContact CG-CD1 4.35Å; L134-T136 HydrophobicContact CD2-CG2 4.07Å; L134-T136 HydrophobicContact CG-CG2 4Å; L134-I146 CarbonylContact O-C 3.47Å; L134-I146 WeakPolarHBondContact O-CA 3.44Å; L134-Y147 PolarHBondContact N-O 3.26Å; L134-Y147 PolarHBondContact O-N 2.84Å; L134-L149 HydrophobicContact CB-CD1 4.25Å; L134-L149 HydrophobicContact CB-CD2 4.3Å; L134-L149 HydrophobicContact CB-CG 4.27Å; L134-L152 HydrophobicContact CD2-CD2 3.6Å
135	A	98.4	Very high	96	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.9	171	0	0	0	0	0	110.5	I125 E126 L144 A145 I146 I169 W171	I125-A135 CarbonylContact C-O 3.53Å; I125-A135 WeakPolarHBondContact CA-O 3.43Å; E126-A135 PolarHBondContact N-O 3.18Å; E126-A135 PolarHBondContact O-N 3.46Å; A135-L144 HydrophobicContact CB-CD1 4.24Å; A135-A145 CarbonylContact C-O 3.48Å; A135-A145 WeakPolarHBondContact CA-O 3.23Å; A135-I146 HydrophobicContact CB-CD1 3.56Å; A135-I169 HydrophobicContact CB-CD1 4.34Å; A135-I169 HydrophobicContact CB-CG2 3.79Å; A135-W171 HydrophobicContact CB-CZ2 3.61Å
136	T	97.6	Very high	96	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	173.7	174.8	76.2	0	0	0	0	110.5	L91 A124 I125 L134 A145 Y147	L91-T136 HydrophobicContact CD1-CG2 4.06Å; L91-T136 HydrophobicContact CD2-CG2 4.12Å; A124-T136 WeakPolarHBondContact O-CA 3.44Å; I125-T136 HydrophobicContact CG1-CG2 4.01Å; I125-T136 HydrophobicContact CG2-CG2 4.22Å; L134-T136 HydrophobicContact CD2-CG2 4.07Å; L134-T136 HydrophobicContact CG-CG2 4Å; T136-A145 PolarHBondContact N-O 2.86Å; T136-A145 PolarHBondContact O-N 2.85Å; T136-Y147 HydrophobicContact CG2-CD2 4.41Å; T136-Y147 HydrophobicContact CG2-CE2 4.16Å; T136-Y147 WeakPolarHBondContact OG1-CE2 3.26Å
137	G	93.9	Very high	96	Very high	8 Å²	8	26.6 Å²	26.6	8%	0.082	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	146.9	157.7	0	0	0	0	0	111.4
138	G	90.5	Very high	96	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.			trans	-86.7	-166.6	177.5	0	0	0	0	0	114.5	N89 N140 S143	N89-G138 PolarHBondContact ND2-O 2.85Å; G138-N140 VanDerWaalsContact C-N 3.31Å; G138-N140 CarbonylContact C-O 3.56Å; G138-S143 PolarHBondContact N-O 2.93Å
139	D	90.3	Very high	95.9	Very high	77 Å²	77	33 Å²	33	41%	0.412	17%	0.169	S	C	.	.	S	Bend	trans	-63.1	-42.8	174.7	-164.4	39.2	0	0	0	110.6	N89 I106 L107 K108	N89-D139 WeakPolarHBondContact ND2-CA 3.38Å; N89-D139 PolarHBondContact ND2-O 3Å; I106-D139 VanDerWaalsContact CG2-CA 3.44Å; I106-D139 HydrophobicContact CG2-CB 3.71Å; L107-D139 WeakPolarHBondContact O-CB 3.45Å; L107-D139 PolarHBondContact O-N 3.38Å; K108-D139 HydrophobicContact CB-CB 4.44Å; K108-D139 HydrophobicContact CG-CB 3.99Å
140	N	90.9	Very high	95.8	Very high	24 Å²	24	34.7 Å²	34.7	13%	0.128	18%	0.18	C	C	.	.	S	Bend	trans	-79.3	122.7	162.6	-178.5	-4.2	0	0	0	109	D109 G138 N142 S143	D109-N140 WeakPolarHBondContact OD2-CB 3.39Å; D109-N140 PolarHBondContact OD2-ND2 3.25Å; G138-N140 VanDerWaalsContact C-N 3.31Å; G138-N140 CarbonylContact C-O 3.56Å; N140-N142 PolarHBondContact O-N 3.31Å; N140-N142 WeakPolarHBondContact OD1-CB 3.42Å; N140-N142 PolarHBondContact OD1-N 2.82Å; N140-S143 PolarHBondContact O-N 2.83Å
141	P	90.9	Very high	95.8	Very high	10 Å²	10	36.1 Å²	36.1	7%	0.065	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-12.6	-179.9	27	-36.5	0	0	0	114.1	C120 S143 W165 I166	C120-P141 HydrophobicContact CB-CB 3.62Å; C120-P141 HydrophobicContact CB-CG 4.01Å; P141-S143 VanDerWaalsContact C-N 3.34Å; P141-W165 HydrophobicContact CB-CB 4.25Å; P141-W165 HydrophobicContact CB-CG 3.95Å; P141-W165 HydrophobicContact CG-CG 4.2Å; P141-W165 WeakPolarHBondContact O-CA 3.21Å; P141-I166 PolarHBondContact O-N 2.81Å
