A0A096MMY0_PAPAN Loading...

Amphoterin-induced protein 1

Promotes growth and fasciculation of neurites from cultured hippocampal neurons. May be involved in fasciculation as well as myelination of developing neural axons. May have a role in regeneration as well as neural plasticity in the adult nervous system. May mediate homophilic as well as heterophilic cell-cell interaction and contribute to signal transduction through its intracellular domain. Assembled with KCNB1 modulates the gating characteristics of the delayed rectifier voltage-dependent potassium channel KCNB1.

AlphaFold DB (Q86WK6), UniProt , Accession A0A096MMY0, Species PAPAN (Papio anubis, Olive baboon), Gene AMIGO1, Length 493 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	40.1	Very low	49.5	Very low	240 Å²	240	168.5 Å²	168.5	100%	1.182	82%	0.823	S	S	*	*				0	136.4	0	-82.8	165.6	153.2	0	0	107.8
2	H	46	Very low	49.6	Very low	190 Å²	190	166.2 Å²	166.2	88%	0.88	82%	0.815	S	S	*	*			trans	76.8	109.5	-175.8	-75.4	-58.2	0	0	0	119.3
3	P	52.1	Low	49.5	Very low	116 Å²	116	163.1 Å²	163.1	75%	0.753	80%	0.803	S	S	*	*			trans	-91.7	147.8	163.3	35	-27	0	0	0	111.8
4	H	47.9	Very low	49.7	Very low	199 Å²	199	158.7 Å²	158.7	92%	0.921	78%	0.784	S	S	*	*			trans	-46.4	132.8	164.5	-97.7	-98.4	0	0	0	112
5	R	56.8	Low	49.8	Very low	247 Å²	247	152.5 Å²	152.5	93%	0.932	76%	0.76	S	S	*	*			trans	-121.8	112	165.3	-148.2	172.9	-171.4	174.6	1.6	109.5
6	D	52.8	Low	49.9	Very low	121 Å²	121	146.4 Å²	146.4	65%	0.647	74%	0.736	S	S	*	*			trans	-70.8	133.1	-173.5	-144.6	-2.6	0	0	0	111.5	R8	D6-R8 VanDerWaalsContact C-N 3.32Å; D6-R8 PolarHBondContact O-N 2.98Å; D6-R8 VanDerWaalsContact O-N 3.1Å
7	P	52.8	Low	50	Low	119 Å²	119	144.2 Å²	144.2	77%	0.773	73%	0.727	S	S	*	*	S	Bend	trans	-89.6	67.6	-178.5	36.8	-31.3	0	0	0	109.7
8	R	51.9	Low	50.3	Low	208 Å²	208	139.6 Å²	139.6	79%	0.785	71%	0.71	S	S	*	*			trans	-120.2	6.6	177.3	-74.1	-174.3	171	-171	-1.2	114.9	D6	D6-R8 VanDerWaalsContact C-N 3.32Å; D6-R8 PolarHBondContact O-N 2.98Å; D6-R8 VanDerWaalsContact O-N 3.1Å
9	G	47.8	Very low	50.5	Low	60 Å²	60	138.4 Å²	138.4	62%	0.619	71%	0.705	S	S	*	*	S	Bend	trans	-94.4	-9.4	-175.8	0	0	0	0	0	117.2
10	L	49.1	Very low	50.6	Low	150 Å²	150	137.3 Å²	137.3	79%	0.785	70%	0.7	S	S	*	*	S	Bend	trans	-97.8	-8.6	-167.4	-125.2	80.9	0	0	0	115.8
11	W	47.8	Very low	50.7	Low	204 Å²	204	136.1 Å²	136.1	77%	0.773	70%	0.695	S	S	*	*	S	Bend	trans	-95.4	-2.9	-173.8	-77.9	94.8	0	0	0	115.1	L14	W11-L14 HydrophobicContact CD2-CD1 4.41Å; W11-L14 HydrophobicContact CE3-CD1 3.83Å; W11-L14 HydrophobicContact CZ3-CD1 3.99Å
12	L	49.8	Very low	51.1	Low	140 Å²	140	131.3 Å²	131.3	73%	0.733	67%	0.668	S	S	*	*	S	Bend	trans	-97.7	-3.5	-179.4	-72.2	168.1	0	0	0	114.4
13	L	48.7	Very low	51.2	Low	126 Å²	126	128 Å²	128	66%	0.66	65%	0.653	S	S	*	*	S	Bend	trans	-100.7	-11.9	176.9	-63.2	178.6	0	0	0	113.8	S16 L17	L13-S16 PolarHBondContact O-OG 3.34Å; L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 PolarHBondContact O-N 3.3Å
14	L	52.2	Low	51.1	Low	102 Å²	102	127.1 Å²	127.1	53%	0.534	65%	0.645	S	S	.	*	H	α-helix	trans	-73.2	-37.7	176.6	-73	161.3	0	0	0	114	W11 S18	W11-L14 HydrophobicContact CD2-CD1 4.41Å; W11-L14 HydrophobicContact CE3-CD1 3.83Å; W11-L14 HydrophobicContact CZ3-CD1 3.99Å; L14-S18 PolarHBondContact O-N 3.37Å
15	P	51.6	Low	51.1	Low	65 Å²	65	121.4 Å²	121.4	42%	0.422	63%	0.632	S	S	.	*	H	α-helix	trans	-76.2	-31.5	179.1	19.7	-12.8	0	0	0	111.9	S18 L19	P15-S18 PolarHBondContact O-N 3.45Å; P15-S18 PolarHBondContact O-OG 3.4Å; P15-L19 PolarHBondContact O-N 3.06Å; P15-L19 VanDerWaalsContact O-N 3.12Å
16	S	51.9	Low	50.6	Low	55 Å²	55	118.5 Å²	118.5	39%	0.385	62%	0.621	S	S	.	*	H	α-helix	trans	-73.2	-33.9	177.1	51	0	0	0	0	112.9	L13 L20	L13-S16 PolarHBondContact O-OG 3.34Å; S16-L20 PolarHBondContact O-N 3.12Å
17	L	51.4	Low	50	Low	110 Å²	110	116.4 Å²	116.4	58%	0.576	62%	0.621	S	S	*	*	H	α-helix	trans	-70.5	-33.5	172.8	-157.8	74.8	0	0	0	111.9	L13 L21	L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 PolarHBondContact O-N 3.3Å; L17-L21 HydrophobicContact CG-CD1 4.36Å; L17-L21 WeakPolarHBondContact O-CB 3.04Å; L17-L21 WeakPolarHBondContact O-CD1 3.48Å; L17-L21 WeakPolarHBondContact O-CG 3.47Å; L17-L21 PolarHBondContact O-N 3.23Å
18	S	55.3	Low	49.2	Very low	60 Å²	60	113.1 Å²	113.1	42%	0.42	61%	0.609	S	S	.	*	H	α-helix	trans	-70	-33.7	175.4	75.4	0	0	0	0	113.3	L14 P15 F22	L14-S18 PolarHBondContact O-N 3.37Å; P15-S18 PolarHBondContact O-N 3.45Å; P15-S18 PolarHBondContact O-OG 3.4Å; S18-F22 WeakPolarHBondContact O-CB 3.36Å; S18-F22 PolarHBondContact O-N 2.92Å
19	L	53.4	Low	48.5	Very low	117 Å²	117	114.3 Å²	114.3	61%	0.613	61%	0.613	S	S	*	*	H	α-helix	trans	-73.8	-37.7	173.9	-99	136.7	0	0	0	112.1	P15 F22 E23	P15-L19 PolarHBondContact O-N 3.06Å; P15-L19 VanDerWaalsContact O-N 3.12Å; L19-F22 PolarHBondContact O-N 3.42Å; L19-E23 PolarHBondContact O-N 2.05Å
20	L	52.5	Low	48.2	Very low	117 Å²	117	115.6 Å²	115.6	61%	0.613	62%	0.618	S	S	*	*	H	α-helix	trans	-67.5	-35.8	170.8	-106.3	104.8	0	0	0	112.2	S16 F22 E23 V24	S16-L20 PolarHBondContact O-N 3.12Å; L20-F22 VanDerWaalsContact C-N 3.34Å; L20-E23 PolarHBondContact O-N 3.26Å; L20-V24 WeakPolarHBondContact O-CB 3.06Å; L20-V24 WeakPolarHBondContact O-CG2 3.32Å; L20-V24 PolarHBondContact O-N 3.33Å
21	L	52.3	Low	48.3	Very low	112 Å²	112	114.8 Å²	114.8	59%	0.586	62%	0.619	S	S	*	*	H	α-helix	trans	-69.4	-31.3	173.2	-82.4	158	0	0	0	112.3	L17 A25	L17-L21 HydrophobicContact CG-CD1 4.36Å; L17-L21 WeakPolarHBondContact O-CB 3.04Å; L17-L21 WeakPolarHBondContact O-CD1 3.48Å; L17-L21 WeakPolarHBondContact O-CG 3.47Å; L17-L21 PolarHBondContact O-N 3.23Å; L21-A25 WeakPolarHBondContact O-CB 3.09Å; L21-A25 PolarHBondContact O-N 3Å
22	F	49.7	Very low	48.9	Very low	139 Å²	139	108.1 Å²	108.1	61%	0.61	60%	0.6	S	S	*	*	H	α-helix	trans	-73.9	-35.2	173.9	-111.7	-86.7	0	0	0	113.2	S18 L19 L20 R26	S18-F22 WeakPolarHBondContact O-CB 3.36Å; S18-F22 PolarHBondContact O-N 2.92Å; L19-F22 PolarHBondContact O-N 3.42Å; L20-F22 VanDerWaalsContact C-N 3.34Å; F22-R26 WeakPolarHBondContact O-CB 3.42Å; F22-R26 PolarHBondContact O-N 3.39Å
23	E	48.5	Very low	50	Low	122 Å²	122	105.8 Å²	105.8	57%	0.57	60%	0.596	S	S	*	*	H	α-helix	trans	-76.2	-35.8	173.2	-79.3	-65.3	150.2	0	0	112	L19 L20 R26 A27	L19-E23 PolarHBondContact O-N 2.05Å; L20-E23 PolarHBondContact O-N 3.26Å; E23-R26 CarbonylContact O-C 3.5Å; E23-R26 PolarHBondContact O-N 3.11Å; E23-A27 VanDerWaalsContact O-CB 3.3Å; E23-A27 WeakPolarHBondContact O-CB 3.45Å; E23-A27 PolarHBondContact O-N 3.44Å
24	V	49.8	Very low	51.9	Low	97 Å²	97	102 Å²	102	59%	0.588	58%	0.579	S	S	*	*	H	α-helix	trans	-72.5	-30.4	173.4	174.2	0	0	0	0	111.6	L20 A27 G28	L20-V24 WeakPolarHBondContact O-CB 3.06Å; L20-V24 WeakPolarHBondContact O-CG2 3.32Å; L20-V24 PolarHBondContact O-N 3.33Å; V24-A27 CarbonylContact O-C 3.6Å; V24-A27 PolarHBondContact O-N 2.73Å; V24-G28 PolarHBondContact O-N 2.84Å
25	A	47.1	Very low	53.7	Low	79 Å²	79	97.9 Å²	97.9	65%	0.653	56%	0.559	S	S	*	*	H	α-helix	trans	-73.2	-27.4	169.5	0	0	0	0	0	112.9	L21	L21-A25 WeakPolarHBondContact O-CB 3.09Å; L21-A25 PolarHBondContact O-N 3Å
26	R	46.1	Very low	55.3	Low	185 Å²	185	100.3 Å²	100.3	70%	0.698	59%	0.585	S	S	*	*	H	α-helix	trans	-82.7	-18.6	170	-85.1	-172.6	169.1	109.5	-0	113.9	F22 E23 G28	F22-R26 WeakPolarHBondContact O-CB 3.42Å; F22-R26 PolarHBondContact O-N 3.39Å; E23-R26 CarbonylContact O-C 3.5Å; E23-R26 PolarHBondContact O-N 3.11Å; R26-G28 VanDerWaalsContact C-N 3.28Å
27	A	40.7	Very low	57.1	Low	78 Å²	78	99.1 Å²	99.1	65%	0.645	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	10.2	169.9	0	0	0	0	0	113.1	E23 V24 R29	E23-A27 VanDerWaalsContact O-CB 3.3Å; E23-A27 WeakPolarHBondContact O-CB 3.45Å; E23-A27 PolarHBondContact O-N 3.44Å; V24-A27 CarbonylContact O-C 3.6Å; V24-A27 PolarHBondContact O-N 2.73Å; A27-R29 PolarHBondContact O-N 3.17Å
28	G	35.3	Very low	59.2	Low	50 Å²	50	94.6 Å²	94.6	52%	0.515	56%	0.555	S	S	.	*	S	Bend	trans	-58.7	108.6	159.7	0	0	0	0	0	107.7	V24 R26 A30	V24-G28 PolarHBondContact O-N 2.84Å; R26-G28 VanDerWaalsContact C-N 3.28Å; G28-A30 PolarHBondContact O-N 2.99Å
29	R	37.7	Very low	61	Low	232 Å²	232	98 Å²	98	88%	0.875	57%	0.568	S	S	*	*			trans	-27.7	118.6	165.9	-98.6	173.3	168.7	160.9	-4.2	107.5	A27 V31	A27-R29 PolarHBondContact O-N 3.17Å; R29-V31 VanDerWaalsContact C-N 3.26Å; R29-V31 PolarHBondContact O-N 3.2Å
30	A	41.4	Very low	62.9	Low	88 Å²	88	94.6 Å²	94.6	73%	0.727	55%	0.553	S	S	*	*			trans	-49.4	104	169.6	0	0	0	0	0	105.7	G28 V32	G28-A30 PolarHBondContact O-N 2.99Å; A30-V32 WeakPolarHBondContact O-CG2 3.25Å; A30-V32 PolarHBondContact O-N 3.34Å
31	V	50.4	Low	64.9	Low	133 Å²	133	92 Å²	92	81%	0.806	55%	0.549	S	S	*	.			trans	-69.8	91.1	174	176.4	0	0	0	0	101.6	R29 S33	R29-V31 VanDerWaalsContact C-N 3.26Å; R29-V31 PolarHBondContact O-N 3.2Å; V31-S33 VanDerWaalsContact C-N 3.27Å; V31-S33 PolarHBondContact O-N 3.4Å
32	V	61	Low	66.8	Low	63 Å²	63	91.5 Å²	91.5	38%	0.382	56%	0.555	S	S	.	*			trans	-59.3	101.8	-178.1	178.1	0	0	0	0	105	A30 C34 P60 Y62	A30-V32 WeakPolarHBondContact O-CG2 3.25Å; A30-V32 PolarHBondContact O-N 3.34Å; V32-C34 PolarHBondContact O-N 2.73Å; V32-P60 HydrophobicContact CG1-CB 3.48Å; V32-P60 VanDerWaalsContact CG1-CB 3.48Å; V32-P60 HydrophobicContact CG1-CG 3.69Å; V32-Y62 HydrophobicContact CB-CE1 3.68Å; V32-Y62 HydrophobicContact CG1-CD1 4.47Å; V32-Y62 HydrophobicContact CG1-CE1 3.56Å; V32-Y62 HydrophobicContact CG2-CE1 4.09Å
33	S	73.4	Confident	68.9	Low	92 Å²	92	88 Å²	88	64%	0.643	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-74.5	127.6	-165.5	-171.8	0	0	0	0	107.9	V31	V31-S33 VanDerWaalsContact C-N 3.27Å; V31-S33 PolarHBondContact O-N 3.4Å
34	C	88.8	Confident	71.2	Confident	45 Å²	45	85.9 Å²	85.9	30%	0.304	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-56.9	127.8	169	-172.8	0	0	0	0	109	V32 A36 C38 C40	V32-C34 PolarHBondContact O-N 2.73Å; C34-A36 PolarHBondContact O-N 2.92Å; C34-C38 PolarHBondContact SG-O 3.43Å; C34-C40 WeakPolarHBondContact CA-SG 3.35Å; C34-C40 HydrophobicContact CB-CB 3.63Å; C34-C40 WeakPolarHBondContact CB-SG 3.19Å; C34-C40 WeakPolarHBondContact SG-CB 3.24Å; C34-C40 PolarHBondContact SG-N 3.33Å; C34-C40 CovalentContact SG-SG 2.02Å; C34-C40 PolarHBondContact SG-SG 3.07Å
35	P	88.4	Confident	73.4	Confident	17 Å²	17	81.2 Å²	81.2	11%	0.11	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-55.5	140.8	176.7	-21.7	30.4	0	0	0	110.7	A37 C38 P56 L59	P35-A37 PolarHBondContact O-N 3.06Å; P35-C38 HydrophobicContact CB-CB 4.2Å; P35-C38 HydrophobicContact CG-CB 4.42Å; P35-C38 PolarHBondContact O-N 2.99Å; P35-P56 HydrophobicContact CB-CB 3.9Å; P35-P56 HydrophobicContact CG-CB 4.37Å; P35-L59 HydrophobicContact CG-CD2 4.37Å
36	A	86.9	Confident	75.8	Confident	116 Å²	116	79.1 Å²	79.1	96%	0.959	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.7	-171.9	0	0	0	0	0	114.5	C34 C38	C34-A36 PolarHBondContact O-N 2.92Å; A36-C38 VanDerWaalsContact C-N 3.34Å
37	A	89.9	Confident	78.2	Confident	30 Å²	30	70.3 Å²	70.3	25%	0.248	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	12.8	177.4	0	0	0	0	0	113.4	P35 Q50 L52	P35-A37 PolarHBondContact O-N 3.06Å; A37-Q50 WeakPolarHBondContact O-CG 3.25Å; A37-L52 HydrophobicContact CB-CD2 3.85Å
38	C	93.8	Very high	80.9	Confident	14 Å²	14	67.9 Å²	67.9	10%	0.095	43%	0.431	C	S	.	.			trans	-128.9	150.7	-175	-57.2	0	0	0	0	111.2	C34 P35 A36 S46 C47	C34-C38 PolarHBondContact SG-O 3.43Å; P35-C38 HydrophobicContact CB-CB 4.2Å; P35-C38 HydrophobicContact CG-CB 4.42Å; P35-C38 PolarHBondContact O-N 2.99Å; A36-C38 VanDerWaalsContact C-N 3.34Å; C38-S46 CarbonylContact C-O 3.57Å; C38-S46 WeakPolarHBondContact CA-O 3.35Å; C38-C47 HydrophobicContact CB-CB 4.07Å; C38-C47 WeakPolarHBondContact CB-SG 3.48Å; C38-C47 WeakPolarHBondContact SG-CB 3.4Å; C38-C47 CovalentContact SG-SG 2.03Å; C38-C47 PolarHBondContact SG-SG 2.96Å
39	L	94.7	Very high	83.8	Confident	133 Å²	133	72.6 Å²	72.6	70%	0.696	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.4	164	-62.4	175.7	0	0	0	107.8	S46	L39-S46 PolarHBondContact N-O 2.03Å; L39-S46 PolarHBondContact O-N 2.81Å
40	C	93.5	Very high	86.5	Confident	44 Å²	44	66.6 Å²	66.6	30%	0.297	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.9	179.4	-55.4	0	0	0	0	110.5	C34 I44 L45	C34-C40 WeakPolarHBondContact CA-SG 3.35Å; C34-C40 HydrophobicContact CB-CB 3.63Å; C34-C40 WeakPolarHBondContact CB-SG 3.19Å; C34-C40 WeakPolarHBondContact SG-CB 3.24Å; C34-C40 PolarHBondContact SG-N 3.33Å; C34-C40 CovalentContact SG-SG 2.02Å; C34-C40 PolarHBondContact SG-SG 3.07Å; C40-I44 WeakPolarHBondContact CA-O 3.46Å; C40-L45 HydrophobicContact CB-CD1 4.44Å
41	A	92.9	Very high	89.1	Confident	63 Å²	63	69.5 Å²	69.5	52%	0.521	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	97.5	174.9	0	0	0	0	0	108.9	N43 I44	A41-N43 PolarHBondContact O-N 3.4Å; A41-I44 PolarHBondContact N-O 2.85Å; A41-I44 WeakPolarHBondContact O-CB 3.38Å; A41-I44 PolarHBondContact O-N 2.66Å
42	S	92.5	Very high	91.3	Very high	101 Å²	101	64.2 Å²	64.2	71%	0.706	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	-110.5	-173.2	-172.5	0	0	0	0	111.2	Y62	S42-Y62 WeakPolarHBondContact O-CE2 3.29Å
43	N	94.6	Very high	92.9	Very high	67 Å²	67	65 Å²	65	36%	0.358	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	5.6	178.9	62.3	-13.1	0	0	0	114.1	A41 Y62 A64 L65	A41-N43 PolarHBondContact O-N 3.4Å; N43-Y62 HydrophobicContact CB-CD2 4.5Å; N43-Y62 WeakPolarHBondContact CB-O 3Å; N43-A64 HydrophobicContact CB-CB 3.87Å; N43-A64 VanDerWaalsContact ND2-CB 3.3Å; N43-A64 WeakPolarHBondContact ND2-CB 3.24Å; N43-A64 PolarHBondContact O-N 2.94Å; N43-L65 PolarHBondContact O-N 3.3Å
44	I	96.8	Very high	93.9	Very high	76 Å²	76	64.8 Å²	64.8	39%	0.39	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	123	176.5	-59.9	176.5	0	0	0	109	C40 A41 L65	C40-I44 WeakPolarHBondContact CA-O 3.46Å; A41-I44 PolarHBondContact N-O 2.85Å; A41-I44 WeakPolarHBondContact O-CB 3.38Å; A41-I44 PolarHBondContact O-N 2.66Å; I44-L65 HydrophobicContact CG1-CB 4.29Å; I44-L65 HydrophobicContact CG2-CB 4.45Å; I44-L65 HydrophobicContact CG2-CD2 4.01Å
45	L	96.3	Very high	94.3	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	112.7	175.2	-90.4	71	0	0	0	109.7	C40 L59 P60 T63 L65 L66 D67	C40-L45 HydrophobicContact CB-CD1 4.44Å; L45-L59 HydrophobicContact CD2-CD2 3.9Å; L45-P60 HydrophobicContact CD1-CG 4.36Å; L45-P60 VanDerWaalsContact CD2-CD 3.4Å; L45-P60 HydrophobicContact CD2-CG 3.99Å; L45-T63 HydrophobicContact CB-CG2 4.06Å; L45-T63 HydrophobicContact CD1-CG2 3.86Å; L45-T63 WeakPolarHBondContact CD1-OG1 3.47Å; L45-T63 HydrophobicContact CD2-CG2 4.32Å; L45-T63 HydrophobicContact CG-CG2 4.26Å; L45-L65 PolarHBondContact N-O 3.34Å; L45-L66 HydrophobicContact CB-CD1 3.8Å; L45-L66 HydrophobicContact CD2-CD1 4.42Å; L45-D67 PolarHBondContact O-N 3.23Å
46	S	96.9	Very high	94.5	Very high	35 Å²	35	63.4 Å²	63.4	25%	0.245	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.3	174.4	-175.6	0	0	0	0	111	C38 L39 S48 D67	C38-S46 CarbonylContact C-O 3.57Å; C38-S46 WeakPolarHBondContact CA-O 3.35Å; L39-S46 PolarHBondContact N-O 2.03Å; L39-S46 PolarHBondContact O-N 2.81Å; S46-S48 PolarHBondContact OG-OG 3.29Å; S46-D67 PolarHBondContact OG-OD2 2.97Å
47	C	96.6	Very high	94.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.36	C	S	.	.			trans	-116.5	25.1	179.1	-43.7	0	0	0	0	110.4	C38 L52 D67 L68 N71	C38-C47 HydrophobicContact CB-CB 4.07Å; C38-C47 WeakPolarHBondContact CB-SG 3.48Å; C38-C47 WeakPolarHBondContact SG-CB 3.4Å; C38-C47 CovalentContact SG-SG 2.03Å; C38-C47 PolarHBondContact SG-SG 2.96Å; C47-L52 HydrophobicContact CB-CD1 4.1Å; C47-D67 CarbonylContact C-O 3.58Å; C47-D67 WeakPolarHBondContact CA-O 3.44Å; C47-D67 PolarHBondContact N-O 2.82Å; C47-L68 HydrophobicContact CB-CD2 3.84Å; C47-N71 PolarHBondContact O-ND2 2.79Å
48	S	96.5	Very high	94.1	Very high	26 Å²	26	67.7 Å²	67.7	18%	0.182	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	152.8	-174	53.8	0	0	0	0	113.2	S46 Q50 D67 S69	S46-S48 PolarHBondContact OG-OG 3.29Å; S48-Q50 VanDerWaalsContact C-N 3.28Å; S48-Q50 WeakPolarHBondContact O-CG 3.42Å; S48-Q50 PolarHBondContact O-N 2.81Å; S48-Q50 PolarHBondContact O-NE2 3.1Å; S48-D67 VanDerWaalsContact CB-OD2 3.25Å; S48-D67 WeakPolarHBondContact CB-OD2 2.95Å; S48-D67 PolarHBondContact OG-OD2 3.48Å; S48-S69 WeakPolarHBondContact CA-O 3.31Å; S48-S69 WeakPolarHBondContact CB-O 3.16Å; S48-S69 WeakPolarHBondContact CB-OG 3.36Å
49	K	96.5	Very high	94	Very high	150 Å²	150	67.2 Å²	67.2	65%	0.652	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	31	178.1	-59.3	177.6	-179	174	0	114.7	S69 H70	K49-S69 PolarHBondContact N-O 3.36Å; K49-H70 VanDerWaalsContact CA-O 3.24Å; K49-H70 WeakPolarHBondContact CA-O 3.25Å; K49-H70 HydrophobicContact CB-CB 4.47Å; K49-H70 HydrophobicContact CG-CB 3.55Å; K49-H70 PolarHBondContact N-O 2.89Å
50	Q	95.6	Very high	94	Very high	105 Å²	105	61 Å²	61	49%	0.491	34%	0.342	S	S	.	.	S	Bend	trans	-103.7	6.6	-177.9	-63.3	-59.7	-38.9	0	0	113.5	A37 S48 L52 N71	A37-Q50 WeakPolarHBondContact O-CG 3.25Å; S48-Q50 VanDerWaalsContact C-N 3.28Å; S48-Q50 WeakPolarHBondContact O-CG 3.42Å; S48-Q50 PolarHBondContact O-N 2.81Å; S48-Q50 PolarHBondContact O-NE2 3.1Å; Q50-L52 HydrophobicContact CB-CD1 4.06Å; Q50-L52 HydrophobicContact CB-CD2 4.15Å; Q50-L52 HydrophobicContact CB-CG 3.7Å; Q50-L52 PolarHBondContact O-N 3.36Å; Q50-L52 VanDerWaalsContact O-N 3.17Å; Q50-N71 PolarHBondContact N-OD1 2.85Å; Q50-N71 VanDerWaalsContact N-OD1 3.08Å
51	Q	95.5	Very high	94	Very high	149 Å²	149	62 Å²	62	70%	0.696	35%	0.35	S	S	*	.			trans	56.1	28.9	-177.8	-55.8	178.7	-8.9	0	0	113.2	P53 N71	Q51-P53 WeakPolarHBondContact O-CD 3.32Å; Q51-N71 PolarHBondContact N-OD1 3.34Å; Q51-N71 VanDerWaalsContact N-OD1 3.11Å
52	L	95.8	Very high	94	Very high	22 Å²	22	63.1 Å²	63.1	12%	0.115	34%	0.341	C	S	.	.			trans	-65.8	124.9	-172.8	-65	170.7	0	0	0	111	A37 C47 Q50 P56 L68 N71 N72 L73	A37-L52 HydrophobicContact CB-CD2 3.85Å; C47-L52 HydrophobicContact CB-CD1 4.1Å; Q50-L52 HydrophobicContact CB-CD1 4.06Å; Q50-L52 HydrophobicContact CB-CD2 4.15Å; Q50-L52 HydrophobicContact CB-CG 3.7Å; Q50-L52 PolarHBondContact O-N 3.36Å; Q50-L52 VanDerWaalsContact O-N 3.17Å; L52-P56 HydrophobicContact CD1-CG 4.11Å; L52-L68 HydrophobicContact CD1-CD2 4.29Å; L52-N71 HydrophobicContact CB-CB 4.1Å; L52-N71 WeakPolarHBondContact CG-OD1 3.36Å; L52-N71 PolarHBondContact N-OD1 2.76Å; L52-N72 CarbonylContact O-C 3.36Å; L52-N72 VanDerWaalsContact O-CA 3.3Å; L52-N72 WeakPolarHBondContact O-CA 3.49Å; L52-N72 PolarHBondContact O-N 3.28Å; L52-L73 PolarHBondContact O-N 3.4Å
53	P	95.4	Very high	94.2	Very high	81 Å²	81	58.3 Å²	58.3	53%	0.526	31%	0.308	S	S	.	.	S	Bend	trans	-80.7	-21.9	173.8	31.5	-34.3	0	0	0	112.6	Q51	Q51-P53 WeakPolarHBondContact O-CD 3.32Å
54	N	95.1	Very high	94.3	Very high	87 Å²	87	56 Å²	56	47%	0.465	30%	0.297	S	S	.	.	S	Bend	trans	-140.7	158.8	179.6	-59.1	-66.8	0	0	0	110.1	L73	N54-L73 VanDerWaalsContact CA-CD2 3.49Å
55	V	95.3	Very high	94.4	Very high	15 Å²	15	54.8 Å²	54.8	9%	0.091	29%	0.292	C	S	.	.			trans	-68	140	175.1	-171.7	0	0	0	0	110.3	H57 L59 L68 L73 L76 W80	V55-H57 PolarHBondContact O-N 3.49Å; V55-L59 HydrophobicContact CG1-CD1 3.97Å; V55-L68 HydrophobicContact CG1-CD1 3.73Å; V55-L68 HydrophobicContact CG1-CD2 4.25Å; V55-L68 HydrophobicContact CG2-CD1 4.1Å; V55-L73 HydrophobicContact CG2-CD1 4.12Å; V55-L73 HydrophobicContact CG2-CD2 4.24Å; V55-L76 HydrophobicContact CG2-CD1 4.44Å; V55-W80 HydrophobicContact CB-CE3 4.21Å; V55-W80 HydrophobicContact CG1-CE3 3.71Å; V55-W80 HydrophobicContact CG1-CZ3 4.05Å; V55-W80 HydrophobicContact CG2-CB 4.34Å; V55-W80 HydrophobicContact CG2-CE3 4.12Å
56	P	92.5	Very high	94.5	Very high	18 Å²	18	54.8 Å²	54.8	12%	0.117	29%	0.292	C	S	.	.			trans	-58.9	130.8	176.3	-25.5	36	0	0	0	112.6	P35 L52 S58	P35-P56 HydrophobicContact CB-CB 3.9Å; P35-P56 HydrophobicContact CG-CB 4.37Å; L52-P56 HydrophobicContact CD1-CG 4.11Å; P56-S58 VanDerWaalsContact C-N 3.33Å; P56-S58 PolarHBondContact O-N 3.36Å
57	H	83.3	Confident	94.6	Very high	146 Å²	146	54 Å²	54	68%	0.676	29%	0.285	S	S	*	.	S	Bend	trans	-66.5	-23.1	-168	-72.4	-69.1	0	0	0	116.3	V55	V55-H57 PolarHBondContact O-N 3.49Å
58	S	85.8	Confident	94.6	Very high	89 Å²	89	54 Å²	54	62%	0.622	29%	0.285	S	S	*	.			trans	-119	66.5	-170.1	-59	0	0	0	0	111.9	P56	P56-S58 VanDerWaalsContact C-N 3.33Å; P56-S58 PolarHBondContact O-N 3.36Å
59	L	92.7	Very high	94.7	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.021	28%	0.28	C	S	.	.			trans	-76.1	129.4	177.2	-64.8	173.3	0	0	0	111.2	P35 L45 V55 L66 W80 T83 L85	P35-L59 HydrophobicContact CG-CD2 4.37Å; L45-L59 HydrophobicContact CD2-CD2 3.9Å; V55-L59 HydrophobicContact CG1-CD1 3.97Å; L59-L66 HydrophobicContact CD1-CD2 3.63Å; L59-L66 HydrophobicContact CD2-CD1 4.02Å; L59-L66 HydrophobicContact CD2-CD2 4.4Å; L59-W80 HydrophobicContact CD1-CE3 4.19Å; L59-W80 HydrophobicContact CD1-CH2 4.47Å; L59-W80 HydrophobicContact CD1-CZ3 3.56Å; L59-T83 PolarHBondContact O-OG1 2.9Å; L59-L85 HydrophobicContact CB-CD1 4.35Å; L59-L85 HydrophobicContact CB-CD2 4.13Å; L59-L85 HydrophobicContact CD1-CD1 4.03Å
60	P	93.1	Very high	94.8	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.019	27%	0.268	C	S	.	.			trans	-59	135.7	173.6	-25.1	35.8	0	0	0	113.1	V32 L45 Y62 T63 L85	V32-P60 HydrophobicContact CG1-CB 3.48Å; V32-P60 VanDerWaalsContact CG1-CB 3.48Å; V32-P60 HydrophobicContact CG1-CG 3.69Å; L45-P60 HydrophobicContact CD1-CG 4.36Å; L45-P60 VanDerWaalsContact CD2-CD 3.4Å; L45-P60 HydrophobicContact CD2-CG 3.99Å; P60-Y62 HydrophobicContact CB-CD1 4Å; P60-Y62 HydrophobicContact CB-CD2 4.1Å; P60-Y62 HydrophobicContact CB-CE1 3.61Å; P60-Y62 HydrophobicContact CB-CE2 3.65Å; P60-Y62 HydrophobicContact CB-CG 4.24Å; P60-Y62 VanDerWaalsContact CB-CZ 3.4Å; P60-Y62 HydrophobicContact CG-CE1 4.47Å; P60-Y62 HydrophobicContact CG-CE2 4.25Å; P60-Y62 PolarHBondContact O-N 3.49Å; P60-T63 WeakPolarHBondContact O-CB 3.17Å; P60-T63 PolarHBondContact O-N 2.97Å; P60-T63 PolarHBondContact O-OG1 2.94Å; P60-L85 WeakPolarHBondContact O-CD2 3.42Å
61	S	93.9	Very high	95	Very high	64 Å²	64	45.4 Å²	45.4	45%	0.448	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.3	179.3	55.6	0	0	0	0	114.7	T63	S61-T63 VanDerWaalsContact C-N 3.27Å; S61-T63 PolarHBondContact O-N 3.16Å
62	Y	93.6	Very high	95.1	Very high	88 Å²	88	41.9 Å²	41.9	35%	0.345	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.1	176.8	59.4	-109.7	0	0	0	113.8	V32 S42 N43 P60 A64	V32-Y62 HydrophobicContact CB-CE1 3.68Å; V32-Y62 HydrophobicContact CG1-CD1 4.47Å; V32-Y62 HydrophobicContact CG1-CE1 3.56Å; V32-Y62 HydrophobicContact CG2-CE1 4.09Å; S42-Y62 WeakPolarHBondContact O-CE2 3.29Å; N43-Y62 HydrophobicContact CB-CD2 4.5Å; N43-Y62 WeakPolarHBondContact CB-O 3Å; P60-Y62 HydrophobicContact CB-CD1 4Å; P60-Y62 HydrophobicContact CB-CD2 4.1Å; P60-Y62 HydrophobicContact CB-CE1 3.61Å; P60-Y62 HydrophobicContact CB-CE2 3.65Å; P60-Y62 HydrophobicContact CB-CG 4.24Å; P60-Y62 VanDerWaalsContact CB-CZ 3.4Å; P60-Y62 HydrophobicContact CG-CE1 4.47Å; P60-Y62 HydrophobicContact CG-CE2 4.25Å; P60-Y62 PolarHBondContact O-N 3.49Å; Y62-A64 PolarHBondContact O-N 2.82Å
63	T	96.4	Very high	95.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.226	C	C	.	.			trans	-61.6	124	-178	-53.9	0	0	0	0	110.2	L45 P60 S61 L65 L66 Q87 L88	L45-T63 HydrophobicContact CB-CG2 4.06Å; L45-T63 HydrophobicContact CD1-CG2 3.86Å; L45-T63 WeakPolarHBondContact CD1-OG1 3.47Å; L45-T63 HydrophobicContact CD2-CG2 4.32Å; L45-T63 HydrophobicContact CG-CG2 4.26Å; P60-T63 WeakPolarHBondContact O-CB 3.17Å; P60-T63 PolarHBondContact O-N 2.97Å; P60-T63 PolarHBondContact O-OG1 2.94Å; S61-T63 VanDerWaalsContact C-N 3.27Å; S61-T63 PolarHBondContact O-N 3.16Å; T63-L65 WeakPolarHBondContact CG2-O 3.02Å; T63-L66 HydrophobicContact CG2-CB 4.08Å; T63-Q87 CarbonylContact O-C 3.59Å; T63-Q87 VanDerWaalsContact O-C 3.27Å; T63-L88 HydrophobicContact CG2-CD1 3.64Å; T63-L88 VanDerWaalsContact O-CA 3.29Å; T63-L88 WeakPolarHBondContact O-CA 3.27Å; T63-L88 PolarHBondContact O-N 3.12Å
64	A	97.8	Very high	95.3	Very high	17 Å²	17	39.5 Å²	39.5	14%	0.14	22%	0.218	C	C	.	.	S	Bend	trans	-102.9	-33.9	176.7	0	0	0	0	0	112.6	N43 Y62 Q87 H89 S90	N43-A64 HydrophobicContact CB-CB 3.87Å; N43-A64 VanDerWaalsContact ND2-CB 3.3Å; N43-A64 WeakPolarHBondContact ND2-CB 3.24Å; N43-A64 PolarHBondContact O-N 2.94Å; Y62-A64 PolarHBondContact O-N 2.82Å; A64-Q87 WeakPolarHBondContact CA-O 3.29Å; A64-H89 PolarHBondContact O-N 3.1Å; A64-S90 PolarHBondContact O-N 2.78Å; A64-S90 VanDerWaalsContact O-N 3.15Å
65	L	98.3	Very high	95.4	Very high	52 Å²	52	41.1 Å²	41.1	27%	0.272	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.5	173.2	-172.2	152.5	0	0	0	109.1	N43 I44 L45 T63 D67 S90 L92	N43-L65 PolarHBondContact O-N 3.3Å; I44-L65 HydrophobicContact CG1-CB 4.29Å; I44-L65 HydrophobicContact CG2-CB 4.45Å; I44-L65 HydrophobicContact CG2-CD2 4.01Å; L45-L65 PolarHBondContact N-O 3.34Å; T63-L65 WeakPolarHBondContact CG2-O 3.02Å; L65-D67 HydrophobicContact CD2-CB 4.08Å; L65-S90 WeakPolarHBondContact CA-O 3.41Å; L65-L92 HydrophobicContact CD2-CD1 4.44Å
66	L	97.9	Very high	95.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	113.3	174.7	179.1	60.1	0	0	0	109.7	L45 L59 T63 L68 W80 L88 S90 L91 L92	L45-L66 HydrophobicContact CB-CD1 3.8Å; L45-L66 HydrophobicContact CD2-CD1 4.42Å; L59-L66 HydrophobicContact CD1-CD2 3.63Å; L59-L66 HydrophobicContact CD2-CD1 4.02Å; L59-L66 HydrophobicContact CD2-CD2 4.4Å; T63-L66 HydrophobicContact CG2-CB 4.08Å; L66-L68 HydrophobicContact CD1-CD1 4.44Å; L66-L68 HydrophobicContact CD1-CG 4.22Å; L66-L68 HydrophobicContact CD2-CD1 3.76Å; L66-L68 HydrophobicContact CD2-CG 4.41Å; L66-L68 HydrophobicContact CG-CD1 3.94Å; L66-L68 HydrophobicContact CG-CG 4.07Å; L66-W80 HydrophobicContact CD2-CH2 3.96Å; L66-W80 HydrophobicContact CD2-CZ3 3.72Å; L66-L88 HydrophobicContact CB-CD1 3.71Å; L66-L88 HydrophobicContact CB-CD2 4.47Å; L66-S90 PolarHBondContact N-O 3.5Å; L66-L91 HydrophobicContact CB-CD1 4.13Å; L66-L91 HydrophobicContact CD2-CD1 3.9Å; L66-L91 HydrophobicContact CG-CD1 4.1Å; L66-L92 PolarHBondContact O-N 3Å
67	D	98.5	Very high	95.7	Very high	19 Å²	19	46.7 Å²	46.7	10%	0.102	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	107.8	176.3	170.6	27.9	0	0	0	110.6	L45 S46 C47 S48 L65 S69 L92	L45-D67 PolarHBondContact O-N 3.23Å; S46-D67 PolarHBondContact OG-OD2 2.97Å; C47-D67 CarbonylContact C-O 3.58Å; C47-D67 WeakPolarHBondContact CA-O 3.44Å; C47-D67 PolarHBondContact N-O 2.82Å; S48-D67 VanDerWaalsContact CB-OD2 3.25Å; S48-D67 WeakPolarHBondContact CB-OD2 2.95Å; S48-D67 PolarHBondContact OG-OD2 3.48Å; L65-D67 HydrophobicContact CD2-CB 4.08Å; D67-S69 WeakPolarHBondContact OD1-CB 3.38Å; D67-S69 PolarHBondContact OD1-N 3.3Å; D67-S69 PolarHBondContact OD1-OG 3.3Å; D67-L92 HydrophobicContact CB-CB 4.47Å; D67-L92 HydrophobicContact CB-CD1 4.06Å
68	L	98.1	Very high	96.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.			trans	-113.9	19.7	174.3	-72.5	162	0	0	0	111.2	C47 L52 V55 L66 N71 L73 L91 L92 L93 N96	C47-L68 HydrophobicContact CB-CD2 3.84Å; L52-L68 HydrophobicContact CD1-CD2 4.29Å; V55-L68 HydrophobicContact CG1-CD1 3.73Å; V55-L68 HydrophobicContact CG1-CD2 4.25Å; V55-L68 HydrophobicContact CG2-CD1 4.1Å; L66-L68 HydrophobicContact CD1-CD1 4.44Å; L66-L68 HydrophobicContact CD1-CG 4.22Å; L66-L68 HydrophobicContact CD2-CD1 3.76Å; L66-L68 HydrophobicContact CD2-CG 4.41Å; L66-L68 HydrophobicContact CG-CD1 3.94Å; L66-L68 HydrophobicContact CG-CG 4.07Å; L68-N71 PolarHBondContact O-ND2 3Å; L68-L73 HydrophobicContact CB-CD1 4.26Å; L68-L91 HydrophobicContact CD1-CD1 4.43Å; L68-L92 CarbonylContact C-O 3.56Å; L68-L92 WeakPolarHBondContact CA-O 3.32Å; L68-L92 WeakPolarHBondContact CB-O 3.06Å; L68-L92 PolarHBondContact N-O 3.2Å; L68-L93 HydrophobicContact CB-CD2 3.86Å; L68-L93 HydrophobicContact CD1-CD2 3.94Å; L68-N96 PolarHBondContact O-ND2 2.82Å
69	S	98.3	Very high	96.5	Very high	13 Å²	13	43.9 Å²	43.9	9%	0.091	22%	0.216	C	C	.	.			trans	-65.9	157.2	-177.5	66	0	0	0	0	112.8	S48 K49 D67 N71 L92 S94	S48-S69 WeakPolarHBondContact CA-O 3.31Å; S48-S69 WeakPolarHBondContact CB-O 3.16Å; S48-S69 WeakPolarHBondContact CB-OG 3.36Å; K49-S69 PolarHBondContact N-O 3.36Å; D67-S69 WeakPolarHBondContact OD1-CB 3.38Å; D67-S69 PolarHBondContact OD1-N 3.3Å; D67-S69 PolarHBondContact OD1-OG 3.3Å; S69-N71 PolarHBondContact O-N 2.88Å; S69-N71 PolarHBondContact O-ND2 3.49Å; S69-L92 PolarHBondContact N-O 2.91Å; S69-S94 CarbonylContact C-O 3.57Å; S69-S94 WeakPolarHBondContact CA-O 3.4Å; S69-S94 WeakPolarHBondContact CB-O 3.21Å
70	H	98.4	Very high	96.6	Very high	84 Å²	84	44.3 Å²	44.3	39%	0.389	22%	0.218	S	C	.	.	S	Bend	trans	55.5	46.9	178	-62	-83.6	0	0	0	113.7	K49 S94 H95	K49-H70 VanDerWaalsContact CA-O 3.24Å; K49-H70 WeakPolarHBondContact CA-O 3.25Å; K49-H70 HydrophobicContact CB-CB 4.47Å; K49-H70 HydrophobicContact CG-CB 3.55Å; K49-H70 PolarHBondContact N-O 2.89Å; H70-S94 PolarHBondContact N-O 2.8Å; H70-H95 WeakPolarHBondContact CA-O 3.45Å; H70-H95 HydrophobicContact CB-CB 4.47Å; H70-H95 AromaticContact CE1-CD2 3.37Å; H70-H95 PolarHBondContact CE1-CD2 3.12Å; H70-H95 AromaticContact CE1-CG 3.43Å; H70-H95 VanDerWaalsContact CE1-CG 3.43Å; H70-H95 AromaticContact CE1-NE2 3.95Å; H70-H95 PolarHBondContact N-O 3.07Å; H70-H95 WeakPolarHBondContact ND1-CB 3.08Å; H70-H95 AromaticContact ND1-CG 3.69Å; H70-H95 AromaticContact NE2-CD2 3.6Å
71	N	98.3	Very high	96.7	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	22%	0.218	C	C	.	.	S	Bend	trans	-119.5	-173.8	176.2	-80.1	-58.3	0	0	0	111	C47 Q50 Q51 L52 L68 S69 L73 H95 N96	C47-N71 PolarHBondContact O-ND2 2.79Å; Q50-N71 PolarHBondContact N-OD1 2.85Å; Q50-N71 VanDerWaalsContact N-OD1 3.08Å; Q51-N71 PolarHBondContact N-OD1 3.34Å; Q51-N71 VanDerWaalsContact N-OD1 3.11Å; L52-N71 HydrophobicContact CB-CB 4.1Å; L52-N71 WeakPolarHBondContact CG-OD1 3.36Å; L52-N71 PolarHBondContact N-OD1 2.76Å; L68-N71 PolarHBondContact O-ND2 3Å; S69-N71 PolarHBondContact O-N 2.88Å; S69-N71 PolarHBondContact O-ND2 3.49Å; N71-L73 HydrophobicContact CB-CG 4.26Å; N71-H95 PolarHBondContact N-O 3.36Å; N71-N96 VanDerWaalsContact CA-OD1 3.28Å; N71-N96 WeakPolarHBondContact CA-OD1 3.38Å; N71-N96 WeakPolarHBondContact CB-OD1 3.41Å; N71-N96 PolarHBondContact N-OD1 2.8Å; N71-N96 PolarHBondContact O-OD1 2.99Å; N71-N96 VanDerWaalsContact O-OD1 3.09Å
72	N	98.2	Very high	96.6	Very high	74 Å²	74	45.6 Å²	45.6	40%	0.396	23%	0.225	S	C	.	.			trans	-107.4	27.9	-179.7	-71.9	-16.2	0	0	0	112.1	L52 S74 H97	L52-N72 CarbonylContact O-C 3.36Å; L52-N72 VanDerWaalsContact O-CA 3.3Å; L52-N72 WeakPolarHBondContact O-CA 3.49Å; L52-N72 PolarHBondContact O-N 3.28Å; N72-S74 PolarHBondContact O-N 3.1Å; N72-H97 PolarHBondContact OD1-CE1 3.04Å; N72-H97 VanDerWaalsContact OD1-CE1 3.27Å
73	L	97.9	Very high	96.5	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	22%	0.223	C	C	.	.			trans	-64.8	126.3	179.9	-56.5	177.6	0	0	0	109.3	L52 N54 V55 L68 N71 L93 N96 H97 L98	L52-L73 PolarHBondContact O-N 3.4Å; N54-L73 VanDerWaalsContact CA-CD2 3.49Å; V55-L73 HydrophobicContact CG2-CD1 4.12Å; V55-L73 HydrophobicContact CG2-CD2 4.24Å; L68-L73 HydrophobicContact CB-CD1 4.26Å; N71-L73 HydrophobicContact CB-CG 4.26Å; L73-L93 HydrophobicContact CD1-CD2 3.69Å; L73-N96 HydrophobicContact CB-CB 4.18Å; L73-N96 VanDerWaalsContact CB-OD1 3.27Å; L73-N96 WeakPolarHBondContact CB-OD1 3.5Å; L73-N96 VanDerWaalsContact CG-OD1 3.25Å; L73-N96 WeakPolarHBondContact CG-OD1 3.46Å; L73-N96 PolarHBondContact N-OD1 2.82Å; L73-H97 CarbonylContact O-C 3.51Å; L73-H97 VanDerWaalsContact O-CA 3.27Å; L73-H97 WeakPolarHBondContact O-CA 3.3Å; L73-H97 PolarHBondContact O-N 3.27Å; L73-L98 HydrophobicContact CB-CD2 3.85Å; L73-L98 HydrophobicContact CB-CG 4.44Å; L73-L98 PolarHBondContact O-N 3.1Å; L73-L98 VanDerWaalsContact O-N 3.12Å
74	S	97.9	Very high	96.4	Very high	51 Å²	51	51 Å²	51	36%	0.357	25%	0.25	S	C	.	.			trans	-103.9	-26.9	179.8	54	0	0	0	0	113.4	N72 H97 L98 N99	N72-S74 PolarHBondContact O-N 3.1Å; S74-H97 WeakPolarHBondContact CA-O 3.03Å; S74-L98 WeakPolarHBondContact O-CA 3.31Å; S74-N99 PolarHBondContact O-N 2.82Å; S74-N99 PolarHBondContact O-OD1 3.49Å
75	R	97.7	Very high	96.3	Very high	122 Å²	122	50.2 Å²	50.2	46%	0.46	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	135.9	-176.2	-55.1	-174.4	71.7	176.7	1.2	110.1	F100	R75-F100 WeakPolarHBondContact CA-O 3.37Å; R75-F100 HydrophobicContact CB-CB 4.46Å; R75-F100 HydrophobicContact CB-CD1 4.12Å; R75-F100 HydrophobicContact CG-CB 4.14Å; R75-F100 HydrophobicContact CG-CD1 4.4Å
76	L	97.4	Very high	96.2	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	99.5	167	-165.1	68.5	0	0	0	108.4	V55 W80 L93 L98 F100 I101 S102 A105 F106	V55-L76 HydrophobicContact CG2-CD1 4.44Å; L76-W80 HydrophobicContact CD1-CB 3.97Å; L76-W80 HydrophobicContact CD1-CD2 4.04Å; L76-W80 HydrophobicContact CD1-CG 3.73Å; L76-W80 HydrophobicContact CG-CG 4.31Å; L76-L93 HydrophobicContact CD1-CD1 4.41Å; L76-L93 HydrophobicContact CD2-CD1 3.98Å; L76-L98 HydrophobicContact CB-CD2 4.35Å; L76-F100 PolarHBondContact N-O 3.44Å; L76-I101 HydrophobicContact CB-CG1 4.26Å; L76-I101 HydrophobicContact CB-CG2 4.4Å; L76-I101 HydrophobicContact CD2-CG2 4.28Å; L76-S102 PolarHBondContact O-N 3.34Å; L76-A105 HydrophobicContact CD2-CB 3.99Å; L76-A105 HydrophobicContact CG-CB 4.04Å; L76-F106 HydrophobicContact CD2-CE1 3.94Å; L76-F106 HydrophobicContact CD2-CZ 4.21Å
77	R	95.7	Very high	96.2	Very high	149 Å²	149	55 Å²	55	56%	0.562	27%	0.268	S	S	*	.			trans	-81.3	157.9	-177.2	-58.6	-178.7	-175.5	176.4	1.9	110.3	E79 W80	R77-E79 PolarHBondContact O-N 3.05Å; R77-W80 WeakPolarHBondContact O-CB 3.48Å; R77-W80 PolarHBondContact O-N 2.66Å; R77-W80 VanDerWaalsContact O-N 3.12Å
78	A	94.4	Very high	96.2	Very high	25 Å²	25	54.1 Å²	54.1	21%	0.207	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48	-47	174.2	0	0	0	0	0	112.7	W80 E104	A78-W80 VanDerWaalsContact C-N 3.31Å; A78-W80 PolarHBondContact O-N 2.92Å; A78-E104 HydrophobicContact CB-CB 3.88Å
79	E	92.3	Very high	96.2	Very high	150 Å²	150	57.7 Å²	57.7	70%	0.701	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	28.9	-176.3	-54.8	-64	169.2	0	0	113.6	R77 T81	R77-E79 PolarHBondContact O-N 3.05Å; E79-T81 PolarHBondContact O-N 3.42Å
80	W	95.3	Very high	96.2	Very high	14 Å²	14	58.6 Å²	58.6	5%	0.053	29%	0.286	C	S	.	.	S	Bend	trans	-61.5	-25.9	-179.4	71.6	-88	0	0	0	112.7	V55 L59 L66 L76 R77 A78 L85 L91 A105 V109	V55-W80 HydrophobicContact CB-CE3 4.21Å; V55-W80 HydrophobicContact CG1-CE3 3.71Å; V55-W80 HydrophobicContact CG1-CZ3 4.05Å; V55-W80 HydrophobicContact CG2-CB 4.34Å; V55-W80 HydrophobicContact CG2-CE3 4.12Å; L59-W80 HydrophobicContact CD1-CE3 4.19Å; L59-W80 HydrophobicContact CD1-CH2 4.47Å; L59-W80 HydrophobicContact CD1-CZ3 3.56Å; L66-W80 HydrophobicContact CD2-CH2 3.96Å; L66-W80 HydrophobicContact CD2-CZ3 3.72Å; L76-W80 HydrophobicContact CD1-CB 3.97Å; L76-W80 HydrophobicContact CD1-CD2 4.04Å; L76-W80 HydrophobicContact CD1-CG 3.73Å; L76-W80 HydrophobicContact CG-CG 4.31Å; R77-W80 WeakPolarHBondContact O-CB 3.48Å; R77-W80 PolarHBondContact O-N 2.66Å; R77-W80 VanDerWaalsContact O-N 3.12Å; A78-W80 VanDerWaalsContact C-N 3.31Å; A78-W80 PolarHBondContact O-N 2.92Å; W80-L85 HydrophobicContact CH2-CD1 3.91Å; W80-L85 HydrophobicContact CZ3-CD1 4.34Å; W80-L91 HydrophobicContact CH2-CD1 4.33Å; W80-L91 HydrophobicContact CH2-CD2 4.29Å; W80-L91 HydrophobicContact CZ2-CD2 4.2Å; W80-A105 PolarHBondContact NE1-O 2.95Å; W80-V109 HydrophobicContact CH2-CG1 4.33Å; W80-V109 HydrophobicContact CZ2-CG1 3.9Å
81	T	93.8	Very high	96.2	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.018	27%	0.268	C	S	.	.			trans	-135	110.1	169.1	179.5	0	0	0	0	109.8	E79 T83 L85 P108	E79-T81 PolarHBondContact O-N 3.42Å; T81-T83 WeakPolarHBondContact CG2-O 3.45Å; T81-T83 PolarHBondContact O-N 3.46Å; T81-T83 PolarHBondContact OG1-N 3.24Å; T81-T83 PolarHBondContact OG1-O 2.91Å; T81-L85 HydrophobicContact CG2-CD1 4.09Å; T81-L85 HydrophobicContact CG2-CG 4.24Å; T81-P108 HydrophobicContact CG2-CB 3.61Å; T81-P108 HydrophobicContact CG2-CG 4.04Å
82	P	91.5	Very high	96.2	Very high	91 Å²	91	56.3 Å²	56.3	59%	0.591	28%	0.276	S	S	*	.	S	Bend	trans	-63.6	-25.2	173	-22.1	33.4	0	0	0	112.4
83	T	92.3	Very high	96.3	Very high	50 Å²	50	52.9 Å²	52.9	31%	0.307	26%	0.258	S	S	.	.	S	Bend	trans	-82.2	128	174.8	-52.5	0	0	0	0	109.7	L59 T81 L85	L59-T83 PolarHBondContact O-OG1 2.9Å; T81-T83 WeakPolarHBondContact CG2-O 3.45Å; T81-T83 PolarHBondContact O-N 3.46Å; T81-T83 PolarHBondContact OG1-N 3.24Å; T81-T83 PolarHBondContact OG1-O 2.91Å; T83-L85 HydrophobicContact CG2-CD2 4.14Å; T83-L85 PolarHBondContact O-N 2.83Å
84	R	94.3	Very high	96.3	Very high	151 Å²	151	53.3 Å²	53.3	57%	0.57	26%	0.261	S	S	*	.			trans	-71.5	116.1	170.2	-163.6	175.8	-170.1	177.9	1.4	110.1	T86 P108	R84-T86 HydrophobicContact CG-CG2 3.87Å; R84-T86 PolarHBondContact O-N 3.44Å; R84-P108 WeakPolarHBondContact CG-O 3.4Å
85	L	96	Very high	96.3	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.263	C	S	.	.			trans	-94.9	68.9	-174.9	-55.7	178.7	0	0	0	110.3	L59 P60 W80 T81 T83 Q87 L88 P108 V109	L59-L85 HydrophobicContact CB-CD1 4.35Å; L59-L85 HydrophobicContact CB-CD2 4.13Å; L59-L85 HydrophobicContact CD1-CD1 4.03Å; P60-L85 WeakPolarHBondContact O-CD2 3.42Å; W80-L85 HydrophobicContact CH2-CD1 3.91Å; W80-L85 HydrophobicContact CZ3-CD1 4.34Å; T81-L85 HydrophobicContact CG2-CD1 4.09Å; T81-L85 HydrophobicContact CG2-CG 4.24Å; T83-L85 HydrophobicContact CG2-CD2 4.14Å; T83-L85 PolarHBondContact O-N 2.83Å; L85-Q87 PolarHBondContact O-N 3.27Å; L85-L88 HydrophobicContact CB-CB 3.95Å; L85-L88 HydrophobicContact CD1-CD2 4.19Å; L85-L88 WeakPolarHBondContact O-CB 3.32Å; L85-L88 PolarHBondContact O-N 2.8Å; L85-L88 VanDerWaalsContact O-N 3.14Å; L85-P108 PolarHBondContact N-O 2.96Å; L85-V109 HydrophobicContact CB-CG1 4.05Å; L85-V109 HydrophobicContact CD1-CG1 4.46Å
86	T	96.6	Very high	96.4	Very high	52 Å²	52	49.4 Å²	49.4	32%	0.319	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15	-175.1	60.1	0	0	0	0	114.2	R84 P110 N111	R84-T86 HydrophobicContact CG-CG2 3.87Å; R84-T86 PolarHBondContact O-N 3.44Å; T86-P110 HydrophobicContact CG2-CG 4.42Å; T86-N111 PolarHBondContact O-ND2 3.43Å
87	Q	97	Very high	96.4	Very high	101 Å²	101	53.2 Å²	53.2	47%	0.472	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-4.2	175.7	-61.2	-59	-66.5	0	0	112.9	T63 A64 L85 H89	T63-Q87 CarbonylContact O-C 3.59Å; T63-Q87 VanDerWaalsContact O-C 3.27Å; A64-Q87 WeakPolarHBondContact CA-O 3.29Å; L85-Q87 PolarHBondContact O-N 3.27Å; Q87-H89 PolarHBondContact O-CD2 3.3Å; Q87-H89 PolarHBondContact O-N 2.92Å
88	L	98.2	Very high	96.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.			trans	-74.1	119.1	-174.8	-162.7	75.3	0	0	0	110.6	T63 L66 L85 L91 V109 N111 L112	T63-L88 HydrophobicContact CG2-CD1 3.64Å; T63-L88 VanDerWaalsContact O-CA 3.29Å; T63-L88 WeakPolarHBondContact O-CA 3.27Å; T63-L88 PolarHBondContact O-N 3.12Å; L66-L88 HydrophobicContact CB-CD1 3.71Å; L66-L88 HydrophobicContact CB-CD2 4.47Å; L85-L88 HydrophobicContact CB-CB 3.95Å; L85-L88 HydrophobicContact CD1-CD2 4.19Å; L85-L88 WeakPolarHBondContact O-CB 3.32Å; L85-L88 PolarHBondContact O-N 2.8Å; L85-L88 VanDerWaalsContact O-N 3.14Å; L88-L91 HydrophobicContact CD2-CB 4.17Å; L88-L91 HydrophobicContact CD2-CD1 4.48Å; L88-V109 HydrophobicContact CB-CG1 4.28Å; L88-V109 HydrophobicContact CD2-CB 4.34Å; L88-V109 HydrophobicContact CD2-CG1 3.48Å; L88-V109 VanDerWaalsContact CD2-CG1 3.48Å; L88-V109 HydrophobicContact CG-CG1 4.49Å; L88-N111 CarbonylContact O-C 3.27Å; L88-L112 HydrophobicContact CD2-CD1 3.93Å; L88-L112 HydrophobicContact CG-CD1 3.99Å; L88-L112 WeakPolarHBondContact O-CA 3.22Å; L88-L112 PolarHBondContact O-N 3Å
89	H	98.4	Very high	96.7	Very high	76 Å²	76	49 Å²	49	35%	0.352	25%	0.246	S	C	.	.			trans	-106.8	-29.5	177.6	-62.2	166.6	0	0	0	112.2	A64 Q87 R113 Y114	A64-H89 PolarHBondContact O-N 3.1Å; Q87-H89 PolarHBondContact O-CD2 3.3Å; Q87-H89 PolarHBondContact O-N 2.92Å; H89-R113 PolarHBondContact O-N 2.63Å; H89-Y114 PolarHBondContact O-N 2.93Å
90	S	98.7	Very high	97	Very high	31 Å²	31	45.3 Å²	45.3	22%	0.217	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.2	-178.2	-58.1	0	0	0	0	111.4	A64 L65 L66 Y114	A64-S90 PolarHBondContact O-N 2.78Å; A64-S90 VanDerWaalsContact O-N 3.15Å; L65-S90 WeakPolarHBondContact CA-O 3.41Å; L66-S90 PolarHBondContact N-O 3.5Å; S90-Y114 WeakPolarHBondContact CA-O 3.39Å
91	L	98.6	Very high	97.1	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	114	176.4	176.9	57.7	0	0	0	109.3	L66 L68 W80 L88 L93 L112 Y114 L115 D116	L66-L91 HydrophobicContact CB-CD1 4.13Å; L66-L91 HydrophobicContact CD2-CD1 3.9Å; L66-L91 HydrophobicContact CG-CD1 4.1Å; L68-L91 HydrophobicContact CD1-CD1 4.43Å; W80-L91 HydrophobicContact CH2-CD1 4.33Å; W80-L91 HydrophobicContact CH2-CD2 4.29Å; W80-L91 HydrophobicContact CZ2-CD2 4.2Å; L88-L91 HydrophobicContact CD2-CB 4.17Å; L88-L91 HydrophobicContact CD2-CD1 4.48Å; L91-L93 HydrophobicContact CD1-CD1 4.32Å; L91-L93 HydrophobicContact CD1-CG 4.15Å; L91-L93 HydrophobicContact CD2-CD1 3.85Å; L91-L93 HydrophobicContact CG-CD1 3.89Å; L91-L93 HydrophobicContact CG-CG 4.08Å; L91-L112 HydrophobicContact CB-CD1 3.68Å; L91-L112 HydrophobicContact CB-CD2 4.06Å; L91-L112 HydrophobicContact CB-CG 4.49Å; L91-L112 HydrophobicContact CD2-CD2 4.48Å; L91-Y114 PolarHBondContact N-O 3.3Å; L91-L115 HydrophobicContact CB-CD1 4.09Å; L91-L115 HydrophobicContact CD2-CD1 3.97Å; L91-L115 HydrophobicContact CG-CD1 4.03Å; L91-D116 PolarHBondContact O-N 3.18Å
92	L	98.7	Very high	97.2	Very high	39 Å²	39	45.8 Å²	45.8	20%	0.204	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	114.2	-179.3	-42.2	-179.7	0	0	0	109.6	L65 L66 D67 L68 S69 Y114 D116	L65-L92 HydrophobicContact CD2-CD1 4.44Å; L66-L92 PolarHBondContact O-N 3Å; D67-L92 HydrophobicContact CB-CB 4.47Å; D67-L92 HydrophobicContact CB-CD1 4.06Å; L68-L92 CarbonylContact C-O 3.56Å; L68-L92 WeakPolarHBondContact CA-O 3.32Å; L68-L92 WeakPolarHBondContact CB-O 3.06Å; L68-L92 PolarHBondContact N-O 3.2Å; S69-L92 PolarHBondContact N-O 2.91Å; L92-Y114 HydrophobicContact CD2-CD1 3.88Å; L92-Y114 HydrophobicContact CD2-CE1 3.72Å; L92-D116 HydrophobicContact CD2-CB 4.05Å
93	L	98.7	Very high	97.3	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.228	C	C	.	.			trans	-124.1	15.5	-179.5	-73.3	164.7	0	0	0	111.6	L68 L73 L76 L91 N96 L98 L115 D116 L117 N120	L68-L93 HydrophobicContact CB-CD2 3.86Å; L68-L93 HydrophobicContact CD1-CD2 3.94Å; L73-L93 HydrophobicContact CD1-CD2 3.69Å; L76-L93 HydrophobicContact CD1-CD1 4.41Å; L76-L93 HydrophobicContact CD2-CD1 3.98Å; L91-L93 HydrophobicContact CD1-CD1 4.32Å; L91-L93 HydrophobicContact CD1-CG 4.15Å; L91-L93 HydrophobicContact CD2-CD1 3.85Å; L91-L93 HydrophobicContact CG-CD1 3.89Å; L91-L93 HydrophobicContact CG-CG 4.08Å; L93-N96 PolarHBondContact O-ND2 3.4Å; L93-L98 HydrophobicContact CB-CD1 4.1Å; L93-L98 HydrophobicContact CD1-CD1 4.4Å; L93-L115 HydrophobicContact CD1-CD1 4.44Å; L93-D116 CarbonylContact C-O 3.29Å; L93-D116 VanDerWaalsContact CA-O 3.29Å; L93-D116 WeakPolarHBondContact CA-O 3.31Å; L93-D116 WeakPolarHBondContact CB-O 3.42Å; L93-D116 PolarHBondContact N-O 3.5Å; L93-L117 HydrophobicContact CB-CD2 3.98Å; L93-L117 HydrophobicContact CD1-CD2 3.86Å; L93-N120 PolarHBondContact O-ND2 3.48Å
94	S	98.6	Very high	97.4	Very high	12 Å²	12	46.9 Å²	46.9	8%	0.084	23%	0.234	C	C	.	.			trans	-66.8	156.1	-178.2	46.7	0	0	0	0	113.6	S69 H70 N96 D116 S118	S69-S94 CarbonylContact C-O 3.57Å; S69-S94 WeakPolarHBondContact CA-O 3.4Å; S69-S94 WeakPolarHBondContact CB-O 3.21Å; H70-S94 PolarHBondContact N-O 2.8Å; S94-N96 PolarHBondContact O-N 3.34Å; S94-N96 PolarHBondContact O-ND2 2.82Å; S94-D116 WeakPolarHBondContact CB-OD2 3.38Å; S94-D116 PolarHBondContact N-O 3.43Å; S94-D116 PolarHBondContact OG-OD2 2.92Å; S94-S118 WeakPolarHBondContact CA-O 3.45Å; S94-S118 WeakPolarHBondContact CB-O 3.47Å; S94-S118 VanDerWaalsContact CB-OG 3.28Å; S94-S118 WeakPolarHBondContact CB-OG 3.31Å
95	H	98.7	Very high	97.6	Very high	85 Å²	85	39.7 Å²	39.7	39%	0.394	21%	0.207	S	C	.	.	S	Bend	trans	55.5	49.1	-179	-64.1	-79.2	0	0	0	112.9	H70 N71 S118 S119	H70-H95 WeakPolarHBondContact CA-O 3.45Å; H70-H95 HydrophobicContact CB-CB 4.47Å; H70-H95 AromaticContact CE1-CD2 3.37Å; H70-H95 PolarHBondContact CE1-CD2 3.12Å; H70-H95 AromaticContact CE1-CG 3.43Å; H70-H95 VanDerWaalsContact CE1-CG 3.43Å; H70-H95 AromaticContact CE1-NE2 3.95Å; H70-H95 PolarHBondContact N-O 3.07Å; H70-H95 WeakPolarHBondContact ND1-CB 3.08Å; H70-H95 AromaticContact ND1-CG 3.69Å; H70-H95 AromaticContact NE2-CD2 3.6Å; N71-H95 PolarHBondContact N-O 3.36Å; H95-S118 PolarHBondContact N-O 3.29Å; H95-S119 VanDerWaalsContact CA-O 3.25Å; H95-S119 WeakPolarHBondContact CA-O 3.42Å; H95-S119 PolarHBondContact CE1-OG 3.41Å; H95-S119 PolarHBondContact N-O 3.38Å; H95-S119 WeakPolarHBondContact ND1-CB 3.49Å
96	N	98.7	Very high	97.6	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.032	21%	0.207	C	C	.	.	S	Bend	trans	-116.1	-172.1	170.2	-83.9	-81	0	0	0	109.9	L68 N71 L73 L93 S94 L98 S119 N120	L68-N96 PolarHBondContact O-ND2 2.82Å; N71-N96 VanDerWaalsContact CA-OD1 3.28Å; N71-N96 WeakPolarHBondContact CA-OD1 3.38Å; N71-N96 WeakPolarHBondContact CB-OD1 3.41Å; N71-N96 PolarHBondContact N-OD1 2.8Å; N71-N96 PolarHBondContact O-OD1 2.99Å; N71-N96 VanDerWaalsContact O-OD1 3.09Å; L73-N96 HydrophobicContact CB-CB 4.18Å; L73-N96 VanDerWaalsContact CB-OD1 3.27Å; L73-N96 WeakPolarHBondContact CB-OD1 3.5Å; L73-N96 VanDerWaalsContact CG-OD1 3.25Å; L73-N96 WeakPolarHBondContact CG-OD1 3.46Å; L73-N96 PolarHBondContact N-OD1 2.82Å; L93-N96 PolarHBondContact O-ND2 3.4Å; S94-N96 PolarHBondContact O-N 3.34Å; S94-N96 PolarHBondContact O-ND2 2.82Å; N96-L98 HydrophobicContact CB-CG 4.1Å; N96-S119 PolarHBondContact N-O 2.93Å; N96-N120 WeakPolarHBondContact CA-OD1 3.31Å; N96-N120 WeakPolarHBondContact CB-OD1 3.36Å; N96-N120 PolarHBondContact N-OD1 2.94Å; N96-N120 PolarHBondContact O-OD1 2.96Å
97	H	98.4	Very high	97.6	Very high	81 Å²	81	40.1 Å²	40.1	38%	0.375	21%	0.211	S	C	.	.			trans	-109	29.1	175	-56.1	111.1	0	0	0	111.4	N72 L73 S74 N99 Q121	N72-H97 PolarHBondContact OD1-CE1 3.04Å; N72-H97 VanDerWaalsContact OD1-CE1 3.27Å; L73-H97 CarbonylContact O-C 3.51Å; L73-H97 VanDerWaalsContact O-CA 3.27Å; L73-H97 WeakPolarHBondContact O-CA 3.3Å; L73-H97 PolarHBondContact O-N 3.27Å; S74-H97 WeakPolarHBondContact CA-O 3.03Å; H97-N99 PolarHBondContact O-N 3.2Å; H97-N99 VanDerWaalsContact O-N 3.09Å; H97-Q121 PolarHBondContact CD2-NE2 3Å
98	L	98.5	Very high	97.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.			trans	-63.2	116	-174.2	-65.8	174	0	0	0	109.8	L73 S74 L76 L93 N96 L117 N120 Q121 L122	L73-L98 HydrophobicContact CB-CD2 3.85Å; L73-L98 HydrophobicContact CB-CG 4.44Å; L73-L98 PolarHBondContact O-N 3.1Å; L73-L98 VanDerWaalsContact O-N 3.12Å; S74-L98 WeakPolarHBondContact O-CA 3.31Å; L76-L98 HydrophobicContact CB-CD2 4.35Å; L93-L98 HydrophobicContact CB-CD1 4.1Å; L93-L98 HydrophobicContact CD1-CD1 4.4Å; N96-L98 HydrophobicContact CB-CG 4.1Å; L98-L117 HydrophobicContact CD1-CD2 3.78Å; L98-N120 HydrophobicContact CB-CB 4.19Å; L98-N120 VanDerWaalsContact CB-OD1 3.24Å; L98-N120 WeakPolarHBondContact CB-OD1 3.34Å; L98-N120 WeakPolarHBondContact CG-OD1 3.28Å; L98-N120 PolarHBondContact N-OD1 3.14Å; L98-Q121 CarbonylContact O-C 3.03Å; L98-Q121 VanDerWaalsContact O-CA 3.25Å; L98-Q121 WeakPolarHBondContact O-CA 3.34Å; L98-Q121 WeakPolarHBondContact O-CB 3.47Å; L98-Q121 PolarHBondContact O-N 3.13Å; L98-L122 HydrophobicContact CB-CD2 4.43Å; L98-L122 PolarHBondContact O-N 3.33Å
99	N	97.6	Very high	97.5	Very high	86 Å²	86	36.2 Å²	36.2	46%	0.46	20%	0.195	S	C	.	.			trans	-117.8	-2.7	175.3	60.4	37.4	0	0	0	112.7	S74 H97 Q121	S74-N99 PolarHBondContact O-N 2.82Å; S74-N99 PolarHBondContact O-OD1 3.49Å; H97-N99 PolarHBondContact O-N 3.2Å; H97-N99 VanDerWaalsContact O-N 3.09Å; N99-Q121 HydrophobicContact CB-CB 4.07Å
100	F	97.7	Very high	97.4	Very high	72 Å²	72	34.2 Å²	34.2	32%	0.316	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	134.2	-179.2	174.1	-90.5	0	0	0	110.4	R75 L76	R75-F100 WeakPolarHBondContact CA-O 3.37Å; R75-F100 HydrophobicContact CB-CB 4.46Å; R75-F100 HydrophobicContact CB-CD1 4.12Å; R75-F100 HydrophobicContact CG-CB 4.14Å; R75-F100 HydrophobicContact CG-CD1 4.4Å; L76-F100 PolarHBondContact N-O 3.44Å
101	I	97.7	Very high	97.4	Very high	9 Å²	9	36 Å²	36	5%	0.046	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.6	172.2	-60.1	174.4	0	0	0	106.8	L76 A105 F106 L117 L122 L129	L76-I101 HydrophobicContact CB-CG1 4.26Å; L76-I101 HydrophobicContact CB-CG2 4.4Å; L76-I101 HydrophobicContact CD2-CG2 4.28Å; I101-A105 HydrophobicContact CG2-CB 3.82Å; I101-F106 HydrophobicContact CG2-CE2 3.76Å; I101-F106 HydrophobicContact CG2-CZ 3.89Å; I101-L117 HydrophobicContact CD1-CD1 3.75Å; I101-L117 HydrophobicContact CD1-CD2 3.99Å; I101-L122 HydrophobicContact CD1-CD1 3.93Å; I101-L122 HydrophobicContact CD1-CD2 3.82Å; I101-L122 HydrophobicContact CG1-CD2 3.98Å; I101-L129 HydrophobicContact CB-CD1 4.05Å; I101-L129 HydrophobicContact CG2-CD1 3.8Å
102	S	96.5	Very high	97.4	Very high	18 Å²	18	36 Å²	36	13%	0.126	20%	0.195	C	C	.	.			trans	-68.1	147.6	175.4	-148.6	0	0	0	0	110.7	L76 E104 A105	L76-S102 PolarHBondContact O-N 3.34Å; S102-E104 PolarHBondContact O-N 2.94Å; S102-E104 VanDerWaalsContact O-N 3.16Å; S102-E104 PolarHBondContact OG-OE2 3.04Å; S102-A105 WeakPolarHBondContact O-CB 3.38Å; S102-A105 PolarHBondContact O-N 2.92Å
103	S	93.3	Very high	97.4	Very high	71 Å²	71	39.9 Å²	39.9	50%	0.497	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.3	171.8	29.2	0	0	0	0	113.2
104	E	95.4	Very high	97.4	Very high	93 Å²	93	43.8 Å²	43.8	44%	0.435	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	5	-177.8	-46.5	72.5	-161.1	0	0	112.7	A78 S102 F106 S107	A78-E104 HydrophobicContact CB-CB 3.88Å; S102-E104 PolarHBondContact O-N 2.94Å; S102-E104 VanDerWaalsContact O-N 3.16Å; S102-E104 PolarHBondContact OG-OE2 3.04Å; E104-F106 PolarHBondContact O-N 2.85Å; E104-F106 VanDerWaalsContact O-N 3.13Å; E104-S107 PolarHBondContact O-N 2.97Å
105	A	97.1	Very high	97.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24	-174.9	0	0	0	0	0	112.9	L76 W80 I101 S102	L76-A105 HydrophobicContact CD2-CB 3.99Å; L76-A105 HydrophobicContact CG-CB 4.04Å; W80-A105 PolarHBondContact NE1-O 2.95Å; I101-A105 HydrophobicContact CG2-CB 3.82Å; S102-A105 WeakPolarHBondContact O-CB 3.38Å; S102-A105 PolarHBondContact O-N 2.92Å
106	F	97.3	Very high	97.4	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-8.3	-175.8	-59.8	-59.1	0	0	0	114.4	L76 I101 E104 P108 V109 L115 L117 L129 F130 D132 L133	L76-F106 HydrophobicContact CD2-CE1 3.94Å; L76-F106 HydrophobicContact CD2-CZ 4.21Å; I101-F106 HydrophobicContact CG2-CE2 3.76Å; I101-F106 HydrophobicContact CG2-CZ 3.89Å; E104-F106 PolarHBondContact O-N 2.85Å; E104-F106 VanDerWaalsContact O-N 3.13Å; F106-P108 VanDerWaalsContact C-N 3.27Å; F106-V109 HydrophobicContact CB-CG2 4.27Å; F106-V109 HydrophobicContact CD1-CG2 4.25Å; F106-V109 WeakPolarHBondContact O-CG2 3.27Å; F106-V109 PolarHBondContact O-N 3.15Å; F106-L115 HydrophobicContact CD1-CD2 4.43Å; F106-L115 HydrophobicContact CE1-CD1 4.31Å; F106-L115 HydrophobicContact CE1-CD2 3.69Å; F106-L115 HydrophobicContact CZ-CD2 3.77Å; F106-L117 HydrophobicContact CZ-CD1 4.38Å; F106-L129 WeakPolarHBondContact CD2-O 3.49Å; F106-F130 HydrophobicContact CD2-CD1 4.29Å; F106-F130 AromaticContact CE2-CD1 3.72Å; F106-F130 HydrophobicContact CE2-CD1 3.72Å; F106-F130 AromaticContact CE2-CE1 3.83Å; F106-F130 HydrophobicContact CE2-CE1 3.83Å; F106-F130 HydrophobicContact CZ-CD1 4.3Å; F106-F130 HydrophobicContact CZ-CE1 4.12Å; F106-D132 HydrophobicContact CB-CB 4.09Å; F106-L133 HydrophobicContact CB-CD1 4.27Å; F106-L133 HydrophobicContact CB-CD2 3.67Å; F106-L133 HydrophobicContact CB-CG 3.8Å; F106-L133 HydrophobicContact CD1-CD1 4.09Å; F106-L133 HydrophobicContact CD1-CD2 4.25Å; F106-L133 HydrophobicContact CD1-CG 4.48Å; F106-L133 HydrophobicContact CD2-CD1 4.05Å; F106-L133 HydrophobicContact CD2-CG 4.38Å; F106-L133 HydrophobicContact CE1-CD1 4.48Å; F106-L133 HydrophobicContact CE2-CD1 4.44Å; F106-L133 HydrophobicContact CG-CD1 3.87Å; F106-L133 HydrophobicContact CG-CD2 4.05Å; F106-L133 HydrophobicContact CG-CG 3.98Å
107	S	96.2	Very high	97.4	Very high	59 Å²	59	39.5 Å²	39.5	41%	0.413	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-36	174.4	-166.4	0	0	0	0	114.5	E104 V109 D132	E104-S107 PolarHBondContact O-N 2.97Å; S107-V109 VanDerWaalsContact C-N 3.28Å; S107-V109 PolarHBondContact O-N 3.38Å; S107-D132 WeakPolarHBondContact CA-OD2 3.42Å; S107-D132 WeakPolarHBondContact CB-OD2 3.32Å; S107-D132 PolarHBondContact N-OD2 3.44Å; S107-D132 VanDerWaalsContact N-OD2 3.15Å
108	P	96	Very high	97.4	Very high	19 Å²	19	35.6 Å²	35.6	12%	0.123	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-14.9	177.6	-21.1	34.7	0	0	0	115.4	T81 R84 L85 F106 P110	T81-P108 HydrophobicContact CG2-CB 3.61Å; T81-P108 HydrophobicContact CG2-CG 4.04Å; R84-P108 WeakPolarHBondContact CG-O 3.4Å; L85-P108 PolarHBondContact N-O 2.96Å; F106-P108 VanDerWaalsContact C-N 3.27Å; P108-P110 VanDerWaalsContact O-CD 3.29Å; P108-P110 WeakPolarHBondContact O-CD 3.41Å
109	V	97.6	Very high	97.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.			trans	-121.7	57.5	-171.3	-68.6	0	0	0	0	112.3	W80 L85 L88 F106 S107 N111 L112 L133	W80-V109 HydrophobicContact CH2-CG1 4.33Å; W80-V109 HydrophobicContact CZ2-CG1 3.9Å; L85-V109 HydrophobicContact CB-CG1 4.05Å; L85-V109 HydrophobicContact CD1-CG1 4.46Å; L88-V109 HydrophobicContact CB-CG1 4.28Å; L88-V109 HydrophobicContact CD2-CB 4.34Å; L88-V109 HydrophobicContact CD2-CG1 3.48Å; L88-V109 VanDerWaalsContact CD2-CG1 3.48Å; L88-V109 HydrophobicContact CG-CG1 4.49Å; F106-V109 HydrophobicContact CB-CG2 4.27Å; F106-V109 HydrophobicContact CD1-CG2 4.25Å; F106-V109 WeakPolarHBondContact O-CG2 3.27Å; F106-V109 PolarHBondContact O-N 3.15Å; S107-V109 VanDerWaalsContact C-N 3.28Å; S107-V109 PolarHBondContact O-N 3.38Å; V109-N111 PolarHBondContact O-N 3.28Å; V109-N111 VanDerWaalsContact O-N 3.09Å; V109-L112 HydrophobicContact CB-CB 4.39Å; V109-L112 HydrophobicContact CG2-CB 4.5Å; V109-L112 HydrophobicContact CG2-CD2 4.34Å; V109-L112 WeakPolarHBondContact O-CB 3.43Å; V109-L112 PolarHBondContact O-N 3.18Å; V109-L133 HydrophobicContact CG2-CD2 4.25Å
110	P	96.3	Very high	97.5	Very high	34 Å²	34	32.5 Å²	32.5	22%	0.221	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.5	-169.9	29.2	-38	0	0	0	114.9	T86 P108 V135	T86-P110 HydrophobicContact CG2-CG 4.42Å; P108-P110 VanDerWaalsContact O-CD 3.29Å; P108-P110 WeakPolarHBondContact O-CD 3.41Å; P110-V135 WeakPolarHBondContact O-CG2 3.22Å
111	N	97.9	Very high	97.5	Very high	68 Å²	68	32.7 Å²	32.7	36%	0.364	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	15.4	-176.5	-67	-39.1	0	0	0	113.3	T86 L88 V109 R113	T86-N111 PolarHBondContact O-ND2 3.43Å; L88-N111 CarbonylContact O-C 3.27Å; V109-N111 PolarHBondContact O-N 3.28Å; V109-N111 VanDerWaalsContact O-N 3.09Å; N111-R113 PolarHBondContact O-N 3.45Å
112	L	98.4	Very high	97.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.17	C	C	.	.			trans	-66.3	129.9	-178	-162.2	74.1	0	0	0	110.6	L88 L91 V109 L115 L133 V135 L136	L88-L112 HydrophobicContact CD2-CD1 3.93Å; L88-L112 HydrophobicContact CG-CD1 3.99Å; L88-L112 WeakPolarHBondContact O-CA 3.22Å; L88-L112 PolarHBondContact O-N 3Å; L91-L112 HydrophobicContact CB-CD1 3.68Å; L91-L112 HydrophobicContact CB-CD2 4.06Å; L91-L112 HydrophobicContact CB-CG 4.49Å; L91-L112 HydrophobicContact CD2-CD2 4.48Å; V109-L112 HydrophobicContact CB-CB 4.39Å; V109-L112 HydrophobicContact CG2-CB 4.5Å; V109-L112 HydrophobicContact CG2-CD2 4.34Å; V109-L112 WeakPolarHBondContact O-CB 3.43Å; V109-L112 PolarHBondContact O-N 3.18Å; L112-L115 HydrophobicContact CD2-CB 3.9Å; L112-L115 HydrophobicContact CD2-CD1 4.17Å; L112-L115 HydrophobicContact CD2-CD2 4.43Å; L112-L115 HydrophobicContact CD2-CG 4.39Å; L112-L133 HydrophobicContact CB-CD2 3.97Å; L112-L133 HydrophobicContact CD2-CD2 3.96Å; L112-V135 CarbonylContact O-C 3.51Å; L112-L136 HydrophobicContact CB-CD1 4.22Å; L112-L136 HydrophobicContact CD2-CD1 3.99Å; L112-L136 HydrophobicContact CG-CD1 3.98Å; L112-L136 VanDerWaalsContact O-CA 3.3Å; L112-L136 WeakPolarHBondContact O-CA 3.3Å; L112-L136 WeakPolarHBondContact O-CD1 3.37Å; L112-L136 PolarHBondContact O-N 3.34Å