142	N	93	Very high	95.7	Very high	19 Å²	19	29.5 Å²	29.5	10%	0.102	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-14.2	174.7	-59.3	5.4	0	0	0	112.5	N140 H162 K163 D164 W165 I166	N140-N142 PolarHBondContact O-N 3.31Å; N140-N142 WeakPolarHBondContact OD1-CB 3.42Å; N140-N142 PolarHBondContact OD1-N 2.82Å; N142-H162 HydrophobicContact CB-CB 4.4Å; N142-K163 PolarHBondContact ND2-O 2.82Å; N142-D164 PolarHBondContact ND2-N 2.78Å; N142-D164 WeakPolarHBondContact OD1-CA 3.27Å; N142-D164 PolarHBondContact OD1-O 2.87Å; N142-W165 PolarHBondContact OD1-N 3.14Å; N142-I166 WeakPolarHBondContact O-CD1 3.47Å
143	S	93.8	Very high	95.6	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	17%	0.165	C	C	.	.	S	Bend	trans	-102.1	145	-171.9	-57.2	0	0	0	0	111.9	D109 G138 N140 P141 G158	D109-S143 WeakPolarHBondContact OD1-CB 3.22Å; D109-S143 PolarHBondContact OD1-OG 3.47Å; D109-S143 PolarHBondContact OD2-OG 3.39Å; G138-S143 PolarHBondContact N-O 2.93Å; N140-S143 PolarHBondContact O-N 2.83Å; P141-S143 VanDerWaalsContact C-N 3.34Å; S143-G158 WeakPolarHBondContact CA-O 3.13Å
144	L	96.1	Very high	95.4	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	133.6	172.2	-170.4	75.1	0	0	0	109.6	A135 I146 V157 G158 I166 I169 A177 W189	A135-L144 HydrophobicContact CB-CD1 4.24Å; L144-I146 HydrophobicContact CD2-CD1 3.78Å; L144-I146 HydrophobicContact CD2-CG1 4.47Å; L144-I146 HydrophobicContact CG-CD1 4.02Å; L144-V157 CarbonylContact O-C 3.52Å; L144-V157 VanDerWaalsContact O-CA 3.23Å; L144-V157 WeakPolarHBondContact O-CA 3.44Å; L144-V157 WeakPolarHBondContact O-CG1 3.03Å; L144-G158 PolarHBondContact N-O 3.03Å; L144-G158 PolarHBondContact O-N 3.29Å; L144-I166 HydrophobicContact CB-CD1 4.24Å; L144-I166 HydrophobicContact CD1-CD1 4.48Å; L144-I169 HydrophobicContact CD1-CD1 3.45Å; L144-I169 VanDerWaalsContact CD1-CD1 3.45Å; L144-I169 HydrophobicContact CD1-CG1 3.76Å; L144-I169 HydrophobicContact CD1-CG2 4.28Å; L144-A177 HydrophobicContact CD2-CB 4.39Å; L144-W189 HydrophobicContact CB-CZ2 4.42Å; L144-W189 HydrophobicContact CD2-CB 4.02Å; L144-W189 HydrophobicContact CD2-CD2 4.19Å; L144-W189 HydrophobicContact CD2-CG 3.65Å
145	A	96.9	Very high	95.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.6	173.2	0	0	0	0	0	110.9	L107 A135 T136 Y147	L107-A145 HydrophobicContact CB-CB 4.15Å; L107-A145 HydrophobicContact CD1-CB 4.46Å; A135-A145 CarbonylContact C-O 3.48Å; A135-A145 WeakPolarHBondContact CA-O 3.23Å; T136-A145 PolarHBondContact N-O 2.86Å; T136-A145 PolarHBondContact O-N 2.85Å; A145-Y147 HydrophobicContact CB-CE2 3.92Å
146	I	98	Very high	95.1	Very high	12 Å²	12	39.7 Å²	39.7	6%	0.062	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.6	179.2	-52.8	-59.3	0	0	0	110.5	L133 L134 A135 L144 V155 C156 W171	L133-I146 HydrophobicContact CB-CG2 4.28Å; L133-I146 HydrophobicContact CD1-CG2 4.34Å; L133-I146 HydrophobicContact CD2-CG2 4.07Å; L133-I146 HydrophobicContact CG-CG2 4.47Å; L134-I146 CarbonylContact O-C 3.47Å; L134-I146 WeakPolarHBondContact O-CA 3.44Å; A135-I146 HydrophobicContact CB-CD1 3.56Å; L144-I146 HydrophobicContact CD2-CD1 3.78Å; L144-I146 HydrophobicContact CD2-CG1 4.47Å; L144-I146 HydrophobicContact CG-CD1 4.02Å; I146-V155 HydrophobicContact CB-CB 4.31Å; I146-V155 HydrophobicContact CG2-CB 4.06Å; I146-V155 HydrophobicContact CG2-CG1 4.41Å; I146-V155 HydrophobicContact CG2-CG2 4.48Å; I146-V155 WeakPolarHBondContact O-CB 3.42Å; I146-V155 PolarHBondContact O-N 3.07Å; I146-C156 PolarHBondContact N-O 2.95Å; I146-C156 PolarHBondContact O-N 2.96Å; I146-W171 HydrophobicContact CD1-CH2 4.05Å; I146-W171 HydrophobicContact CD1-CZ2 4.06Å