113	R	98.7	Very high	97.6	Very high	122 Å²	122	40.3 Å²	40.3	46%	0.46	20%	0.196	S	C	.	.			trans	-108.2	-31	178.6	-63.4	-169.6	-176.9	-162.9	3.4	113	H89 N111 E137 V138	H89-R113 PolarHBondContact O-N 2.63Å; N111-R113 PolarHBondContact O-N 3.45Å; R113-E137 IonicContact CZ-OE1 4Å; R113-E137 IonicContact NH1-OE1 3.51Å; R113-E137 PolarHBondContact O-N 3.11Å; R113-V138 PolarHBondContact O-N 3.24Å
114	Y	98.8	Very high	97.8	Very high	82 Å²	82	41 Å²	41	32%	0.322	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.2	-177.4	-170.5	-80.4	0	0	0	110.4	H89 S90 L91 L92 D116 V138 L140	H89-Y114 PolarHBondContact O-N 2.93Å; S90-Y114 WeakPolarHBondContact CA-O 3.39Å; L91-Y114 PolarHBondContact N-O 3.3Å; L92-Y114 HydrophobicContact CD2-CD1 3.88Å; L92-Y114 HydrophobicContact CD2-CE1 3.72Å; Y114-D116 HydrophobicContact CE1-CB 3.94Å; Y114-V138 HydrophobicContact CD2-CB 3.67Å; Y114-V138 HydrophobicContact CD2-CG1 3.75Å; Y114-V138 HydrophobicContact CD2-CG2 4.25Å; Y114-V138 HydrophobicContact CE2-CB 4.08Å; Y114-V138 HydrophobicContact CE2-CG1 3.61Å; Y114-V138 HydrophobicContact CG-CB 4.47Å; Y114-L140 HydrophobicContact CE1-CD2 4.39Å; Y114-L140 HydrophobicContact CE2-CD1 4.19Å; Y114-L140 WeakPolarHBondContact OH-CD2 3.46Å
115	L	98.8	Very high	97.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119.8	177.3	177.3	56.8	0	0	0	110.2	L91 L93 F106 L112 L117 F130 L133 L136 V138 L139 L140	L91-L115 HydrophobicContact CB-CD1 4.09Å; L91-L115 HydrophobicContact CD2-CD1 3.97Å; L91-L115 HydrophobicContact CG-CD1 4.03Å; L93-L115 HydrophobicContact CD1-CD1 4.44Å; F106-L115 HydrophobicContact CD1-CD2 4.43Å; F106-L115 HydrophobicContact CE1-CD1 4.31Å; F106-L115 HydrophobicContact CE1-CD2 3.69Å; F106-L115 HydrophobicContact CZ-CD2 3.77Å; L112-L115 HydrophobicContact CD2-CB 3.9Å; L112-L115 HydrophobicContact CD2-CD1 4.17Å; L112-L115 HydrophobicContact CD2-CD2 4.43Å; L112-L115 HydrophobicContact CD2-CG 4.39Å; L115-L117 HydrophobicContact CD1-CD1 4.46Å; L115-L117 HydrophobicContact CD1-CG 4.1Å; L115-L117 HydrophobicContact CD2-CD1 3.88Å; L115-L117 HydrophobicContact CD2-CG 4.38Å; L115-L117 HydrophobicContact CG-CD1 4.1Å; L115-L117 HydrophobicContact CG-CG 4.07Å; L115-F130 HydrophobicContact CD2-CD1 4.36Å; L115-F130 HydrophobicContact CD2-CE1 4.21Å; L115-L133 HydrophobicContact CD2-CD1 3.69Å; L115-L136 HydrophobicContact CB-CD1 3.85Å; L115-L136 HydrophobicContact CB-CD2 4.2Å; L115-V138 PolarHBondContact N-O 3.36Å; L115-L139 HydrophobicContact CB-CD1 4.06Å; L115-L139 HydrophobicContact CD2-CD1 3.85Å; L115-L139 HydrophobicContact CG-CD1 3.93Å; L115-L140 PolarHBondContact O-N 2.8Å
116	D	98.9	Very high	97.6	Very high	13 Å²	13	41.1 Å²	41.1	7%	0.07	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	106.2	175.1	-176.5	13.3	0	0	0	112.3	L91 L92 L93 S94 Y114 S118 L140	L91-D116 PolarHBondContact O-N 3.18Å; L92-D116 HydrophobicContact CD2-CB 4.05Å; L93-D116 CarbonylContact C-O 3.29Å; L93-D116 VanDerWaalsContact CA-O 3.29Å; L93-D116 WeakPolarHBondContact CA-O 3.31Å; L93-D116 WeakPolarHBondContact CB-O 3.42Å; L93-D116 PolarHBondContact N-O 3.5Å; S94-D116 WeakPolarHBondContact CB-OD2 3.38Å; S94-D116 PolarHBondContact N-O 3.43Å; S94-D116 PolarHBondContact OG-OD2 2.92Å; Y114-D116 HydrophobicContact CE1-CB 3.94Å; D116-S118 WeakPolarHBondContact OD1-CB 3.41Å; D116-S118 PolarHBondContact OD1-N 3.35Å; D116-S118 PolarHBondContact OD1-OG 2.89Å; D116-L140 HydrophobicContact CB-CB 4.37Å; D116-L140 HydrophobicContact CB-CD2 4.08Å; D116-L140 WeakPolarHBondContact OD1-CB 3.39Å
117	L	98.8	Very high	97.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.229	C	C	.	.			trans	-112.3	15.5	174.2	-72.6	168.2	0	0	0	111.6	L93 L98 I101 F106 L115 N120 L122 F130 L140 L141 N144	L93-L117 HydrophobicContact CB-CD2 3.98Å; L93-L117 HydrophobicContact CD1-CD2 3.86Å; L98-L117 HydrophobicContact CD1-CD2 3.78Å; I101-L117 HydrophobicContact CD1-CD1 3.75Å; I101-L117 HydrophobicContact CD1-CD2 3.99Å; F106-L117 HydrophobicContact CZ-CD1 4.38Å; L115-L117 HydrophobicContact CD1-CD1 4.46Å; L115-L117 HydrophobicContact CD1-CG 4.1Å; L115-L117 HydrophobicContact CD2-CD1 3.88Å; L115-L117 HydrophobicContact CD2-CG 4.38Å; L115-L117 HydrophobicContact CG-CD1 4.1Å; L115-L117 HydrophobicContact CG-CG 4.07Å; L117-N120 PolarHBondContact O-ND2 2.95Å; L117-L122 HydrophobicContact CB-CD1 4.3Å; L117-L122 HydrophobicContact CD1-CD1 4.44Å; L117-F130 HydrophobicContact CD1-CE1 3.89Å; L117-F130 HydrophobicContact CD1-CZ 4.24Å; L117-L140 CarbonylContact C-O 3.47Å; L117-L140 WeakPolarHBondContact CA-O 3.31Å; L117-L140 WeakPolarHBondContact CB-O 3.3Å; L117-L140 PolarHBondContact N-O 3.3Å; L117-L141 HydrophobicContact CB-CD2 3.83Å; L117-L141 HydrophobicContact CD1-CD2 4.03Å; L117-N144 PolarHBondContact O-ND2 2.77Å
118	S	98.8	Very high	97.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.231	C	C	.	.			trans	-65.5	158.5	-178.2	66.3	0	0	0	0	113	S94 H95 D116 N120 L140 Y142	S94-S118 WeakPolarHBondContact CA-O 3.45Å; S94-S118 WeakPolarHBondContact CB-O 3.47Å; S94-S118 VanDerWaalsContact CB-OG 3.28Å; S94-S118 WeakPolarHBondContact CB-OG 3.31Å; H95-S118 PolarHBondContact N-O 3.29Å; D116-S118 WeakPolarHBondContact OD1-CB 3.41Å; D116-S118 PolarHBondContact OD1-N 3.35Å; D116-S118 PolarHBondContact OD1-OG 2.89Å; S118-N120 PolarHBondContact O-N 3.31Å; S118-N120 PolarHBondContact O-ND2 3.33Å; S118-N120 VanDerWaalsContact O-ND2 3.17Å; S118-L140 PolarHBondContact N-O 3.29Å; S118-Y142 CarbonylContact C-O 3.57Å; S118-Y142 WeakPolarHBondContact CA-O 3.15Å; S118-Y142 VanDerWaalsContact CB-CE1 3.44Å; S118-Y142 WeakPolarHBondContact CB-O 3.18Å; S118-Y142 VanDerWaalsContact OG-CZ 3.28Å; S118-Y142 PolarHBondContact OG-OH 3.26Å
119	S	98.8	Very high	97.4	Very high	15 Å²	15	48.9 Å²	48.9	11%	0.105	23%	0.228	C	C	.	.	S	Bend	trans	55.3	51.1	177.5	-56.9	0	0	0	0	112.8	H95 N96 Y142 N143	H95-S119 VanDerWaalsContact CA-O 3.25Å; H95-S119 WeakPolarHBondContact CA-O 3.42Å; H95-S119 PolarHBondContact CE1-OG 3.41Å; H95-S119 PolarHBondContact N-O 3.38Å; H95-S119 WeakPolarHBondContact ND1-CB 3.49Å; N96-S119 PolarHBondContact N-O 2.93Å; S119-Y142 PolarHBondContact N-O 3.21Å; S119-N143 WeakPolarHBondContact CA-O 3.24Å; S119-N143 WeakPolarHBondContact CB-ND2 2.93Å; S119-N143 PolarHBondContact N-O 3.04Å; S119-N143 PolarHBondContact OG-ND2 3.25Å
120	N	98.8	Very high	97.4	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.032	23%	0.228	C	C	.	.	S	Bend	trans	-125.1	-166.4	178.2	-87.7	-71.2	0	0	0	110.9	L93 N96 L98 L117 S118 L122 N143 N144	L93-N120 PolarHBondContact O-ND2 3.48Å; N96-N120 WeakPolarHBondContact CA-OD1 3.31Å; N96-N120 WeakPolarHBondContact CB-OD1 3.36Å; N96-N120 PolarHBondContact N-OD1 2.94Å; N96-N120 PolarHBondContact O-OD1 2.96Å; L98-N120 HydrophobicContact CB-CB 4.19Å; L98-N120 VanDerWaalsContact CB-OD1 3.24Å; L98-N120 WeakPolarHBondContact CB-OD1 3.34Å; L98-N120 WeakPolarHBondContact CG-OD1 3.28Å; L98-N120 PolarHBondContact N-OD1 3.14Å; L117-N120 PolarHBondContact O-ND2 2.95Å; S118-N120 PolarHBondContact O-N 3.31Å; S118-N120 PolarHBondContact O-ND2 3.33Å; S118-N120 VanDerWaalsContact O-ND2 3.17Å; N120-L122 HydrophobicContact CB-CG 4.43Å; N120-N143 PolarHBondContact N-O 2.93Å; N120-N144 VanDerWaalsContact CA-OD1 3.31Å; N120-N144 WeakPolarHBondContact CA-OD1 3.47Å; N120-N144 WeakPolarHBondContact CB-OD1 3.41Å; N120-N144 PolarHBondContact N-OD1 2.83Å; N120-N144 PolarHBondContact O-OD1 2.86Å
121	Q	98.6	Very high	97.3	Very high	75 Å²	75	48 Å²	48	35%	0.35	22%	0.222	S	C	.	.			trans	-115.4	24.4	-176.9	-61.4	-178.2	-2.5	0	0	112.9	H97 L98 N99 R123 N144	H97-Q121 PolarHBondContact CD2-NE2 3Å; L98-Q121 CarbonylContact O-C 3.03Å; L98-Q121 VanDerWaalsContact O-CA 3.25Å; L98-Q121 WeakPolarHBondContact O-CA 3.34Å; L98-Q121 WeakPolarHBondContact O-CB 3.47Å; L98-Q121 PolarHBondContact O-N 3.13Å; N99-Q121 HydrophobicContact CB-CB 4.07Å; Q121-R123 PolarHBondContact O-N 2.9Å; Q121-N144 PolarHBondContact N-OD1 3.01Å
122	L	98.3	Very high	97.1	Very high	7 Å²	7	48 Å²	48	4%	0.037	22%	0.222	C	C	.	.			trans	-68.2	131.6	-178.7	-58.9	174.5	0	0	0	110.3	L98 I101 L117 N120 L141 N144 H145 I146	L98-L122 HydrophobicContact CB-CD2 4.43Å; L98-L122 PolarHBondContact O-N 3.33Å; I101-L122 HydrophobicContact CD1-CD1 3.93Å; I101-L122 HydrophobicContact CD1-CD2 3.82Å; I101-L122 HydrophobicContact CG1-CD2 3.98Å; L117-L122 HydrophobicContact CB-CD1 4.3Å; L117-L122 HydrophobicContact CD1-CD1 4.44Å; N120-L122 HydrophobicContact CB-CG 4.43Å; L122-L141 HydrophobicContact CD1-CD2 3.8Å; L122-N144 HydrophobicContact CB-CB 4.39Å; L122-N144 WeakPolarHBondContact CB-OD1 3.5Å; L122-N144 PolarHBondContact N-OD1 3.44Å; L122-H145 CarbonylContact O-C 3.08Å; L122-H145 WeakPolarHBondContact O-CA 3.42Å; L122-H145 WeakPolarHBondContact O-CB 3.31Å; L122-H145 PolarHBondContact O-N 2.96Å; L122-I146 HydrophobicContact CB-CG1 4.46Å; L122-I146 PolarHBondContact O-N 3.12Å
123	R	97.6	Very high	97	Very high	180 Å²	180	47.9 Å²	47.9	68%	0.679	22%	0.222	S	C	*	.			trans	-110.8	-32.7	-177	-65.2	-178.7	-178.1	-175.9	0.6	113.6	Q121 H145 I146 M147	Q121-R123 PolarHBondContact O-N 2.9Å; R123-H145 HydrophobicContact CG-CB 4Å; R123-I146 WeakPolarHBondContact O-CA 3.31Å; R123-M147 PolarHBondContact O-N 3.36Å
124	T	96.2	Very high	96.9	Very high	85 Å²	85	47.7 Å²	47.7	52%	0.521	23%	0.226	S	C	.	.			trans	-129.4	153.9	179.5	58.5	0	0	0	0	109	D126	T124-D126 PolarHBondContact OG1-OD1 2.83Å
125	L	96.2	Very high	96.8	Very high	13 Å²	13	46.2 Å²	46.2	7%	0.068	23%	0.226	C	C	.	.			trans	-112.9	102.6	165.8	-58.3	-179.9	0	0	0	105.3	L129 F130 L141 I146 A153 F154 L165	L125-L129 HydrophobicContact CD2-CD2 4.36Å; L125-F130 HydrophobicContact CD2-CE2 4.08Å; L125-F130 HydrophobicContact CD2-CZ 4.28Å; L125-L141 HydrophobicContact CD1-CD1 3.97Å; L125-L141 HydrophobicContact CD2-CD1 4.05Å; L125-L141 HydrophobicContact CD2-CD2 4.32Å; L125-I146 HydrophobicContact CD1-CD1 4.23Å; L125-I146 HydrophobicContact CD1-CG2 4.39Å; L125-I146 HydrophobicContact CD2-CD1 3.88Å; L125-I146 HydrophobicContact CD2-CG1 4.37Å; L125-I146 HydrophobicContact CG-CD1 4.13Å; L125-I146 HydrophobicContact CG-CG1 4.45Å; L125-I146 HydrophobicContact CG-CG2 4.23Å; L125-A153 HydrophobicContact CB-CB 3.83Å; L125-F154 HydrophobicContact CD1-CE1 4.42Å; L125-F154 HydrophobicContact CD1-CE2 4.33Å; L125-F154 HydrophobicContact CD1-CZ 3.63Å; L125-L165 HydrophobicContact CD1-CD2 4.44Å
126	D	94.1	Very high	96.8	Very high	84 Å²	84	46.2 Å²	46.2	45%	0.449	23%	0.226	S	C	.	.			trans	-69.7	159.3	-175.6	-60.9	-10.7	0	0	0	110.2	T124 F128 L129 A153	T124-D126 PolarHBondContact OG1-OD1 2.83Å; D126-F128 PolarHBondContact O-N 2.96Å; D126-L129 VanDerWaalsContact O-CB 3.24Å; D126-L129 WeakPolarHBondContact O-CB 3.48Å; D126-L129 PolarHBondContact O-N 2.86Å; D126-A153 WeakPolarHBondContact O-CA 3.28Å; D126-A153 WeakPolarHBondContact O-CB 3.32Å
127	E	93.9	Very high	96.8	Very high	127 Å²	127	48.5 Å²	48.5	59%	0.593	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	138	179.2	-63.3	176.8	-169.6	0	0	110.8	L129 C152	E127-L129 PolarHBondContact O-N 3.35Å; E127-C152 HydrophobicContact CB-CB 4.25Å; E127-C152 HydrophobicContact CG-CB 4Å
128	F	94.6	Very high	96.8	Very high	104 Å²	104	49.3 Å²	49.3	46%	0.456	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	13.4	179.2	-44.5	-68.8	0	0	0	115.9	D126 F130 S131 C152 D155	D126-F128 PolarHBondContact O-N 2.96Å; F128-F130 PolarHBondContact O-N 2.97Å; F128-S131 WeakPolarHBondContact CA-OG 3.4Å; F128-S131 WeakPolarHBondContact O-CB 3.42Å; F128-S131 PolarHBondContact O-N 3.35Å; F128-S131 PolarHBondContact O-OG 3.02Å; F128-C152 WeakPolarHBondContact CA-O 3.26Å; F128-C152 PolarHBondContact N-O 3.03Å; F128-D155 HydrophobicContact CD1-CB 3.89Å; F128-D155 HydrophobicContact CE1-CB 4.01Å
129	L	96.5	Very high	96.8	Very high	11 Å²	11	49.3 Å²	49.3	6%	0.058	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-33.2	-175.6	-179	61.4	0	0	0	113.5	I101 F106 L125 D126 E127	I101-L129 HydrophobicContact CB-CD1 4.05Å; I101-L129 HydrophobicContact CG2-CD1 3.8Å; F106-L129 WeakPolarHBondContact CD2-O 3.49Å; L125-L129 HydrophobicContact CD2-CD2 4.36Å; D126-L129 VanDerWaalsContact O-CB 3.24Å; D126-L129 WeakPolarHBondContact O-CB 3.48Å; D126-L129 PolarHBondContact O-N 2.86Å; E127-L129 PolarHBondContact O-N 3.35Å
130	F	96.9	Very high	96.8	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	9.8	-179.3	-55.8	-67.3	0	0	0	113.6	F106 L115 L117 L125 F128 D132 L133 L139 L141 A153 F154 M157	F106-F130 HydrophobicContact CD2-CD1 4.29Å; F106-F130 AromaticContact CE2-CD1 3.72Å; F106-F130 HydrophobicContact CE2-CD1 3.72Å; F106-F130 AromaticContact CE2-CE1 3.83Å; F106-F130 HydrophobicContact CE2-CE1 3.83Å; F106-F130 HydrophobicContact CZ-CD1 4.3Å; F106-F130 HydrophobicContact CZ-CE1 4.12Å; L115-F130 HydrophobicContact CD2-CD1 4.36Å; L115-F130 HydrophobicContact CD2-CE1 4.21Å; L117-F130 HydrophobicContact CD1-CE1 3.89Å; L117-F130 HydrophobicContact CD1-CZ 4.24Å; L125-F130 HydrophobicContact CD2-CE2 4.08Å; L125-F130 HydrophobicContact CD2-CZ 4.28Å; F128-F130 PolarHBondContact O-N 2.97Å; F130-D132 VanDerWaalsContact C-N 3.27Å; F130-D132 PolarHBondContact O-N 2.88Å; F130-L133 HydrophobicContact CB-CD1 4.37Å; F130-L133 HydrophobicContact CD1-CD1 4Å; F130-L133 VanDerWaalsContact O-CB 3.31Å; F130-L133 WeakPolarHBondContact O-CB 3.5Å; F130-L133 PolarHBondContact O-N 3.32Å; F130-L139 HydrophobicContact CD1-CD2 4.34Å; F130-L139 HydrophobicContact CD2-CD2 4Å; F130-L139 HydrophobicContact CE1-CD1 4.28Å; F130-L139 HydrophobicContact CE1-CD2 4.3Å; F130-L139 HydrophobicContact CE2-CD2 3.96Å; F130-L139 HydrophobicContact CG-CD2 4.2Å; F130-L139 HydrophobicContact CZ-CD1 4.5Å; F130-L139 HydrophobicContact CZ-CD2 4.12Å; F130-L141 HydrophobicContact CE2-CD1 4.15Å; F130-L141 HydrophobicContact CZ-CD1 4.14Å; F130-L141 HydrophobicContact CZ-CD2 4.28Å; F130-A153 WeakPolarHBondContact CD2-O 3.43Å; F130-A153 PolarHBondContact N-O 2.8Å; F130-F154 HydrophobicContact CD2-CD1 4.07Å; F130-F154 HydrophobicContact CD2-CE1 4.06Å; F130-F154 HydrophobicContact CE2-CE1 4.18Å; F130-M157 HydrophobicContact CB-CE 3.96Å; F130-M157 HydrophobicContact CB-CG 4.4Å; F130-M157 HydrophobicContact CB-SD 3.49Å; F130-M157 WeakPolarHBondContact CB-SD 3.46Å; F130-M157 HydrophobicContact CG-SD 4.39Å
131	S	93.7	Very high	96.8	Very high	14 Å²	14	48.7 Å²	48.7	10%	0.098	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.5	-173	-65.6	0	0	0	0	114.5	F128 L133 D155	F128-S131 WeakPolarHBondContact CA-OG 3.4Å; F128-S131 WeakPolarHBondContact O-CB 3.42Å; F128-S131 PolarHBondContact O-N 3.35Å; F128-S131 PolarHBondContact O-OG 3.02Å; S131-L133 PolarHBondContact O-N 3.4Å; S131-D155 VanDerWaalsContact CA-O 3.29Å; S131-D155 WeakPolarHBondContact CA-O 3.27Å; S131-D155 WeakPolarHBondContact CB-O 3.43Å; S131-D155 PolarHBondContact OG-O 2.94Å
132	D	94.4	Very high	96.8	Very high	68 Å²	68	47.4 Å²	47.4	36%	0.364	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-19	171.2	-78.7	-18.2	0	0	0	112.8	F106 S107 F130 Q134	F106-D132 HydrophobicContact CB-CB 4.09Å; S107-D132 WeakPolarHBondContact CA-OD2 3.42Å; S107-D132 WeakPolarHBondContact CB-OD2 3.32Å; S107-D132 PolarHBondContact N-OD2 3.44Å; S107-D132 VanDerWaalsContact N-OD2 3.15Å; F130-D132 VanDerWaalsContact C-N 3.27Å; F130-D132 PolarHBondContact O-N 2.88Å; D132-Q134 PolarHBondContact O-N 3.27Å
133	L	96.8	Very high	96.8	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.244	C	C	.	.			trans	-93.7	54.6	-173	-59.8	177.6	0	0	0	112.3	F106 V109 L112 L115 F130 S131 V135 L136	F106-L133 HydrophobicContact CB-CD1 4.27Å; F106-L133 HydrophobicContact CB-CD2 3.67Å; F106-L133 HydrophobicContact CB-CG 3.8Å; F106-L133 HydrophobicContact CD1-CD1 4.09Å; F106-L133 HydrophobicContact CD1-CD2 4.25Å; F106-L133 HydrophobicContact CD1-CG 4.48Å; F106-L133 HydrophobicContact CD2-CD1 4.05Å; F106-L133 HydrophobicContact CD2-CG 4.38Å; F106-L133 HydrophobicContact CE1-CD1 4.48Å; F106-L133 HydrophobicContact CE2-CD1 4.44Å; F106-L133 HydrophobicContact CG-CD1 3.87Å; F106-L133 HydrophobicContact CG-CD2 4.05Å; F106-L133 HydrophobicContact CG-CG 3.98Å; V109-L133 HydrophobicContact CG2-CD2 4.25Å; L112-L133 HydrophobicContact CB-CD2 3.97Å; L112-L133 HydrophobicContact CD2-CD2 3.96Å; L115-L133 HydrophobicContact CD2-CD1 3.69Å; F130-L133 HydrophobicContact CB-CD1 4.37Å; F130-L133 HydrophobicContact CD1-CD1 4Å; F130-L133 VanDerWaalsContact O-CB 3.31Å; F130-L133 WeakPolarHBondContact O-CB 3.5Å; F130-L133 PolarHBondContact O-N 3.32Å; S131-L133 PolarHBondContact O-N 3.4Å; L133-V135 PolarHBondContact O-N 3.32Å; L133-V135 VanDerWaalsContact O-N 3.15Å; L133-L136 HydrophobicContact CB-CB 3.94Å; L133-L136 HydrophobicContact CB-CD2 4.38Å; L133-L136 HydrophobicContact CD1-CD1 4.39Å; L133-L136 HydrophobicContact CD1-CD2 3.98Å; L133-L136 VanDerWaalsContact O-CB 3.32Å; L133-L136 WeakPolarHBondContact O-CB 3.29Å; L133-L136 PolarHBondContact O-N 3.02Å; L133-L136 VanDerWaalsContact O-N 3.09Å
134	Q	95.7	Very high	96.9	Very high	117 Å²	117	42.1 Å²	42.1	55%	0.547	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.6	-171.4	-62.6	-177.8	4.6	0	0	114.7	D132 Q159	D132-Q134 PolarHBondContact O-N 3.27Å; Q134-Q159 WeakPolarHBondContact O-CG 3.23Å
135	V	97.3	Very high	97	Very high	52 Å²	52	41.9 Å²	41.9	32%	0.315	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	8.6	178.8	-57.4	0	0	0	0	113.8	P110 L112 L133 E137	P110-V135 WeakPolarHBondContact O-CG2 3.22Å; L112-V135 CarbonylContact O-C 3.51Å; L133-V135 PolarHBondContact O-N 3.32Å; L133-V135 VanDerWaalsContact O-N 3.15Å; V135-E137 PolarHBondContact O-N 3.37Å
136	L	98.4	Very high	97.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.			trans	-65.9	130.5	178.8	-159.9	77.7	0	0	0	110.5	L112 L115 L133 L139 M157 Q159 L160	L112-L136 HydrophobicContact CB-CD1 4.22Å; L112-L136 HydrophobicContact CD2-CD1 3.99Å; L112-L136 HydrophobicContact CG-CD1 3.98Å; L112-L136 VanDerWaalsContact O-CA 3.3Å; L112-L136 WeakPolarHBondContact O-CA 3.3Å; L112-L136 WeakPolarHBondContact O-CD1 3.37Å; L112-L136 PolarHBondContact O-N 3.34Å; L115-L136 HydrophobicContact CB-CD1 3.85Å; L115-L136 HydrophobicContact CB-CD2 4.2Å; L133-L136 HydrophobicContact CB-CB 3.94Å; L133-L136 HydrophobicContact CB-CD2 4.38Å; L133-L136 HydrophobicContact CD1-CD1 4.39Å; L133-L136 HydrophobicContact CD1-CD2 3.98Å; L133-L136 VanDerWaalsContact O-CB 3.32Å; L133-L136 WeakPolarHBondContact O-CB 3.29Å; L133-L136 PolarHBondContact O-N 3.02Å; L133-L136 VanDerWaalsContact O-N 3.09Å; L136-L139 HydrophobicContact CD2-CB 3.91Å; L136-L139 HydrophobicContact CD2-CD1 4.32Å; L136-L139 HydrophobicContact CD2-CG 4.49Å; L136-M157 HydrophobicContact CB-CE 3.97Å; L136-M157 HydrophobicContact CD2-CE 3.43Å; L136-M157 VanDerWaalsContact CD2-CE 3.43Å; L136-M157 HydrophobicContact CG-CE 4.3Å; L136-Q159 CarbonylContact O-C 3.45Å; L136-L160 HydrophobicContact CD2-CD1 4.18Å; L136-L160 HydrophobicContact CG-CD1 4.44Å; L136-L160 WeakPolarHBondContact O-CA 3.49Å; L136-L160 PolarHBondContact O-N 3.24Å
137	E	98.5	Very high	97.3	Very high	60 Å²	60	42.7 Å²	42.7	28%	0.28	21%	0.209	S	C	.	.			trans	-103.2	-35.8	-179.4	-65.4	171.5	-174.6	0	0	110.8	R113 V135 Q161 K162	R113-E137 IonicContact CZ-OE1 4Å; R113-E137 IonicContact NH1-OE1 3.51Å; R113-E137 PolarHBondContact O-N 3.11Å; V135-E137 PolarHBondContact O-N 3.37Å; E137-Q161 WeakPolarHBondContact O-CA 3.28Å; E137-Q161 WeakPolarHBondContact O-CB 3.44Å; E137-Q161 PolarHBondContact O-N 3.37Å; E137-K162 PolarHBondContact O-N 2.97Å
138	V	98.8	Very high	97.4	Very high	17 Å²	17	39.8 Å²	39.8	10%	0.103	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	125	-173.9	-178.2	0	0	0	0	111.1	R113 Y114 L115 L140 K162 Y164	R113-V138 PolarHBondContact O-N 3.24Å; Y114-V138 HydrophobicContact CD2-CB 3.67Å; Y114-V138 HydrophobicContact CD2-CG1 3.75Å; Y114-V138 HydrophobicContact CD2-CG2 4.25Å; Y114-V138 HydrophobicContact CE2-CB 4.08Å; Y114-V138 HydrophobicContact CE2-CG1 3.61Å; Y114-V138 HydrophobicContact CG-CB 4.47Å; L115-V138 PolarHBondContact N-O 3.36Å; V138-L140 HydrophobicContact CG1-CD1 3.29Å; V138-K162 HydrophobicContact CG1-CB 4.29Å; V138-K162 HydrophobicContact CG2-CB 4.24Å; V138-K162 HydrophobicContact CG2-CD 4.2Å; V138-K162 HydrophobicContact CG2-CG 4.34Å; V138-Y164 HydrophobicContact CG1-CE2 4.38Å
139	L	98.7	Very high	97.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.1	176.8	179.2	54.9	0	0	0	110.9	L115 F130 L136 L141 F154 M157 L160 K162 L163 Y164	L115-L139 HydrophobicContact CB-CD1 4.06Å; L115-L139 HydrophobicContact CD2-CD1 3.85Å; L115-L139 HydrophobicContact CG-CD1 3.93Å; F130-L139 HydrophobicContact CD1-CD2 4.34Å; F130-L139 HydrophobicContact CD2-CD2 4Å; F130-L139 HydrophobicContact CE1-CD1 4.28Å; F130-L139 HydrophobicContact CE1-CD2 4.3Å; F130-L139 HydrophobicContact CE2-CD2 3.96Å; F130-L139 HydrophobicContact CG-CD2 4.2Å; F130-L139 HydrophobicContact CZ-CD1 4.5Å; F130-L139 HydrophobicContact CZ-CD2 4.12Å; L136-L139 HydrophobicContact CD2-CB 3.91Å; L136-L139 HydrophobicContact CD2-CD1 4.32Å; L136-L139 HydrophobicContact CD2-CG 4.49Å; L139-L141 HydrophobicContact CD1-CD1 4.46Å; L139-L141 HydrophobicContact CD1-CG 4.2Å; L139-L141 HydrophobicContact CD2-CD1 3.89Å; L139-L141 HydrophobicContact CD2-CG 4.49Å; L139-L141 HydrophobicContact CG-CD1 4.01Å; L139-L141 HydrophobicContact CG-CG 4.1Å; L139-F154 HydrophobicContact CD2-CD1 4.27Å; L139-F154 HydrophobicContact CD2-CE1 3.93Å; L139-M157 HydrophobicContact CD2-CE 4.38Å; L139-L160 HydrophobicContact CB-CD1 3.89Å; L139-K162 PolarHBondContact N-O 3.35Å; L139-L163 HydrophobicContact CB-CD1 4.05Å; L139-L163 HydrophobicContact CD2-CD1 3.86Å; L139-L163 HydrophobicContact CG-CD1 3.93Å; L139-Y164 PolarHBondContact O-N 2.94Å
140	L	98.9	Very high	97.2	Very high	9 Å²	9	38.9 Å²	38.9	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	116.5	176.7	-75.6	56	0	0	0	109.7	Y114 L115 D116 L117 S118 V138 Y142 Y164	Y114-L140 HydrophobicContact CE1-CD2 4.39Å; Y114-L140 HydrophobicContact CE2-CD1 4.19Å; Y114-L140 WeakPolarHBondContact OH-CD2 3.46Å; L115-L140 PolarHBondContact O-N 2.8Å; D116-L140 HydrophobicContact CB-CB 4.37Å; D116-L140 HydrophobicContact CB-CD2 4.08Å; D116-L140 WeakPolarHBondContact OD1-CB 3.39Å; L117-L140 CarbonylContact C-O 3.47Å; L117-L140 WeakPolarHBondContact CA-O 3.31Å; L117-L140 WeakPolarHBondContact CB-O 3.3Å; L117-L140 PolarHBondContact N-O 3.3Å; S118-L140 PolarHBondContact N-O 3.29Å; V138-L140 HydrophobicContact CG1-CD1 3.29Å; L140-Y142 HydrophobicContact CB-CD1 4.04Å; L140-Y142 HydrophobicContact CB-CE1 3.88Å; L140-Y142 HydrophobicContact CD2-CE1 3.62Å; L140-Y142 HydrophobicContact CG-CD1 4.12Å; L140-Y142 HydrophobicContact CG-CE1 3.7Å; L140-Y164 HydrophobicContact CD1-CD2 3.9Å; L140-Y164 HydrophobicContact CD1-CE2 4.33Å; L140-Y164 HydrophobicContact CG-CD2 4.18Å
141	L	98.8	Very high	97	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.			trans	-126	11.1	176	-74.2	166.8	0	0	0	112	L117 L122 L125 F130 L139 N144 I146 L163 Y164 L165 N168	L117-L141 HydrophobicContact CB-CD2 3.83Å; L117-L141 HydrophobicContact CD1-CD2 4.03Å; L122-L141 HydrophobicContact CD1-CD2 3.8Å; L125-L141 HydrophobicContact CD1-CD1 3.97Å; L125-L141 HydrophobicContact CD2-CD1 4.05Å; L125-L141 HydrophobicContact CD2-CD2 4.32Å; F130-L141 HydrophobicContact CE2-CD1 4.15Å; F130-L141 HydrophobicContact CZ-CD1 4.14Å; F130-L141 HydrophobicContact CZ-CD2 4.28Å; L139-L141 HydrophobicContact CD1-CD1 4.46Å; L139-L141 HydrophobicContact CD1-CG 4.2Å; L139-L141 HydrophobicContact CD2-CD1 3.89Å; L139-L141 HydrophobicContact CD2-CG 4.49Å; L139-L141 HydrophobicContact CG-CD1 4.01Å; L139-L141 HydrophobicContact CG-CG 4.1Å; L141-N144 PolarHBondContact O-ND2 2.77Å; L141-I146 HydrophobicContact CB-CD1 4.06Å; L141-I146 HydrophobicContact CD1-CD1 4.45Å; L141-I146 HydrophobicContact CD2-CD1 4.35Å; L141-L163 HydrophobicContact CD1-CD1 4.24Å; L141-Y164 CarbonylContact C-O 3.5Å; L141-Y164 VanDerWaalsContact CA-O 3.31Å; L141-Y164 WeakPolarHBondContact CA-O 2.93Å; L141-Y164 WeakPolarHBondContact CB-O 3.2Å; L141-Y164 PolarHBondContact N-O 3.4Å; L141-L165 HydrophobicContact CB-CD2 3.82Å; L141-L165 HydrophobicContact CD1-CD2 4Å; L141-N168 PolarHBondContact O-ND2 2.83Å
142	Y	98.7	Very high	97	Very high	47 Å²	47	42.6 Å²	42.6	18%	0.184	23%	0.225	C	C	.	.			trans	-65.2	156.1	-178.4	65.9	-97.5	0	0	0	112.1	S118 S119 L140 N144 Y164 S166	S118-Y142 CarbonylContact C-O 3.57Å; S118-Y142 WeakPolarHBondContact CA-O 3.15Å; S118-Y142 VanDerWaalsContact CB-CE1 3.44Å; S118-Y142 WeakPolarHBondContact CB-O 3.18Å; S118-Y142 VanDerWaalsContact OG-CZ 3.28Å; S118-Y142 PolarHBondContact OG-OH 3.26Å; S119-Y142 PolarHBondContact N-O 3.21Å; L140-Y142 HydrophobicContact CB-CD1 4.04Å; L140-Y142 HydrophobicContact CB-CE1 3.88Å; L140-Y142 HydrophobicContact CD2-CE1 3.62Å; L140-Y142 HydrophobicContact CG-CD1 4.12Å; L140-Y142 HydrophobicContact CG-CE1 3.7Å; Y142-N144 PolarHBondContact O-ND2 2.6Å; Y142-Y164 PolarHBondContact N-O 3.28Å; Y142-Y164 VanDerWaalsContact N-O 3.15Å; Y142-S166 CarbonylContact C-O 3.52Å; Y142-S166 WeakPolarHBondContact CA-O 3.26Å; Y142-S166 VanDerWaalsContact CB-O 3.27Å; Y142-S166 WeakPolarHBondContact CB-O 3.37Å; Y142-S166 WeakPolarHBondContact CB-OG 3.34Å
143	N	98.7	Very high	97	Very high	69 Å²	69	39.3 Å²	39.3	37%	0.369	21%	0.208	S	C	.	.	S	Bend	trans	56.3	54.2	-178	-169.5	32.4	0	0	0	112.3	S119 N120 S166 Q167	S119-N143 WeakPolarHBondContact CA-O 3.24Å; S119-N143 WeakPolarHBondContact CB-ND2 2.93Å; S119-N143 PolarHBondContact N-O 3.04Å; S119-N143 PolarHBondContact OG-ND2 3.25Å; N120-N143 PolarHBondContact N-O 2.93Å; N143-S166 PolarHBondContact N-O 2.86Å; N143-Q167 VanDerWaalsContact CA-O 3.26Å; N143-Q167 WeakPolarHBondContact CA-O 3.15Å; N143-Q167 HydrophobicContact CB-CB 4.23Å; N143-Q167 PolarHBondContact N-O 3.32Å
144	N	98.8	Very high	96.9	Very high	7 Å²	7	39.3 Å²	39.3	4%	0.037	21%	0.208	C	C	.	.	S	Bend	trans	-123.9	-166.2	173.3	-88.7	-78.6	0	0	0	109.5	L117 N120 Q121 L122 L141 Y142 I146 Q167 N168	L117-N144 PolarHBondContact O-ND2 2.77Å; N120-N144 VanDerWaalsContact CA-OD1 3.31Å; N120-N144 WeakPolarHBondContact CA-OD1 3.47Å; N120-N144 WeakPolarHBondContact CB-OD1 3.41Å; N120-N144 PolarHBondContact N-OD1 2.83Å; N120-N144 PolarHBondContact O-OD1 2.86Å; Q121-N144 PolarHBondContact N-OD1 3.01Å; L122-N144 HydrophobicContact CB-CB 4.39Å; L122-N144 WeakPolarHBondContact CB-OD1 3.5Å; L122-N144 PolarHBondContact N-OD1 3.44Å; L141-N144 PolarHBondContact O-ND2 2.77Å; Y142-N144 PolarHBondContact O-ND2 2.6Å; N144-I146 HydrophobicContact CB-CD1 4.13Å; N144-I146 HydrophobicContact CB-CG1 4.11Å; N144-Q167 PolarHBondContact N-O 3.34Å; N144-N168 VanDerWaalsContact CA-OD1 3.28Å; N144-N168 WeakPolarHBondContact CA-OD1 3.4Å; N144-N168 WeakPolarHBondContact CB-OD1 3.29Å; N144-N168 PolarHBondContact N-OD1 3.43Å; N144-N168 PolarHBondContact O-OD1 3.26Å
145	H	98.5	Very high	96.7	Very high	80 Å²	80	36.2 Å²	36.2	37%	0.37	20%	0.195	S	C	.	.			trans	-114	25.5	179	-58.3	79.3	0	0	0	112.1	L122 R123 M147 N168	L122-H145 CarbonylContact O-C 3.08Å; L122-H145 WeakPolarHBondContact O-CA 3.42Å; L122-H145 WeakPolarHBondContact O-CB 3.31Å; L122-H145 PolarHBondContact O-N 2.96Å; R123-H145 HydrophobicContact CG-CB 4Å; H145-M147 PolarHBondContact O-N 3.44Å; H145-N168 PolarHBondContact N-OD1 3.03Å
146	I	98.5	Very high	96.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.205	C	C	.	.			trans	-67.5	125	-174.6	-59.9	163.2	0	0	0	109.4	L122 R123 L125 L141 N144 A148 V149 L165 N168 Q169 I170	L122-I146 HydrophobicContact CB-CG1 4.46Å; L122-I146 PolarHBondContact O-N 3.12Å; R123-I146 WeakPolarHBondContact O-CA 3.31Å; L125-I146 HydrophobicContact CD1-CD1 4.23Å; L125-I146 HydrophobicContact CD1-CG2 4.39Å; L125-I146 HydrophobicContact CD2-CD1 3.88Å; L125-I146 HydrophobicContact CD2-CG1 4.37Å; L125-I146 HydrophobicContact CG-CD1 4.13Å; L125-I146 HydrophobicContact CG-CG1 4.45Å; L125-I146 HydrophobicContact CG-CG2 4.23Å; L141-I146 HydrophobicContact CB-CD1 4.06Å; L141-I146 HydrophobicContact CD1-CD1 4.45Å; L141-I146 HydrophobicContact CD2-CD1 4.35Å; N144-I146 HydrophobicContact CB-CD1 4.13Å; N144-I146 HydrophobicContact CB-CG1 4.11Å; I146-A148 VanDerWaalsContact CG2-O 3.23Å; I146-A148 WeakPolarHBondContact CG2-O 3.38Å; I146-V149 HydrophobicContact CG2-CG2 4.08Å; I146-L165 HydrophobicContact CD1-CD2 3.95Å; I146-N168 HydrophobicContact CB-CB 4.24Å; I146-N168 VanDerWaalsContact CB-OD1 3.28Å; I146-N168 WeakPolarHBondContact CB-OD1 3.32Å; I146-N168 WeakPolarHBondContact CG1-OD1 3.36Å; I146-N168 PolarHBondContact N-OD1 3.3Å; I146-Q169 CarbonylContact O-C 3.57Å; I146-Q169 VanDerWaalsContact O-C 3.29Å; I146-Q169 WeakPolarHBondContact O-CA 3.37Å; I146-Q169 PolarHBondContact O-N 2.82Å; I146-I170 HydrophobicContact CG2-CG1 4.32Å; I146-I170 PolarHBondContact O-N 2.84Å