147	Y	98.3	Very high	94.9	Very high	1 Å²	1	41 Å²	41	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	148.1	176.2	-54.8	-101.4	0	0	0	110.8	L91 I104 P105 L107 L133 L134 T136 A145 L152 D153	L91-Y147 HydrophobicContact CD2-CD2 4.4Å; L91-Y147 HydrophobicContact CD2-CE1 4.28Å; L91-Y147 HydrophobicContact CD2-CE2 3.8Å; I104-Y147 HydrophobicContact CG2-CD1 4.27Å; I104-Y147 HydrophobicContact CG2-CE1 3.93Å; P105-Y147 VanDerWaalsContact O-CE1 3.3Å; P105-Y147 WeakPolarHBondContact O-CE1 3.22Å; P105-Y147 PolarHBondContact O-OH 3.4Å; L107-Y147 HydrophobicContact CD1-CD1 3.72Å; L107-Y147 HydrophobicContact CD1-CE1 3.05Å; L107-Y147 HydrophobicContact CD1-CE2 3.94Å; L107-Y147 HydrophobicContact CD1-CG 4.4Å; L107-Y147 VanDerWaalsContact CD1-OH 3.32Å; L107-Y147 WeakPolarHBondContact CD1-OH 3.31Å; L107-Y147 PolarHBondContact N-OH 3.11Å; L133-Y147 CarbonylContact C-O 3.56Å; L133-Y147 VanDerWaalsContact CA-O 3.31Å; L133-Y147 WeakPolarHBondContact CA-O 3.37Å; L134-Y147 PolarHBondContact N-O 3.26Å; L134-Y147 PolarHBondContact O-N 2.84Å; T136-Y147 HydrophobicContact CG2-CD2 4.41Å; T136-Y147 HydrophobicContact CG2-CE2 4.16Å; T136-Y147 WeakPolarHBondContact OG1-CE2 3.26Å; A145-Y147 HydrophobicContact CB-CE2 3.92Å; Y147-L152 WeakPolarHBondContact CD1-O 3.46Å; Y147-D153 CarbonylContact C-O 3.59Å; Y147-D153 VanDerWaalsContact CA-O 3.29Å; Y147-D153 WeakPolarHBondContact CA-O 3.19Å
148	R	98.1	Very high	94.8	Very high	126 Å²	126	41.2 Å²	41.2	48%	0.475	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	135.9	173	-178.1	173.2	-60.1	-72.6	-3.4	110.1	L152 D153 V155	R148-L152 WeakPolarHBondContact O-CA 3.25Å; R148-L152 PolarHBondContact O-N 3.06Å; R148-D153 HydrophobicContact CB-CB 4.39Å; R148-D153 PolarHBondContact N-O 2.98Å; R148-D153 PolarHBondContact O-N 2.76Å; R148-V155 HydrophobicContact CB-CG2 3.73Å
149	L	98.1	Very high	94.7	Very high	28 Å²	28	42.8 Å²	42.8	15%	0.147	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	151	172.7	-66	169	0	0	0	111.2	L77 L127 R131 T132 L134 L152	L77-L149 HydrophobicContact CD2-CD2 3.9Å; L127-L149 HydrophobicContact CD2-CD1 3.29Å; R131-L149 WeakPolarHBondContact O-CD1 3.3Å; T132-L149 PolarHBondContact O-N 3.14Å; L134-L149 HydrophobicContact CB-CD1 4.25Å; L134-L149 HydrophobicContact CB-CD2 4.3Å; L134-L149 HydrophobicContact CB-CG 4.27Å; L149-L152 HydrophobicContact CD2-CD2 3.64Å; L149-L152 HydrophobicContact CD2-CG 4.27Å
150	P	96.4	Very high	94.6	Very high	120 Å²	120	46.9 Å²	46.9	78%	0.779	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.6	-3.4	0.5	35.9	-36.6	0	0	0	114.6	L152	P150-L152 VanDerWaalsContact C-N 3.32Å; P150-L152 PolarHBondContact O-N 3.5Å
151	T	96.1	Very high	94.4	Very high	83 Å²	83	47.8 Å²	47.8	51%	0.509	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-20.8	-169.7	49.3	0	0	0	0	114.5	D153	T151-D153 WeakPolarHBondContact CB-OD2 3.42Å; T151-D153 PolarHBondContact O-N 3.3Å; T151-D153 PolarHBondContact OG1-OD2 2.75Å
152	L	97.1	Very high	94.6	Very high	18 Å²	18	47.7 Å²	47.7	9%	0.094	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	33.5	-170.5	-61.4	162.9	0	0	0	112.3	L77 V93 I104 L134 Y147 R148 L149 P150	L77-L152 HydrophobicContact CD1-CD1 4.19Å; V93-L152 HydrophobicContact CG2-CD1 3.52Å; I104-L152 HydrophobicContact CD1-CB 4.33Å; I104-L152 HydrophobicContact CD1-CD1 3.52Å; I104-L152 HydrophobicContact CG1-CD1 3.91Å; I104-L152 HydrophobicContact CG2-CB 4.11Å; L134-L152 HydrophobicContact CD2-CD2 3.6Å; Y147-L152 WeakPolarHBondContact CD1-O 3.46Å; R148-L152 WeakPolarHBondContact O-CA 3.25Å; R148-L152 PolarHBondContact O-N 3.06Å; L149-L152 HydrophobicContact CD2-CD2 3.64Å; L149-L152 HydrophobicContact CD2-CG 4.27Å; P150-L152 VanDerWaalsContact C-N 3.32Å; P150-L152 PolarHBondContact O-N 3.5Å
153	D	95.8	Very high	94.6	Very high	83 Å²	83	56 Å²	56	44%	0.444	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	139.5	172.2	-60.8	-38.4	0	0	0	109.9	Y147 R148 T151	Y147-D153 CarbonylContact C-O 3.59Å; Y147-D153 VanDerWaalsContact CA-O 3.29Å; Y147-D153 WeakPolarHBondContact CA-O 3.19Å; R148-D153 HydrophobicContact CB-CB 4.39Å; R148-D153 PolarHBondContact N-O 2.98Å; R148-D153 PolarHBondContact O-N 2.76Å; T151-D153 WeakPolarHBondContact CB-OD2 3.42Å; T151-D153 PolarHBondContact O-N 3.3Å; T151-D153 PolarHBondContact OG1-OD2 2.75Å
154	P	94.8	Very high	94.5	Very high	92 Å²	92	58.1 Å²	58.1	60%	0.597	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	137.7	176.9	28	-35.3	0	0	0	111.1	L107	L107-P154 HydrophobicContact CD1-CB 3.65Å; L107-P154 HydrophobicContact CD2-CB 3.75Å; L107-P154 HydrophobicContact CG-CB 3.69Å