147	M	97.5	Very high	96.2	Very high	115 Å²	115	38.5 Å²	38.5	57%	0.567	21%	0.205	S	C	*	.			trans	-100	-25.3	-177	-55.4	-170.2	-43.7	0	0	113.8	R123 H145 Q169 I170	R123-M147 PolarHBondContact O-N 3.36Å; H145-M147 PolarHBondContact O-N 3.44Å; M147-Q169 HydrophobicContact CG-CB 4.31Å; M147-I170 WeakPolarHBondContact O-CA 3.47Å
148	A	96.4	Very high	95.9	Very high	66 Å²	66	37.8 Å²	37.8	55%	0.545	21%	0.21	S	C	.	.			trans	-148.4	152.6	-178.7	0	0	0	0	0	109.2	I146	I146-A148 VanDerWaalsContact CG2-O 3.23Å; I146-A148 WeakPolarHBondContact CG2-O 3.38Å
149	V	96.3	Very high	95.8	Very high	16 Å²	16	39.9 Å²	39.9	10%	0.097	22%	0.218	C	C	.	.			trans	-128.1	115.9	-178.4	179.5	0	0	0	0	106.9	I146 F154 L165 I170 P174 L177	I146-V149 HydrophobicContact CG2-CG2 4.08Å; V149-F154 HydrophobicContact CG1-CE2 3.48Å; V149-F154 VanDerWaalsContact CG1-CE2 3.48Å; V149-F154 HydrophobicContact CG1-CZ 3.89Å; V149-L165 HydrophobicContact CG1-CD1 4.21Å; V149-L165 HydrophobicContact CG2-CD1 3.99Å; V149-L165 HydrophobicContact CG2-CD2 4.3Å; V149-I170 HydrophobicContact CG2-CD1 3.5Å; V149-I170 HydrophobicContact CG2-CG1 3.98Å; V149-P174 HydrophobicContact CB-CB 4.06Å; V149-P174 HydrophobicContact CB-CG 4.38Å; V149-P174 HydrophobicContact CG1-CB 4.15Å; V149-P174 HydrophobicContact CG1-CG 4.46Å; V149-L177 HydrophobicContact CG1-CD1 3.99Å
150	D	90.9	Very high	95.8	Very high	80 Å²	80	39.9 Å²	39.9	43%	0.428	22%	0.218	S	C	.	.			trans	-97.8	141.6	175.3	-159.6	-42.9	0	0	0	109.7	C152 A153 F154	D150-C152 PolarHBondContact O-N 2.82Å; D150-C152 PolarHBondContact OD1-N 2.77Å; D150-A153 PolarHBondContact O-N 3.03Å; D150-F154 WeakPolarHBondContact O-CD2 3.41Å; D150-F154 WeakPolarHBondContact O-CE2 3.49Å
151	R	92.4	Very high	95.7	Very high	47 Å²	47	42.4 Å²	42.4	18%	0.177	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-62.9	-29.6	174.8	173	58.4	-173.6	68.2	6.2	111.6	A153 F154 D155 E176 A182	R151-A153 PolarHBondContact O-N 3.45Å; R151-F154 PolarHBondContact O-N 3.49Å; R151-D155 IonicContact CZ-OD1 3.51Å; R151-D155 IonicContact NH1-OD1 2.78Å; R151-D155 PolarHBondContact NH1-OD1 3.27Å; R151-D155 IonicContact NH2-OD1 3.34Å; R151-D155 PolarHBondContact NH2-OD1 3.05Å; R151-E176 HydrophobicContact CB-CB 3.77Å; R151-E176 HydrophobicContact CG-CB 4.3Å; R151-A182 PolarHBondContact NE-O 2.91Å
152	C	93.9	Very high	95.7	Very high	44 Å²	44	43.4 Å²	43.4	30%	0.297	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-65.1	-24.1	179.3	-69.6	0	0	0	0	113.5	E127 F128 D150 F154 D155	E127-C152 HydrophobicContact CB-CB 4.25Å; E127-C152 HydrophobicContact CG-CB 4Å; F128-C152 WeakPolarHBondContact CA-O 3.26Å; F128-C152 PolarHBondContact N-O 3.03Å; D150-C152 PolarHBondContact O-N 2.82Å; D150-C152 PolarHBondContact OD1-N 2.77Å; C152-F154 PolarHBondContact O-N 2.96Å; C152-D155 PolarHBondContact O-N 3.24Å
153	A	95.4	Very high	95.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-65.5	-23.8	175.7	0	0	0	0	0	113.2	L125 D126 F130 D150 R151	L125-A153 HydrophobicContact CB-CB 3.83Å; D126-A153 WeakPolarHBondContact O-CA 3.28Å; D126-A153 WeakPolarHBondContact O-CB 3.32Å; F130-A153 WeakPolarHBondContact CD2-O 3.43Å; F130-A153 PolarHBondContact N-O 2.8Å; D150-A153 PolarHBondContact O-N 3.03Å; R151-A153 PolarHBondContact O-N 3.45Å
154	F	94.8	Very high	95.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-112	19.6	-176.2	-46	-85.4	0	0	0	112.5	L125 F130 L139 V149 D150 R151 C152 M157 L160 L163 L177 L184	L125-F154 HydrophobicContact CD1-CE1 4.42Å; L125-F154 HydrophobicContact CD1-CE2 4.33Å; L125-F154 HydrophobicContact CD1-CZ 3.63Å; F130-F154 HydrophobicContact CD2-CD1 4.07Å; F130-F154 HydrophobicContact CD2-CE1 4.06Å; F130-F154 HydrophobicContact CE2-CE1 4.18Å; L139-F154 HydrophobicContact CD2-CD1 4.27Å; L139-F154 HydrophobicContact CD2-CE1 3.93Å; V149-F154 HydrophobicContact CG1-CE2 3.48Å; V149-F154 VanDerWaalsContact CG1-CE2 3.48Å; V149-F154 HydrophobicContact CG1-CZ 3.89Å; D150-F154 WeakPolarHBondContact O-CD2 3.41Å; D150-F154 WeakPolarHBondContact O-CE2 3.49Å; R151-F154 PolarHBondContact O-N 3.49Å; C152-F154 PolarHBondContact O-N 2.96Å; F154-M157 HydrophobicContact CB-CG 4.37Å; F154-M157 HydrophobicContact CB-SD 3.69Å; F154-M157 HydrophobicContact CD1-SD 3.77Å; F154-M157 HydrophobicContact CG-SD 4.22Å; F154-M157 WeakPolarHBondContact O-CB 3.42Å; F154-M157 WeakPolarHBondContact O-CG 3.48Å; F154-M157 PolarHBondContact O-N 2.86Å; F154-L160 HydrophobicContact CD1-CD2 4.42Å; F154-L163 HydrophobicContact CD1-CD2 4.35Å; F154-L163 HydrophobicContact CE1-CD1 3.91Å; F154-L163 HydrophobicContact CE1-CD2 3.8Å; F154-L163 HydrophobicContact CE2-CD2 4.48Å; F154-L163 HydrophobicContact CZ-CD1 4.45Å; F154-L163 HydrophobicContact CZ-CD2 3.86Å; F154-L177 HydrophobicContact CD2-CD2 3.73Å; F154-L177 HydrophobicContact CE2-CD2 4.13Å; F154-L177 HydrophobicContact CG-CD2 4.45Å; F154-L184 HydrophobicContact CB-CD1 4.14Å; F154-L184 HydrophobicContact CB-CD2 4.24Å; F154-L184 WeakPolarHBondContact O-CD2 3.22Å
155	D	91.3	Very high	95.6	Very high	51 Å²	51	38.8 Å²	38.8	27%	0.273	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	146.6	-179.5	-135.2	18.2	0	0	0	111.5	F128 S131 R151 C152 M157	F128-D155 HydrophobicContact CD1-CB 3.89Å; F128-D155 HydrophobicContact CE1-CB 4.01Å; S131-D155 VanDerWaalsContact CA-O 3.29Å; S131-D155 WeakPolarHBondContact CA-O 3.27Å; S131-D155 WeakPolarHBondContact CB-O 3.43Å; S131-D155 PolarHBondContact OG-O 2.94Å; R151-D155 IonicContact CZ-OD1 3.51Å; R151-D155 IonicContact NH1-OD1 2.78Å; R151-D155 PolarHBondContact NH1-OD1 3.27Å; R151-D155 IonicContact NH2-OD1 3.34Å; R151-D155 PolarHBondContact NH2-OD1 3.05Å; C152-D155 PolarHBondContact O-N 3.24Å; D155-M157 PolarHBondContact O-N 3.13Å; D155-M157 VanDerWaalsContact O-N 3.09Å
156	D	90.1	Very high	95.6	Very high	99 Å²	99	35.2 Å²	35.2	53%	0.529	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	5.6	-174.9	-58.3	-40.3	0	0	0	116.9	A158	D156-A158 PolarHBondContact O-N 2.93Å
157	M	94.7	Very high	95.7	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	22%	0.216	C	C	.	.			trans	-76.2	65	174.5	-61.2	-173	81	0	0	112.4	F130 L136 L139 F154 D155 Q159 L160 L184	F130-M157 HydrophobicContact CB-CE 3.96Å; F130-M157 HydrophobicContact CB-CG 4.4Å; F130-M157 HydrophobicContact CB-SD 3.49Å; F130-M157 WeakPolarHBondContact CB-SD 3.46Å; F130-M157 HydrophobicContact CG-SD 4.39Å; L136-M157 HydrophobicContact CB-CE 3.97Å; L136-M157 HydrophobicContact CD2-CE 3.43Å; L136-M157 VanDerWaalsContact CD2-CE 3.43Å; L136-M157 HydrophobicContact CG-CE 4.3Å; L139-M157 HydrophobicContact CD2-CE 4.38Å; F154-M157 HydrophobicContact CB-CG 4.37Å; F154-M157 HydrophobicContact CB-SD 3.69Å; F154-M157 HydrophobicContact CD1-SD 3.77Å; F154-M157 HydrophobicContact CG-SD 4.22Å; F154-M157 WeakPolarHBondContact O-CB 3.42Å; F154-M157 WeakPolarHBondContact O-CG 3.48Å; F154-M157 PolarHBondContact O-N 2.86Å; D155-M157 PolarHBondContact O-N 3.13Å; D155-M157 VanDerWaalsContact O-N 3.09Å; M157-Q159 PolarHBondContact O-N 3.35Å; M157-L160 HydrophobicContact CB-CB 4.09Å; M157-L160 HydrophobicContact CE-CB 4.31Å; M157-L160 HydrophobicContact CE-CD1 3.87Å; M157-L160 HydrophobicContact CE-CD2 3.91Å; M157-L160 HydrophobicContact CE-CG 4.26Å; M157-L160 PolarHBondContact O-N 2.88Å; M157-L160 HydrophobicContact SD-CD2 4.12Å; M157-L184 HydrophobicContact CB-CD2 4.34Å
158	A	92.3	Very high	95.7	Very high	45 Å²	45	34.8 Å²	34.8	37%	0.372	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.3	-173.6	0	0	0	0	0	114.2	D156	D156-A158 PolarHBondContact O-N 2.93Å
159	Q	96.8	Very high	95.8	Very high	60 Å²	60	34.7 Å²	34.7	28%	0.28	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-3.6	-179.1	-58.7	-53.3	-51.4	0	0	114.4	Q134 L136 M157 Q161	Q134-Q159 WeakPolarHBondContact O-CG 3.23Å; L136-Q159 CarbonylContact O-C 3.45Å; M157-Q159 PolarHBondContact O-N 3.35Å; Q159-Q161 WeakPolarHBondContact O-CG 3.43Å; Q159-Q161 PolarHBondContact O-N 2.92Å
160	L	97.5	Very high	95.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.175	C	C	.	.			trans	-66.4	121.9	-173.7	-168.7	69	0	0	0	110.8	L136 L139 F154 M157 L163 L184 K186 L187	L136-L160 HydrophobicContact CD2-CD1 4.18Å; L136-L160 HydrophobicContact CG-CD1 4.44Å; L136-L160 WeakPolarHBondContact O-CA 3.49Å; L136-L160 PolarHBondContact O-N 3.24Å; L139-L160 HydrophobicContact CB-CD1 3.89Å; F154-L160 HydrophobicContact CD1-CD2 4.42Å; M157-L160 HydrophobicContact CB-CB 4.09Å; M157-L160 HydrophobicContact CE-CB 4.31Å; M157-L160 HydrophobicContact CE-CD1 3.87Å; M157-L160 HydrophobicContact CE-CD2 3.91Å; M157-L160 HydrophobicContact CE-CG 4.26Å; M157-L160 PolarHBondContact O-N 2.88Å; M157-L160 HydrophobicContact SD-CD2 4.12Å; L160-L163 HydrophobicContact CD2-CB 4.35Å; L160-L184 HydrophobicContact CD2-CD1 3.87Å; L160-K186 CarbonylContact O-C 3.16Å; L160-L187 HydrophobicContact CD2-CD1 4.41Å; L160-L187 HydrophobicContact CG-CD1 4.4Å; L160-L187 WeakPolarHBondContact O-CA 3.44Å; L160-L187 PolarHBondContact O-N 3.15Å; L160-L187 VanDerWaalsContact O-N 3.1Å
161	Q	97.1	Very high	96.2	Very high	63 Å²	63	33.8 Å²	33.8	29%	0.294	18%	0.181	S	C	.	.			trans	-106.7	-41.1	-178.9	-64.8	174.2	34.5	0	0	111.8	E137 Q159 K186 T188 L189	E137-Q161 WeakPolarHBondContact O-CA 3.28Å; E137-Q161 WeakPolarHBondContact O-CB 3.44Å; E137-Q161 PolarHBondContact O-N 3.37Å; Q159-Q161 WeakPolarHBondContact O-CG 3.43Å; Q159-Q161 PolarHBondContact O-N 2.92Å; Q161-K186 WeakPolarHBondContact CA-O 3.14Å; Q161-K186 HydrophobicContact CG-CB 4.23Å; Q161-T188 PolarHBondContact O-N 3.2Å; Q161-T188 PolarHBondContact O-OG1 2.99Å; Q161-L189 PolarHBondContact O-N 3.27Å
162	K	98.4	Very high	96.4	Very high	21 Å²	21	39.5 Å²	39.5	9%	0.091	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.7	-173.5	-51.3	-174.4	-177.1	-178.9	0	111.3	E137 V138 L139 Y164 L189 E480	E137-K162 PolarHBondContact O-N 2.97Å; V138-K162 HydrophobicContact CG1-CB 4.29Å; V138-K162 HydrophobicContact CG2-CB 4.24Å; V138-K162 HydrophobicContact CG2-CD 4.2Å; V138-K162 HydrophobicContact CG2-CG 4.34Å; L139-K162 PolarHBondContact N-O 3.35Å; K162-Y164 HydrophobicContact CB-CD2 4.44Å; K162-Y164 HydrophobicContact CB-CE2 3.8Å; K162-Y164 HydrophobicContact CD-CE2 4.39Å; K162-L189 HydrophobicContact CB-CB 4.17Å; K162-L189 HydrophobicContact CB-CD2 4.44Å; K162-L189 HydrophobicContact CG-CB 4Å; K162-E480 IonicContact NZ-OE1 2.81Å; K162-E480 PolarHBondContact NZ-OE1 2.77Å; K162-E480 IonicContact NZ-OE2 3.53Å; K162-E480 PolarHBondContact NZ-OE2 3.09Å
163	L	98.4	Very high	96.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	113.6	176.4	179.1	57.2	0	0	0	109.9	L139 L141 F154 L160 L165 L177 L187 L189 L190 D191	L139-L163 HydrophobicContact CB-CD1 4.05Å; L139-L163 HydrophobicContact CD2-CD1 3.86Å; L139-L163 HydrophobicContact CG-CD1 3.93Å; L141-L163 HydrophobicContact CD1-CD1 4.24Å; F154-L163 HydrophobicContact CD1-CD2 4.35Å; F154-L163 HydrophobicContact CE1-CD1 3.91Å; F154-L163 HydrophobicContact CE1-CD2 3.8Å; F154-L163 HydrophobicContact CE2-CD2 4.48Å; F154-L163 HydrophobicContact CZ-CD1 4.45Å; F154-L163 HydrophobicContact CZ-CD2 3.86Å; L160-L163 HydrophobicContact CD2-CB 4.35Å; L163-L165 HydrophobicContact CD1-CD1 4.35Å; L163-L165 HydrophobicContact CD1-CG 4.22Å; L163-L165 HydrophobicContact CD2-CD1 3.79Å; L163-L165 HydrophobicContact CG-CD1 3.85Å; L163-L165 HydrophobicContact CG-CG 4.09Å; L163-L177 HydrophobicContact CD2-CD1 4.02Å; L163-L187 HydrophobicContact CB-CD1 3.85Å; L163-L189 PolarHBondContact N-O 2.83Å; L163-L190 HydrophobicContact CB-CD1 4.22Å; L163-L190 HydrophobicContact CD2-CD1 3.98Å; L163-L190 HydrophobicContact CG-CD1 4.09Å; L163-L190 WeakPolarHBondContact O-CA 3.33Å; L163-D191 PolarHBondContact O-N 3.19Å
164	Y	98.8	Very high	96.6	Very high	26 Å²	26	38 Å²	38	10%	0.102	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115	178.7	-64.1	-94.3	0	0	0	110.7	V138 L139 L140 L141 Y142 K162 L189 D191	V138-Y164 HydrophobicContact CG1-CE2 4.38Å; L139-Y164 PolarHBondContact O-N 2.94Å; L140-Y164 HydrophobicContact CD1-CD2 3.9Å; L140-Y164 HydrophobicContact CD1-CE2 4.33Å; L140-Y164 HydrophobicContact CG-CD2 4.18Å; L141-Y164 CarbonylContact C-O 3.5Å; L141-Y164 VanDerWaalsContact CA-O 3.31Å; L141-Y164 WeakPolarHBondContact CA-O 2.93Å; L141-Y164 WeakPolarHBondContact CB-O 3.2Å; L141-Y164 PolarHBondContact N-O 3.4Å; Y142-Y164 PolarHBondContact N-O 3.28Å; Y142-Y164 VanDerWaalsContact N-O 3.15Å; K162-Y164 HydrophobicContact CB-CD2 4.44Å; K162-Y164 HydrophobicContact CB-CE2 3.8Å; K162-Y164 HydrophobicContact CD-CE2 4.39Å; Y164-L189 HydrophobicContact CD1-CD2 4.01Å; Y164-L189 HydrophobicContact CD2-CD2 4.4Å; Y164-L189 HydrophobicContact CE1-CD1 4.32Å; Y164-L189 HydrophobicContact CE1-CD2 3.6Å; Y164-L189 HydrophobicContact CE2-CD2 4.05Å; Y164-L189 HydrophobicContact CG-CD2 4.39Å; Y164-D191 HydrophobicContact CD1-CB 3.79Å; Y164-D191 HydrophobicContact CE1-CB 4.44Å; Y164-D191 HydrophobicContact CG-CB 4.49Å
165	L	98.7	Very high	96.5	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.			trans	-124.4	15.2	-178.2	-76.6	162.7	0	0	0	112	L125 L141 I146 V149 L163 N168 I170 L190 D191 L192 N195	L125-L165 HydrophobicContact CD1-CD2 4.44Å; L141-L165 HydrophobicContact CB-CD2 3.82Å; L141-L165 HydrophobicContact CD1-CD2 4Å; I146-L165 HydrophobicContact CD1-CD2 3.95Å; V149-L165 HydrophobicContact CG1-CD1 4.21Å; V149-L165 HydrophobicContact CG2-CD1 3.99Å; V149-L165 HydrophobicContact CG2-CD2 4.3Å; L163-L165 HydrophobicContact CD1-CD1 4.35Å; L163-L165 HydrophobicContact CD1-CG 4.22Å; L163-L165 HydrophobicContact CD2-CD1 3.79Å; L163-L165 HydrophobicContact CG-CD1 3.85Å; L163-L165 HydrophobicContact CG-CG 4.09Å; L165-N168 WeakPolarHBondContact O-CB 3.3Å; L165-N168 PolarHBondContact O-ND2 2.97Å; L165-I170 HydrophobicContact CB-CD1 3.97Å; L165-I170 HydrophobicContact CD1-CD1 4.4Å; L165-I170 HydrophobicContact CD2-CD1 4.29Å; L165-I170 HydrophobicContact CG-CD1 4.47Å; L165-L190 HydrophobicContact CD1-CD1 4.1Å; L165-D191 CarbonylContact C-O 3.56Å; L165-D191 VanDerWaalsContact C-O 3.3Å; L165-D191 VanDerWaalsContact CA-O 3.28Å; L165-D191 WeakPolarHBondContact CA-O 3.31Å; L165-D191 WeakPolarHBondContact CB-O 3.17Å; L165-D191 PolarHBondContact N-O 3.21Å; L165-L192 HydrophobicContact CB-CD2 4.04Å; L165-L192 HydrophobicContact CD1-CD2 4.15Å; L165-N195 PolarHBondContact O-ND2 2.69Å
166	S	98.6	Very high	96.6	Very high	4 Å²	4	39.8 Å²	39.8	3%	0.028	20%	0.198	C	C	.	.			trans	-64.2	158.4	-179.3	50.1	0	0	0	0	113.4	Y142 N143 N168 D191 S193	Y142-S166 CarbonylContact C-O 3.52Å; Y142-S166 WeakPolarHBondContact CA-O 3.26Å; Y142-S166 VanDerWaalsContact CB-O 3.27Å; Y142-S166 WeakPolarHBondContact CB-O 3.37Å; Y142-S166 WeakPolarHBondContact CB-OG 3.34Å; N143-S166 PolarHBondContact N-O 2.86Å; S166-N168 VanDerWaalsContact C-N 3.3Å; S166-N168 PolarHBondContact O-N 2.96Å; S166-N168 PolarHBondContact O-ND2 3.4Å; S166-D191 WeakPolarHBondContact CB-OD2 3.34Å; S166-D191 PolarHBondContact N-O 3.03Å; S166-D191 PolarHBondContact OG-OD2 3.21Å; S166-S193 CarbonylContact C-O 3.55Å; S166-S193 WeakPolarHBondContact CA-O 3.49Å; S166-S193 WeakPolarHBondContact CB-O 3.43Å; S166-S193 WeakPolarHBondContact CB-OG 3.4Å
167	Q	98.7	Very high	96.7	Very high	96 Å²	96	35.1 Å²	35.1	45%	0.449	17%	0.174	S	C	.	.	S	Bend	trans	56.6	44.9	179.8	-56.7	176	58.2	0	0	112.2	N143 N144 S193 S194	N143-Q167 VanDerWaalsContact CA-O 3.26Å; N143-Q167 WeakPolarHBondContact CA-O 3.15Å; N143-Q167 HydrophobicContact CB-CB 4.23Å; N143-Q167 PolarHBondContact N-O 3.32Å; N144-Q167 PolarHBondContact N-O 3.34Å; Q167-S193 PolarHBondContact N-O 2.99Å; Q167-S193 VanDerWaalsContact N-O 3.11Å; Q167-S194 WeakPolarHBondContact CA-O 3.4Å; Q167-S194 PolarHBondContact N-O 2.98Å
168	N	98.8	Very high	96.6	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.053	17%	0.174	C	C	.	.	S	Bend	trans	-116	-165.9	171.6	-85.1	-75.5	0	0	0	109.5	L141 N144 H145 I146 L165 S166 I170 N195	L141-N168 PolarHBondContact O-ND2 2.83Å; N144-N168 VanDerWaalsContact CA-OD1 3.28Å; N144-N168 WeakPolarHBondContact CA-OD1 3.4Å; N144-N168 WeakPolarHBondContact CB-OD1 3.29Å; N144-N168 PolarHBondContact N-OD1 3.43Å; N144-N168 PolarHBondContact O-OD1 3.26Å; H145-N168 PolarHBondContact N-OD1 3.03Å; I146-N168 HydrophobicContact CB-CB 4.24Å; I146-N168 VanDerWaalsContact CB-OD1 3.28Å; I146-N168 WeakPolarHBondContact CB-OD1 3.32Å; I146-N168 WeakPolarHBondContact CG1-OD1 3.36Å; I146-N168 PolarHBondContact N-OD1 3.3Å; L165-N168 WeakPolarHBondContact O-CB 3.3Å; L165-N168 PolarHBondContact O-ND2 2.97Å; S166-N168 VanDerWaalsContact C-N 3.3Å; S166-N168 PolarHBondContact O-N 2.96Å; S166-N168 PolarHBondContact O-ND2 3.4Å; N168-I170 HydrophobicContact CB-CD1 4.13Å; N168-I170 HydrophobicContact CB-CG1 4.08Å; N168-N195 VanDerWaalsContact CA-OD1 3.3Å; N168-N195 WeakPolarHBondContact CA-OD1 3.34Å; N168-N195 WeakPolarHBondContact CB-OD1 3.42Å; N168-N195 PolarHBondContact N-OD1 3.23Å; N168-N195 PolarHBondContact O-OD1 3.37Å
169	Q	98.4	Very high	96.3	Very high	64 Å²	64	37.7 Å²	37.7	30%	0.299	18%	0.176	S	C	.	.			trans	-114.7	25.2	-179.2	-56	-169.3	43.8	0	0	112.3	I146 M147 S171 N195 K196	I146-Q169 CarbonylContact O-C 3.57Å; I146-Q169 VanDerWaalsContact O-C 3.29Å; I146-Q169 WeakPolarHBondContact O-CA 3.37Å; I146-Q169 PolarHBondContact O-N 2.82Å; M147-Q169 HydrophobicContact CG-CB 4.31Å; Q169-S171 PolarHBondContact O-N 2.84Å; Q169-N195 PolarHBondContact N-OD1 2.86Å; Q169-K196 HydrophobicContact CB-CD 4.13Å
170	I	98.4	Very high	95.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.192	C	C	.	.			trans	-68.5	120.9	-173.3	-57.9	164.5	0	0	0	109.7	I146 M147 V149 L165 N168 R172 L192 N195 K196 L197	I146-I170 HydrophobicContact CG2-CG1 4.32Å; I146-I170 PolarHBondContact O-N 2.84Å; M147-I170 WeakPolarHBondContact O-CA 3.47Å; V149-I170 HydrophobicContact CG2-CD1 3.5Å; V149-I170 HydrophobicContact CG2-CG1 3.98Å; L165-I170 HydrophobicContact CB-CD1 3.97Å; L165-I170 HydrophobicContact CD1-CD1 4.4Å; L165-I170 HydrophobicContact CD2-CD1 4.29Å; L165-I170 HydrophobicContact CG-CD1 4.47Å; N168-I170 HydrophobicContact CB-CD1 4.13Å; N168-I170 HydrophobicContact CB-CG1 4.08Å; I170-R172 WeakPolarHBondContact CG2-O 3.34Å; I170-L192 HydrophobicContact CD1-CD2 3.79Å; I170-N195 HydrophobicContact CB-CB 4.3Å; I170-N195 VanDerWaalsContact CB-OD1 3.29Å; I170-N195 WeakPolarHBondContact CB-OD1 3.4Å; I170-N195 WeakPolarHBondContact CG1-OD1 3.02Å; I170-N195 PolarHBondContact N-OD1 2.77Å; I170-K196 CarbonylContact O-C 3.43Å; I170-K196 VanDerWaalsContact O-CA 3.3Å; I170-K196 WeakPolarHBondContact O-CA 3.06Å; I170-K196 PolarHBondContact O-N 2.95Å; I170-L197 HydrophobicContact CG2-CD2 4.14Å; I170-L197 PolarHBondContact O-N 2.03Å
171	S	97.4	Very high	94.4	Very high	77 Å²	77	45.3 Å²	45.3	54%	0.538	24%	0.236	S	C	.	.			trans	-104.5	-19.1	-178.8	59.7	0	0	0	0	114.8	Q169 K196	Q169-S171 PolarHBondContact O-N 2.84Å; S171-K196 WeakPolarHBondContact CA-O 3.45Å
172	R	97.1	Very high	93.3	Very high	168 Å²	168	44.3 Å²	44.3	63%	0.634	24%	0.239	S	C	*	.	S	Bend	trans	-112.4	133.1	177.4	174.9	-177.6	163.7	112.5	-2.7	109.3	I170 E176	I170-R172 WeakPolarHBondContact CG2-O 3.34Å; R172-E176 IonicContact NH2-OE1 2.69Å; R172-E176 PolarHBondContact NH2-OE1 3.27Å
173	F	96.8	Very high	92.5	Very high	9 Å²	9	46.6 Å²	46.6	4%	0.039	25%	0.248	C	C	.	.			trans	-67.1	124.9	172.8	-177.2	-95.1	0	0	0	110.5	L175 V178 L192 L197 L200 P201 L205 L216 L218	F173-L175 VanDerWaalsContact C-N 3.28Å; F173-L175 HydrophobicContact CD1-CB 4Å; F173-L175 HydrophobicContact CE1-CB 4.22Å; F173-L175 HydrophobicContact CE1-CD1 4.11Å; F173-L175 PolarHBondContact O-N 2.91Å; F173-V178 HydrophobicContact CE1-CG2 3.98Å; F173-V178 HydrophobicContact CZ-CG2 4.09Å; F173-L192 HydrophobicContact CD2-CD1 3.83Å; F173-L192 HydrophobicContact CE2-CD1 3.7Å; F173-L197 HydrophobicContact CB-CD2 4.43Å; F173-L197 HydrophobicContact CD2-CD1 4.45Å; F173-L200 HydrophobicContact CB-CD2 4.22Å; F173-L200 HydrophobicContact CD2-CD2 3.94Å; F173-L200 HydrophobicContact CG-CD2 4.3Å; F173-P201 HydrophobicContact CD1-CG 3.63Å; F173-P201 HydrophobicContact CE1-CG 4.19Å; F173-P201 HydrophobicContact CG-CG 4.33Å; F173-L205 HydrophobicContact CE1-CD2 3.77Å; F173-L205 HydrophobicContact CE2-CD2 4.31Å; F173-L205 HydrophobicContact CZ-CD2 3.59Å; F173-L216 HydrophobicContact CE2-CD1 4.03Å; F173-L216 HydrophobicContact CE2-CD2 4.18Å; F173-L216 HydrophobicContact CZ-CD1 4.24Å; F173-L216 HydrophobicContact CZ-CD2 3.97Å; F173-L218 HydrophobicContact CD2-CD2 4.16Å; F173-L218 HydrophobicContact CE2-CD2 3.97Å
174	P	95.3	Very high	91.9	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.026	25%	0.249	C	C	.	.			trans	-80.7	73.4	-179.6	34	-35.6	0	0	0	111	V149 E176 L177 L192	V149-P174 HydrophobicContact CB-CB 4.06Å; V149-P174 HydrophobicContact CB-CG 4.38Å; V149-P174 HydrophobicContact CG1-CB 4.15Å; V149-P174 HydrophobicContact CG1-CG 4.46Å; P174-E176 PolarHBondContact O-N 2.81Å; P174-E176 VanDerWaalsContact O-N 3.15Å; P174-L177 HydrophobicContact CB-CD1 3.88Å; P174-L177 HydrophobicContact CB-CG 4.09Å; P174-L177 HydrophobicContact CG-CD1 3.82Å; P174-L177 HydrophobicContact CG-CG 4.46Å; P174-L177 PolarHBondContact O-N 3.14Å; P174-L177 VanDerWaalsContact O-N 3.14Å; P174-L192 HydrophobicContact CG-CD1 4.02Å; P174-L192 HydrophobicContact CG-CD2 4.33Å
175	L	93.8	Very high	91.4	Very high	19 Å²	19	48.9 Å²	48.9	10%	0.099	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-56	-32.6	-176.4	179	60.4	0	0	0	112.8	F173 L177 V178 K179 P201 D204	F173-L175 VanDerWaalsContact C-N 3.28Å; F173-L175 HydrophobicContact CD1-CB 4Å; F173-L175 HydrophobicContact CE1-CB 4.22Å; F173-L175 HydrophobicContact CE1-CD1 4.11Å; F173-L175 PolarHBondContact O-N 2.91Å; L175-L177 PolarHBondContact O-N 3.11Å; L175-V178 HydrophobicContact CD1-CG2 4.27Å; L175-V178 WeakPolarHBondContact O-CG2 3.23Å; L175-V178 PolarHBondContact O-N 3.12Å; L175-V178 VanDerWaalsContact O-N 3.1Å; L175-K179 HydrophobicContact CD1-CB 4.14Å; L175-K179 HydrophobicContact CD2-CD 3.99Å; L175-K179 HydrophobicContact CG-CB 4.07Å; L175-K179 HydrophobicContact CG-CD 4.03Å; L175-K179 VanDerWaalsContact O-CB 3.26Å; L175-K179 WeakPolarHBondContact O-CB 3.22Å; L175-K179 PolarHBondContact O-N 3.28Å; L175-P201 HydrophobicContact CB-CG 4.45Å; L175-P201 HydrophobicContact CD1-CG 4.08Å; L175-P201 HydrophobicContact CD2-CB 4.32Å; L175-P201 HydrophobicContact CD2-CG 4.34Å; L175-D204 HydrophobicContact CD1-CB 3.7Å; L175-D204 HydrophobicContact CD2-CB 4.08Å; L175-D204 WeakPolarHBondContact CD2-OD2 3.32Å
176	E	92.1	Very high	91.2	Very high	69 Å²	69	53.1 Å²	53.1	32%	0.322	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-63	-20.3	-177.4	-59	78.4	-170.3	0	0	112.6	R151 R172 P174 A182	R151-E176 HydrophobicContact CB-CB 3.77Å; R151-E176 HydrophobicContact CG-CB 4.3Å; R172-E176 IonicContact NH2-OE1 2.69Å; R172-E176 PolarHBondContact NH2-OE1 3.27Å; P174-E176 PolarHBondContact O-N 2.81Å; P174-E176 VanDerWaalsContact O-N 3.15Å; E176-A182 CarbonylContact O-C 3.21Å
177	L	93.1	Very high	91	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-75	-27.3	175.2	-63.3	-179.7	0	0	0	113.6	V149 F154 L163 P174 L175 K183 L184 L187 L190	V149-L177 HydrophobicContact CG1-CD1 3.99Å; F154-L177 HydrophobicContact CD2-CD2 3.73Å; F154-L177 HydrophobicContact CE2-CD2 4.13Å; F154-L177 HydrophobicContact CG-CD2 4.45Å; L163-L177 HydrophobicContact CD2-CD1 4.02Å; P174-L177 HydrophobicContact CB-CD1 3.88Å; P174-L177 HydrophobicContact CB-CG 4.09Å; P174-L177 HydrophobicContact CG-CD1 3.82Å; P174-L177 HydrophobicContact CG-CG 4.46Å; P174-L177 PolarHBondContact O-N 3.14Å; P174-L177 VanDerWaalsContact O-N 3.14Å; L175-L177 PolarHBondContact O-N 3.11Å; L177-K183 WeakPolarHBondContact O-CA 3.46Å; L177-L184 HydrophobicContact CD2-CD1 4.27Å; L177-L184 PolarHBondContact O-N 3.29Å; L177-L187 HydrophobicContact CB-CD2 4.41Å; L177-L190 HydrophobicContact CB-CD2 4.49Å; L177-L190 HydrophobicContact CD1-CD1 4.28Å; L177-L190 HydrophobicContact CD1-CD2 4.3Å
178	V	91.4	Very high	90.8	Very high	5 Å²	5	51 Å²	51	3%	0.03	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-19.7	-171.1	-64.4	0	0	0	0	114	F173 L175 L190 L208 I212	F173-V178 HydrophobicContact CE1-CG2 3.98Å; F173-V178 HydrophobicContact CZ-CG2 4.09Å; L175-V178 HydrophobicContact CD1-CG2 4.27Å; L175-V178 WeakPolarHBondContact O-CG2 3.23Å; L175-V178 PolarHBondContact O-N 3.12Å; L175-V178 VanDerWaalsContact O-N 3.1Å; V178-L190 HydrophobicContact CG1-CD2 3.96Å; V178-L208 HydrophobicContact CB-CD1 4.2Å; V178-L208 HydrophobicContact CB-CD2 4.2Å; V178-L208 HydrophobicContact CG2-CD1 3.86Å; V178-L208 HydrophobicContact CG2-CD2 4.22Å; V178-L208 WeakPolarHBondContact O-CD2 3.4Å; V178-I212 HydrophobicContact CB-CG2 4.18Å; V178-I212 HydrophobicContact CG1-CG2 4Å
179	K	87.3	Confident	90.7	Very high	95 Å²	95	51.1 Å²	51.1	41%	0.413	28%	0.279	S	S	.	.	S	Bend	trans	-70.6	137	-177	-174.4	172.2	-178.4	164.2	0	112.2	L175 G181 A182 K183 D204	L175-K179 HydrophobicContact CD1-CB 4.14Å; L175-K179 HydrophobicContact CD2-CD 3.99Å; L175-K179 HydrophobicContact CG-CB 4.07Å; L175-K179 HydrophobicContact CG-CD 4.03Å; L175-K179 VanDerWaalsContact O-CB 3.26Å; L175-K179 WeakPolarHBondContact O-CB 3.22Å; L175-K179 PolarHBondContact O-N 3.28Å; K179-G181 PolarHBondContact O-N 2.95Å; K179-A182 PolarHBondContact O-N 3.08Å; K179-K183 WeakPolarHBondContact O-CB 3.07Å; K179-K183 PolarHBondContact O-N 3.08Å; K179-D204 IonicContact NZ-OD1 2.99Å
180	E	76.6	Confident	90.7	Very high	132 Å²	132	48.3 Å²	48.3	62%	0.617	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	138	174.6	-68.8	-170.7	161.5	0	0	111.5
181	G	76.9	Confident	90.7	Very high	89 Å²	89	48.4 Å²	48.4	92%	0.918	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.9	-31	-176.2	0	0	0	0	0	114.8	K179	K179-G181 PolarHBondContact O-N 2.95Å
182	A	75.2	Confident	90.8	Very high	42 Å²	42	44.7 Å²	44.7	35%	0.347	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-8.7	179.4	0	0	0	0	0	114.2	R151 E176 K179	R151-A182 PolarHBondContact NE-O 2.91Å; E176-A182 CarbonylContact O-C 3.21Å; K179-A182 PolarHBondContact O-N 3.08Å
183	K	79.8	Confident	90.8	Very high	68 Å²	68	36.9 Å²	36.9	30%	0.296	21%	0.212	S	C	.	.	S	Bend	trans	-56.8	150.8	-175.4	71.2	177.3	-174.4	-179.7	0	113.4	L177 K179	L177-K183 WeakPolarHBondContact O-CA 3.46Å; K179-K183 WeakPolarHBondContact O-CB 3.07Å; K179-K183 PolarHBondContact O-N 3.08Å
184	L	86.9	Confident	90.9	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.016	22%	0.22	C	C	.	.			trans	-67.3	125.2	161.5	-68.5	175	0	0	0	108.6	F154 M157 L160 L177 K186 L187	F154-L184 HydrophobicContact CB-CD1 4.14Å; F154-L184 HydrophobicContact CB-CD2 4.24Å; F154-L184 WeakPolarHBondContact O-CD2 3.22Å; M157-L184 HydrophobicContact CB-CD2 4.34Å; L160-L184 HydrophobicContact CD2-CD1 3.87Å; L177-L184 HydrophobicContact CD2-CD1 4.27Å; L177-L184 PolarHBondContact O-N 3.29Å; L184-K186 VanDerWaalsContact C-N 3.3Å; L184-K186 PolarHBondContact O-N 2.94Å; L184-L187 HydrophobicContact CB-CB 3.7Å; L184-L187 HydrophobicContact CB-CD2 4.48Å; L184-L187 HydrophobicContact CD1-CD1 4.41Å; L184-L187 HydrophobicContact CD1-CD2 4.29Å; L184-L187 PolarHBondContact O-N 3.02Å
185	P	88.1	Confident	91.1	Very high	72 Å²	72	38.2 Å²	38.2	47%	0.468	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-30.2	-163.4	24.4	-34.5	0	0	0	113.6
186	K	93.6	Very high	91.3	Very high	89 Å²	89	42 Å²	42	39%	0.387	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	2.1	-177.3	-68.2	-162.3	177.5	-173.4	0	114.5	L160 Q161 L184 T188	L160-K186 CarbonylContact O-C 3.16Å; Q161-K186 WeakPolarHBondContact CA-O 3.14Å; Q161-K186 HydrophobicContact CG-CB 4.23Å; L184-K186 VanDerWaalsContact C-N 3.3Å; L184-K186 PolarHBondContact O-N 2.94Å; K186-T188 PolarHBondContact O-N 3.18Å
187	L	95.1	Very high	91.5	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.037	22%	0.222	C	C	.	.			trans	-68.3	108.6	-175.4	-174	78.2	0	0	0	110.3	L160 L163 L177 L184 L189 L190 W211	L160-L187 HydrophobicContact CD2-CD1 4.41Å; L160-L187 HydrophobicContact CG-CD1 4.4Å; L160-L187 WeakPolarHBondContact O-CA 3.44Å; L160-L187 PolarHBondContact O-N 3.15Å; L160-L187 VanDerWaalsContact O-N 3.1Å; L163-L187 HydrophobicContact CB-CD1 3.85Å; L177-L187 HydrophobicContact CB-CD2 4.41Å; L184-L187 HydrophobicContact CB-CB 3.7Å; L184-L187 HydrophobicContact CB-CD2 4.48Å; L184-L187 HydrophobicContact CD1-CD1 4.41Å; L184-L187 HydrophobicContact CD1-CD2 4.29Å; L184-L187 PolarHBondContact O-N 3.02Å; L187-L189 WeakPolarHBondContact CD1-O 3.43Å; L187-L190 HydrophobicContact CD2-CB 4.36Å; L187-W211 VanDerWaalsContact O-CZ3 3.25Å; L187-W211 WeakPolarHBondContact O-CZ3 3.41Å
188	T	94.2	Very high	91.7	Very high	48 Å²	48	44.6 Å²	44.6	29%	0.294	25%	0.247	S	C	.	.			trans	-104	-23.1	179.4	53.2	0	0	0	0	112.6	Q161 K186 W211 G215	Q161-T188 PolarHBondContact O-N 3.2Å; Q161-T188 PolarHBondContact O-OG1 2.99Å; K186-T188 PolarHBondContact O-N 3.18Å; T188-W211 HydrophobicContact CG2-CE3 4.05Å; T188-W211 HydrophobicContact CG2-CZ3 3.95Å; T188-G215 WeakPolarHBondContact O-CA 3.25Å
189	L	97.9	Very high	91.9	Very high	12 Å²	12	49.7 Å²	49.7	6%	0.063	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124	-179.8	-171.6	154.6	0	0	0	111	Q161 K162 L163 Y164 L187 D191 G215 Y217 P479	Q161-L189 PolarHBondContact O-N 3.27Å; K162-L189 HydrophobicContact CB-CB 4.17Å; K162-L189 HydrophobicContact CB-CD2 4.44Å; K162-L189 HydrophobicContact CG-CB 4Å; L163-L189 PolarHBondContact N-O 2.83Å; Y164-L189 HydrophobicContact CD1-CD2 4.01Å; Y164-L189 HydrophobicContact CD2-CD2 4.4Å; Y164-L189 HydrophobicContact CE1-CD1 4.32Å; Y164-L189 HydrophobicContact CE1-CD2 3.6Å; Y164-L189 HydrophobicContact CE2-CD2 4.05Å; Y164-L189 HydrophobicContact CG-CD2 4.39Å; L187-L189 WeakPolarHBondContact CD1-O 3.43Å; L189-D191 HydrophobicContact CD2-CB 4.14Å; L189-G215 WeakPolarHBondContact CA-O 3.09Å; L189-Y217 HydrophobicContact CD1-CE2 3.84Å; L189-Y217 HydrophobicContact CD2-CE2 4.41Å; L189-Y217 HydrophobicContact CG-CD2 4.32Å; L189-Y217 HydrophobicContact CG-CE2 3.84Å; L189-P479 HydrophobicContact CD1-CG 4.36Å
190	L	98	Very high	92.3	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.026	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	104.8	171.8	176.5	58.5	0	0	0	108.8	L163 L165 L177 V178 L187 L192 G215 L216 Y217	L163-L190 HydrophobicContact CB-CD1 4.22Å; L163-L190 HydrophobicContact CD2-CD1 3.98Å; L163-L190 HydrophobicContact CG-CD1 4.09Å; L163-L190 WeakPolarHBondContact O-CA 3.33Å; L165-L190 HydrophobicContact CD1-CD1 4.1Å; L177-L190 HydrophobicContact CB-CD2 4.49Å; L177-L190 HydrophobicContact CD1-CD1 4.28Å; L177-L190 HydrophobicContact CD1-CD2 4.3Å; V178-L190 HydrophobicContact CG1-CD2 3.96Å; L187-L190 HydrophobicContact CD2-CB 4.36Å; L190-L192 HydrophobicContact CD1-CD1 4.49Å; L190-L192 HydrophobicContact CD1-CG 4.19Å; L190-L192 HydrophobicContact CD2-CD1 3.91Å; L190-L192 HydrophobicContact CD2-CG 4.46Å; L190-L192 HydrophobicContact CG-CD1 4.02Å; L190-L192 HydrophobicContact CG-CG 4.05Å; L190-G215 CarbonylContact C-O 3.39Å; L190-G215 PolarHBondContact N-O 2.63Å; L190-L216 HydrophobicContact CB-CD1 4.04Å; L190-L216 HydrophobicContact CD2-CD1 3.93Å; L190-L216 HydrophobicContact CG-CD1 4.03Å; L190-Y217 PolarHBondContact O-N 2.99Å
191	D	98.7	Very high	93.2	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.011	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	108.1	177.1	176.2	19.8	0	0	0	110.9	L163 Y164 L165 S166 L189 S193 Y217	L163-D191 PolarHBondContact O-N 3.19Å; Y164-D191 HydrophobicContact CD1-CB 3.79Å; Y164-D191 HydrophobicContact CE1-CB 4.44Å; Y164-D191 HydrophobicContact CG-CB 4.49Å; L165-D191 CarbonylContact C-O 3.56Å; L165-D191 VanDerWaalsContact C-O 3.3Å; L165-D191 VanDerWaalsContact CA-O 3.28Å; L165-D191 WeakPolarHBondContact CA-O 3.31Å; L165-D191 WeakPolarHBondContact CB-O 3.17Å; L165-D191 PolarHBondContact N-O 3.21Å; S166-D191 WeakPolarHBondContact CB-OD2 3.34Å; S166-D191 PolarHBondContact N-O 3.03Å; S166-D191 PolarHBondContact OG-OD2 3.21Å; L189-D191 HydrophobicContact CD2-CB 4.14Å; D191-S193 WeakPolarHBondContact OD1-CB 3.18Å; D191-S193 PolarHBondContact OD1-N 3.27Å; D191-S193 PolarHBondContact OD1-OG 3.21Å; D191-Y217 HydrophobicContact CB-CD2 4.16Å
192	L	98.6	Very high	94.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.201	C	C	.	.			trans	-112.2	17.3	175.3	-72.4	165.9	0	0	0	111.4	L165 I170 F173 P174 L190 N195 L197 Y217 L218 N221	L165-L192 HydrophobicContact CB-CD2 4.04Å; L165-L192 HydrophobicContact CD1-CD2 4.15Å; I170-L192 HydrophobicContact CD1-CD2 3.79Å; F173-L192 HydrophobicContact CD2-CD1 3.83Å; F173-L192 HydrophobicContact CE2-CD1 3.7Å; P174-L192 HydrophobicContact CG-CD1 4.02Å; P174-L192 HydrophobicContact CG-CD2 4.33Å; L190-L192 HydrophobicContact CD1-CD1 4.49Å; L190-L192 HydrophobicContact CD1-CG 4.19Å; L190-L192 HydrophobicContact CD2-CD1 3.91Å; L190-L192 HydrophobicContact CD2-CG 4.46Å; L190-L192 HydrophobicContact CG-CD1 4.02Å; L190-L192 HydrophobicContact CG-CG 4.05Å; L192-N195 WeakPolarHBondContact O-CB 3.28Å; L192-N195 PolarHBondContact O-ND2 2.71Å; L192-N195 VanDerWaalsContact O-ND2 3.08Å; L192-L197 HydrophobicContact CB-CD1 4.1Å; L192-L197 HydrophobicContact CD1-CD1 4.48Å; L192-Y217 CarbonylContact C-O 3.34Å; L192-Y217 WeakPolarHBondContact CA-O 3.47Å; L192-Y217 PolarHBondContact N-O 2.95Å; L192-L218 HydrophobicContact CB-CD2 4.19Å; L192-L218 HydrophobicContact CD1-CD2 4.36Å; L192-N221 PolarHBondContact O-ND2 2.8Å
193	S	98.5	Very high	95	Very high	4 Å²	4	40 Å²	40	3%	0.028	21%	0.21	C	C	.	.			trans	-63	157.8	-179.2	68.2	0	0	0	0	112.2	S166 Q167 D191 N195 Y217 H219	S166-S193 CarbonylContact C-O 3.55Å; S166-S193 WeakPolarHBondContact CA-O 3.49Å; S166-S193 WeakPolarHBondContact CB-O 3.43Å; S166-S193 WeakPolarHBondContact CB-OG 3.4Å; Q167-S193 PolarHBondContact N-O 2.99Å; Q167-S193 VanDerWaalsContact N-O 3.11Å; D191-S193 WeakPolarHBondContact OD1-CB 3.18Å; D191-S193 PolarHBondContact OD1-N 3.27Å; D191-S193 PolarHBondContact OD1-OG 3.21Å; S193-N195 VanDerWaalsContact C-N 3.32Å; S193-N195 PolarHBondContact O-N 3.06Å; S193-N195 PolarHBondContact O-ND2 3.19Å; S193-N195 VanDerWaalsContact O-ND2 3.12Å; S193-Y217 PolarHBondContact N-O 2.78Å; S193-H219 CarbonylContact C-O 3.51Å; S193-H219 WeakPolarHBondContact CA-O 3.13Å; S193-H219 WeakPolarHBondContact CB-CE1 3.5Å; S193-H219 WeakPolarHBondContact CB-NE2 3.05Å; S193-H219 VanDerWaalsContact CB-O 3.31Å; S193-H219 WeakPolarHBondContact CB-O 3.35Å
194	S	98.4	Very high	95.7	Very high	30 Å²	30	38.9 Å²	38.9	21%	0.21	21%	0.208	C	C	.	.	S	Bend	trans	57.2	42.7	175.4	-47.2	0	0	0	0	113.4	Q167 H219 N220	Q167-S194 WeakPolarHBondContact CA-O 3.4Å; Q167-S194 PolarHBondContact N-O 2.98Å; S194-H219 PolarHBondContact N-O 3.02Å; S194-H219 VanDerWaalsContact N-O 3.08Å; S194-N220 WeakPolarHBondContact CA-O 3.27Å; S194-N220 WeakPolarHBondContact CB-ND2 3.37Å; S194-N220 PolarHBondContact N-O 3.34Å; S194-N220 PolarHBondContact OG-ND2 2.87Å
195	N	98.6	Very high	96.1	Very high	10 Å²	10	38.8 Å²	38.8	5%	0.053	21%	0.207	C	C	.	.	S	Bend	trans	-116.2	-162.5	178.2	-89.9	-77	0	0	0	110.7	L165 N168 Q169 I170 L192 S193 L197 N221 P222	L165-N195 PolarHBondContact O-ND2 2.69Å; N168-N195 VanDerWaalsContact CA-OD1 3.3Å; N168-N195 WeakPolarHBondContact CA-OD1 3.34Å; N168-N195 WeakPolarHBondContact CB-OD1 3.42Å; N168-N195 PolarHBondContact N-OD1 3.23Å; N168-N195 PolarHBondContact O-OD1 3.37Å; Q169-N195 PolarHBondContact N-OD1 2.86Å; I170-N195 HydrophobicContact CB-CB 4.3Å; I170-N195 VanDerWaalsContact CB-OD1 3.29Å; I170-N195 WeakPolarHBondContact CB-OD1 3.4Å; I170-N195 WeakPolarHBondContact CG1-OD1 3.02Å; I170-N195 PolarHBondContact N-OD1 2.77Å; L192-N195 WeakPolarHBondContact O-CB 3.28Å; L192-N195 PolarHBondContact O-ND2 2.71Å; L192-N195 VanDerWaalsContact O-ND2 3.08Å; S193-N195 VanDerWaalsContact C-N 3.32Å; S193-N195 PolarHBondContact O-N 3.06Å; S193-N195 PolarHBondContact O-ND2 3.19Å; S193-N195 VanDerWaalsContact O-ND2 3.12Å; N195-L197 HydrophobicContact CB-CG 4.39Å; N195-N221 VanDerWaalsContact CA-OD1 3.24Å; N195-N221 WeakPolarHBondContact CA-OD1 3.45Å; N195-N221 WeakPolarHBondContact CB-OD1 3.42Å; N195-N221 PolarHBondContact N-OD1 3.36Å; N195-N221 PolarHBondContact O-OD1 2.82Å; N195-P222 WeakPolarHBondContact O-CD 3.43Å
196	K	97.9	Very high	96.3	Very high	100 Å²	100	39.3 Å²	39.3	44%	0.435	20%	0.203	S	C	.	.			trans	-110.9	26.1	-179.9	-63.2	-179.2	179.7	172.7	0	112.1	Q169 I170 S171 K198 N221	Q169-K196 HydrophobicContact CB-CD 4.13Å; I170-K196 CarbonylContact O-C 3.43Å; I170-K196 VanDerWaalsContact O-CA 3.3Å; I170-K196 WeakPolarHBondContact O-CA 3.06Å; I170-K196 PolarHBondContact O-N 2.95Å; S171-K196 WeakPolarHBondContact CA-O 3.45Å; K196-K198 PolarHBondContact O-N 2.81Å; K196-N221 PolarHBondContact N-OD1 2.7Å
197	L	97.6	Very high	96.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.			trans	-65.9	128.2	-179.8	-59.1	177	0	0	0	110	I170 F173 L192 N195 L200 L218 N221 P222 L223	I170-L197 HydrophobicContact CG2-CD2 4.14Å; I170-L197 PolarHBondContact O-N 2.03Å; F173-L197 HydrophobicContact CB-CD2 4.43Å; F173-L197 HydrophobicContact CD2-CD1 4.45Å; L192-L197 HydrophobicContact CB-CD1 4.1Å; L192-L197 HydrophobicContact CD1-CD1 4.48Å; N195-L197 HydrophobicContact CB-CG 4.39Å; L197-L200 HydrophobicContact CD1-CD2 4.28Å; L197-L218 HydrophobicContact CD1-CD2 3.88Å; L197-N221 HydrophobicContact CB-CB 4.05Å; L197-N221 VanDerWaalsContact CB-OD1 3.3Å; L197-N221 WeakPolarHBondContact CB-OD1 3.41Å; L197-N221 WeakPolarHBondContact CG-OD1 3.34Å; L197-N221 PolarHBondContact N-OD1 2.86Å; L197-P222 CarbonylContact O-C 3.49Å; L197-P222 VanDerWaalsContact O-CD 3.31Å; L197-P222 WeakPolarHBondContact O-CD 3.48Å; L197-L223 HydrophobicContact CB-CD2 4.02Å; L197-L223 PolarHBondContact O-N 2.99Å
198	K	95.8	Very high	96.2	Very high	123 Å²	123	43 Å²	43	54%	0.535	22%	0.219	S	C	.	.			trans	-113.6	-45.7	177.4	-64.5	-176.7	179.5	179.9	0	112.7	K196 P222 L223 N224	K196-K198 PolarHBondContact O-N 2.81Å; K198-P222 WeakPolarHBondContact CA-O 3.45Å; K198-P222 HydrophobicContact CG-CG 4.36Å; K198-L223 CarbonylContact O-C 3.59Å; K198-L223 WeakPolarHBondContact O-CA 3.25Å; K198-N224 PolarHBondContact O-N 2.84Å
199	N	95.6	Very high	96.2	Very high	113 Å²	113	42 Å²	42	60%	0.604	21%	0.213	S	C	*	.			trans	-116.3	132.5	-179.2	-63.3	-36.1	0	0	0	109	N224	N199-N224 PolarHBondContact OD1-ND2 2.81Å
200	L	96.7	Very high	96	Very high	23 Å²	23	41.5 Å²	41.5	12%	0.12	21%	0.211	C	C	.	.			trans	-109.3	146.5	174.6	-62.9	175.7	0	0	0	109.5	F173 L197 L202 L205 L218 L223 L229	F173-L200 HydrophobicContact CB-CD2 4.22Å; F173-L200 HydrophobicContact CD2-CD2 3.94Å; F173-L200 HydrophobicContact CG-CD2 4.3Å; L197-L200 HydrophobicContact CD1-CD2 4.28Å; L200-L202 HydrophobicContact CB-CD2 3.89Å; L200-L202 HydrophobicContact CB-CG 4.49Å; L200-L202 PolarHBondContact O-N 2.83Å; L200-L205 HydrophobicContact CB-CD1 3.92Å; L200-L205 HydrophobicContact CD1-CD1 4.24Å; L200-L205 HydrophobicContact CG-CD1 4.49Å; L200-L218 HydrophobicContact CD1-CD1 3.88Å; L200-L218 HydrophobicContact CD2-CD1 4.44Å; L200-L218 HydrophobicContact CD2-CD2 4.35Å; L200-L223 HydrophobicContact CD1-CD1 4.09Å; L200-L223 HydrophobicContact CD1-CD2 3.8Å; L200-L223 HydrophobicContact CD2-CD2 4.08Å; L200-L223 HydrophobicContact CG-CD2 3.78Å; L200-L229 HydrophobicContact CD1-CD1 3.89Å
201	P	95.9	Very high	95.8	Very high	33 Å²	33	42.7 Å²	42.7	21%	0.214	22%	0.215	C	C	.	.			trans	-77.7	72.1	173	32.9	-34.1	0	0	0	110	F173 L175 P203 D204 L205	F173-P201 HydrophobicContact CD1-CG 3.63Å; F173-P201 HydrophobicContact CE1-CG 4.19Å; F173-P201 HydrophobicContact CG-CG 4.33Å; L175-P201 HydrophobicContact CB-CG 4.45Å; L175-P201 HydrophobicContact CD1-CG 4.08Å; L175-P201 HydrophobicContact CD2-CB 4.32Å; L175-P201 HydrophobicContact CD2-CG 4.34Å; P201-P203 VanDerWaalsContact C-CD 3.44Å; P201-P203 VanDerWaalsContact C-N 3.35Å; P201-D204 HydrophobicContact CB-CB 4.27Å; P201-D204 PolarHBondContact O-N 2.84Å; P201-L205 HydrophobicContact CG-CG 4.38Å; P201-L205 WeakPolarHBondContact O-CG 3.48Å; P201-L205 PolarHBondContact O-N 2.85Å
202	L	95.2	Very high	95.6	Very high	16 Å²	16	43.1 Å²	43.1	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-52	-42.7	-173.2	-55.6	174.6	0	0	0	113.6	L200 D204 L205 Q206 E228 L229 L232	L200-L202 HydrophobicContact CB-CD2 3.89Å; L200-L202 HydrophobicContact CB-CG 4.49Å; L200-L202 PolarHBondContact O-N 2.83Å; L202-D204 VanDerWaalsContact C-N 3.31Å; L202-D204 PolarHBondContact O-N 3.24Å; L202-L205 PolarHBondContact O-N 3.06Å; L202-Q206 WeakPolarHBondContact O-CB 3.43Å; L202-Q206 PolarHBondContact O-N 2.99Å; L202-E228 HydrophobicContact CD1-CB 3.37Å; L202-L229 HydrophobicContact CD1-CB 4.41Å; L202-L229 HydrophobicContact CD2-CD1 3.85Å; L202-L232 HydrophobicContact CD2-CD2 3.61Å
203	P	94	Very high	95.5	Very high	82 Å²	82	43.4 Å²	43.4	53%	0.532	22%	0.218	S	C	.	.	H	α-helix	trans	-63.5	-33.6	178.1	-23.9	35.5	0	0	0	113.9	P201 K207	P201-P203 VanDerWaalsContact C-CD 3.44Å; P201-P203 VanDerWaalsContact C-N 3.35Å; P203-K207 WeakPolarHBondContact O-CG 3.46Å
204	D	94.4	Very high	95.4	Very high	45 Å²	45	44.6 Å²	44.6	24%	0.241	23%	0.225	C	C	.	.	H	α-helix	trans	-77.3	-41.9	176.7	-65.5	-68.7	0	0	0	110.6	L175 K179 P201 L202 Q206 K207 L208	L175-D204 HydrophobicContact CD1-CB 3.7Å; L175-D204 HydrophobicContact CD2-CB 4.08Å; L175-D204 WeakPolarHBondContact CD2-OD2 3.32Å; K179-D204 IonicContact NZ-OD1 2.99Å; P201-D204 HydrophobicContact CB-CB 4.27Å; P201-D204 PolarHBondContact O-N 2.84Å; L202-D204 VanDerWaalsContact C-N 3.31Å; L202-D204 PolarHBondContact O-N 3.24Å; D204-Q206 VanDerWaalsContact C-N 3.29Å; D204-Q206 PolarHBondContact O-N 3.14Å; D204-K207 PolarHBondContact O-N 3.1Å; D204-K207 VanDerWaalsContact O-N 3.11Å; D204-L208 PolarHBondContact O-N 3.4Å
205	L	95.2	Very high	95.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-38	176.3	-68.2	-176.4	0	0	0	112.2	F173 L200 P201 L202 K207 L208 K213 L216 L218 L232	F173-L205 HydrophobicContact CE1-CD2 3.77Å; F173-L205 HydrophobicContact CE2-CD2 4.31Å; F173-L205 HydrophobicContact CZ-CD2 3.59Å; L200-L205 HydrophobicContact CB-CD1 3.92Å; L200-L205 HydrophobicContact CD1-CD1 4.24Å; L200-L205 HydrophobicContact CG-CD1 4.49Å; P201-L205 HydrophobicContact CG-CG 4.38Å; P201-L205 WeakPolarHBondContact O-CG 3.48Å; P201-L205 PolarHBondContact O-N 2.85Å; L202-L205 PolarHBondContact O-N 3.06Å; L205-K207 PolarHBondContact O-N 3.17Å; L205-L208 HydrophobicContact CD2-CD1 3.65Å; L205-L208 WeakPolarHBondContact O-CB 3.43Å; L205-L208 PolarHBondContact O-N 3.38Å; L205-K213 WeakPolarHBondContact O-CE 3.23Å; L205-L216 HydrophobicContact CD2-CD2 3.8Å; L205-L218 HydrophobicContact CD1-CD1 4.41Å; L205-L232 HydrophobicContact CB-CD1 4.38Å; L205-L232 HydrophobicContact CB-CD2 4.11Å; L205-L232 HydrophobicContact CD1-CD2 3.96Å
206	Q	92.9	Very high	95.3	Very high	83 Å²	83	43.1 Å²	43.1	39%	0.388	22%	0.216	S	C	.	.	H	α-helix	trans	-62.2	-33.4	177.1	-172.3	62.5	26.3	0	0	112	L202 D204 K213 L232	L202-Q206 WeakPolarHBondContact O-CB 3.43Å; L202-Q206 PolarHBondContact O-N 2.99Å; D204-Q206 VanDerWaalsContact C-N 3.29Å; D204-Q206 PolarHBondContact O-N 3.14Å; Q206-K213 PolarHBondContact O-NZ 3.15Å; Q206-L232 HydrophobicContact CB-CD1 4.47Å
207	K	92.8	Very high	95.4	Very high	165 Å²	165	39.4 Å²	39.4	72%	0.717	20%	0.2	S	C	*	.	H	α-helix	trans	-79.1	-16.4	179.9	-67.5	172.6	-175.4	176.5	0	113.8	P203 D204 L205	P203-K207 WeakPolarHBondContact O-CG 3.46Å; D204-K207 PolarHBondContact O-N 3.1Å; D204-K207 VanDerWaalsContact O-N 3.11Å; L205-K207 PolarHBondContact O-N 3.17Å
208	L	93.7	Very high	95.4	Very high	10 Å²	10	39.5 Å²	39.5	5%	0.052	20%	0.2	C	C	.	.	S	Bend	trans	-62.4	144.9	178.3	-63.8	177.1	0	0	0	110.7	V178 D204 L205 I212 K213 L216	V178-L208 HydrophobicContact CB-CD1 4.2Å; V178-L208 HydrophobicContact CB-CD2 4.2Å; V178-L208 HydrophobicContact CG2-CD1 3.86Å; V178-L208 HydrophobicContact CG2-CD2 4.22Å; V178-L208 WeakPolarHBondContact O-CD2 3.4Å; D204-L208 PolarHBondContact O-N 3.4Å; L205-L208 HydrophobicContact CD2-CD1 3.65Å; L205-L208 WeakPolarHBondContact O-CB 3.43Å; L205-L208 PolarHBondContact O-N 3.38Å; L208-I212 HydrophobicContact CD1-CG2 4.1Å; L208-K213 HydrophobicContact CB-CG 4.1Å; L208-K213 WeakPolarHBondContact O-CE 3.22Å; L208-K213 PolarHBondContact O-NZ 2.67Å; L208-L216 HydrophobicContact CD1-CD2 4.38Å
209	P	93.3	Very high	95.5	Very high	26 Å²	26	34.3 Å²	34.3	17%	0.169	18%	0.177	C	C	.	.			trans	-66	151.1	173.3	29.8	-37	0	0	0	111.5	W211 I212 K213 D291	P209-W211 VanDerWaalsContact C-N 3.26Å; P209-W211 HydrophobicContact CG-CD2 4.45Å; P209-W211 HydrophobicContact CG-CZ2 3.99Å; P209-W211 VanDerWaalsContact CG-NE1 3.27Å; P209-W211 PolarHBondContact O-N 2.92Å; P209-I212 HydrophobicContact CG-CB 4.29Å; P209-I212 HydrophobicContact CG-CD1 3.73Å; P209-I212 HydrophobicContact CG-CG1 3.86Å; P209-I212 PolarHBondContact O-N 3.46Å; P209-K213 PolarHBondContact O-N 3.25Å; P209-D291 VanDerWaalsContact CA-OD1 3.31Å; P209-D291 WeakPolarHBondContact CA-OD1 3.46Å
210	A	95	Very high	95.6	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-55.5	-37.1	-176.8	0	0	0	0	0	113.1	I212 K213 N214 L241 D291	A210-I212 VanDerWaalsContact C-N 3.3Å; A210-I212 PolarHBondContact O-N 2.82Å; A210-K213 PolarHBondContact O-N 3.43Å; A210-N214 VanDerWaalsContact O-CB 3.28Å; A210-N214 WeakPolarHBondContact O-CB 3.28Å; A210-N214 PolarHBondContact O-N 3.35Å; A210-L241 HydrophobicContact CB-CD2 4.43Å; A210-D291 WeakPolarHBondContact CB-O 3.34Å; A210-D291 WeakPolarHBondContact CB-OD2 3.5Å; A210-D291 PolarHBondContact N-OD1 2.79Å; A210-D291 PolarHBondContact N-OD2 3.34Å
211	W	93.4	Very high	95.6	Very high	30 Å²	30	30.6 Å²	30.6	11%	0.114	16%	0.158	C	C	.	.	H	α-helix	trans	-64.6	-29.6	178.1	67.4	-94	0	0	0	114.1	L187 T188 P209 T292 K293 Q295	L187-W211 VanDerWaalsContact O-CZ3 3.25Å; L187-W211 WeakPolarHBondContact O-CZ3 3.41Å; T188-W211 HydrophobicContact CG2-CE3 4.05Å; T188-W211 HydrophobicContact CG2-CZ3 3.95Å; P209-W211 VanDerWaalsContact C-N 3.26Å; P209-W211 HydrophobicContact CG-CD2 4.45Å; P209-W211 HydrophobicContact CG-CZ2 3.99Å; P209-W211 VanDerWaalsContact CG-NE1 3.27Å; P209-W211 PolarHBondContact O-N 2.92Å; W211-T292 PolarHBondContact N-O 2.94Å; W211-K293 VanDerWaalsContact CA-O 3.31Å; W211-K293 WeakPolarHBondContact CA-O 3.14Å; W211-Q295 HydrophobicContact CB-CG 4.23Å; W211-Q295 HydrophobicContact CD2-CG 3.63Å; W211-Q295 HydrophobicContact CE3-CG 3.99Å; W211-Q295 HydrophobicContact CG-CG 3.71Å
212	I	94.6	Very high	95.7	Very high	11 Å²	11	30.3 Å²	30.3	6%	0.056	16%	0.156	C	C	.	.	H	α-helix	trans	-74.5	-46.9	171.6	-67.1	180	0	0	0	109.5	V178 L208 P209 A210 N214 G215 L216	V178-I212 HydrophobicContact CB-CG2 4.18Å; V178-I212 HydrophobicContact CG1-CG2 4Å; L208-I212 HydrophobicContact CD1-CG2 4.1Å; P209-I212 HydrophobicContact CG-CB 4.29Å; P209-I212 HydrophobicContact CG-CD1 3.73Å; P209-I212 HydrophobicContact CG-CG1 3.86Å; P209-I212 PolarHBondContact O-N 3.46Å; A210-I212 VanDerWaalsContact C-N 3.3Å; A210-I212 PolarHBondContact O-N 2.82Å; I212-N214 PolarHBondContact O-N 3.39Å; I212-G215 CarbonylContact O-C 3.58Å; I212-G215 PolarHBondContact O-N 2.93Å; I212-L216 WeakPolarHBondContact O-CB 3.48Å; I212-L216 PolarHBondContact O-N 3.36Å; I212-L216 VanDerWaalsContact O-N 3.15Å
213	K	96.7	Very high	95.8	Very high	6 Å²	6	29.6 Å²	29.6	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-57.9	-36.3	178.3	-64.9	168.1	168.7	156.7	0	111.6	L205 Q206 L208 P209 A210 G215 L216 W236 L241 S243	L205-K213 WeakPolarHBondContact O-CE 3.23Å; Q206-K213 PolarHBondContact O-NZ 3.15Å; L208-K213 HydrophobicContact CB-CG 4.1Å; L208-K213 WeakPolarHBondContact O-CE 3.22Å; L208-K213 PolarHBondContact O-NZ 2.67Å; P209-K213 PolarHBondContact O-N 3.25Å; A210-K213 PolarHBondContact O-N 3.43Å; K213-G215 VanDerWaalsContact C-N 3.3Å; K213-G215 PolarHBondContact O-N 3.24Å; K213-L216 PolarHBondContact O-N 3.28Å; K213-W236 HydrophobicContact CB-CD2 4.17Å; K213-W236 HydrophobicContact CB-CE3 4.37Å; K213-W236 HydrophobicContact CB-CH2 4.07Å; K213-W236 HydrophobicContact CB-CZ2 3.81Å; K213-W236 HydrophobicContact CB-CZ3 4.33Å; K213-W236 HydrophobicContact CD-CZ2 4.11Å; K213-W236 HydrophobicContact CG-CH2 4.21Å; K213-W236 HydrophobicContact CG-CZ2 3.58Å; K213-L241 HydrophobicContact CB-CD1 3.56Å; K213-L241 HydrophobicContact CD-CD1 4.46Å; K213-S243 WeakPolarHBondContact O-CB 3.14Å; K213-S243 PolarHBondContact O-OG 2.99Å
214	N	96.6	Very high	95.9	Very high	30 Å²	30	29.1 Å²	29.1	16%	0.16	15%	0.145	C	C	.	.	H	α-helix	trans	-60.7	-36.2	179.5	-168.4	66.7	0	0	0	113	A210 I212 L241 S242 S243 K293	A210-N214 VanDerWaalsContact O-CB 3.28Å; A210-N214 WeakPolarHBondContact O-CB 3.28Å; A210-N214 PolarHBondContact O-N 3.35Å; I212-N214 PolarHBondContact O-N 3.39Å; N214-L241 HydrophobicContact CB-CD2 4.26Å; N214-L241 WeakPolarHBondContact OD1-CA 3.43Å; N214-S242 PolarHBondContact OD1-N 3.24Å; N214-S243 WeakPolarHBondContact O-CB 3.12Å; N214-S243 PolarHBondContact O-N 3.45Å; N214-K293 HydrophobicContact CB-CB 4.27Å
215	G	96.9	Very high	95.9	Very high	7 Å²	7	27.9 Å²	27.9	7%	0.072	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	12.9	176.9	0	0	0	0	0	114.5	T188 L189 L190 I212 K213 Y217	T188-G215 WeakPolarHBondContact O-CA 3.25Å; L189-G215 WeakPolarHBondContact CA-O 3.09Å; L190-G215 CarbonylContact C-O 3.39Å; L190-G215 PolarHBondContact N-O 2.63Å; I212-G215 CarbonylContact O-C 3.58Å; I212-G215 PolarHBondContact O-N 2.93Å; K213-G215 VanDerWaalsContact C-N 3.3Å; K213-G215 PolarHBondContact O-N 3.24Å; G215-Y217 WeakPolarHBondContact O-CD2 3.28Å
216	L	97.8	Very high	95.8	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	95.7	179.4	-177.3	55.6	0	0	0	110.8	F173 L190 L205 L208 I212 K213 L218 W236 S243	F173-L216 HydrophobicContact CE2-CD1 4.03Å; F173-L216 HydrophobicContact CE2-CD2 4.18Å; F173-L216 HydrophobicContact CZ-CD1 4.24Å; F173-L216 HydrophobicContact CZ-CD2 3.97Å; L190-L216 HydrophobicContact CB-CD1 4.04Å; L190-L216 HydrophobicContact CD2-CD1 3.93Å; L190-L216 HydrophobicContact CG-CD1 4.03Å; L205-L216 HydrophobicContact CD2-CD2 3.8Å; L208-L216 HydrophobicContact CD1-CD2 4.38Å; I212-L216 WeakPolarHBondContact O-CB 3.48Å; I212-L216 PolarHBondContact O-N 3.36Å; I212-L216 VanDerWaalsContact O-N 3.15Å; K213-L216 PolarHBondContact O-N 3.28Å; L216-L218 HydrophobicContact CD1-CD2 4.39Å; L216-L218 HydrophobicContact CD2-CD1 4.36Å; L216-L218 HydrophobicContact CG-CD1 4.23Å; L216-L218 HydrophobicContact CG-CD2 4.49Å; L216-L218 HydrophobicContact CG-CG 4.16Å; L216-W236 HydrophobicContact CB-CH2 4.29Å; L216-W236 HydrophobicContact CB-CZ3 4.44Å; L216-W236 HydrophobicContact CD2-CH2 3.98Å; L216-W236 HydrophobicContact CG-CH2 4.31Å; L216-S243 VanDerWaalsContact O-CB 3.25Å; L216-S243 WeakPolarHBondContact O-CB 3.48Å
217	Y	98.4	Very high	95.9	Very high	23 Å²	23	28.9 Å²	28.9	9%	0.09	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	119.6	-176.8	-58.5	-84.9	0	0	0	111.2	L189 L190 D191 L192 S193 G215 F247	L189-Y217 HydrophobicContact CD1-CE2 3.84Å; L189-Y217 HydrophobicContact CD2-CE2 4.41Å; L189-Y217 HydrophobicContact CG-CD2 4.32Å; L189-Y217 HydrophobicContact CG-CE2 3.84Å; L190-Y217 PolarHBondContact O-N 2.99Å; D191-Y217 HydrophobicContact CB-CD2 4.16Å; L192-Y217 CarbonylContact C-O 3.34Å; L192-Y217 WeakPolarHBondContact CA-O 3.47Å; L192-Y217 PolarHBondContact N-O 2.95Å; S193-Y217 PolarHBondContact N-O 2.78Å; G215-Y217 WeakPolarHBondContact O-CD2 3.28Å; Y217-F247 AromaticContact CD1-CD2 3.65Å; Y217-F247 HydrophobicContact CD1-CD2 3.65Å; Y217-F247 AromaticContact CD1-CE2 3.49Å; Y217-F247 HydrophobicContact CD1-CE2 3.49Å; Y217-F247 VanDerWaalsContact CD1-CE2 3.49Å; Y217-F247 AromaticContact CE1-CD2 3.81Å; Y217-F247 HydrophobicContact CE1-CD2 3.81Å; Y217-F247 AromaticContact CE1-CE2 3.39Å; Y217-F247 HydrophobicContact CE1-CE2 3.39Å
218	L	98.1	Very high	96	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.142	C	C	.	.			trans	-124.1	-0.3	-175.5	-64.5	173.8	0	0	0	113.7	F173 L192 L197 L200 L205 L216 N221 F233 W236	F173-L218 HydrophobicContact CD2-CD2 4.16Å; F173-L218 HydrophobicContact CE2-CD2 3.97Å; L192-L218 HydrophobicContact CB-CD2 4.19Å; L192-L218 HydrophobicContact CD1-CD2 4.36Å; L197-L218 HydrophobicContact CD1-CD2 3.88Å; L200-L218 HydrophobicContact CD1-CD1 3.88Å; L200-L218 HydrophobicContact CD2-CD1 4.44Å; L200-L218 HydrophobicContact CD2-CD2 4.35Å; L205-L218 HydrophobicContact CD1-CD1 4.41Å; L216-L218 HydrophobicContact CD1-CD2 4.39Å; L216-L218 HydrophobicContact CD2-CD1 4.36Å; L216-L218 HydrophobicContact CG-CD1 4.23Å; L216-L218 HydrophobicContact CG-CD2 4.49Å; L216-L218 HydrophobicContact CG-CG 4.16Å; L218-N221 PolarHBondContact O-ND2 2.98Å; L218-F233 HydrophobicContact CB-CZ 4.22Å; L218-F233 HydrophobicContact CD1-CZ 4.22Å; L218-W236 HydrophobicContact CD1-CH2 4.44Å
219	H	97.9	Very high	96.1	Very high	14 Å²	14	26.3 Å²	26.3	7%	0.065	14%	0.141	C	C	.	.			trans	-60.1	162.3	179.9	67.9	96.4	0	0	0	112.2	S193 S194 N221 F247 D250 L251	S193-H219 CarbonylContact C-O 3.51Å; S193-H219 WeakPolarHBondContact CA-O 3.13Å; S193-H219 WeakPolarHBondContact CB-CE1 3.5Å; S193-H219 WeakPolarHBondContact CB-NE2 3.05Å; S193-H219 VanDerWaalsContact CB-O 3.31Å; S193-H219 WeakPolarHBondContact CB-O 3.35Å; S194-H219 PolarHBondContact N-O 3.02Å; S194-H219 VanDerWaalsContact N-O 3.08Å; H219-N221 VanDerWaalsContact C-N 3.31Å; H219-N221 PolarHBondContact O-N 3.22Å; H219-N221 PolarHBondContact O-ND2 2.83Å; H219-F247 HydrophobicContact CB-CB 3.88Å; H219-F247 AromaticContact CD2-CD1 3.84Å; H219-F247 AromaticContact CD2-CD2 3.77Å; H219-F247 AromaticContact CD2-CG 3.49Å; H219-F247 VanDerWaalsContact CD2-CG 3.49Å; H219-F247 WeakPolarHBondContact CD2-CG 3.09Å; H219-F247 AromaticContact CE1-CD1 3.47Å; H219-F247 VanDerWaalsContact CE1-CD1 3.47Å; H219-F247 WeakPolarHBondContact CE1-CD1 3.26Å; H219-F247 AromaticContact CE1-CE1 3.68Å; H219-F247 AromaticContact CE1-CG 3.95Å; H219-F247 AromaticContact CG-CG 3.82Å; H219-F247 AromaticContact ND1-CD1 3.77Å; H219-F247 AromaticContact NE2-CD1 3.54Å; H219-F247 AromaticContact NE2-CD2 3.85Å; H219-F247 AromaticContact NE2-CE1 3.68Å; H219-F247 AromaticContact NE2-CE2 3.99Å; H219-F247 AromaticContact NE2-CG 3.62Å; H219-F247 AromaticContact NE2-CZ 3.9Å; H219-D250 HydrophobicContact CB-CB 3.85Å; H219-L251 HydrophobicContact CB-CD2 3.96Å; H219-L251 HydrophobicContact CB-CG 4.07Å
220	N	97.7	Very high	96.1	Very high	57 Å²	57	26.9 Å²	26.9	31%	0.305	14%	0.14	S	C	.	.	S	Bend	trans	56.9	38.7	-178.5	-159.8	31.8	0	0	0	114.4	S194 D250 Y252	S194-N220 WeakPolarHBondContact CA-O 3.27Å; S194-N220 WeakPolarHBondContact CB-ND2 3.37Å; S194-N220 PolarHBondContact N-O 3.34Å; S194-N220 PolarHBondContact OG-ND2 2.87Å; N220-D250 PolarHBondContact N-O 3.25Å; N220-Y252 VanDerWaalsContact CA-CE1 3.46Å; N220-Y252 WeakPolarHBondContact CA-OH 3.42Å; N220-Y252 HydrophobicContact CB-CE1 4.2Å; N220-Y252 PolarHBondContact O-OH 3.44Å; N220-Y252 VanDerWaalsContact OD1-CE1 3.22Å; N220-Y252 WeakPolarHBondContact OD1-CE1 3.49Å; N220-Y252 VanDerWaalsContact OD1-CZ 3.3Å; N220-Y252 PolarHBondContact OD1-OH 3.35Å
221	N	97.9	Very high	96.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.157	C	C	.	.	S	Bend	trans	-119.7	146.2	174.3	-85	-83	0	0	0	111.2	L192 N195 K196 L197 L218 H219 L223 Y252	L192-N221 PolarHBondContact O-ND2 2.8Å; N195-N221 VanDerWaalsContact CA-OD1 3.24Å; N195-N221 WeakPolarHBondContact CA-OD1 3.45Å; N195-N221 WeakPolarHBondContact CB-OD1 3.42Å; N195-N221 PolarHBondContact N-OD1 3.36Å; N195-N221 PolarHBondContact O-OD1 2.82Å; K196-N221 PolarHBondContact N-OD1 2.7Å; L197-N221 HydrophobicContact CB-CB 4.05Å; L197-N221 VanDerWaalsContact CB-OD1 3.3Å; L197-N221 WeakPolarHBondContact CB-OD1 3.41Å; L197-N221 WeakPolarHBondContact CG-OD1 3.34Å; L197-N221 PolarHBondContact N-OD1 2.86Å; L218-N221 PolarHBondContact O-ND2 2.98Å; H219-N221 VanDerWaalsContact C-N 3.31Å; H219-N221 PolarHBondContact O-N 3.22Å; H219-N221 PolarHBondContact O-ND2 2.83Å; N221-L223 HydrophobicContact CB-CD2 3.99Å; N221-L223 HydrophobicContact CB-CG 3.94Å; N221-L223 PolarHBondContact O-N 2.94Å; N221-Y252 VanDerWaalsContact C-CE2 3.49Å; N221-Y252 WeakPolarHBondContact O-CD2 3.28Å; N221-Y252 WeakPolarHBondContact O-CE2 3.35Å