155	V	95.9	Very high	94.4	Very high	64 Å²	64	60.2 Å²	60.2	39%	0.388	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-60.7	177.8	179.3	0	0	0	0	111.1	L133 I146 R148	L133-V155 HydrophobicContact CD2-CG2 4.23Å; I146-V155 HydrophobicContact CB-CB 4.31Å; I146-V155 HydrophobicContact CG2-CB 4.06Å; I146-V155 HydrophobicContact CG2-CG1 4.41Å; I146-V155 HydrophobicContact CG2-CG2 4.48Å; I146-V155 WeakPolarHBondContact O-CB 3.42Å; I146-V155 PolarHBondContact O-N 3.07Å; R148-V155 HydrophobicContact CB-CG2 3.73Å
156	C	93.6	Very high	94.4	Very high	64 Å²	64	60.5 Å²	60.5	43%	0.432	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	164.1	-179.8	59.3	0	0	0	0	111.7	L107 I146	L107-C156 WeakPolarHBondContact CD2-O 3.3Å; I146-C156 PolarHBondContact N-O 2.95Å; I146-C156 PolarHBondContact O-N 2.96Å
157	V	94.9	Very high	94.3	Very high	29 Å²	29	63.5 Å²	63.5	18%	0.176	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	134	168.8	-179.5	0	0	0	0	108	L107 L144 D159	L107-V157 HydrophobicContact CB-CG2 3.44Å; L107-V157 VanDerWaalsContact CB-CG2 3.44Å; L107-V157 HydrophobicContact CD2-CG2 3.71Å; L107-V157 HydrophobicContact CG-CG2 4.19Å; L144-V157 CarbonylContact O-C 3.52Å; L144-V157 VanDerWaalsContact O-CA 3.23Å; L144-V157 WeakPolarHBondContact O-CA 3.44Å; L144-V157 WeakPolarHBondContact O-CG1 3.03Å; V157-D159 HydrophobicContact CG1-CB 4.11Å
158	G	92.3	Very high	94.3	Very high	11 Å²	11	66.7 Å²	66.7	11%	0.113	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	93.6	162.7	0	0	0	0	0	108.9	S143 L144 W189	S143-G158 WeakPolarHBondContact CA-O 3.13Å; L144-G158 PolarHBondContact N-O 3.03Å; L144-G158 PolarHBondContact O-N 3.29Å; G158-W189 VanDerWaalsContact CA-CE3 3.49Å; G158-W189 WeakPolarHBondContact O-CH2 3.43Å
159	D	88.4	Confident	94.3	Very high	33 Å²	33	61.1 Å²	61.1	18%	0.176	35%	0.35	C	S	.	.			trans	-98.4	167.7	176.5	50.7	3.6	0	0	0	111.6	D109 R110 V157 G161	D109-D159 HydrophobicContact CB-CB 4.26Å; R110-D159 WeakPolarHBondContact CB-OD2 3.38Å; R110-D159 WeakPolarHBondContact CG-OD2 3.35Å; R110-D159 PolarHBondContact N-OD2 2.88Å; V157-D159 HydrophobicContact CG1-CB 4.11Å; D159-G161 PolarHBondContact O-N 3.49Å
160	D	86.5	Confident	94.3	Very high	163 Å²	163	62.2 Å²	62.2	87%	0.872	36%	0.364	S	S	*	.	S	Bend	trans	59.4	2.9	178.9	-76.4	-19.9	0	0	0	118
161	G	87.6	Confident	94.4	Very high	43 Å²	43	58.4 Å²	58.4	44%	0.443	33%	0.334	S	S	.	.	S	Bend	trans	-77	-30.4	176.1	0	0	0	0	0	114.5	D159	D159-G161 PolarHBondContact O-N 3.49Å
162	H	94.1	Very high	94.4	Very high	9 Å²	9	59.7 Å²	59.7	4%	0.042	34%	0.336	C	S	.	.			trans	-125.3	149.3	-177.6	-69.4	-57.3	0	0	0	112.7	N142 S179 S181 D183 S185 G187	N142-H162 HydrophobicContact CB-CB 4.4Å; H162-S179 PolarHBondContact CD2-OG 3.07Å; H162-S179 PolarHBondContact NE2-OG 3.19Å; H162-S181 VanDerWaalsContact ND1-CB 3.26Å; H162-S181 WeakPolarHBondContact ND1-CB 3.4Å; H162-D183 WeakPolarHBondContact CA-OD2 3.24Å; H162-D183 IonicContact CG-OD2 3.94Å; H162-D183 IonicContact ND1-OD1 3.5Å; H162-D183 IonicContact ND1-OD2 3.83Å; H162-S185 PolarHBondContact CE1-OG 2.94Å; H162-S185 PolarHBondContact ND1-OG 2.93Å; H162-G187 PolarHBondContact CE1-N 2.91Å; H162-G187 VanDerWaalsContact CE1-N 3.25Å
163	K	93	Very high	94.5	Very high	192 Å²	192	60.9 Å²	60.9	84%	0.835	35%	0.346	S	S	*	.	S	Bend	trans	-101	-9.4	178.7	-63	-180	-177.3	176.3	0	113.2	N142 D183	N142-K163 PolarHBondContact ND2-O 2.82Å; K163-D183 HydrophobicContact CB-CB 4.32Å; K163-D183 PolarHBondContact N-OD2 3.32Å
164	D	93.1	Very high	94.6	Very high	46 Å²	46	60.1 Å²	60.1	25%	0.246	34%	0.342	C	S	.	.	S	Bend	trans	-144.7	177.2	177	-155.1	-23.8	0	0	0	109.5	N142 S181 R182 D183	N142-D164 PolarHBondContact ND2-N 2.78Å; N142-D164 WeakPolarHBondContact OD1-CA 3.27Å; N142-D164 PolarHBondContact OD1-O 2.87Å; D164-S181 PolarHBondContact O-OG 3.32Å; D164-R182 HydrophobicContact CB-CB 4.18Å; D164-R182 IonicContact OD1-NH1 3.93Å; D164-R182 VanDerWaalsContact OD2-CD 3.27Å; D164-R182 WeakPolarHBondContact OD2-CD 3.07Å; D164-D183 HydrophobicContact CB-CB 3.77Å