222	P	96.3	Very high	96.2	Very high	27 Å²	27	29.3 Å²	29.3	18%	0.175	15%	0.152	C	C	.	.			trans	-77	54.5	178.2	35	-37.8	0	0	0	112.6	N195 L197 K198 M254	N195-P222 WeakPolarHBondContact O-CD 3.43Å; L197-P222 CarbonylContact O-C 3.49Å; L197-P222 VanDerWaalsContact O-CD 3.31Å; L197-P222 WeakPolarHBondContact O-CD 3.48Å; K198-P222 WeakPolarHBondContact CA-O 3.45Å; K198-P222 HydrophobicContact CG-CG 4.36Å; P222-M254 HydrophobicContact CB-CE 3.85Å
223	L	97.3	Very high	96.3	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	145.3	-178.7	-58.2	176	0	0	0	110.9	L197 K198 L200 N221 L229 F233 C253 M254	L197-L223 HydrophobicContact CB-CD2 4.02Å; L197-L223 PolarHBondContact O-N 2.99Å; K198-L223 CarbonylContact O-C 3.59Å; K198-L223 WeakPolarHBondContact O-CA 3.25Å; L200-L223 HydrophobicContact CD1-CD1 4.09Å; L200-L223 HydrophobicContact CD1-CD2 3.8Å; L200-L223 HydrophobicContact CD2-CD2 4.08Å; L200-L223 HydrophobicContact CG-CD2 3.78Å; N221-L223 HydrophobicContact CB-CD2 3.99Å; N221-L223 HydrophobicContact CB-CG 3.94Å; N221-L223 PolarHBondContact O-N 2.94Å; L223-L229 HydrophobicContact CB-CD2 4.06Å; L223-L229 HydrophobicContact CD1-CD1 4.34Å; L223-L229 HydrophobicContact CD1-CD2 4.41Å; L223-F233 HydrophobicContact CD1-CE2 4.2Å; L223-F233 HydrophobicContact CD1-CZ 4.49Å; L223-C253 HydrophobicContact CB-CB 4.21Å; L223-C253 CarbonylContact O-C 3.59Å; L223-C253 WeakPolarHBondContact O-CA 3.25Å; L223-C253 VanDerWaalsContact O-CB 3.29Å; L223-C253 WeakPolarHBondContact O-CB 3.45Å; L223-M254 PolarHBondContact O-N 3.28Å
224	N	96.1	Very high	96.2	Very high	72 Å²	72	29.1 Å²	29.1	39%	0.385	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	129.8	173.6	-74.1	-24.2	0	0	0	110.2	K198 N199 D226 L229	K198-N224 PolarHBondContact O-N 2.84Å; N199-N224 PolarHBondContact OD1-ND2 2.81Å; N224-D226 PolarHBondContact O-N 3.47Å; N224-L229 WeakPolarHBondContact O-CD2 3.44Å
225	C	95.5	Very high	96.1	Very high	18 Å²	18	28.4 Å²	28.4	12%	0.122	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-73.8	121.7	177.7	-58.8	0	0	0	0	111.3	C253 M254 N255 L265 F267 L268	C225-C253 WeakPolarHBondContact CA-SG 3.19Å; C225-C253 HydrophobicContact CB-CB 3.9Å; C225-C253 WeakPolarHBondContact CB-SG 3.39Å; C225-C253 WeakPolarHBondContact SG-CB 3.28Å; C225-C253 CovalentContact SG-SG 2.03Å; C225-C253 PolarHBondContact SG-SG 3.15Å; C225-M254 PolarHBondContact N-O 3.35Å; C225-M254 VanDerWaalsContact SG-C 3.52Å; C225-M254 PolarHBondContact SG-N 2.6Å; C225-M254 VanDerWaalsContact SG-N 3.4Å; C225-N255 HydrophobicContact CB-CB 4.08Å; C225-L265 HydrophobicContact CB-CD1 4.47Å; C225-L265 HydrophobicContact CB-CD2 4.41Å; C225-F267 HydrophobicContact CB-CZ 4.25Å; C225-L268 HydrophobicContact CB-CD1 4.34Å
226	D	93.7	Very high	96.1	Very high	64 Å²	64	28.1 Å²	28.1	34%	0.342	15%	0.145	S	C	.	.			trans	-145.7	174.5	165.6	63.9	37.1	0	0	0	110.5	N224 E228 L229 Y230	N224-D226 PolarHBondContact O-N 3.47Å; D226-E228 PolarHBondContact OD1-N 3.5Å; D226-L229 VanDerWaalsContact OD1-CB 3.25Å; D226-L229 WeakPolarHBondContact OD1-CB 3.48Å; D226-L229 PolarHBondContact OD1-N 2.74Å; D226-Y230 PolarHBondContact O-N 3.26Å
227	C	94.6	Very high	96	Very high	40 Å²	40	31 Å²	31	27%	0.27	16%	0.158	S	C	.	.	H	α-helix	trans	-76.5	-21.8	-179.5	-67.7	0	0	0	0	113.9	Q231 C270	C227-Q231 WeakPolarHBondContact O-CB 3.31Å; C227-Q231 VanDerWaalsContact O-CG 3.24Å; C227-Q231 WeakPolarHBondContact O-CG 3.49Å; C227-Q231 PolarHBondContact O-N 3Å; C227-C270 WeakPolarHBondContact CA-SG 3.37Å; C227-C270 HydrophobicContact CB-CB 3.79Å; C227-C270 WeakPolarHBondContact CB-SG 3.1Å; C227-C270 WeakPolarHBondContact SG-CA 3.37Å; C227-C270 WeakPolarHBondContact SG-CB 3.44Å; C227-C270 CovalentContact SG-SG 2.05Å; C227-C270 PolarHBondContact SG-SG 2.87Å
228	E	94.1	Very high	95.7	Very high	117 Å²	117	36.6 Å²	36.6	55%	0.547	18%	0.18	S	C	.	.	H	α-helix	trans	-71.5	-39.5	176.5	-65.9	-172.5	-179.9	0	0	110.4	L202 D226 Q231 L232	L202-E228 HydrophobicContact CD1-CB 3.37Å; D226-E228 PolarHBondContact OD1-N 3.5Å; E228-Q231 PolarHBondContact O-N 2.88Å; E228-L232 WeakPolarHBondContact O-CB 3.42Å; E228-L232 PolarHBondContact O-N 2.92Å
229	L	95.4	Very high	95.5	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-47	173.4	-173.2	72.7	0	0	0	110.9	L200 L202 L223 N224 D226 L232 F233 C253 V262	L200-L229 HydrophobicContact CD1-CD1 3.89Å; L202-L229 HydrophobicContact CD1-CB 4.41Å; L202-L229 HydrophobicContact CD2-CD1 3.85Å; L223-L229 HydrophobicContact CB-CD2 4.06Å; L223-L229 HydrophobicContact CD1-CD1 4.34Å; L223-L229 HydrophobicContact CD1-CD2 4.41Å; N224-L229 WeakPolarHBondContact O-CD2 3.44Å; D226-L229 VanDerWaalsContact OD1-CB 3.25Å; D226-L229 WeakPolarHBondContact OD1-CB 3.48Å; D226-L229 PolarHBondContact OD1-N 2.74Å; L229-L232 PolarHBondContact O-N 2.8Å; L229-F233 HydrophobicContact CD1-CD2 3.96Å; L229-F233 HydrophobicContact CD1-CE2 3.57Å; L229-F233 HydrophobicContact CG-CD2 4Å; L229-F233 HydrophobicContact CG-CE2 4.02Å; L229-F233 WeakPolarHBondContact O-CD2 3.33Å; L229-F233 PolarHBondContact O-N 3.5Å; L229-F233 VanDerWaalsContact O-N 3.07Å; L229-C253 HydrophobicContact CD2-CB 3.86Å; L229-V262 HydrophobicContact CD2-CG2 4.24Å; L229-V262 HydrophobicContact CG-CG1 4.4Å
230	Y	95	Very high	95.3	Very high	38 Å²	38	43 Å²	43	15%	0.149	21%	0.209	C	C	.	.	H	α-helix	trans	-57.2	-50.5	174	167.7	-103.1	0	0	0	111.2	D226 L232 F233 S234 V262 C270 G271	D226-Y230 PolarHBondContact O-N 3.26Å; Y230-L232 VanDerWaalsContact C-N 3.32Å; Y230-L232 PolarHBondContact O-N 2.83Å; Y230-F233 PolarHBondContact O-N 3.05Å; Y230-S234 VanDerWaalsContact CE2-OG 3.25Å; Y230-S234 WeakPolarHBondContact CE2-OG 3.3Å; Y230-S234 VanDerWaalsContact O-CB 3.29Å; Y230-S234 WeakPolarHBondContact O-CB 3.36Å; Y230-S234 PolarHBondContact O-N 2.84Å; Y230-S234 PolarHBondContact O-OG 2.9Å; Y230-S234 VanDerWaalsContact O-OG 3.1Å; Y230-V262 WeakPolarHBondContact CD2-O 3.36Å; Y230-C270 HydrophobicContact CD1-CB 3.57Å; Y230-C270 HydrophobicContact CE1-CB 3.97Å; Y230-C270 HydrophobicContact CG-CB 4.21Å; Y230-G271 WeakPolarHBondContact CE1-O 3.44Å
231	Q	94.2	Very high	95.3	Very high	80 Å²	80	40.3 Å²	40.3	37%	0.374	20%	0.195	S	C	.	.	H	α-helix	trans	-59.3	-41.5	179.2	-76.1	174.4	0.8	0	0	112.5	C227 E228 H235	C227-Q231 WeakPolarHBondContact O-CB 3.31Å; C227-Q231 VanDerWaalsContact O-CG 3.24Å; C227-Q231 WeakPolarHBondContact O-CG 3.49Å; C227-Q231 PolarHBondContact O-N 3Å; E228-Q231 PolarHBondContact O-N 2.88Å; Q231-H235 WeakPolarHBondContact O-CB 3.5Å; Q231-H235 PolarHBondContact O-N 2.89Å
232	L	95.4	Very high	95.2	Very high	3 Å²	3	42 Å²	42	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-59.4	-52.9	176.5	-179.7	70.1	0	0	0	111	L202 L205 Q206 E228 L229 Y230 H235 W236	L202-L232 HydrophobicContact CD2-CD2 3.61Å; L205-L232 HydrophobicContact CB-CD1 4.38Å; L205-L232 HydrophobicContact CB-CD2 4.11Å; L205-L232 HydrophobicContact CD1-CD2 3.96Å; Q206-L232 HydrophobicContact CB-CD1 4.47Å; E228-L232 WeakPolarHBondContact O-CB 3.42Å; E228-L232 PolarHBondContact O-N 2.92Å; L229-L232 PolarHBondContact O-N 2.8Å; Y230-L232 VanDerWaalsContact C-N 3.32Å; Y230-L232 PolarHBondContact O-N 2.83Å; L232-H235 WeakPolarHBondContact O-CB 3.38Å; L232-H235 PolarHBondContact O-N 3Å; L232-W236 HydrophobicContact CD1-CZ2 4.13Å; L232-W236 HydrophobicContact CD2-CZ2 4.34Å; L232-W236 HydrophobicContact CG-CZ2 4.28Å; L232-W236 PolarHBondContact O-N 3.36Å; L232-W236 VanDerWaalsContact O-N 3.12Å
233	F	96.2	Very high	95.2	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-73.2	-31.7	-177.8	-76.5	-64.2	0	0	0	113.2	L218 L223 L229 Y230 H235 W236 Q237 V244 L251 V262 F263	L218-F233 HydrophobicContact CB-CZ 4.22Å; L218-F233 HydrophobicContact CD1-CZ 4.22Å; L223-F233 HydrophobicContact CD1-CE2 4.2Å; L223-F233 HydrophobicContact CD1-CZ 4.49Å; L229-F233 HydrophobicContact CD1-CD2 3.96Å; L229-F233 HydrophobicContact CD1-CE2 3.57Å; L229-F233 HydrophobicContact CG-CD2 4Å; L229-F233 HydrophobicContact CG-CE2 4.02Å; L229-F233 WeakPolarHBondContact O-CD2 3.33Å; L229-F233 PolarHBondContact O-N 3.5Å; L229-F233 VanDerWaalsContact O-N 3.07Å; Y230-F233 PolarHBondContact O-N 3.05Å; F233-H235 VanDerWaalsContact C-N 3.33Å; F233-W236 HydrophobicContact CD1-CE3 4.3Å; F233-W236 HydrophobicContact CE1-CE3 4.24Å; F233-W236 HydrophobicContact CE1-CZ3 4.27Å; F233-W236 PolarHBondContact O-N 3.32Å; F233-Q237 WeakPolarHBondContact O-CB 3.35Å; F233-Q237 PolarHBondContact O-N 3.33Å; F233-V244 HydrophobicContact CD1-CG2 3.74Å; F233-V244 HydrophobicContact CE1-CG2 4.35Å; F233-L251 HydrophobicContact CD1-CD1 4.21Å; F233-L251 HydrophobicContact CD1-CD2 4.26Å; F233-L251 HydrophobicContact CE1-CD1 4.37Å; F233-L251 HydrophobicContact CE1-CD2 3.71Å; F233-L251 HydrophobicContact CE2-CD2 4.39Å; F233-L251 HydrophobicContact CZ-CD2 3.77Å; F233-V262 HydrophobicContact CB-CG1 4.09Å; F233-V262 HydrophobicContact CD2-CG1 3.78Å; F233-V262 HydrophobicContact CG-CG1 4.31Å; F233-F263 HydrophobicContact CB-CE1 3.94Å; F233-F263 HydrophobicContact CB-CZ 3.91Å
234	S	94.8	Very high	95.3	Very high	10 Å²	10	40.8 Å²	40.8	7%	0.07	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-38.7	171	-70.1	0	0	0	0	111.9	Y230 W236 Q237 Y238	Y230-S234 VanDerWaalsContact CE2-OG 3.25Å; Y230-S234 WeakPolarHBondContact CE2-OG 3.3Å; Y230-S234 VanDerWaalsContact O-CB 3.29Å; Y230-S234 WeakPolarHBondContact O-CB 3.36Å; Y230-S234 PolarHBondContact O-N 2.84Å; Y230-S234 PolarHBondContact O-OG 2.9Å; Y230-S234 VanDerWaalsContact O-OG 3.1Å; S234-W236 VanDerWaalsContact C-N 3.34Å; S234-Q237 PolarHBondContact O-N 3.39Å; S234-Y238 WeakPolarHBondContact O-CB 3.35Å; S234-Y238 PolarHBondContact O-N 3.18Å
235	H	94.5	Very high	95.3	Very high	16 Å²	16	41 Å²	41	7%	0.074	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-45.3	170.4	174.6	59.3	0	0	0	111.4	Q231 L232 F233 Q237 Y238 R239 Y273	Q231-H235 WeakPolarHBondContact O-CB 3.5Å; Q231-H235 PolarHBondContact O-N 2.89Å; L232-H235 WeakPolarHBondContact O-CB 3.38Å; L232-H235 PolarHBondContact O-N 3Å; F233-H235 VanDerWaalsContact C-N 3.33Å; H235-Q237 PolarHBondContact O-N 3.48Å; H235-Y238 PolarHBondContact O-N 3.27Å; H235-R239 WeakPolarHBondContact O-CB 3.48Å; H235-R239 VanDerWaalsContact O-CG 3.31Å; H235-R239 WeakPolarHBondContact O-CG 3.39Å; H235-R239 PolarHBondContact O-N 2.87Å; H235-Y273 HydrophobicContact CB-CD2 3.96Å; H235-Y273 HydrophobicContact CB-CE1 4.41Å; H235-Y273 HydrophobicContact CB-CE2 3.54Å; H235-Y273 AromaticContact CG-CE2 3.98Å; H235-Y273 AromaticContact CG-CZ 3.89Å; H235-Y273 AromaticContact ND1-CE2 3.84Å; H235-Y273 AromaticContact ND1-CZ 3.3Å; H235-Y273 VanDerWaalsContact ND1-CZ 3.3Å; H235-Y273 PolarHBondContact ND1-OH 3.02Å
236	W	96.5	Very high	95.3	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-68.5	-34.9	-179	-68.7	25.5	0	0	0	112.3	K213 L216 L218 L232 F233 S234 R239 Q240 L241 V244	K213-W236 HydrophobicContact CB-CD2 4.17Å; K213-W236 HydrophobicContact CB-CE3 4.37Å; K213-W236 HydrophobicContact CB-CH2 4.07Å; K213-W236 HydrophobicContact CB-CZ2 3.81Å; K213-W236 HydrophobicContact CB-CZ3 4.33Å; K213-W236 HydrophobicContact CD-CZ2 4.11Å; K213-W236 HydrophobicContact CG-CH2 4.21Å; K213-W236 HydrophobicContact CG-CZ2 3.58Å; L216-W236 HydrophobicContact CB-CH2 4.29Å; L216-W236 HydrophobicContact CB-CZ3 4.44Å; L216-W236 HydrophobicContact CD2-CH2 3.98Å; L216-W236 HydrophobicContact CG-CH2 4.31Å; L218-W236 HydrophobicContact CD1-CH2 4.44Å; L232-W236 HydrophobicContact CD1-CZ2 4.13Å; L232-W236 HydrophobicContact CD2-CZ2 4.34Å; L232-W236 HydrophobicContact CG-CZ2 4.28Å; L232-W236 PolarHBondContact O-N 3.36Å; L232-W236 VanDerWaalsContact O-N 3.12Å; F233-W236 HydrophobicContact CD1-CE3 4.3Å; F233-W236 HydrophobicContact CE1-CE3 4.24Å; F233-W236 HydrophobicContact CE1-CZ3 4.27Å; F233-W236 PolarHBondContact O-N 3.32Å; S234-W236 VanDerWaalsContact C-N 3.34Å; W236-R239 CarbonylContact O-C 3.5Å; W236-R239 PolarHBondContact O-N 3.2Å; W236-Q240 PolarHBondContact O-N 3.04Å; W236-Q240 VanDerWaalsContact O-N 3.12Å; W236-L241 HydrophobicContact CB-CB 4.41Å; W236-L241 HydrophobicContact CB-CD1 3.87Å; W236-L241 HydrophobicContact CB-CG 4.3Å; W236-L241 HydrophobicContact CD2-CD1 3.96Å; W236-L241 HydrophobicContact CE3-CD1 4.35Å; W236-L241 HydrophobicContact CG-CD1 3.7Å; W236-L241 PolarHBondContact O-N 3.24Å; W236-V244 HydrophobicContact CB-CG2 3.62Å; W236-V244 HydrophobicContact CE3-CG2 3.99Å; W236-V244 HydrophobicContact CG-CG2 4.5Å
237	Q	95.5	Very high	95.5	Very high	60 Å²	60	43.4 Å²	43.4	28%	0.28	21%	0.209	S	C	.	.	H	α-helix	trans	-65.4	-46.4	172.5	-171	-176.7	30.6	0	0	111.2	F233 S234 H235 R239 Q240 V244 M245 F263	F233-Q237 WeakPolarHBondContact O-CB 3.35Å; F233-Q237 PolarHBondContact O-N 3.33Å; S234-Q237 PolarHBondContact O-N 3.39Å; H235-Q237 PolarHBondContact O-N 3.48Å; Q237-R239 VanDerWaalsContact C-N 3.27Å; Q237-R239 PolarHBondContact O-N 3.39Å; Q237-Q240 WeakPolarHBondContact O-CA 3.25Å; Q237-Q240 PolarHBondContact O-N 3.25Å; Q237-V244 HydrophobicContact CB-CG1 3.97Å; Q237-V244 HydrophobicContact CG-CG1 4.36Å; Q237-M245 HydrophobicContact CG-SD 4.35Å; Q237-F263 HydrophobicContact CB-CE1 3.96Å; Q237-F263 HydrophobicContact CB-CZ 4.42Å; Q237-F263 HydrophobicContact CG-CE1 4.4Å
238	Y	93.4	Very high	95.5	Very high	142 Å²	142	45 Å²	45	56%	0.557	21%	0.212	S	C	*	.	H	α-helix	trans	-57.8	-41.8	174.7	174.2	-99.1	0	0	0	111.6	S234 H235 Q240 Y273	S234-Y238 WeakPolarHBondContact O-CB 3.35Å; S234-Y238 PolarHBondContact O-N 3.18Å; H235-Y238 PolarHBondContact O-N 3.27Å; Y238-Q240 PolarHBondContact O-N 3.48Å; Y238-Y273 HydrophobicContact CD1-CE1 4.18Å; Y238-Y273 HydrophobicContact CG-CE1 4.26Å
239	R	93.6	Very high	95.5	Very high	24 Å²	24	47.8 Å²	47.8	9%	0.091	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	0.9	175.1	-68	-62.1	-52.9	-74.7	-7.1	114.3	H235 W236 Q237 L241 D291 E350	H235-R239 WeakPolarHBondContact O-CB 3.48Å; H235-R239 VanDerWaalsContact O-CG 3.31Å; H235-R239 WeakPolarHBondContact O-CG 3.39Å; H235-R239 PolarHBondContact O-N 2.87Å; W236-R239 CarbonylContact O-C 3.5Å; W236-R239 PolarHBondContact O-N 3.2Å; Q237-R239 VanDerWaalsContact C-N 3.27Å; Q237-R239 PolarHBondContact O-N 3.39Å; R239-L241 VanDerWaalsContact C-N 3.25Å; R239-L241 HydrophobicContact CB-CD2 4.05Å; R239-L241 HydrophobicContact CB-CG 3.95Å; R239-L241 PolarHBondContact O-N 3.41Å; R239-D291 PolarHBondContact NH1-O 3.31Å; R239-D291 IonicContact NH1-OD2 2.64Å; R239-D291 PolarHBondContact NH2-O 2.94Å; R239-E350 IonicContact CZ-OE1 3.75Å; R239-E350 IonicContact NE-OE1 3.8Å; R239-E350 IonicContact NH2-OE1 3.71Å; R239-E350 PolarHBondContact NH2-OE1 3.23Å
240	Q	94.5	Very high	95.5	Very high	125 Å²	125	51.2 Å²	51.2	58%	0.584	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	43.5	-179.6	-59	-174.3	-41.7	0	0	113.5	W236 Q237 Y238 M245	W236-Q240 PolarHBondContact O-N 3.04Å; W236-Q240 VanDerWaalsContact O-N 3.12Å; Q237-Q240 WeakPolarHBondContact O-CA 3.25Å; Q237-Q240 PolarHBondContact O-N 3.25Å; Y238-Q240 PolarHBondContact O-N 3.48Å; Q240-M245 HydrophobicContact CB-CG 4.25Å
241	L	96.6	Very high	95.6	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	24%	0.237	C	C	.	.			trans	-73	133.3	178	-58.5	-171.5	0	0	0	110.6	A210 K213 N214 W236 R239 S243 V244 M245 K293	A210-L241 HydrophobicContact CB-CD2 4.43Å; K213-L241 HydrophobicContact CB-CD1 3.56Å; K213-L241 HydrophobicContact CD-CD1 4.46Å; N214-L241 HydrophobicContact CB-CD2 4.26Å; N214-L241 WeakPolarHBondContact OD1-CA 3.43Å; W236-L241 HydrophobicContact CB-CB 4.41Å; W236-L241 HydrophobicContact CB-CD1 3.87Å; W236-L241 HydrophobicContact CB-CG 4.3Å; W236-L241 HydrophobicContact CD2-CD1 3.96Å; W236-L241 HydrophobicContact CE3-CD1 4.35Å; W236-L241 HydrophobicContact CG-CD1 3.7Å; W236-L241 PolarHBondContact O-N 3.24Å; R239-L241 VanDerWaalsContact C-N 3.25Å; R239-L241 HydrophobicContact CB-CD2 4.05Å; R239-L241 HydrophobicContact CB-CG 3.95Å; R239-L241 PolarHBondContact O-N 3.41Å; L241-S243 VanDerWaalsContact C-N 3.25Å; L241-S243 PolarHBondContact O-N 3Å; L241-V244 PolarHBondContact O-N 2.92Å; L241-M245 WeakPolarHBondContact O-CG 3.31Å; L241-M245 PolarHBondContact O-N 2.81Å; L241-K293 HydrophobicContact CD2-CB 3.81Å
242	S	96.5	Very high	95.6	Very high	37 Å²	37	47.7 Å²	47.7	26%	0.259	23%	0.227	S	C	.	.	H	α-helix	trans	-55	-39.3	-177.6	-66.9	0	0	0	0	112.7	N214 V244 M245 D246	N214-S242 PolarHBondContact OD1-N 3.24Å; S242-V244 PolarHBondContact O-N 3.15Å; S242-M245 PolarHBondContact O-N 2.99Å; S242-D246 WeakPolarHBondContact CB-OD2 3.15Å; S242-D246 WeakPolarHBondContact O-CB 3.33Å; S242-D246 PolarHBondContact O-N 2.9Å
243	S	97.1	Very high	95.7	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.014	23%	0.226	C	C	.	.	H	α-helix	trans	-53.9	-23.1	175.1	55.5	0	0	0	0	115.1	K213 N214 L216 L241	K213-S243 WeakPolarHBondContact O-CB 3.14Å; K213-S243 PolarHBondContact O-OG 2.99Å; N214-S243 WeakPolarHBondContact O-CB 3.12Å; N214-S243 PolarHBondContact O-N 3.45Å; L216-S243 VanDerWaalsContact O-CB 3.25Å; L216-S243 WeakPolarHBondContact O-CB 3.48Å; L241-S243 VanDerWaalsContact C-N 3.25Å; L241-S243 PolarHBondContact O-N 3Å
244	V	97.4	Very high	95.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-104.9	-48.5	174.2	172.2	0	0	0	0	112.1	F233 W236 Q237 L241 S242 D246 F247 Q248 L251 F263	F233-V244 HydrophobicContact CD1-CG2 3.74Å; F233-V244 HydrophobicContact CE1-CG2 4.35Å; W236-V244 HydrophobicContact CB-CG2 3.62Å; W236-V244 HydrophobicContact CE3-CG2 3.99Å; W236-V244 HydrophobicContact CG-CG2 4.5Å; Q237-V244 HydrophobicContact CB-CG1 3.97Å; Q237-V244 HydrophobicContact CG-CG1 4.36Å; L241-V244 PolarHBondContact O-N 2.92Å; S242-V244 PolarHBondContact O-N 3.15Å; V244-D246 PolarHBondContact O-N 2.94Å; V244-F247 CarbonylContact O-C 3.55Å; V244-F247 PolarHBondContact O-N 3.02Å; V244-F247 VanDerWaalsContact O-N 3.13Å; V244-Q248 WeakPolarHBondContact O-CA 3.31Å; V244-Q248 PolarHBondContact O-N 2.84Å; V244-L251 HydrophobicContact CB-CD1 4.16Å; V244-L251 HydrophobicContact CG1-CD1 3.99Å; V244-L251 HydrophobicContact CG2-CD1 3.92Å; V244-F263 HydrophobicContact CG1-CE1 4.39Å; V244-F263 HydrophobicContact CG1-CE2 4.15Å; V244-F263 HydrophobicContact CG1-CZ 3.51Å
245	M	96.3	Very high	95.4	Very high	78 Å²	78	52.9 Å²	52.9	38%	0.384	25%	0.253	S	S	.	.	H	α-helix	trans	-61.3	-35.9	-172.8	-64.3	-52.4	-58.4	0	0	112.4	Q237 Q240 L241 S242	Q237-M245 HydrophobicContact CG-SD 4.35Å; Q240-M245 HydrophobicContact CB-CG 4.25Å; L241-M245 WeakPolarHBondContact O-CG 3.31Å; L241-M245 PolarHBondContact O-N 2.81Å; S242-M245 PolarHBondContact O-N 2.99Å
246	D	96.1	Very high	95.1	Very high	103 Å²	103	57 Å²	57	55%	0.551	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-20.4	-178.1	-58.8	-25.2	0	0	0	112.4	S242 V244	S242-D246 WeakPolarHBondContact CB-OD2 3.15Å; S242-D246 WeakPolarHBondContact O-CB 3.33Å; S242-D246 PolarHBondContact O-N 2.9Å; V244-D246 PolarHBondContact O-N 2.94Å
247	F	97	Very high	94.7	Very high	28 Å²	28	66.3 Å²	66.3	12%	0.123	32%	0.324	C	S	.	.	S	Bend	trans	-133.2	25.8	-168.3	-60	-74.5	0	0	0	114	Y217 H219 V244 E249 D250 L251	Y217-F247 AromaticContact CD1-CD2 3.65Å; Y217-F247 HydrophobicContact CD1-CD2 3.65Å; Y217-F247 AromaticContact CD1-CE2 3.49Å; Y217-F247 HydrophobicContact CD1-CE2 3.49Å; Y217-F247 VanDerWaalsContact CD1-CE2 3.49Å; Y217-F247 AromaticContact CE1-CD2 3.81Å; Y217-F247 HydrophobicContact CE1-CD2 3.81Å; Y217-F247 AromaticContact CE1-CE2 3.39Å; Y217-F247 HydrophobicContact CE1-CE2 3.39Å; H219-F247 HydrophobicContact CB-CB 3.88Å; H219-F247 AromaticContact CD2-CD1 3.84Å; H219-F247 AromaticContact CD2-CD2 3.77Å; H219-F247 AromaticContact CD2-CG 3.49Å; H219-F247 VanDerWaalsContact CD2-CG 3.49Å; H219-F247 WeakPolarHBondContact CD2-CG 3.09Å; H219-F247 AromaticContact CE1-CD1 3.47Å; H219-F247 VanDerWaalsContact CE1-CD1 3.47Å; H219-F247 WeakPolarHBondContact CE1-CD1 3.26Å; H219-F247 AromaticContact CE1-CE1 3.68Å; H219-F247 AromaticContact CE1-CG 3.95Å; H219-F247 AromaticContact CG-CG 3.82Å; H219-F247 AromaticContact ND1-CD1 3.77Å; H219-F247 AromaticContact NE2-CD1 3.54Å; H219-F247 AromaticContact NE2-CD2 3.85Å; H219-F247 AromaticContact NE2-CE1 3.68Å; H219-F247 AromaticContact NE2-CE2 3.99Å; H219-F247 AromaticContact NE2-CG 3.62Å; H219-F247 AromaticContact NE2-CZ 3.9Å; V244-F247 CarbonylContact O-C 3.55Å; V244-F247 PolarHBondContact O-N 3.02Å; V244-F247 VanDerWaalsContact O-N 3.13Å; F247-E249 PolarHBondContact O-N 3.06Å; F247-E249 VanDerWaalsContact O-N 3.15Å; F247-D250 PolarHBondContact O-N 3.02Å; F247-L251 PolarHBondContact O-N 3.1Å; F247-L251 VanDerWaalsContact O-N 3.13Å
248	Q	94.6	Very high	94.5	Very high	74 Å²	74	70.4 Å²	70.4	35%	0.346	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-32.6	-175.3	-161.6	-175.6	-63.3	0	0	113	V244 N261 F263	V244-Q248 WeakPolarHBondContact O-CA 3.31Å; V244-Q248 PolarHBondContact O-N 2.84Å; Q248-N261 PolarHBondContact O-ND2 3.29Å; Q248-F263 HydrophobicContact CG-CD2 3.6Å; Q248-F263 HydrophobicContact CG-CE2 3.5Å; Q248-F263 VanDerWaalsContact CG-CE2 3.5Å; Q248-F263 HydrophobicContact CG-CZ 4.36Å
249	E	94.1	Very high	94.5	Very high	176 Å²	176	68.5 Å²	68.5	82%	0.822	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-32.7	178.9	-61.8	-173	173.2	0	0	112.6	F247	F247-E249 PolarHBondContact O-N 3.06Å; F247-E249 VanDerWaalsContact O-N 3.15Å
250	D	96.6	Very high	94.6	Very high	76 Å²	76	69.9 Å²	69.9	41%	0.406	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.9	-178.3	-65.8	-46.5	0	0	0	113.1	H219 N220 F247 Y252	H219-D250 HydrophobicContact CB-CB 3.85Å; N220-D250 PolarHBondContact N-O 3.25Å; F247-D250 PolarHBondContact O-N 3.02Å; D250-Y252 WeakPolarHBondContact O-CD1 3.42Å; D250-Y252 PolarHBondContact O-N 3.06Å; D250-Y252 VanDerWaalsContact O-N 3.14Å
251	L	96.5	Very high	94.6	Very high	2 Å²	2	66.4 Å²	66.4	1%	0.01	33%	0.333	C	S	.	.			trans	-79.7	92	173.3	-78	169.1	0	0	0	110.3	H219 F233 V244 F247 V262 F263	H219-L251 HydrophobicContact CB-CD2 3.96Å; H219-L251 HydrophobicContact CB-CG 4.07Å; F233-L251 HydrophobicContact CD1-CD1 4.21Å; F233-L251 HydrophobicContact CD1-CD2 4.26Å; F233-L251 HydrophobicContact CE1-CD1 4.37Å; F233-L251 HydrophobicContact CE1-CD2 3.71Å; F233-L251 HydrophobicContact CE2-CD2 4.39Å; F233-L251 HydrophobicContact CZ-CD2 3.77Å; V244-L251 HydrophobicContact CB-CD1 4.16Å; V244-L251 HydrophobicContact CG1-CD1 3.99Å; V244-L251 HydrophobicContact CG2-CD1 3.92Å; F247-L251 PolarHBondContact O-N 3.1Å; F247-L251 VanDerWaalsContact O-N 3.13Å; L251-V262 PolarHBondContact O-N 3.43Å; L251-F263 HydrophobicContact CB-CE2 4.15Å; L251-F263 HydrophobicContact CD1-CE2 3.87Å; L251-F263 HydrophobicContact CD1-CZ 4.1Å
252	Y	95.1	Very high	94.5	Very high	41 Å²	41	66.4 Å²	66.4	16%	0.161	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	160.9	176.3	61.9	-106.4	0	0	0	112.8	N220 N221 D250 L259 H260	N220-Y252 VanDerWaalsContact CA-CE1 3.46Å; N220-Y252 WeakPolarHBondContact CA-OH 3.42Å; N220-Y252 HydrophobicContact CB-CE1 4.2Å; N220-Y252 PolarHBondContact O-OH 3.44Å; N220-Y252 VanDerWaalsContact OD1-CE1 3.22Å; N220-Y252 WeakPolarHBondContact OD1-CE1 3.49Å; N220-Y252 VanDerWaalsContact OD1-CZ 3.3Å; N220-Y252 PolarHBondContact OD1-OH 3.35Å; N221-Y252 VanDerWaalsContact C-CE2 3.49Å; N221-Y252 WeakPolarHBondContact O-CD2 3.28Å; N221-Y252 WeakPolarHBondContact O-CE2 3.35Å; D250-Y252 WeakPolarHBondContact O-CD1 3.42Å; D250-Y252 PolarHBondContact O-N 3.06Å; D250-Y252 VanDerWaalsContact O-N 3.14Å; Y252-L259 HydrophobicContact CD1-CD2 3.76Å; Y252-L259 HydrophobicContact CD1-CG 4.35Å; Y252-L259 HydrophobicContact CD2-CD1 3.31Å; Y252-L259 HydrophobicContact CD2-CD2 3.87Å; Y252-L259 HydrophobicContact CD2-CG 3.59Å; Y252-L259 HydrophobicContact CE1-CD2 4.11Å; Y252-L259 HydrophobicContact CE2-CD1 3.53Å; Y252-L259 HydrophobicContact CE2-CD2 4.24Å; Y252-L259 HydrophobicContact CE2-CG 4.19Å; Y252-L259 HydrophobicContact CG-CD1 3.96Å; Y252-L259 HydrophobicContact CG-CD2 3.61Å; Y252-L259 HydrophobicContact CG-CG 3.68Å; Y252-H260 CarbonylContact C-O 3.15Å; Y252-H260 WeakPolarHBondContact CA-O 3.33Å; Y252-H260 VanDerWaalsContact CB-O 3.31Å; Y252-H260 WeakPolarHBondContact CB-O 3.44Å
253	C	96.5	Very high	94.3	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	166.9	169.5	65.3	0	0	0	0	109.6	L223 C225 L229 H260 V262	L223-C253 HydrophobicContact CB-CB 4.21Å; L223-C253 CarbonylContact O-C 3.59Å; L223-C253 WeakPolarHBondContact O-CA 3.25Å; L223-C253 VanDerWaalsContact O-CB 3.29Å; L223-C253 WeakPolarHBondContact O-CB 3.45Å; C225-C253 WeakPolarHBondContact CA-SG 3.19Å; C225-C253 HydrophobicContact CB-CB 3.9Å; C225-C253 WeakPolarHBondContact CB-SG 3.39Å; C225-C253 WeakPolarHBondContact SG-CB 3.28Å; C225-C253 CovalentContact SG-SG 2.03Å; C225-C253 PolarHBondContact SG-SG 3.15Å; L229-C253 HydrophobicContact CD2-CB 3.86Å; C253-H260 PolarHBondContact N-O 3.46Å; C253-H260 PolarHBondContact O-N 3.29Å; C253-V262 HydrophobicContact CB-CG2 4.05Å
254	M	94.2	Very high	93.9	Very high	69 Å²	69	71.3 Å²	71.3	34%	0.34	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.8	-178.4	-166.7	177.2	-63.2	0	0	109.5	P222 L223 C225 K258	P222-M254 HydrophobicContact CB-CE 3.85Å; L223-M254 PolarHBondContact O-N 3.28Å; C225-M254 PolarHBondContact N-O 3.35Å; C225-M254 VanDerWaalsContact SG-C 3.52Å; C225-M254 PolarHBondContact SG-N 2.6Å; C225-M254 VanDerWaalsContact SG-N 3.4Å; M254-K258 WeakPolarHBondContact CA-O 3.45Å
255	N	91.7	Very high	93.3	Very high	56 Å²	56	71.7 Å²	71.7	30%	0.299	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.3	165.8	-175.5	9.2	0	0	0	108.2	C225 K257 K258 F267	C225-N255 HydrophobicContact CB-CB 4.08Å; N255-K257 PolarHBondContact O-N 2.69Å; N255-K257 VanDerWaalsContact O-N 3.12Å; N255-K258 PolarHBondContact N-O 3.46Å; N255-K258 PolarHBondContact O-N 2.64Å; N255-F267 HydrophobicContact CB-CE2 4.09Å; N255-F267 HydrophobicContact CB-CZ 4.11Å; N255-F267 WeakPolarHBondContact ND2-CE2 3.29Å
256	S	88.1	Confident	92.6	Very high	103 Å²	103	72.1 Å²	72.1	72%	0.72	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	39.5	177.1	-58.9	0	0	0	0	114	K258	S256-K258 PolarHBondContact O-N 2.94Å
257	K	87.2	Confident	92	Very high	196 Å²	196	71 Å²	71	85%	0.852	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	9	-176.4	-52.6	179.8	179.8	177.8	0	115.8	N255	N255-K257 PolarHBondContact O-N 2.69Å; N255-K257 VanDerWaalsContact O-N 3.12Å
258	K	92.1	Very high	91.6	Very high	146 Å²	146	72.4 Å²	72.4	64%	0.635	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	144.3	171.8	-68.4	-174.6	178.9	-178.7	0	110.1	M254 N255 S256 H260	M254-K258 WeakPolarHBondContact CA-O 3.45Å; N255-K258 PolarHBondContact N-O 3.46Å; N255-K258 PolarHBondContact O-N 2.64Å; S256-K258 PolarHBondContact O-N 2.94Å; K258-H260 PolarHBondContact O-CD2 3.06Å
259	L	93	Very high	91.4	Very high	102 Å²	102	76 Å²	76	53%	0.534	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.7	175.1	-142.8	78	0	0	0	109.2	Y252	Y252-L259 HydrophobicContact CD1-CD2 3.76Å; Y252-L259 HydrophobicContact CD1-CG 4.35Å; Y252-L259 HydrophobicContact CD2-CD1 3.31Å; Y252-L259 HydrophobicContact CD2-CD2 3.87Å; Y252-L259 HydrophobicContact CD2-CG 3.59Å; Y252-L259 HydrophobicContact CE1-CD2 4.11Å; Y252-L259 HydrophobicContact CE2-CD1 3.53Å; Y252-L259 HydrophobicContact CE2-CD2 4.24Å; Y252-L259 HydrophobicContact CE2-CG 4.19Å; Y252-L259 HydrophobicContact CG-CD1 3.96Å; Y252-L259 HydrophobicContact CG-CD2 3.61Å; Y252-L259 HydrophobicContact CG-CG 3.68Å
260	H	94.6	Very high	91.3	Very high	52 Å²	52	68.9 Å²	68.9	24%	0.241	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.9	176.2	-65	-89.2	0	0	0	109	Y252 C253 K258 V262 L265 F267	Y252-H260 CarbonylContact C-O 3.15Å; Y252-H260 WeakPolarHBondContact CA-O 3.33Å; Y252-H260 VanDerWaalsContact CB-O 3.31Å; Y252-H260 WeakPolarHBondContact CB-O 3.44Å; C253-H260 PolarHBondContact N-O 3.46Å; C253-H260 PolarHBondContact O-N 3.29Å; K258-H260 PolarHBondContact O-CD2 3.06Å; H260-V262 PolarHBondContact O-N 2.88Å; H260-L265 HydrophobicContact CB-CD2 3.89Å; H260-F267 HydrophobicContact CB-CE1 4.08Å; H260-F267 HydrophobicContact CB-CZ 4.47Å; H260-F267 AromaticContact CE1-CE1 3.84Å; H260-F267 AromaticContact CG-CE1 3.61Å; H260-F267 AromaticContact ND1-CE1 3.47Å; H260-F267 WeakPolarHBondContact ND1-CE1 3.35Å