165	W	94.1	Very high	94.6	Very high	47 Å²	47	61.1 Å²	61.1	18%	0.178	35%	0.347	C	S	.	.			trans	-63.6	141	-166.1	-51.6	-20.2	0	0	0	113.6	C120 P141 N142 F167 S181 R182	C120-W165 HydrophobicContact CB-CD2 3.43Å; C120-W165 VanDerWaalsContact CB-CD2 3.43Å; C120-W165 VanDerWaalsContact CB-CE2 3.5Å; C120-W165 HydrophobicContact CB-CE3 3.64Å; C120-W165 HydrophobicContact CB-CG 3.88Å; C120-W165 HydrophobicContact CB-CH2 3.98Å; C120-W165 HydrophobicContact CB-CZ2 3.8Å; C120-W165 HydrophobicContact CB-CZ3 3.9Å; P141-W165 HydrophobicContact CB-CB 4.25Å; P141-W165 HydrophobicContact CB-CG 3.95Å; P141-W165 HydrophobicContact CG-CG 4.2Å; P141-W165 WeakPolarHBondContact O-CA 3.21Å; N142-W165 PolarHBondContact OD1-N 3.14Å; W165-F167 HydrophobicContact CB-CD2 4.37Å; W165-F167 HydrophobicContact CB-CE2 3.79Å; W165-F167 HydrophobicContact CB-CZ 4.4Å; W165-F167 HydrophobicContact CE3-CE2 4.17Å; W165-F167 AromaticContact CE3-CZ 3.85Å; W165-F167 HydrophobicContact CE3-CZ 3.85Å; W165-F167 WeakPolarHBondContact O-CD2 3.37Å; W165-S181 VanDerWaalsContact O-CA 3.28Å; W165-S181 WeakPolarHBondContact O-CA 3.42Å; W165-S181 PolarHBondContact O-OG 3.29Å; W165-R182 VanDerWaalsContact CE3-NH2 3.28Å; W165-R182 VanDerWaalsContact CZ3-NH2 3.33Å; W165-R182 PolarHBondContact O-N 3.29Å
166	I	95.9	Very high	94.7	Very high	6 Å²	6	61.6 Å²	61.6	3%	0.031	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.1	169.6	-63.3	175.4	0	0	0	109.5	P141 N142 L144 S168 I169	P141-I166 PolarHBondContact O-N 2.81Å; N142-I166 WeakPolarHBondContact O-CD1 3.47Å; L144-I166 HydrophobicContact CB-CD1 4.24Å; L144-I166 HydrophobicContact CD1-CD1 4.48Å; I166-S168 WeakPolarHBondContact CG2-O 3.12Å; I166-I169 HydrophobicContact CG2-CD1 4.38Å; I166-I169 HydrophobicContact CG2-CG1 3.9Å
167	F	96.5	Very high	94.9	Very high	76 Å²	76	58.6 Å²	58.6	33%	0.333	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-20.3	178.3	-85.1	-78.7	0	0	0	113.9	H123 W165 G180 R182	H123-F167 HydrophobicContact CB-CD1 4.12Å; H123-F167 HydrophobicContact CB-CE1 4.46Å; H123-F167 AromaticContact CD2-CE1 3.9Å; H123-F167 AromaticContact CE1-CE1 3.87Å; H123-F167 AromaticContact CG-CD1 3.95Å; H123-F167 AromaticContact CG-CE1 3.8Å; H123-F167 AromaticContact ND1-CE1 3.79Å; H123-F167 AromaticContact NE2-CE1 3.94Å; W165-F167 HydrophobicContact CB-CD2 4.37Å; W165-F167 HydrophobicContact CB-CE2 3.79Å; W165-F167 HydrophobicContact CB-CZ 4.4Å; W165-F167 HydrophobicContact CE3-CE2 4.17Å; W165-F167 AromaticContact CE3-CZ 3.85Å; W165-F167 HydrophobicContact CE3-CZ 3.85Å; W165-F167 WeakPolarHBondContact O-CD2 3.37Å; F167-G180 PolarHBondContact N-O 3.04Å; F167-R182 HydrophobicContact CD2-CB 3.92Å; F167-R182 HydrophobicContact CE2-CB 3.75Å
168	S	97.3	Very high	95	Very high	68 Å²	68	58.3 Å²	58.3	48%	0.476	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	145.8	-177.4	-173.5	0	0	0	0	109.9	I166 S179 G180	I166-S168 WeakPolarHBondContact CG2-O 3.12Å; S168-S179 CarbonylContact O-C 3.58Å; S168-S179 VanDerWaalsContact O-CA 3.26Å; S168-S179 WeakPolarHBondContact O-CA 3.39Å; S168-G180 PolarHBondContact N-O 3.18Å; S168-G180 PolarHBondContact O-N 3.49Å
169	I	98.4	Very high	95.3	Very high	8 Å²	8	57.8 Å²	57.8	4%	0.041	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	143.9	173.2	-61.8	163.7	0	0	0	106.6	A124 E126 A135 L144 I166 V178	A124-I169 HydrophobicContact CB-CB 4.12Å; A124-I169 HydrophobicContact CB-CD1 3.71Å; A124-I169 HydrophobicContact CB-CG1 3.7Å; E126-I169 HydrophobicContact CB-CB 4.43Å; E126-I169 HydrophobicContact CB-CG2 4.18Å; E126-I169 VanDerWaalsContact CG-O 3.31Å; E126-I169 WeakPolarHBondContact CG-O 3.32Å; A135-I169 HydrophobicContact CB-CD1 4.34Å; A135-I169 HydrophobicContact CB-CG2 3.79Å; L144-I169 HydrophobicContact CD1-CD1 3.45Å; L144-I169 VanDerWaalsContact CD1-CD1 3.45Å; L144-I169 HydrophobicContact CD1-CG1 3.76Å; L144-I169 HydrophobicContact CD1-CG2 4.28Å; I166-I169 HydrophobicContact CG2-CD1 4.38Å; I166-I169 HydrophobicContact CG2-CG1 3.9Å; I169-V178 CarbonylContact C-O 3.49Å; I169-V178 VanDerWaalsContact CA-O 3.25Å; I169-V178 WeakPolarHBondContact CA-O 3.49Å
170	A	98.3	Very high	95.8	Very high	52 Å²	52	57.2 Å²	57.2	43%	0.43	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	141.7	169.9	0	0	0	0	0	110	A177 V178	A170-A177 CarbonylContact O-C 3.59Å; A170-A177 WeakPolarHBondContact O-CA 3.39Å; A170-V178 PolarHBondContact N-O 2.7Å; A170-V178 PolarHBondContact O-N 3.2Å
171	W	98.5	Very high	96.3	Very high	39 Å²	39	50.1 Å²	50.1	15%	0.148	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.2	174.2	-68.9	89.8	0	0	0	110.7	E126 N128 L133 A135 I146 A177	E126-W171 PolarHBondContact O-NE1 2.69Å; N128-W171 HydrophobicContact CB-CD2 3.47Å; N128-W171 VanDerWaalsContact CB-CD2 3.47Å; N128-W171 HydrophobicContact CB-CE3 3.6Å; N128-W171 HydrophobicContact CB-CG 3.92Å; N128-W171 HydrophobicContact CB-CH2 4.13Å; N128-W171 HydrophobicContact CB-CZ2 4Å; N128-W171 HydrophobicContact CB-CZ3 3.94Å; L133-W171 HydrophobicContact CB-CH2 3.85Å; L133-W171 HydrophobicContact CB-CZ2 3.98Å; L133-W171 HydrophobicContact CD1-CH2 3.83Å; L133-W171 HydrophobicContact CD1-CZ3 4.24Å; A135-W171 HydrophobicContact CB-CZ2 3.61Å; I146-W171 HydrophobicContact CD1-CH2 4.05Å; I146-W171 HydrophobicContact CD1-CZ2 4.06Å; W171-A177 HydrophobicContact CD2-CB 3.97Å; W171-A177 HydrophobicContact CE3-CB 3.85Å; W171-A177 HydrophobicContact CH2-CB 4.44Å; W171-A177 HydrophobicContact CZ3-CB 4.09Å
172	I	97.4	Very high	96.6	Very high	111 Å²	111	54.1 Å²	54.1	57%	0.569	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	-33.3	173.8	-57.9	174.8	0	0	0	110.1	M176 V178 L188	I172-M176 HydrophobicContact CD1-SD 4.41Å; I172-M176 PolarHBondContact N-O 2.66Å; I172-V178 HydrophobicContact CD1-CG2 3.4Å; I172-V178 VanDerWaalsContact CD1-CG2 3.4Å; I172-V178 HydrophobicContact CG1-CG2 4.03Å; I172-L188 HydrophobicContact CD1-CD1 3.88Å
173	S	97.8	Very high	96.7	Very high	43 Å²	43	56.3 Å²	56.3	30%	0.301	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	-175	176.8	76.5	0	0	0	0	110.1	P129 T175 M176	P129-S173 WeakPolarHBondContact CD-O 3.44Å; S173-T175 PolarHBondContact O-N 3.04Å; S173-T175 PolarHBondContact OG-N 3.36Å; S173-T175 PolarHBondContact OG-OG1 3.05Å; S173-M176 PolarHBondContact N-O 3.4Å; S173-M176 WeakPolarHBondContact OG-CB 3.35Å; S173-M176 PolarHBondContact OG-N 3.38Å
174	D	97.5	Very high	96.9	Very high	66 Å²	66	50.8 Å²	50.8	35%	0.353	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.2	175.1	-79.6	-43.6	0	0	0	114.7	N128 S130	N128-D174 PolarHBondContact ND2-O 3.25Å; N128-D174 PolarHBondContact ND2-OD1 3.38Å; S130-D174 WeakPolarHBondContact CA-OD1 3.2Å; S130-D174 VanDerWaalsContact CB-CG 3.5Å; S130-D174 WeakPolarHBondContact CB-OD1 3.4Å; S130-D174 PolarHBondContact N-OD1 2.9Å; S130-D174 PolarHBondContact OG-OD1 2.85Å
175	T	96.1	Very high	97.1	Very high	114 Å²	114	50.6 Å²	50.6	70%	0.699	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	2.8	-171.9	65.1	0	0	0	0	113.2	S173	S173-T175 PolarHBondContact O-N 3.04Å; S173-T175 PolarHBondContact OG-N 3.36Å; S173-T175 PolarHBondContact OG-OG1 3.05Å
176	M	97.4	Very high	97.2	Very high	73 Å²	73	55.6 Å²	55.6	36%	0.36	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	124.6	-174.2	-172.3	177.3	-74.4	0	0	110.8	I172 S173 L188 W189	I172-M176 HydrophobicContact CD1-SD 4.41Å; I172-M176 PolarHBondContact N-O 2.66Å; S173-M176 PolarHBondContact N-O 3.4Å; S173-M176 WeakPolarHBondContact OG-CB 3.35Å; S173-M176 PolarHBondContact OG-N 3.38Å; M176-L188 HydrophobicContact CG-CD1 3.58Å; M176-L188 HydrophobicContact CG-CG 4.23Å; M176-L188 HydrophobicContact SD-CD1 3.77Å; M176-L188 HydrophobicContact SD-CD2 4.18Å; M176-L188 HydrophobicContact SD-CG 4.31Å; M176-W189 VanDerWaalsContact CA-O 3.3Å; M176-W189 WeakPolarHBondContact CA-O 3.27Å