261	N	94.6	Very high	90.9	Very high	53 Å²	53	67.5 Å²	67.5	28%	0.283	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	134.4	170.2	-174.3	-70.7	0	0	0	108.8	Q248 F263 N264	Q248-N261 PolarHBondContact O-ND2 3.29Å; N261-F263 PolarHBondContact O-N 3.28Å; N261-F263 VanDerWaalsContact O-N 3.16Å; N261-F263 WeakPolarHBondContact OD1-CB 3.46Å; N261-F263 WeakPolarHBondContact OD1-CD2 3.24Å; N261-F263 PolarHBondContact OD1-N 3.34Å; N261-N264 CarbonylContact O-C 3.41Å; N261-N264 PolarHBondContact O-N 2.78Å
262	V	94.2	Very high	90.4	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.5	-174.5	175.7	0	0	0	0	112.1	L229 Y230 F233 L251 C253 H260 N264 L265	L229-V262 HydrophobicContact CD2-CG2 4.24Å; L229-V262 HydrophobicContact CG-CG1 4.4Å; Y230-V262 WeakPolarHBondContact CD2-O 3.36Å; F233-V262 HydrophobicContact CB-CG1 4.09Å; F233-V262 HydrophobicContact CD2-CG1 3.78Å; F233-V262 HydrophobicContact CG-CG1 4.31Å; L251-V262 PolarHBondContact O-N 3.43Å; C253-V262 HydrophobicContact CB-CG2 4.05Å; H260-V262 PolarHBondContact O-N 2.88Å; V262-N264 VanDerWaalsContact C-N 3.31Å; V262-N264 PolarHBondContact O-N 3.18Å; V262-L265 WeakPolarHBondContact O-CG 3.47Å
263	F	92.7	Very high	90	Very high	38 Å²	38	75.8 Å²	75.8	17%	0.167	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-5.3	178.9	-56.7	-74.1	0	0	0	113.6	F233 Q237 V244 Q248 L251 N261	F233-F263 HydrophobicContact CB-CE1 3.94Å; F233-F263 HydrophobicContact CB-CZ 3.91Å; Q237-F263 HydrophobicContact CB-CE1 3.96Å; Q237-F263 HydrophobicContact CB-CZ 4.42Å; Q237-F263 HydrophobicContact CG-CE1 4.4Å; V244-F263 HydrophobicContact CG1-CE1 4.39Å; V244-F263 HydrophobicContact CG1-CE2 4.15Å; V244-F263 HydrophobicContact CG1-CZ 3.51Å; Q248-F263 HydrophobicContact CG-CD2 3.6Å; Q248-F263 HydrophobicContact CG-CE2 3.5Å; Q248-F263 VanDerWaalsContact CG-CE2 3.5Å; Q248-F263 HydrophobicContact CG-CZ 4.36Å; L251-F263 HydrophobicContact CB-CE2 4.15Å; L251-F263 HydrophobicContact CD1-CE2 3.87Å; L251-F263 HydrophobicContact CD1-CZ 4.1Å; N261-F263 PolarHBondContact O-N 3.28Å; N261-F263 VanDerWaalsContact O-N 3.16Å; N261-F263 WeakPolarHBondContact OD1-CB 3.46Å; N261-F263 WeakPolarHBondContact OD1-CD2 3.24Å; N261-F263 PolarHBondContact OD1-N 3.34Å
264	N	90.1	Very high	89.5	Confident	105 Å²	105	83.7 Å²	83.7	56%	0.561	43%	0.433	S	S	*	.			trans	-125.6	69.2	177.9	-169.6	-4.8	0	0	0	111.2	N261 V262	N261-N264 CarbonylContact O-C 3.41Å; N261-N264 PolarHBondContact O-N 2.78Å; V262-N264 VanDerWaalsContact C-N 3.31Å; V262-N264 PolarHBondContact O-N 3.18Å
265	L	84.4	Confident	89	Confident	8 Å²	8	84.9 Å²	84.9	4%	0.042	44%	0.437	C	S	.	.			trans	-105.9	45.2	176.3	-54.8	-177.6	0	0	0	112	C225 H260 V262 F267 L268	C225-L265 HydrophobicContact CB-CD1 4.47Å; C225-L265 HydrophobicContact CB-CD2 4.41Å; H260-L265 HydrophobicContact CB-CD2 3.89Å; V262-L265 WeakPolarHBondContact O-CG 3.47Å; L265-F267 HydrophobicContact CB-CE1 4.29Å; L265-F267 HydrophobicContact CB-CZ 4.48Å; L265-F267 HydrophobicContact CD2-CE1 3.64Å; L265-F267 HydrophobicContact CD2-CZ 3.71Å; L265-F267 PolarHBondContact O-N 3.18Å; L265-L268 HydrophobicContact CB-CD1 4.24Å; L265-L268 HydrophobicContact CD1-CD1 4.04Å; L265-L268 PolarHBondContact O-N 3.06Å
266	S	80.2	Confident	88.8	Confident	86 Å²	86	92.3 Å²	92.3	60%	0.601	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-52.5	-30.3	178.2	48.7	0	0	0	0	113.5	L268 N269	S266-L268 VanDerWaalsContact C-N 3.28Å; S266-L268 PolarHBondContact O-N 2.79Å; S266-N269 PolarHBondContact O-N 3.09Å; S266-N269 PolarHBondContact O-OD1 3.09Å
267	F	85.3	Confident	88.9	Confident	81 Å²	81	88.4 Å²	88.4	36%	0.355	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-70.4	-16.3	178.5	64.3	-91.2	0	0	0	114.9	C225 N255 H260 L265	C225-F267 HydrophobicContact CB-CZ 4.25Å; N255-F267 HydrophobicContact CB-CE2 4.09Å; N255-F267 HydrophobicContact CB-CZ 4.11Å; N255-F267 WeakPolarHBondContact ND2-CE2 3.29Å; H260-F267 HydrophobicContact CB-CE1 4.08Å; H260-F267 HydrophobicContact CB-CZ 4.47Å; H260-F267 AromaticContact CE1-CE1 3.84Å; H260-F267 AromaticContact CG-CE1 3.61Å; H260-F267 AromaticContact ND1-CE1 3.47Å; H260-F267 WeakPolarHBondContact ND1-CE1 3.35Å; L265-F267 HydrophobicContact CB-CE1 4.29Å; L265-F267 HydrophobicContact CB-CZ 4.48Å; L265-F267 HydrophobicContact CD2-CE1 3.64Å; L265-F267 HydrophobicContact CD2-CZ 3.71Å; L265-F267 PolarHBondContact O-N 3.18Å
268	L	88.2	Confident	89.2	Confident	56 Å²	56	84.4 Å²	84.4	29%	0.293	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-95.6	-9.6	177.7	-67.6	176.7	0	0	0	113.4	C225 L265 S266 C270	C225-L268 HydrophobicContact CB-CD1 4.34Å; L265-L268 HydrophobicContact CB-CD1 4.24Å; L265-L268 HydrophobicContact CD1-CD1 4.04Å; L265-L268 PolarHBondContact O-N 3.06Å; S266-L268 VanDerWaalsContact C-N 3.28Å; S266-L268 PolarHBondContact O-N 2.79Å; L268-C270 WeakPolarHBondContact CB-SG 3.38Å; L268-C270 PolarHBondContact O-N 3.02Å
269	N	90.7	Very high	89.2	Confident	150 Å²	150	83.8 Å²	83.8	80%	0.802	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	42.1	-172.4	-66.9	-29.9	0	0	0	113.2	S266 G271	S266-N269 PolarHBondContact O-N 3.09Å; S266-N269 PolarHBondContact O-OD1 3.09Å; N269-G271 PolarHBondContact O-N 3.35Å
270	C	90.3	Very high	89.2	Confident	27 Å²	27	79 Å²	79	18%	0.182	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-65.7	132.5	176.2	-55.7	0	0	0	0	110.3	C227 Y230 L268	C227-C270 WeakPolarHBondContact CA-SG 3.37Å; C227-C270 HydrophobicContact CB-CB 3.79Å; C227-C270 WeakPolarHBondContact CB-SG 3.1Å; C227-C270 WeakPolarHBondContact SG-CA 3.37Å; C227-C270 WeakPolarHBondContact SG-CB 3.44Å; C227-C270 CovalentContact SG-SG 2.05Å; C227-C270 PolarHBondContact SG-SG 2.87Å; Y230-C270 HydrophobicContact CD1-CB 3.57Å; Y230-C270 HydrophobicContact CE1-CB 3.97Å; Y230-C270 HydrophobicContact CG-CB 4.21Å; L268-C270 WeakPolarHBondContact CB-SG 3.38Å; L268-C270 PolarHBondContact O-N 3.02Å
271	G	88.1	Confident	89.2	Confident	47 Å²	47	78 Å²	78	49%	0.485	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-67.1	144	174.7	0	0	0	0	0	111.4	Y230 N269	Y230-G271 WeakPolarHBondContact CE1-O 3.44Å; N269-G271 PolarHBondContact O-N 3.35Å
272	E	86.2	Confident	89	Confident	157 Å²	157	78 Å²	78	73%	0.734	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-54.4	143	176.1	-69	-177	167	0	0	111.4	K274	E272-K274 PolarHBondContact O-N 3.32Å
273	Y	86.6	Confident	88.7	Confident	60 Å²	60	79.6 Å²	79.6	24%	0.235	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-61.2	125.1	174.4	172.7	-97.3	0	0	0	110	H235 Y238 E275	H235-Y273 HydrophobicContact CB-CD2 3.96Å; H235-Y273 HydrophobicContact CB-CE1 4.41Å; H235-Y273 HydrophobicContact CB-CE2 3.54Å; H235-Y273 AromaticContact CG-CE2 3.98Å; H235-Y273 AromaticContact CG-CZ 3.89Å; H235-Y273 AromaticContact ND1-CE2 3.84Å; H235-Y273 AromaticContact ND1-CZ 3.3Å; H235-Y273 VanDerWaalsContact ND1-CZ 3.3Å; H235-Y273 PolarHBondContact ND1-OH 3.02Å; Y238-Y273 HydrophobicContact CD1-CE1 4.18Å; Y238-Y273 HydrophobicContact CG-CE1 4.26Å; Y273-E275 HydrophobicContact CE1-CB 4.34Å
274	K	85.9	Confident	88.7	Confident	166 Å²	166	80.1 Å²	80.1	72%	0.722	41%	0.405	S	S	*	.			trans	-120.9	125.3	171.8	-67.1	-176.3	-179.1	-178.1	0	108.3	E272 R276	E272-K274 PolarHBondContact O-N 3.32Å; K274-R276 PolarHBondContact O-N 3.22Å
275	E	85.2	Confident	88.7	Confident	93 Å²	93	80 Å²	80	44%	0.435	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-61.1	129.5	172	-170.4	157.2	-133.4	0	0	109.3	Y273	Y273-E275 HydrophobicContact CE1-CB 4.34Å
276	R	86.3	Confident	89.1	Confident	213 Å²	213	80.8 Å²	80.8	80%	0.804	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-89.1	131.8	-179	-66.7	-174.2	-177	-180	2.1	108.8	K274	K274-R276 PolarHBondContact O-N 3.22Å
277	A	91.4	Very high	89.7	Confident	20 Å²	20	81.2 Å²	81.2	17%	0.165	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-62.7	148.3	168.3	0	0	0	0	0	110.2	E355 K357	A277-E355 CarbonylContact C-O 3.59Å; A277-E355 WeakPolarHBondContact CA-O 3.24Å; A277-E355 HydrophobicContact CB-CB 3.98Å; A277-E355 HydrophobicContact CB-CG 4.03Å; A277-K357 HydrophobicContact CB-CD 3.69Å; A277-K357 HydrophobicContact CB-CG 3.88Å
278	W	92.4	Very high	90.2	Very high	113 Å²	113	77.3 Å²	77.3	43%	0.428	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	132.3	165.5	-69.8	79.9	0	0	0	108.4	L286 I288 E355 L356 K357	W278-L286 HydrophobicContact CE3-CD1 4.05Å; W278-L286 HydrophobicContact CZ3-CD1 4.32Å; W278-I288 HydrophobicContact CB-CD1 4.47Å; W278-I288 HydrophobicContact CD2-CD1 4.42Å; W278-I288 HydrophobicContact CD2-CG1 4.3Å; W278-I288 HydrophobicContact CE3-CG1 4.47Å; W278-I288 HydrophobicContact CG-CD1 4.2Å; W278-I288 HydrophobicContact CZ2-CG2 4.21Å; W278-E355 PolarHBondContact N-O 2.73Å; W278-L356 HydrophobicContact CB-CD1 3.96Å; W278-K357 PolarHBondContact O-N 3.27Å
279	E	93.3	Very high	90.4	Very high	133 Å²	133	80.5 Å²	80.5	62%	0.621	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.6	177.7	-67	178.7	176.4	0	0	108.6	K357	E279-K357 WeakPolarHBondContact CA-O 3.25Å; E279-K357 HydrophobicContact CG-CB 4.45Å
280	A	93.1	Very high	90.6	Very high	2 Å²	2	73.5 Å²	73.5	2%	0.017	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	154.1	177.8	0	0	0	0	0	110.6	L286 V331 L356 K357 V358 H359	A280-L286 HydrophobicContact CB-CD2 4.26Å; A280-V331 HydrophobicContact CB-CG1 4.16Å; A280-V331 HydrophobicContact CB-CG2 4.35Å; A280-L356 HydrophobicContact CB-CD1 4.05Å; A280-K357 PolarHBondContact N-O 3.13Å; A280-V358 CarbonylContact O-C 3.51Å; A280-V358 WeakPolarHBondContact O-CA 3.49Å; A280-H359 PolarHBondContact O-N 3.12Å
281	H	93.2	Very high	90.7	Very high	30 Å²	30	74.1 Å²	74.1	14%	0.139	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	160.3	174.9	-62.2	-81.8	0	0	0	110.7	G283 D284 H359 F361 L363	H281-G283 PolarHBondContact O-N 3.22Å; H281-D284 WeakPolarHBondContact CB-OD2 3.34Å; H281-D284 IonicContact CD2-OD2 3.64Å; H281-D284 IonicContact CG-OD2 3.91Å; H281-D284 PolarHBondContact N-OD2 3.46Å; H281-D284 WeakPolarHBondContact O-CB 3.27Å; H281-D284 PolarHBondContact O-N 2.99Å; H281-D284 VanDerWaalsContact O-N 3.12Å; H281-H359 AromaticContact CE1-CD2 3.64Å; H281-H359 AromaticContact ND1-CD2 3.95Å; H281-F361 WeakPolarHBondContact CB-O 3.42Å; H281-F361 AromaticContact CE1-CE2 3.35Å; H281-F361 WeakPolarHBondContact CE1-CE2 3.2Å; H281-F361 AromaticContact CE1-CZ 3.44Å; H281-F361 VanDerWaalsContact CE1-CZ 3.44Å; H281-F361 WeakPolarHBondContact CE1-CZ 3.43Å; H281-F361 AromaticContact ND1-CD2 3.71Å; H281-F361 AromaticContact ND1-CE2 3.19Å; H281-F361 WeakPolarHBondContact ND1-CE2 3.5Å; H281-F361 AromaticContact ND1-CZ 3.53Å; H281-L363 HydrophobicContact CB-CB 4.22Å
282	L	91.4	Very high	91	Very high	52 Å²	52	72.2 Å²	72.2	27%	0.272	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	131.6	176.6	-168	81.4	0	0	0	109.7	D284 V333 H359 F361 T362	L282-D284 VanDerWaalsContact C-N 3.3Å; L282-D284 PolarHBondContact O-N 2.87Å; L282-V333 HydrophobicContact CD1-CG2 3.91Å; L282-H359 PolarHBondContact N-O 3.33Å; L282-F361 PolarHBondContact N-O 2.71Å; L282-T362 HydrophobicContact CB-CG2 3.97Å; L282-T362 HydrophobicContact CD2-CG2 4.18Å; L282-T362 HydrophobicContact CG-CG2 4.44Å; L282-T362 VanDerWaalsContact O-CG2 3.31Å; L282-T362 WeakPolarHBondContact O-CG2 3.47Å
283	G	88.3	Confident	91.4	Very high	34 Å²	34	66.6 Å²	66.6	35%	0.351	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	-2.6	178.6	0	0	0	0	0	116	H281 V331	H281-G283 PolarHBondContact O-N 3.22Å; G283-V331 PolarHBondContact N-O 3.23Å
284	D	91.2	Very high	91.6	Very high	49 Å²	49	67.4 Å²	67.4	26%	0.262	32%	0.323	S	S	.	.			trans	-64.9	150.1	174.8	-73.4	-11.7	0	0	0	111	H281 L282 V331	H281-D284 WeakPolarHBondContact CB-OD2 3.34Å; H281-D284 IonicContact CD2-OD2 3.64Å; H281-D284 IonicContact CG-OD2 3.91Å; H281-D284 PolarHBondContact N-OD2 3.46Å; H281-D284 WeakPolarHBondContact O-CB 3.27Å; H281-D284 PolarHBondContact O-N 2.99Å; H281-D284 VanDerWaalsContact O-N 3.12Å; L282-D284 VanDerWaalsContact C-N 3.3Å; L282-D284 PolarHBondContact O-N 2.87Å; D284-V331 VanDerWaalsContact O-CG2 3.29Å; D284-V331 WeakPolarHBondContact O-CG2 3.12Å; D284-V331 PolarHBondContact O-N 3.09Å
285	T	91.7	Very high	91.8	Very high	102 Å²	102	63.7 Å²	63.7	63%	0.626	31%	0.309	S	S	*	.			trans	-96.6	120.3	165	-57.1	0	0	0	0	108.2	L327 F328 Q329	T285-L327 HydrophobicContact CG2-CD1 4.25Å; T285-F328 WeakPolarHBondContact CA-O 3.41Å; T285-F328 WeakPolarHBondContact CG2-O 3.45Å; T285-Q329 PolarHBondContact OG1-O 3.43Å
286	L	92.3	Very high	92	Very high	26 Å²	26	63.3 Å²	63.3	14%	0.136	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.7	-175.4	-177.7	67	0	0	0	110.9	W278 A280 I288 F328 V331 L356	W278-L286 HydrophobicContact CE3-CD1 4.05Å; W278-L286 HydrophobicContact CZ3-CD1 4.32Å; A280-L286 HydrophobicContact CB-CD2 4.26Å; L286-I288 HydrophobicContact CD2-CD1 3.83Å; L286-I288 HydrophobicContact CD2-CG1 3.84Å; L286-I288 HydrophobicContact CG-CD1 4.49Å; L286-I288 HydrophobicContact CG-CG1 3.96Å; L286-F328 HydrophobicContact CB-CB 4.23Å; L286-F328 HydrophobicContact CB-CD2 4.19Å; L286-F328 HydrophobicContact CD2-CD2 4.36Å; L286-F328 HydrophobicContact CG-CD2 4.45Å; L286-F328 PolarHBondContact N-O 2.99Å; L286-F328 PolarHBondContact O-N 3.15Å; L286-V331 HydrophobicContact CB-CG2 4.17Å; L286-L356 HydrophobicContact CD2-CD1 3.52Å; L286-L356 HydrophobicContact CD2-CD2 4.44Å
287	I	93.3	Very high	92.2	Very high	94 Å²	94	53.9 Å²	53.9	48%	0.482	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	116	173.3	-58.4	172.7	0	0	0	108.4	L326 L327	I287-L326 CarbonylContact C-O 3.15Å; I287-L326 WeakPolarHBondContact CA-O 3.37Å; I287-L327 HydrophobicContact CD1-CD1 4.18Å; I287-L327 HydrophobicContact CG1-CD1 3.6Å
288	I	94.2	Very high	92.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	112.3	175.6	-51.6	-178.6	0	0	0	108.7	W278 L286 W301 L326 F328 V354	W278-I288 HydrophobicContact CB-CD1 4.47Å; W278-I288 HydrophobicContact CD2-CD1 4.42Å; W278-I288 HydrophobicContact CD2-CG1 4.3Å; W278-I288 HydrophobicContact CE3-CG1 4.47Å; W278-I288 HydrophobicContact CG-CD1 4.2Å; W278-I288 HydrophobicContact CZ2-CG2 4.21Å; L286-I288 HydrophobicContact CD2-CD1 3.83Å; L286-I288 HydrophobicContact CD2-CG1 3.84Å; L286-I288 HydrophobicContact CG-CD1 4.49Å; L286-I288 HydrophobicContact CG-CG1 3.96Å; I288-W301 HydrophobicContact CG2-CH2 4.19Å; I288-L326 HydrophobicContact CB-CB 4.32Å; I288-L326 PolarHBondContact N-O 3.17Å; I288-L326 PolarHBondContact O-N 3.01Å; I288-F328 HydrophobicContact CD1-CE2 3.91Å; I288-F328 HydrophobicContact CG1-CE2 4.29Å; I288-V354 HydrophobicContact CD1-CG2 4.41Å; I288-V354 HydrophobicContact CG2-CB 4.43Å; I288-V354 HydrophobicContact CG2-CG1 4.21Å; I288-V354 HydrophobicContact CG2-CG2 4.08Å
289	K	93.4	Very high	92.4	Very high	123 Å²	123	54.7 Å²	54.7	54%	0.535	31%	0.306	S	S	.	.			trans	-75.4	133.7	177.6	-64.7	-178.3	178.9	175.2	0	109.9	D291	K289-D291 VanDerWaalsContact C-N 3.34Å; K289-D291 PolarHBondContact O-N 2.87Å
290	C	94	Very high	92.4	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.014	28%	0.284	C	S	.	.			trans	-75.5	92.8	163.2	-178.9	0	0	0	0	108.3	T292 K299 W301 C341	C290-T292 PolarHBondContact O-N 2.97Å; C290-K299 HydrophobicContact CB-CD 3.96Å; C290-K299 HydrophobicContact CB-CG 4.41Å; C290-K299 PolarHBondContact O-NZ 3.29Å; C290-W301 HydrophobicContact CB-CZ2 3.59Å; C290-C341 HydrophobicContact CB-CB 3.81Å; C290-C341 WeakPolarHBondContact CB-SG 3.28Å; C290-C341 WeakPolarHBondContact SG-CB 3.12Å; C290-C341 CovalentContact SG-SG 2.03Å; C290-C341 PolarHBondContact SG-SG 2.98Å
291	D	93.9	Very high	92.5	Very high	41 Å²	41	49.6 Å²	49.6	22%	0.219	28%	0.284	C	S	.	.			trans	-81.7	73.7	-168.8	-174.7	38.2	0	0	0	111.9	P209 A210 R239 K289 L352	P209-D291 VanDerWaalsContact CA-OD1 3.31Å; P209-D291 WeakPolarHBondContact CA-OD1 3.46Å; A210-D291 WeakPolarHBondContact CB-O 3.34Å; A210-D291 WeakPolarHBondContact CB-OD2 3.5Å; A210-D291 PolarHBondContact N-OD1 2.79Å; A210-D291 PolarHBondContact N-OD2 3.34Å; R239-D291 PolarHBondContact NH1-O 3.31Å; R239-D291 IonicContact NH1-OD2 2.64Å; R239-D291 PolarHBondContact NH2-O 2.94Å; K289-D291 VanDerWaalsContact C-N 3.34Å; K289-D291 PolarHBondContact O-N 2.87Å; D291-L352 WeakPolarHBondContact O-CD1 3.29Å
292	T	94.5	Very high	92.5	Very high	6 Å²	6	49 Å²	49	4%	0.037	28%	0.282	C	S	.	.			trans	-76.3	148.8	-175	54.9	0	0	0	0	113.1	W211 C290 Q294 M297 A343 E350 L352	W211-T292 PolarHBondContact N-O 2.94Å; C290-T292 PolarHBondContact O-N 2.97Å; T292-Q294 PolarHBondContact O-N 3.02Å; T292-Q294 PolarHBondContact OG1-O 3.02Å; T292-M297 HydrophobicContact CG2-CE 4.26Å; T292-M297 HydrophobicContact CG2-SD 3.98Å; T292-A343 HydrophobicContact CG2-CB 3.37Å; T292-E350 WeakPolarHBondContact CA-OE2 3.48Å; T292-L352 HydrophobicContact CG2-CD1 4.37Å
293	K	93	Very high	92.6	Very high	39 Å²	39	47.5 Å²	47.5	17%	0.17	28%	0.275	C	S	.	.	S	Bend	trans	-74.1	-5.2	179.1	73.1	-175.7	178.9	178.4	0	115.1	W211 N214 L241 M297 F348 E350	W211-K293 VanDerWaalsContact CA-O 3.31Å; W211-K293 WeakPolarHBondContact CA-O 3.14Å; N214-K293 HydrophobicContact CB-CB 4.27Å; L241-K293 HydrophobicContact CD2-CB 3.81Å; K293-M297 HydrophobicContact CG-CE 4.36Å; K293-F348 HydrophobicContact CD-CE2 3.93Å; K293-F348 HydrophobicContact CD-CZ 3.96Å; K293-F348 HydrophobicContact CG-CE2 3.65Å; K293-F348 HydrophobicContact CG-CZ 3.5Å; K293-E350 PolarHBondContact N-OE2 2.95Å
294	Q	91.5	Very high	92.8	Very high	77 Å²	77	49 Å²	49	36%	0.36	28%	0.278	S	S	.	.	S	Bend	trans	-138.7	150	173.5	-171.5	-178.1	-30.1	0	0	109.7	T292 M297 F348	T292-Q294 PolarHBondContact O-N 3.02Å; T292-Q294 PolarHBondContact OG1-O 3.02Å; Q294-M297 HydrophobicContact CB-CE 3.48Å; Q294-M297 VanDerWaalsContact CB-CE 3.48Å; Q294-M297 VanDerWaalsContact N-CE 3.33Å; Q294-F348 HydrophobicContact CB-CE1 4.45Å; Q294-F348 HydrophobicContact CB-CZ 3.89Å
295	Q	90	Very high	92.7	Very high	88 Å²	88	50.4 Å²	50.4	41%	0.411	29%	0.292	S	S	.	.	S	Bend	trans	-80.6	161	174	-64.3	-175.1	-31.4	0	0	111.7	W211 M297	W211-Q295 HydrophobicContact CB-CG 4.23Å; W211-Q295 HydrophobicContact CD2-CG 3.63Å; W211-Q295 HydrophobicContact CE3-CG 3.99Å; W211-Q295 HydrophobicContact CG-CG 3.71Å; Q295-M297 VanDerWaalsContact C-N 3.29Å; Q295-M297 PolarHBondContact O-N 3.21Å
296	G	88.8	Confident	92.6	Very high	86 Å²	86	51.8 Å²	51.8	89%	0.887	30%	0.296	S	S	*	.	S	Bend	trans	77	6.4	173.3	0	0	0	0	0	115.7
297	M	92.2	Very high	92.5	Very high	15 Å²	15	56.7 Å²	56.7	7%	0.074	32%	0.318	C	S	.	.			trans	-69.9	144.8	174.2	-62	-167.2	-144	0	0	111.9	T292 K293 Q294 Q295 A343 M344 F348	T292-M297 HydrophobicContact CG2-CE 4.26Å; T292-M297 HydrophobicContact CG2-SD 3.98Å; K293-M297 HydrophobicContact CG-CE 4.36Å; Q294-M297 HydrophobicContact CB-CE 3.48Å; Q294-M297 VanDerWaalsContact CB-CE 3.48Å; Q294-M297 VanDerWaalsContact N-CE 3.33Å; Q295-M297 VanDerWaalsContact C-N 3.29Å; Q295-M297 PolarHBondContact O-N 3.21Å; M297-A343 HydrophobicContact CB-CB 4.23Å; M297-A343 HydrophobicContact SD-CB 3.61Å; M297-M344 WeakPolarHBondContact CA-O 3.48Å; M297-F348 HydrophobicContact CE-CE2 3.43Å; M297-F348 VanDerWaalsContact CE-CE2 3.43Å; M297-F348 HydrophobicContact CE-CZ 3.59Å; M297-F348 HydrophobicContact SD-CE2 4.29Å
298	T	92.9	Very high	92.5	Very high	92 Å²	92	60.2 Å²	60.2	56%	0.564	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.4	169.5	-59.9	0	0	0	0	109.2	A343 M344	T298-A343 CarbonylContact O-C 3.38Å; T298-A343 WeakPolarHBondContact O-CA 3.47Å; T298-M344 HydrophobicContact CG2-CE 4.02Å; T298-M344 PolarHBondContact N-O 2.97Å; T298-M344 PolarHBondContact O-N 2.89Å
299	K	93.5	Very high	92.2	Very high	58 Å²	58	60.7 Å²	60.7	25%	0.252	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.7	-172.3	-63.8	165.1	177.8	-168.4	0	110.7	C290 Y342	C290-K299 HydrophobicContact CB-CD 3.96Å; C290-K299 HydrophobicContact CB-CG 4.41Å; C290-K299 PolarHBondContact O-NZ 3.29Å; K299-Y342 WeakPolarHBondContact CA-O 3.19Å
300	V	93.7	Very high	91.7	Very high	26 Å²	26	59.9 Å²	59.9	16%	0.158	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	127.8	174.7	178.9	0	0	0	0	109.1	R308 C341 Y342 M344	V300-R308 HydrophobicContact CG1-CG 4.01Å; V300-C341 CarbonylContact O-C 3.17Å; V300-C341 WeakPolarHBondContact O-CA 3.27Å; V300-Y342 PolarHBondContact N-O 2.82Å; V300-Y342 PolarHBondContact O-N 3.41Å; V300-M344 HydrophobicContact CG2-CE 3.76Å
301	W	94.9	Very high	90.9	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.008	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	139.9	177.4	-77.9	99.9	0	0	0	111.9	I288 C290 V309 V320 G324 L326 T340 C341 V354	I288-W301 HydrophobicContact CG2-CH2 4.19Å; C290-W301 HydrophobicContact CB-CZ2 3.59Å; W301-V309 HydrophobicContact CB-CB 4.1Å; W301-V309 HydrophobicContact CB-CG2 4.06Å; W301-V309 PolarHBondContact O-N 2.83Å; W301-V320 HydrophobicContact CB-CG2 4.15Å; W301-V320 HydrophobicContact CG-CG2 4.39Å; W301-G324 PolarHBondContact NE1-O 3.3Å; W301-L326 HydrophobicContact CB-CD1 4.03Å; W301-L326 HydrophobicContact CD2-CB 4.06Å; W301-L326 HydrophobicContact CD2-CD1 4.2Å; W301-L326 HydrophobicContact CD2-CD2 4.25Å; W301-L326 HydrophobicContact CD2-CG 4.42Å; W301-L326 HydrophobicContact CE3-CD2 4.02Å; W301-L326 HydrophobicContact CG-CB 4.4Å; W301-L326 HydrophobicContact CG-CD1 3.93Å; W301-L326 HydrophobicContact CZ2-CB 4Å; W301-L326 HydrophobicContact CZ3-CD2 4.24Å; W301-T340 WeakPolarHBondContact CA-O 3.14Å; W301-C341 HydrophobicContact CD2-CB 3.86Å; W301-C341 HydrophobicContact CE3-CB 3.84Å; W301-C341 HydrophobicContact CH2-CB 3.81Å; W301-C341 HydrophobicContact CZ2-CB 3.83Å; W301-C341 HydrophobicContact CZ3-CB 3.8Å; W301-V354 HydrophobicContact CH2-CG1 4.48Å; W301-V354 HydrophobicContact CH2-CG2 3.87Å; W301-V354 HydrophobicContact CZ3-CG2 3.69Å
302	V	94.3	Very high	89.8	Confident	16 Å²	16	70.6 Å²	70.6	10%	0.097	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.8	175.7	179.8	0	0	0	0	109.4	E307 Y339 T340 Y342	V302-E307 CarbonylContact C-O 3.59Å; V302-E307 VanDerWaalsContact CA-O 3.32Å; V302-E307 WeakPolarHBondContact CA-O 3.38Å; V302-Y339 WeakPolarHBondContact O-CA 3.3Å; V302-T340 PolarHBondContact N-O 3.37Å; V302-T340 PolarHBondContact O-N 2.99Å; V302-Y342 HydrophobicContact CB-CE2 4.25Å; V302-Y342 HydrophobicContact CG2-CD2 3.93Å; V302-Y342 HydrophobicContact CG2-CE2 3.7Å
303	T	92.6	Very high	88.3	Confident	21 Å²	21	73.4 Å²	73.4	13%	0.129	40%	0.398	C	S	.	.			trans	-74.4	167.9	179	63.6	0	0	0	0	112	S305 N306 E307 V309 Y339	T303-S305 PolarHBondContact O-N 2.97Å; T303-S305 PolarHBondContact OG1-N 3.17Å; T303-S305 PolarHBondContact OG1-OG 3.43Å; T303-N306 WeakPolarHBondContact O-CA 3.15Å; T303-N306 PolarHBondContact O-N 3.37Å; T303-E307 PolarHBondContact N-O 3.38Å; T303-E307 WeakPolarHBondContact OG1-CB 3.44Å; T303-E307 PolarHBondContact OG1-N 3.32Å; T303-E307 PolarHBondContact OG1-O 2.93Å; T303-V309 HydrophobicContact CG2-CG2 3.58Å; T303-Y339 HydrophobicContact CG2-CE1 4.13Å
304	P	92.2	Very high	86.5	Confident	66 Å²	66	76 Å²	76	43%	0.429	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.6	172.2	-23	32.7	0	0	0	114	N306 V338 Y339	P304-N306 PolarHBondContact O-N 2.77Å; P304-V338 WeakPolarHBondContact CA-O 3.38Å; P304-Y339 HydrophobicContact CG-CD2 4.23Å; P304-Y339 HydrophobicContact CG-CE2 3.97Å
305	S	90.4	Very high	85	Confident	79 Å²	79	80.8 Å²	80.8	55%	0.552	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	5.1	174	54.6	0	0	0	0	114	T303 E307	T303-S305 PolarHBondContact O-N 2.97Å; T303-S305 PolarHBondContact OG1-N 3.17Å; T303-S305 PolarHBondContact OG1-OG 3.43Å; S305-E307 VanDerWaalsContact C-N 3.32Å
306	N	89.2	Confident	83.8	Confident	130 Å²	130	78.4 Å²	78.4	70%	0.695	45%	0.445	S	S	*	.	S	Bend	trans	65.4	29.7	-177.8	-156.1	47.6	0	0	0	114.2	T303 P304	T303-N306 WeakPolarHBondContact O-CA 3.15Å; T303-N306 PolarHBondContact O-N 3.37Å; P304-N306 PolarHBondContact O-N 2.77Å
307	E	90.9	Very high	83.4	Confident	129 Å²	129	76.3 Å²	76.3	60%	0.603	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-100.8	143.9	175.8	-62.4	178.7	160.2	0	0	110.6	V302 T303 S305	V302-E307 CarbonylContact C-O 3.59Å; V302-E307 VanDerWaalsContact CA-O 3.32Å; V302-E307 WeakPolarHBondContact CA-O 3.38Å; T303-E307 PolarHBondContact N-O 3.38Å; T303-E307 WeakPolarHBondContact OG1-CB 3.44Å; T303-E307 PolarHBondContact OG1-N 3.32Å; T303-E307 PolarHBondContact OG1-O 2.93Å; S305-E307 VanDerWaalsContact C-N 3.32Å
308	R	91.4	Very high	83.2	Confident	168 Å²	168	76.9 Å²	76.9	63%	0.634	42%	0.419	S	S	*	.	B	Isolated β-bridge	trans	-76.8	128.4	177.9	-179	176.7	174.6	178.8	0.1	110.1	V300	V300-R308 HydrophobicContact CG1-CG 4.01Å
309	V	88.3	Confident	83.1	Confident	10 Å²	10	72.8 Å²	72.8	6%	0.061	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-74.9	131.2	173.1	-171.8	0	0	0	0	109.2	W301 T303 V318 V320 L326	W301-V309 HydrophobicContact CB-CB 4.1Å; W301-V309 HydrophobicContact CB-CG2 4.06Å; W301-V309 PolarHBondContact O-N 2.83Å; T303-V309 HydrophobicContact CG2-CG2 3.58Å; V309-V318 HydrophobicContact CG1-CG1 4.2Å; V309-V318 HydrophobicContact CG1-CG2 4.19Å; V309-V320 HydrophobicContact CB-CG2 3.9Å; V309-V320 HydrophobicContact CG1-CG2 3.77Å; V309-L326 HydrophobicContact CB-CD1 4.32Å; V309-L326 HydrophobicContact CG1-CD1 3.98Å; V309-L326 HydrophobicContact CG2-CD1 4.08Å
310	L	84.2	Confident	82.9	Confident	106 Å²	106	70.6 Å²	70.6	56%	0.555	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-89.6	157.6	179	-62.7	172.8	0	0	0	111.4	E312 V320	L310-E312 VanDerWaalsContact C-N 3.3Å; L310-E312 PolarHBondContact O-N 3.32Å; L310-V320 PolarHBondContact O-N 3.16Å; L310-V320 VanDerWaalsContact O-N 3.15Å
311	D	77.5	Confident	82.6	Confident	117 Å²	117	71.6 Å²	71.6	63%	0.626	39%	0.394	S	S	*	.	S	Bend	trans	-71.2	-25.2	-178.9	-61.2	-21.7	0	0	0	112.6
312	E	69.6	Low	82.2	Confident	152 Å²	152	82.1 Å²	82.1	71%	0.71	44%	0.44	S	S	*	.	S	Bend	trans	-115.7	132.1	-178.3	-67.6	-173.5	167.3	0	0	111.9	L310 T314	L310-E312 VanDerWaalsContact C-N 3.3Å; L310-E312 PolarHBondContact O-N 3.32Å; E312-T314 VanDerWaalsContact C-N 3.35Å; E312-T314 PolarHBondContact O-N 2.91Å; E312-T314 PolarHBondContact O-OG1 3.06Å
313	V	63.2	Low	81.8	Confident	65 Å²	65	85.5 Å²	85.5	39%	0.394	46%	0.457	S	S	.	.			trans	-67.2	91.7	175.8	-179.5	0	0	0	0	108.7	G316	V313-G316 VanDerWaalsContact CG1-O 3.23Å; V313-G316 WeakPolarHBondContact CG1-O 3.46Å
314	T	55.1	Low	81.6	Confident	94 Å²	94	85 Å²	85	58%	0.577	46%	0.456	S	S	*	.	S	Bend	trans	-100.5	-4.6	178.3	42.6	0	0	0	0	113.9	E312	E312-T314 VanDerWaalsContact C-N 3.35Å; E312-T314 PolarHBondContact O-N 2.91Å; E312-T314 PolarHBondContact O-OG1 3.06Å
315	N	59.3	Low	81.6	Confident	176 Å²	176	81.9 Å²	81.9	94%	0.941	44%	0.436	S	S	*	.	S	Bend	trans	173.8	18.7	163.3	-88.2	-26.9	0	0	0	113.2
316	G	66.1	Low	81.7	Confident	39 Å²	39	78.1 Å²	78.1	40%	0.402	41%	0.41	S	S	.	.			trans	-116	160.2	-173.4	0	0	0	0	0	113.7	V313	V313-G316 VanDerWaalsContact CG1-O 3.23Å; V313-G316 WeakPolarHBondContact CG1-O 3.46Å
317	T	80.3	Confident	81.9	Confident	42 Å²	42	73.9 Å²	73.9	26%	0.258	39%	0.387	S	S	.	.	S	Bend	trans	-72.6	-20.2	172.7	48.4	0	0	0	0	112.6	F328 Q329 Q332 D335	T317-F328 WeakPolarHBondContact O-CA 3.31Å; T317-Q329 PolarHBondContact O-N 3.03Å; T317-Q329 VanDerWaalsContact O-N 3.14Å; T317-Q332 HydrophobicContact CG2-CG 3.7Å; T317-D335 PolarHBondContact OG1-OD1 3.32Å; T317-D335 PolarHBondContact OG1-OD2 2.95Å
318	V	87.5	Confident	82	Confident	26 Å²	26	67.7 Å²	67.7	16%	0.158	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	139.2	-170.7	67.9	0	0	0	0	112.2	V309 L326 L327 F328	V309-V318 HydrophobicContact CG1-CG1 4.2Å; V309-V318 HydrophobicContact CG1-CG2 4.19Å; V318-L326 HydrophobicContact CG2-CD1 3.37Å; V318-L326 HydrophobicContact CG2-CD2 4.21Å; V318-L326 HydrophobicContact CG2-CG 3.65Å; V318-L327 CarbonylContact C-O 3.48Å; V318-L327 WeakPolarHBondContact CA-O 3.48Å; V318-F328 HydrophobicContact CB-CD1 3.99Å; V318-F328 HydrophobicContact CB-CE1 3.9Å; V318-F328 HydrophobicContact CG2-CD1 4Å; V318-F328 HydrophobicContact CG2-CE1 3.69Å; V318-F328 HydrophobicContact CG2-CE2 4.28Å; V318-F328 HydrophobicContact CG2-CG 4.42Å; V318-F328 HydrophobicContact CG2-CZ 3.84Å