177	A	97.8	Very high	97.2	Very high	2 Å²	2	55.9 Å²	55.9	2%	0.017	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	151.3	-179.2	0	0	0	0	0	111	L144 A170 W171 W189	L144-A177 HydrophobicContact CD2-CB 4.39Å; A170-A177 CarbonylContact O-C 3.59Å; A170-A177 WeakPolarHBondContact O-CA 3.39Å; W171-A177 HydrophobicContact CD2-CB 3.97Å; W171-A177 HydrophobicContact CE3-CB 3.85Å; W171-A177 HydrophobicContact CH2-CB 4.44Å; W171-A177 HydrophobicContact CZ3-CB 4.09Å; A177-W189 PolarHBondContact N-O 2.97Å; A177-W189 PolarHBondContact O-N 2.98Å
178	V	98.1	Very high	97.2	Very high	23 Å²	23	57.4 Å²	57.4	14%	0.139	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.3	172.5	173.7	0	0	0	0	109	I169 A170 I172 M186 G187 L188	I169-V178 CarbonylContact C-O 3.49Å; I169-V178 VanDerWaalsContact CA-O 3.25Å; I169-V178 WeakPolarHBondContact CA-O 3.49Å; A170-V178 PolarHBondContact N-O 2.7Å; A170-V178 PolarHBondContact O-N 3.2Å; I172-V178 HydrophobicContact CD1-CG2 3.4Å; I172-V178 VanDerWaalsContact CD1-CG2 3.4Å; I172-V178 HydrophobicContact CG1-CG2 4.03Å; V178-M186 HydrophobicContact CG1-CB 4.38Å; V178-M186 HydrophobicContact CG1-CE 3.45Å; V178-M186 VanDerWaalsContact CG1-CE 3.45Å; V178-G187 CarbonylContact C-O 3.58Å; V178-G187 WeakPolarHBondContact CA-O 3.45Å; V178-L188 HydrophobicContact CG2-CD1 3.44Å; V178-L188 VanDerWaalsContact CG2-CD1 3.44Å
179	S	98.1	Very high	97.1	Very high	0 Å²	0	59 Å²	59	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	145.2	168.3	53.4	0	0	0	0	110.9	H162 S168 M186 G187 W189	H162-S179 PolarHBondContact CD2-OG 3.07Å; H162-S179 PolarHBondContact NE2-OG 3.19Å; S168-S179 CarbonylContact O-C 3.58Å; S168-S179 VanDerWaalsContact O-CA 3.26Å; S168-S179 WeakPolarHBondContact O-CA 3.39Å; S179-M186 CarbonylContact O-C 3.48Å; S179-M186 WeakPolarHBondContact O-CA 3.23Å; S179-G187 PolarHBondContact N-O 3.29Å; S179-G187 PolarHBondContact O-N 2.83Å; S179-W189 PolarHBondContact OG-NE1 2.9Å
180	G	97.9	Very high	97.1	Very high	20 Å²	20	61.5 Å²	61.5	21%	0.206	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.8	169.5	0	0	0	0	0	110.4	F167 S168	F167-G180 PolarHBondContact N-O 3.04Å; S168-G180 PolarHBondContact N-O 3.18Å; S168-G180 PolarHBondContact O-N 3.49Å
181	S	96.6	Very high	97	Very high	15 Å²	15	62 Å²	62	11%	0.105	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	156.6	-177.3	172.8	0	0	0	0	112.8	H162 D164 W165 D183 G184 S185	H162-S181 VanDerWaalsContact ND1-CB 3.26Å; H162-S181 WeakPolarHBondContact ND1-CB 3.4Å; D164-S181 PolarHBondContact O-OG 3.32Å; W165-S181 VanDerWaalsContact O-CA 3.28Å; W165-S181 WeakPolarHBondContact O-CA 3.42Å; W165-S181 PolarHBondContact O-OG 3.29Å; S181-D183 VanDerWaalsContact CB-OD1 3.24Å; S181-D183 WeakPolarHBondContact CB-OD1 3.26Å; S181-D183 PolarHBondContact O-N 3.42Å; S181-D183 PolarHBondContact OG-N 3Å; S181-D183 VanDerWaalsContact OG-N 3.15Å; S181-D183 PolarHBondContact OG-OD1 2.8Å; S181-D183 PolarHBondContact OG-OD2 3.01Å; S181-G184 PolarHBondContact O-N 2.73Å; S181-S185 PolarHBondContact N-O 3.46Å
182	R	95.8	Very high	96.9	Very high	126 Å²	126	63.3 Å²	63.3	48%	0.475	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.6	170.1	-179.3	-175.1	-69.9	163.3	-6.1	113	D164 W165 F167 G184	D164-R182 HydrophobicContact CB-CB 4.18Å; D164-R182 IonicContact OD1-NH1 3.93Å; D164-R182 VanDerWaalsContact OD2-CD 3.27Å; D164-R182 WeakPolarHBondContact OD2-CD 3.07Å; W165-R182 VanDerWaalsContact CE3-NH2 3.28Å; W165-R182 VanDerWaalsContact CZ3-NH2 3.33Å; W165-R182 PolarHBondContact O-N 3.29Å; F167-R182 HydrophobicContact CD2-CB 3.92Å; F167-R182 HydrophobicContact CE2-CB 3.75Å; R182-G184 PolarHBondContact O-N 3.25Å
183	D	95.9	Very high	96.9	Very high	55 Å²	55	60.5 Å²	60.5	29%	0.294	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-2	176	66.5	15.8	0	0	0	113.5	H162 K163 D164 S181 S185	H162-D183 WeakPolarHBondContact CA-OD2 3.24Å; H162-D183 IonicContact CG-OD2 3.94Å; H162-D183 IonicContact ND1-OD1 3.5Å; H162-D183 IonicContact ND1-OD2 3.83Å; K163-D183 HydrophobicContact CB-CB 4.32Å; K163-D183 PolarHBondContact N-OD2 3.32Å; D164-D183 HydrophobicContact CB-CB 3.77Å; S181-D183 VanDerWaalsContact CB-OD1 3.24Å; S181-D183 WeakPolarHBondContact CB-OD1 3.26Å; S181-D183 PolarHBondContact O-N 3.42Å; S181-D183 PolarHBondContact OG-N 3Å; S181-D183 VanDerWaalsContact OG-N 3.15Å; S181-D183 PolarHBondContact OG-OD1 2.8Å; S181-D183 PolarHBondContact OG-OD2 3.01Å; D183-S185 VanDerWaalsContact C-N 3.35Å; D183-S185 VanDerWaalsContact CG-OG 3.25Å; D183-S185 WeakPolarHBondContact OD1-CA 3.28Å; D183-S185 VanDerWaalsContact OD1-CB 3.23Å; D183-S185 WeakPolarHBondContact OD1-CB 3.35Å; D183-S185 PolarHBondContact OD1-N 3.15Å; D183-S185 PolarHBondContact OD1-OG 2.56Å; D183-S185 PolarHBondContact OD2-OG 3.18Å
184	G	96.7	Very high	96.8	Very high	76 Å²	76	61.6 Å²	61.6	78%	0.784	35%	0.347	S	S	*	.	S	Bend	trans	86.1	6.3	178.9	0	0	0	0	0	113.5	S181 R182	S181-G184 PolarHBondContact O-N 2.73Å; R182-G184 PolarHBondContact O-N 3.25Å
185	S	97.1	Very high	96.8	Very high	43 Å²	43	61.3 Å²	61.3	30%	0.301	35%	0.346	S	S	.	.			trans	-107.7	162	179.7	76.6	0	0	0	0	113.2	H162 S181 D183	H162-S185 PolarHBondContact CE1-OG 2.94Å; H162-S185 PolarHBondContact ND1-OG 2.93Å; S181-S185 PolarHBondContact N-O 3.46Å; D183-S185 VanDerWaalsContact C-N 3.35Å; D183-S185 VanDerWaalsContact CG-OG 3.25Å; D183-S185 WeakPolarHBondContact OD1-CA 3.28Å; D183-S185 VanDerWaalsContact OD1-CB 3.23Å; D183-S185 WeakPolarHBondContact OD1-CB 3.35Å; D183-S185 PolarHBondContact OD1-N 3.15Å; D183-S185 PolarHBondContact OD1-OG 2.56Å; D183-S185 PolarHBondContact OD2-OG 3.18Å
186	M	97.1	Very high	96.8	Very high	151 Å²	151	57.5 Å²	57.5	74%	0.744	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	133.9	166.7	-65.3	173.6	63	0	0	108.8	V178 S179	V178-M186 HydrophobicContact CG1-CB 4.38Å; V178-M186 HydrophobicContact CG1-CE 3.45Å; V178-M186 VanDerWaalsContact CG1-CE 3.45Å; S179-M186 CarbonylContact O-C 3.48Å; S179-M186 WeakPolarHBondContact O-CA 3.23Å
187	G	96	Very high	96.8	Very high	12 Å²	12	56.3 Å²	56.3	12%	0.124	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135.6	174.8	0	0	0	0	0	110.2	H162 V178 S179	H162-G187 PolarHBondContact CE1-N 2.91Å; H162-G187 VanDerWaalsContact CE1-N 3.25Å; V178-G187 CarbonylContact C-O 3.58Å; V178-G187 WeakPolarHBondContact CA-O 3.45Å; S179-G187 PolarHBondContact N-O 3.29Å; S179-G187 PolarHBondContact O-N 2.83Å
188	L	96.3	Very high	96.7	Very high	109 Å²	109	60.8 Å²	60.8	57%	0.571	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.4	171.2	-176.3	71.8	0	0	0	108.2	I172 M176 V178	I172-L188 HydrophobicContact CD1-CD1 3.88Å; M176-L188 HydrophobicContact CG-CD1 3.58Å; M176-L188 HydrophobicContact CG-CG 4.23Å; M176-L188 HydrophobicContact SD-CD1 3.77Å; M176-L188 HydrophobicContact SD-CD2 4.18Å; M176-L188 HydrophobicContact SD-CG 4.31Å; V178-L188 HydrophobicContact CG2-CD1 3.44Å; V178-L188 VanDerWaalsContact CG2-CD1 3.44Å
189	W	94.8	Very high	96.6	Very high	100 Å²	100	64.3 Å²	64.3	38%	0.379	36%	0.362	S	S	.	.			trans	-124.2	0	-174.8	-48.8	90.3	0	0	0	110.9	L144 G158 M176 A177 S179	L144-W189 HydrophobicContact CB-CZ2 4.42Å; L144-W189 HydrophobicContact CD2-CB 4.02Å; L144-W189 HydrophobicContact CD2-CD2 4.19Å; L144-W189 HydrophobicContact CD2-CG 3.65Å; G158-W189 VanDerWaalsContact CA-CE3 3.49Å; G158-W189 WeakPolarHBondContact O-CH2 3.43Å; M176-W189 VanDerWaalsContact CA-O 3.3Å; M176-W189 WeakPolarHBondContact CA-O 3.27Å; A177-W189 PolarHBondContact N-O 2.97Å; A177-W189 PolarHBondContact O-N 2.98Å; S179-W189 PolarHBondContact OG-NE1 2.9Å

Retrieved 189 of 189 residues in 121.3 ms (Link to these results)

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