319	S	90.1	Very high	81.8	Confident	7 Å²	7	64.8 Å²	64.8	5%	0.049	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	161.6	176.9	52.8	0	0	0	0	111.4	L327	S319-L327 PolarHBondContact N-O 3.09Å; S319-L327 PolarHBondContact O-N 3.22Å
320	V	90.3	Very high	81.8	Confident	11 Å²	11	70.1 Å²	70.1	7%	0.067	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122	171.9	-175.5	0	0	0	0	109.8	W301 V309 L310	W301-V320 HydrophobicContact CB-CG2 4.15Å; W301-V320 HydrophobicContact CG-CG2 4.39Å; V309-V320 HydrophobicContact CB-CG2 3.9Å; V309-V320 HydrophobicContact CG1-CG2 3.77Å; L310-V320 PolarHBondContact O-N 3.16Å; L310-V320 VanDerWaalsContact O-N 3.15Å
321	S	87.4	Confident	82.1	Confident	48 Å²	48	65.1 Å²	65.1	34%	0.336	35%	0.35	S	S	.	.			trans	-71.6	161.2	174.7	167.2	0	0	0	0	111.3	D323 G324 S325	S321-D323 WeakPolarHBondContact CB-OD1 3.47Å; S321-D323 PolarHBondContact O-N 3.49Å; S321-D323 PolarHBondContact OG-OD1 3.05Å; S321-G324 WeakPolarHBondContact O-CA 3.33Å; S321-G324 PolarHBondContact O-N 2.81Å; S321-S325 WeakPolarHBondContact CB-O 3.11Å; S321-S325 PolarHBondContact N-O 2.95Å
322	K	85.7	Confident	82.8	Confident	223 Å²	223	62.8 Å²	62.8	97%	0.97	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.7	-178.4	-65.2	-174.8	179.1	-178.4	0	114.3	G324	K322-G324 VanDerWaalsContact C-N 3.3Å
323	D	86	Confident	83.8	Confident	86 Å²	86	59.3 Å²	59.3	46%	0.46	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	0.1	175.6	68	-30.8	0	0	0	113.5	S321 S325	S321-D323 WeakPolarHBondContact CB-OD1 3.47Å; S321-D323 PolarHBondContact O-N 3.49Å; S321-D323 PolarHBondContact OG-OD1 3.05Å; D323-S325 VanDerWaalsContact CG-OG 3.23Å; D323-S325 WeakPolarHBondContact OD1-CB 3.18Å; D323-S325 PolarHBondContact OD1-N 3.27Å; D323-S325 PolarHBondContact OD1-OG 3.3Å; D323-S325 WeakPolarHBondContact OD2-CB 3.2Å; D323-S325 PolarHBondContact OD2-OG 2.97Å
324	G	89.2	Confident	85	Confident	10 Å²	10	65.1 Å²	65.1	10%	0.103	35%	0.347	C	S	.	.	S	Bend	trans	79.3	14.3	-176.1	0	0	0	0	0	114.2	W301 S321 K322	W301-G324 PolarHBondContact NE1-O 3.3Å; S321-G324 WeakPolarHBondContact O-CA 3.33Å; S321-G324 PolarHBondContact O-N 2.81Å; K322-G324 VanDerWaalsContact C-N 3.3Å
325	S	92.2	Very high	86.8	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.014	32%	0.323	C	S	.	.			trans	-83.2	146	174.4	-60.8	0	0	0	0	111.1	S321 D323	S321-S325 WeakPolarHBondContact CB-O 3.11Å; S321-S325 PolarHBondContact N-O 2.95Å; D323-S325 VanDerWaalsContact CG-OG 3.23Å; D323-S325 WeakPolarHBondContact OD1-CB 3.18Å; D323-S325 PolarHBondContact OD1-N 3.27Å; D323-S325 PolarHBondContact OD1-OG 3.3Å; D323-S325 WeakPolarHBondContact OD2-CB 3.2Å; D323-S325 PolarHBondContact OD2-OG 2.97Å
326	L	92.6	Very high	88.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.3	175.5	-166.9	67.3	0	0	0	109.4	I287 I288 W301 V309 V318 F328 Y339	I287-L326 CarbonylContact C-O 3.15Å; I287-L326 WeakPolarHBondContact CA-O 3.37Å; I288-L326 HydrophobicContact CB-CB 4.32Å; I288-L326 PolarHBondContact N-O 3.17Å; I288-L326 PolarHBondContact O-N 3.01Å; W301-L326 HydrophobicContact CB-CD1 4.03Å; W301-L326 HydrophobicContact CD2-CB 4.06Å; W301-L326 HydrophobicContact CD2-CD1 4.2Å; W301-L326 HydrophobicContact CD2-CD2 4.25Å; W301-L326 HydrophobicContact CD2-CG 4.42Å; W301-L326 HydrophobicContact CE3-CD2 4.02Å; W301-L326 HydrophobicContact CG-CB 4.4Å; W301-L326 HydrophobicContact CG-CD1 3.93Å; W301-L326 HydrophobicContact CZ2-CB 4Å; W301-L326 HydrophobicContact CZ3-CD2 4.24Å; V309-L326 HydrophobicContact CB-CD1 4.32Å; V309-L326 HydrophobicContact CG1-CD1 3.98Å; V309-L326 HydrophobicContact CG2-CD1 4.08Å; V318-L326 HydrophobicContact CG2-CD1 3.37Å; V318-L326 HydrophobicContact CG2-CD2 4.21Å; V318-L326 HydrophobicContact CG2-CG 3.65Å; L326-F328 HydrophobicContact CD2-CE2 3.56Å; L326-F328 HydrophobicContact CD2-CZ 3.61Å; L326-F328 HydrophobicContact CG-CE2 3.77Å; L326-F328 HydrophobicContact CG-CZ 4.11Å; L326-Y339 HydrophobicContact CD2-CD1 3.52Å; L326-Y339 HydrophobicContact CD2-CE1 4.05Å; L326-Y339 HydrophobicContact CD2-CG 3.81Å
327	L	93.2	Very high	89.7	Confident	40 Å²	40	53.8 Å²	53.8	21%	0.209	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.5	-177.8	173.1	67.4	0	0	0	110.2	T285 I287 V318 S319 Q329	T285-L327 HydrophobicContact CG2-CD1 4.25Å; I287-L327 HydrophobicContact CD1-CD1 4.18Å; I287-L327 HydrophobicContact CG1-CD1 3.6Å; V318-L327 CarbonylContact C-O 3.48Å; V318-L327 WeakPolarHBondContact CA-O 3.48Å; S319-L327 PolarHBondContact N-O 3.09Å; S319-L327 PolarHBondContact O-N 3.22Å; L327-Q329 HydrophobicContact CD2-CG 4.46Å
328	F	91.8	Very high	90.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.4	167.2	-60.3	-96	0	0	0	108.3	T285 L286 I288 T317 V318 L326 V331 D335 Y339 L356	T285-F328 WeakPolarHBondContact CA-O 3.41Å; T285-F328 WeakPolarHBondContact CG2-O 3.45Å; L286-F328 HydrophobicContact CB-CB 4.23Å; L286-F328 HydrophobicContact CB-CD2 4.19Å; L286-F328 HydrophobicContact CD2-CD2 4.36Å; L286-F328 HydrophobicContact CG-CD2 4.45Å; L286-F328 PolarHBondContact N-O 2.99Å; L286-F328 PolarHBondContact O-N 3.15Å; I288-F328 HydrophobicContact CD1-CE2 3.91Å; I288-F328 HydrophobicContact CG1-CE2 4.29Å; T317-F328 WeakPolarHBondContact O-CA 3.31Å; V318-F328 HydrophobicContact CB-CD1 3.99Å; V318-F328 HydrophobicContact CB-CE1 3.9Å; V318-F328 HydrophobicContact CG2-CD1 4Å; V318-F328 HydrophobicContact CG2-CE1 3.69Å; V318-F328 HydrophobicContact CG2-CE2 4.28Å; V318-F328 HydrophobicContact CG2-CG 4.42Å; V318-F328 HydrophobicContact CG2-CZ 3.84Å; L326-F328 HydrophobicContact CD2-CE2 3.56Å; L326-F328 HydrophobicContact CD2-CZ 3.61Å; L326-F328 HydrophobicContact CG-CE2 3.77Å; L326-F328 HydrophobicContact CG-CZ 4.11Å; F328-V331 HydrophobicContact CB-CG2 3.62Å; F328-V331 HydrophobicContact CD1-CG2 4.4Å; F328-V331 HydrophobicContact CG-CG2 4.12Å; F328-D335 HydrophobicContact CD1-CB 4.36Å; F328-D335 HydrophobicContact CE1-CB 4.1Å; F328-Y339 HydrophobicContact CE1-CE1 4.29Å; F328-Y339 HydrophobicContact CE1-CE2 4.29Å; F328-Y339 AromaticContact CE1-CZ 3.78Å; F328-Y339 WeakPolarHBondContact CE1-OH 3.25Å; F328-Y339 HydrophobicContact CZ-CD2 4.4Å; F328-Y339 AromaticContact CZ-CE1 3.96Å; F328-Y339 HydrophobicContact CZ-CE1 3.96Å; F328-Y339 AromaticContact CZ-CE2 3.86Å; F328-Y339 HydrophobicContact CZ-CE2 3.86Å; F328-Y339 AromaticContact CZ-CZ 3.62Å; F328-L356 HydrophobicContact CE1-CD2 3.92Å; F328-L356 HydrophobicContact CE2-CD2 4.16Å; F328-L356 HydrophobicContact CZ-CD2 3.73Å
329	Q	87.3	Confident	90.9	Very high	107 Å²	107	54.2 Å²	54.2	50%	0.5	29%	0.288	S	S	.	.	S	Bend	trans	-74.8	-43.6	178	-69.6	-176.2	-11.1	0	0	111.3	T285 T317 L327	T285-Q329 PolarHBondContact OG1-O 3.43Å; T317-Q329 PolarHBondContact O-N 3.03Å; T317-Q329 VanDerWaalsContact O-N 3.14Å; L327-Q329 HydrophobicContact CD2-CG 4.46Å
330	Q	88.3	Confident	91.1	Very high	122 Å²	122	54.9 Å²	54.9	57%	0.57	29%	0.292	S	S	*	.	S	Bend	trans	-147	93.8	-178.1	-162.4	177	14.8	0	0	109.8	Q332	Q330-Q332 PolarHBondContact O-N 2.9Å; Q330-Q332 PolarHBondContact O-NE2 3.11Å
331	V	91.5	Very high	91.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.289	C	S	.	.			trans	-59.3	129.2	-174.5	173.5	0	0	0	0	111.5	A280 G283 D284 L286 F328 V358	A280-V331 HydrophobicContact CB-CG1 4.16Å; A280-V331 HydrophobicContact CB-CG2 4.35Å; G283-V331 PolarHBondContact N-O 3.23Å; D284-V331 VanDerWaalsContact O-CG2 3.29Å; D284-V331 WeakPolarHBondContact O-CG2 3.12Å; D284-V331 PolarHBondContact O-N 3.09Å; L286-V331 HydrophobicContact CB-CG2 4.17Å; F328-V331 HydrophobicContact CB-CG2 3.62Å; F328-V331 HydrophobicContact CD1-CG2 4.4Å; F328-V331 HydrophobicContact CG-CG2 4.12Å; V331-V358 HydrophobicContact CG1-CB 4.19Å; V331-V358 HydrophobicContact CG1-CG1 3.55Å; V331-V358 HydrophobicContact CG1-CG2 3.52Å
332	Q	91.5	Very high	91.8	Very high	68 Å²	68	56.9 Å²	56.9	32%	0.318	29%	0.292	S	S	.	.			trans	-108.1	157.5	173.6	-59.4	-57.6	-46.7	0	0	110.9	T317 Q330 E334 D335	T317-Q332 HydrophobicContact CG2-CG 3.7Å; Q330-Q332 PolarHBondContact O-N 2.9Å; Q330-Q332 PolarHBondContact O-NE2 3.11Å; Q332-E334 PolarHBondContact O-N 3.42Å; Q332-D335 PolarHBondContact N-OD2 2.83Å; Q332-D335 VanDerWaalsContact O-CB 3.3Å; Q332-D335 WeakPolarHBondContact O-CB 3.39Å; Q332-D335 PolarHBondContact O-N 3.34Å
333	V	90.9	Very high	92.3	Very high	79 Å²	79	46.3 Å²	46.3	48%	0.479	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-59.1	-32.4	177.9	-175.5	0	0	0	0	111.8	L282 D335 G336 N360	L282-V333 HydrophobicContact CD1-CG2 3.91Å; V333-D335 PolarHBondContact O-N 3.08Å; V333-G336 PolarHBondContact O-N 2.99Å; V333-N360 HydrophobicContact CG2-CB 4.17Å
334	E	89.8	Confident	92.7	Very high	188 Å²	188	46 Å²	46	88%	0.879	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-69.1	-18.5	178.3	-60.7	176.8	-165.5	0	0	113.2	Q332 G336	Q332-E334 PolarHBondContact O-N 3.42Å; E334-G336 PolarHBondContact O-N 3.39Å
335	D	91.3	Very high	92.7	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.08	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-74.6	-4.8	176.1	-60	-31.4	0	0	0	112	T317 F328 Q332 V333 Y339	T317-D335 PolarHBondContact OG1-OD1 3.32Å; T317-D335 PolarHBondContact OG1-OD2 2.95Å; F328-D335 HydrophobicContact CD1-CB 4.36Å; F328-D335 HydrophobicContact CE1-CB 4.1Å; Q332-D335 PolarHBondContact N-OD2 2.83Å; Q332-D335 VanDerWaalsContact O-CB 3.3Å; Q332-D335 WeakPolarHBondContact O-CB 3.39Å; Q332-D335 PolarHBondContact O-N 3.34Å; V333-D335 PolarHBondContact O-N 3.08Å; D335-Y339 VanDerWaalsContact O-CE2 3.27Å; D335-Y339 WeakPolarHBondContact O-CE2 3.32Å; D335-Y339 PolarHBondContact O-OH 2.87Å
336	G	93.3	Very high	92.6	Very high	34 Å²	34	56.1 Å²	56.1	35%	0.351	29%	0.294	S	S	.	.			trans	-67	136.1	178.7	0	0	0	0	0	113.1	V333 E334 L356	V333-G336 PolarHBondContact O-N 2.99Å; E334-G336 PolarHBondContact O-N 3.39Å; G336-L356 WeakPolarHBondContact CA-O 3.22Å
337	G	94.3	Very high	92.4	Very high	22 Å²	22	61.4 Å²	61.4	23%	0.227	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.3	-166.3	175.6	0	0	0	0	0	113.9	L356	G337-L356 PolarHBondContact N-O 3.12Å; G337-L356 PolarHBondContact O-N 3.22Å
338	V	95.7	Very high	92.3	Very high	69 Å²	69	62.2 Å²	62.2	42%	0.418	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	114.7	-179.9	-176.9	0	0	0	0	110.5	P304 V354 E355	P304-V338 WeakPolarHBondContact CA-O 3.38Å; V338-V354 CarbonylContact C-O 3.37Å; V338-V354 WeakPolarHBondContact CA-O 3.13Å; V338-E355 HydrophobicContact CG2-CB 4.43Å; V338-E355 HydrophobicContact CG2-CG 4.4Å
339	Y	95.5	Very high	92.3	Very high	7 Å²	7	67.7 Å²	67.7	3%	0.027	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	141.8	170	-68.4	-100	0	0	0	109.4	V302 T303 P304 L326 F328 D335 S353 V354 L356	V302-Y339 WeakPolarHBondContact O-CA 3.3Å; T303-Y339 HydrophobicContact CG2-CE1 4.13Å; P304-Y339 HydrophobicContact CG-CD2 4.23Å; P304-Y339 HydrophobicContact CG-CE2 3.97Å; L326-Y339 HydrophobicContact CD2-CD1 3.52Å; L326-Y339 HydrophobicContact CD2-CE1 4.05Å; L326-Y339 HydrophobicContact CD2-CG 3.81Å; F328-Y339 HydrophobicContact CE1-CE1 4.29Å; F328-Y339 HydrophobicContact CE1-CE2 4.29Å; F328-Y339 AromaticContact CE1-CZ 3.78Å; F328-Y339 WeakPolarHBondContact CE1-OH 3.25Å; F328-Y339 HydrophobicContact CZ-CD2 4.4Å; F328-Y339 AromaticContact CZ-CE1 3.96Å; F328-Y339 HydrophobicContact CZ-CE1 3.96Å; F328-Y339 AromaticContact CZ-CE2 3.86Å; F328-Y339 HydrophobicContact CZ-CE2 3.86Å; F328-Y339 AromaticContact CZ-CZ 3.62Å; D335-Y339 VanDerWaalsContact O-CE2 3.27Å; D335-Y339 WeakPolarHBondContact O-CE2 3.32Å; D335-Y339 PolarHBondContact O-OH 2.87Å; Y339-S353 CarbonylContact O-C 3.3Å; Y339-S353 WeakPolarHBondContact O-CA 3.15Å; Y339-V354 PolarHBondContact N-O 3.31Å; Y339-V354 PolarHBondContact O-N 2.97Å; Y339-L356 HydrophobicContact CD2-CB 4.38Å; Y339-L356 HydrophobicContact CE2-CB 4.29Å; Y339-L356 HydrophobicContact CE2-CD2 4.21Å
340	T	96.2	Very high	92.6	Very high	22 Å²	22	63.5 Å²	63.5	14%	0.135	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.6	179.6	-57.8	0	0	0	0	110.5	W301 V302 Y342 T351 L352 S353	W301-T340 WeakPolarHBondContact CA-O 3.14Å; V302-T340 PolarHBondContact N-O 3.37Å; V302-T340 PolarHBondContact O-N 2.99Å; T340-Y342 HydrophobicContact CG2-CD2 4.33Å; T340-Y342 HydrophobicContact CG2-CE1 4.13Å; T340-Y342 HydrophobicContact CG2-CE2 3.81Å; T340-T351 HydrophobicContact CG2-CG2 3.48Å; T340-T351 VanDerWaalsContact CG2-CG2 3.48Å; T340-L352 CarbonylContact C-O 3.17Å; T340-L352 WeakPolarHBondContact CA-O 3.24Å; T340-S353 PolarHBondContact OG1-OG 2.87Å
341	C	96.2	Very high	92.9	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	120.6	169.5	-178.1	0	0	0	0	109.9	C290 V300 W301 T351 L352	C290-C341 HydrophobicContact CB-CB 3.81Å; C290-C341 WeakPolarHBondContact CB-SG 3.28Å; C290-C341 WeakPolarHBondContact SG-CB 3.12Å; C290-C341 CovalentContact SG-SG 2.03Å; C290-C341 PolarHBondContact SG-SG 2.98Å; V300-C341 CarbonylContact O-C 3.17Å; V300-C341 WeakPolarHBondContact O-CA 3.27Å; W301-C341 HydrophobicContact CD2-CB 3.86Å; W301-C341 HydrophobicContact CE3-CB 3.84Å; W301-C341 HydrophobicContact CH2-CB 3.81Å; W301-C341 HydrophobicContact CZ2-CB 3.83Å; W301-C341 HydrophobicContact CZ3-CB 3.8Å; C341-T351 WeakPolarHBondContact O-CA 3.39Å; C341-L352 HydrophobicContact CB-CB 4.35Å; C341-L352 PolarHBondContact N-O 2.6Å; C341-L352 PolarHBondContact O-N 3.19Å
342	Y	95.3	Very high	93.1	Very high	101 Å²	101	62.7 Å²	62.7	40%	0.396	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	114.2	167.1	-62.9	-78.5	0	0	0	108.8	K299 V300 V302 T340 T351	K299-Y342 WeakPolarHBondContact CA-O 3.19Å; V300-Y342 PolarHBondContact N-O 2.82Å; V300-Y342 PolarHBondContact O-N 3.41Å; V302-Y342 HydrophobicContact CB-CE2 4.25Å; V302-Y342 HydrophobicContact CG2-CD2 3.93Å; V302-Y342 HydrophobicContact CG2-CE2 3.7Å; T340-Y342 HydrophobicContact CG2-CD2 4.33Å; T340-Y342 HydrophobicContact CG2-CE1 4.13Å; T340-Y342 HydrophobicContact CG2-CE2 3.81Å; Y342-T351 HydrophobicContact CD1-CG2 3.9Å; Y342-T351 HydrophobicContact CE1-CG2 3.61Å
343	A	95.3	Very high	93.2	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.8	176.9	0	0	0	0	0	110.2	T292 M297 T298 N349 E350	T292-A343 HydrophobicContact CG2-CB 3.37Å; M297-A343 HydrophobicContact CB-CB 4.23Å; M297-A343 HydrophobicContact SD-CB 3.61Å; T298-A343 CarbonylContact O-C 3.38Å; T298-A343 WeakPolarHBondContact O-CA 3.47Å; A343-N349 CarbonylContact O-C 3.57Å; A343-N349 VanDerWaalsContact O-CA 3.3Å; A343-N349 WeakPolarHBondContact O-CA 3.3Å; A343-E350 HydrophobicContact CB-CB 4.37Å; A343-E350 PolarHBondContact N-O 3.31Å; A343-E350 PolarHBondContact O-N 3.31Å
344	M	94.5	Very high	93.3	Very high	81 Å²	81	59.3 Å²	59.3	40%	0.399	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	115.3	-176.8	-64.1	160.7	-73.7	0	0	109.2	M297 T298 V300 N349	M297-M344 WeakPolarHBondContact CA-O 3.48Å; T298-M344 HydrophobicContact CG2-CE 4.02Å; T298-M344 PolarHBondContact N-O 2.97Å; T298-M344 PolarHBondContact O-N 2.89Å; V300-M344 HydrophobicContact CG2-CE 3.76Å; M344-N349 WeakPolarHBondContact CA-OD1 3.47Å
345	G	90.7	Very high	93.6	Very high	23 Å²	23	54.6 Å²	54.6	24%	0.237	30%	0.304	C	S	.	.			trans	-105.5	177.4	172.3	0	0	0	0	0	111.6	F348	G345-F348 WeakPolarHBondContact CA-O 3.38Å; G345-F348 PolarHBondContact N-O 2.93Å
346	E	90	Very high	93.7	Very high	201 Å²	201	54 Å²	54	94%	0.939	30%	0.301	S	S	*	.	S	Bend	trans	-71.4	-33	176.1	-64	-177.6	169.7	0	0	112.4
347	T	88.3	Confident	93.8	Very high	110 Å²	110	56.8 Å²	56.8	68%	0.675	30%	0.304	S	S	*	.	S	Bend	trans	-104.8	-31.9	-172.3	52	0	0	0	0	113.8
348	F	89.8	Confident	93.8	Very high	58 Å²	58	57 Å²	57	25%	0.254	30%	0.3	S	S	.	.			trans	-152	160.7	178.1	65.4	-93.2	0	0	0	111.2	K293 Q294 M297 G345 E350	K293-F348 HydrophobicContact CD-CE2 3.93Å; K293-F348 HydrophobicContact CD-CZ 3.96Å; K293-F348 HydrophobicContact CG-CE2 3.65Å; K293-F348 HydrophobicContact CG-CZ 3.5Å; Q294-F348 HydrophobicContact CB-CE1 4.45Å; Q294-F348 HydrophobicContact CB-CZ 3.89Å; M297-F348 HydrophobicContact CE-CE2 3.43Å; M297-F348 VanDerWaalsContact CE-CE2 3.43Å; M297-F348 HydrophobicContact CE-CZ 3.59Å; M297-F348 HydrophobicContact SD-CE2 4.29Å; G345-F348 WeakPolarHBondContact CA-O 3.38Å; G345-F348 PolarHBondContact N-O 2.93Å; F348-E350 HydrophobicContact CE2-CB 4.47Å
349	N	93.2	Very high	93.7	Very high	115 Å²	115	56.6 Å²	56.6	62%	0.615	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	149.7	170.5	-61.2	-28.6	0	0	0	109.6	A343 M344	A343-N349 CarbonylContact O-C 3.57Å; A343-N349 VanDerWaalsContact O-CA 3.3Å; A343-N349 WeakPolarHBondContact O-CA 3.3Å; M344-N349 WeakPolarHBondContact CA-OD1 3.47Å
350	E	93.1	Very high	93.5	Very high	18 Å²	18	62.7 Å²	62.7	8%	0.084	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.1	177.7	-166.9	176.8	-172.1	0	0	108.9	R239 T292 K293 A343 F348 L352	R239-E350 IonicContact CZ-OE1 3.75Å; R239-E350 IonicContact NE-OE1 3.8Å; R239-E350 IonicContact NH2-OE1 3.71Å; R239-E350 PolarHBondContact NH2-OE1 3.23Å; T292-E350 WeakPolarHBondContact CA-OE2 3.48Å; K293-E350 PolarHBondContact N-OE2 2.95Å; A343-E350 HydrophobicContact CB-CB 4.37Å; A343-E350 PolarHBondContact N-O 3.31Å; A343-E350 PolarHBondContact O-N 3.31Å; F348-E350 HydrophobicContact CE2-CB 4.47Å; E350-L352 HydrophobicContact CG-CD2 3.97Å; E350-L352 HydrophobicContact CG-CG 4.08Å; E350-L352 WeakPolarHBondContact OE1-CD2 3.36Å
351	T	95.1	Very high	93.2	Very high	84 Å²	84	66.2 Å²	66.2	52%	0.515	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.4	173.9	-57.9	0	0	0	0	108.1	T340 C341 Y342	T340-T351 HydrophobicContact CG2-CG2 3.48Å; T340-T351 VanDerWaalsContact CG2-CG2 3.48Å; C341-T351 WeakPolarHBondContact O-CA 3.39Å; Y342-T351 HydrophobicContact CD1-CG2 3.9Å; Y342-T351 HydrophobicContact CE1-CG2 3.61Å
352	L	94.5	Very high	92.6	Very high	21 Å²	21	69.5 Å²	69.5	11%	0.11	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.3	-177.1	-61.6	176.9	0	0	0	109.5	D291 T292 T340 C341 E350	D291-L352 WeakPolarHBondContact O-CD1 3.29Å; T292-L352 HydrophobicContact CG2-CD1 4.37Å; T340-L352 CarbonylContact C-O 3.17Å; T340-L352 WeakPolarHBondContact CA-O 3.24Å; C341-L352 HydrophobicContact CB-CB 4.35Å; C341-L352 PolarHBondContact N-O 2.6Å; C341-L352 PolarHBondContact O-N 3.19Å; E350-L352 HydrophobicContact CG-CD2 3.97Å; E350-L352 HydrophobicContact CG-CG 4.08Å; E350-L352 WeakPolarHBondContact OE1-CD2 3.36Å
353	S	93.3	Very high	91.6	Very high	55 Å²	55	70 Å²	70	39%	0.385	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135.9	175.8	-62.8	0	0	0	0	110.1	Y339 T340	Y339-S353 CarbonylContact O-C 3.3Å; Y339-S353 WeakPolarHBondContact O-CA 3.15Å; T340-S353 PolarHBondContact OG1-OG 2.87Å
354	V	93.8	Very high	89.9	Confident	21 Å²	21	76.7 Å²	76.7	13%	0.127	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.9	177.5	-61.9	0	0	0	0	109	I288 W301 V338 Y339	I288-V354 HydrophobicContact CD1-CG2 4.41Å; I288-V354 HydrophobicContact CG2-CB 4.43Å; I288-V354 HydrophobicContact CG2-CG1 4.21Å; I288-V354 HydrophobicContact CG2-CG2 4.08Å; W301-V354 HydrophobicContact CH2-CG1 4.48Å; W301-V354 HydrophobicContact CH2-CG2 3.87Å; W301-V354 HydrophobicContact CZ3-CG2 3.69Å; V338-V354 CarbonylContact C-O 3.37Å; V338-V354 WeakPolarHBondContact CA-O 3.13Å; Y339-V354 PolarHBondContact N-O 3.31Å; Y339-V354 PolarHBondContact O-N 2.97Å
355	E	95.5	Very high	87.7	Confident	89 Å²	89	75.5 Å²	75.5	42%	0.416	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	124.9	174.2	-172	-174	-179.1	0	0	109.2	A277 W278 V338 K357	A277-E355 CarbonylContact C-O 3.59Å; A277-E355 WeakPolarHBondContact CA-O 3.24Å; A277-E355 HydrophobicContact CB-CB 3.98Å; A277-E355 HydrophobicContact CB-CG 4.03Å; W278-E355 PolarHBondContact N-O 2.73Å; V338-E355 HydrophobicContact CG2-CB 4.43Å; V338-E355 HydrophobicContact CG2-CG 4.4Å; E355-K357 VanDerWaalsContact CD-CE 3.43Å; E355-K357 WeakPolarHBondContact OE1-CE 3.39Å; E355-K357 IonicContact OE1-NZ 3.73Å; E355-K357 IonicContact OE2-NZ 3.95Å
356	L	95.1	Very high	85.6	Confident	3 Å²	3	79.5 Å²	79.5	2%	0.016	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.1	172.7	179.2	61.1	0	0	0	109.7	W278 A280 L286 F328 G336 G337 Y339 V358	W278-L356 HydrophobicContact CB-CD1 3.96Å; A280-L356 HydrophobicContact CB-CD1 4.05Å; L286-L356 HydrophobicContact CD2-CD1 3.52Å; L286-L356 HydrophobicContact CD2-CD2 4.44Å; F328-L356 HydrophobicContact CE1-CD2 3.92Å; F328-L356 HydrophobicContact CE2-CD2 4.16Å; F328-L356 HydrophobicContact CZ-CD2 3.73Å; G336-L356 WeakPolarHBondContact CA-O 3.22Å; G337-L356 PolarHBondContact N-O 3.12Å; G337-L356 PolarHBondContact O-N 3.22Å; Y339-L356 HydrophobicContact CD2-CB 4.38Å; Y339-L356 HydrophobicContact CE2-CB 4.29Å; Y339-L356 HydrophobicContact CE2-CD2 4.21Å; L356-V358 HydrophobicContact CD2-CG2 4.16Å; L356-V358 HydrophobicContact CG-CG2 3.97Å
357	K	95	Very high	83.7	Confident	93 Å²	93	75.7 Å²	75.7	40%	0.404	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	116.5	173.2	-68.8	-179.3	-175.2	172.5	0	109.1	A277 W278 E279 A280 E355	A277-K357 HydrophobicContact CB-CD 3.69Å; A277-K357 HydrophobicContact CB-CG 3.88Å; W278-K357 PolarHBondContact O-N 3.27Å; E279-K357 WeakPolarHBondContact CA-O 3.25Å; E279-K357 HydrophobicContact CG-CB 4.45Å; A280-K357 PolarHBondContact N-O 3.13Å; E355-K357 VanDerWaalsContact CD-CE 3.43Å; E355-K357 WeakPolarHBondContact OE1-CE 3.39Å; E355-K357 IonicContact OE1-NZ 3.73Å; E355-K357 IonicContact OE2-NZ 3.95Å
358	V	94.1	Very high	81.9	Confident	25 Å²	25	75.3 Å²	75.3	15%	0.152	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.6	179.7	-174.8	0	0	0	0	109.9	A280 V331 L356	A280-V358 CarbonylContact O-C 3.51Å; A280-V358 WeakPolarHBondContact O-CA 3.49Å; V331-V358 HydrophobicContact CG1-CB 4.19Å; V331-V358 HydrophobicContact CG1-CG1 3.55Å; V331-V358 HydrophobicContact CG1-CG2 3.52Å; L356-V358 HydrophobicContact CD2-CG2 4.16Å; L356-V358 HydrophobicContact CG-CG2 3.97Å
359	H	93.5	Very high	80.4	Confident	62 Å²	62	76.3 Å²	76.3	29%	0.287	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	136.7	172.8	-65.8	-71.6	0	0	0	110.8	A280 H281 L282 F361	A280-H359 PolarHBondContact O-N 3.12Å; H281-H359 AromaticContact CE1-CD2 3.64Å; H281-H359 AromaticContact ND1-CD2 3.95Å; L282-H359 PolarHBondContact N-O 3.33Å; H359-F361 HydrophobicContact CB-CD1 3.85Å; H359-F361 HydrophobicContact CB-CE1 3.54Å; H359-F361 HydrophobicContact CB-CZ 3.99Å; H359-F361 AromaticContact CG-CE1 3.89Å; H359-F361 AromaticContact ND1-CE1 3.99Å; H359-F361 PolarHBondContact O-N 3.15Å
360	N	91.2	Very high	78.7	Confident	134 Å²	134	75.8 Å²	75.8	72%	0.717	41%	0.405	S	S	*	.	S	Bend	trans	-76.7	21.4	-178.4	69.8	-19.6	0	0	0	114.5	V333	V333-N360 HydrophobicContact CG2-CB 4.17Å
361	F	89.6	Confident	77.3	Confident	97 Å²	97	79 Å²	79	43%	0.425	42%	0.422	S	S	.	.	S	Bend	trans	-135.8	152.2	176.7	62.9	-90.5	0	0	0	109.4	H281 L282 H359 L363	H281-F361 WeakPolarHBondContact CB-O 3.42Å; H281-F361 AromaticContact CE1-CE2 3.35Å; H281-F361 WeakPolarHBondContact CE1-CE2 3.2Å; H281-F361 AromaticContact CE1-CZ 3.44Å; H281-F361 VanDerWaalsContact CE1-CZ 3.44Å; H281-F361 WeakPolarHBondContact CE1-CZ 3.43Å; H281-F361 AromaticContact ND1-CD2 3.71Å; H281-F361 AromaticContact ND1-CE2 3.19Å; H281-F361 WeakPolarHBondContact ND1-CE2 3.5Å; H281-F361 AromaticContact ND1-CZ 3.53Å; L282-F361 PolarHBondContact N-O 2.71Å; H359-F361 HydrophobicContact CB-CD1 3.85Å; H359-F361 HydrophobicContact CB-CE1 3.54Å; H359-F361 HydrophobicContact CB-CZ 3.99Å; H359-F361 AromaticContact CG-CE1 3.89Å; H359-F361 AromaticContact ND1-CE1 3.99Å; H359-F361 PolarHBondContact O-N 3.15Å; F361-L363 HydrophobicContact CE2-CD1 3.99Å
362	T	84.6	Confident	76.2	Confident	68 Å²	68	79.3 Å²	79.3	42%	0.417	42%	0.424	S	S	.	.			trans	-86.1	131.5	172.8	63.5	0	0	0	0	108.3	L282 H364	L282-T362 HydrophobicContact CB-CG2 3.97Å; L282-T362 HydrophobicContact CD2-CG2 4.18Å; L282-T362 HydrophobicContact CG-CG2 4.44Å; L282-T362 VanDerWaalsContact O-CG2 3.31Å; L282-T362 WeakPolarHBondContact O-CG2 3.47Å; T362-H364 PolarHBondContact O-N 3.27Å
363	L	74.1	Confident	75.3	Confident	111 Å²	111	81 Å²	81	58%	0.581	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-21.1	175.1	-157.8	75.1	0	0	0	111.4	H281 F361	H281-L363 HydrophobicContact CB-CB 4.22Å; F361-L363 HydrophobicContact CE2-CD1 3.99Å
364	H	59.6	Low	74.7	Confident	141 Å²	141	85.6 Å²	85.6	65%	0.653	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	45.9	179.6	-71.7	81.4	0	0	0	113.1	T362 H366	T362-H364 PolarHBondContact O-N 3.27Å; H364-H366 VanDerWaalsContact C-N 3.35Å; H364-H366 PolarHBondContact O-N 3.09Å; H364-H366 VanDerWaalsContact O-N 3.11Å
365	G	48.5	Very low	74.3	Confident	56 Å²	56	88.8 Å²	88.8	58%	0.577	47%	0.471	S	S	*	.			trans	-79.9	74.2	168.7	0	0	0	0	0	112.9
366	H	46.3	Very low	73.9	Confident	108 Å²	108	88.4 Å²	88.4	50%	0.5	48%	0.475	S	S	.	.			trans	139.3	87.4	156.8	-90.3	-36.3	0	0	0	113.1	H364 D368 T369	H364-H366 VanDerWaalsContact C-N 3.35Å; H364-H366 PolarHBondContact O-N 3.09Å; H364-H366 VanDerWaalsContact O-N 3.11Å; H366-D368 IonicContact CE1-OD2 3.96Å; H366-D368 IonicContact ND1-OD2 3.39Å; H366-D368 PolarHBondContact ND1-OD2 2.99Å; H366-T369 HydrophobicContact CB-CG2 3.97Å; H366-T369 WeakPolarHBondContact CB-OG1 3.43Å; H366-T369 WeakPolarHBondContact CD2-CG2 3.4Å
367	H	49.4	Very low	73.7	Confident	121 Å²	121	92.9 Å²	92.9	56%	0.56	50%	0.498	S	S	*	.	H	α-helix	trans	-74.9	-10.3	143.2	-91	-73	0	0	0	111.9	L370 N371	H367-L370 PolarHBondContact O-N 2.83Å; H367-N371 WeakPolarHBondContact O-CB 3.4Å; H367-N371 PolarHBondContact O-N 3.17Å; H367-N371 PolarHBondContact O-ND2 2.76Å
368	D	51.6	Low	73.5	Confident	101 Å²	101	91 Å²	91	54%	0.54	49%	0.494	S	S	.	.	H	α-helix	trans	-73.5	-28.1	-179	-49.9	-48.7	0	0	0	113.6	H366 T372	H366-D368 IonicContact CE1-OD2 3.96Å; H366-D368 IonicContact ND1-OD2 3.39Å; H366-D368 PolarHBondContact ND1-OD2 2.99Å; D368-T372 PolarHBondContact O-N 2.82Å; D368-T372 PolarHBondContact O-OG1 3.15Å
369	T	56.6	Low	73.4	Confident	79 Å²	79	91.6 Å²	91.6	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-74.4	-38.5	174	53.2	0	0	0	0	111.7	H366 N371 T372 A373	H366-T369 HydrophobicContact CB-CG2 3.97Å; H366-T369 WeakPolarHBondContact CB-OG1 3.43Å; H366-T369 WeakPolarHBondContact CD2-CG2 3.4Å; T369-N371 VanDerWaalsContact C-N 3.34Å; T369-T372 PolarHBondContact O-N 3.44Å; T369-A373 PolarHBondContact O-N 2.85Å; T369-A373 VanDerWaalsContact O-N 3.1Å
370	L	57.3	Low	73.4	Confident	105 Å²	105	92.3 Å²	92.3	55%	0.55	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-35.5	172.3	-80.2	166.6	0	0	0	111.7	H367 T372 A373 Y374	H367-L370 PolarHBondContact O-N 2.83Å; L370-T372 VanDerWaalsContact C-N 3.31Å; L370-T372 PolarHBondContact O-N 3.39Å; L370-A373 PolarHBondContact O-N 3.33Å; L370-Y374 WeakPolarHBondContact O-CB 3.46Å; L370-Y374 PolarHBondContact O-N 3.48Å
371	N	64.2	Low	73.6	Confident	85 Å²	85	90.6 Å²	90.6	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-62.4	-38.9	174.6	-77.4	-21	0	0	0	111.8	H367 T369 T375	H367-N371 WeakPolarHBondContact O-CB 3.4Å; H367-N371 PolarHBondContact O-N 3.17Å; H367-N371 PolarHBondContact O-ND2 2.76Å; T369-N371 VanDerWaalsContact C-N 3.34Å; N371-T375 WeakPolarHBondContact O-CB 3.46Å; N371-T375 WeakPolarHBondContact O-CG2 3.1Å; N371-T375 PolarHBondContact O-N 2.76Å; N371-T375 PolarHBondContact O-OG1 3.28Å
372	T	71.7	Confident	73.9	Confident	90 Å²	90	90.9 Å²	90.9	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-71.2	-42.3	178.1	-43.9	0	0	0	0	111.6	D368 T369 L370 T375 T376	D368-T372 PolarHBondContact O-N 2.82Å; D368-T372 PolarHBondContact O-OG1 3.15Å; T369-T372 PolarHBondContact O-N 3.44Å; L370-T372 VanDerWaalsContact C-N 3.31Å; L370-T372 PolarHBondContact O-N 3.39Å; T372-T375 WeakPolarHBondContact CA-OG1 3.4Å; T372-T375 PolarHBondContact O-OG1 2.96Å; T372-T375 VanDerWaalsContact O-OG1 3.05Å; T372-T376 WeakPolarHBondContact O-CB 3.41Å; T372-T376 VanDerWaalsContact O-CG2 3.25Å; T372-T376 WeakPolarHBondContact O-CG2 3.46Å; T372-T376 PolarHBondContact O-N 3.21Å; T372-T376 PolarHBondContact O-OG1 2.87Å
373	A	76.5	Confident	74.3	Confident	56 Å²	56	90.5 Å²	90.5	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	-38.4	175.7	0	0	0	0	0	112.7	T369 L370 T376 L377	T369-A373 PolarHBondContact O-N 2.85Å; T369-A373 VanDerWaalsContact O-N 3.1Å; L370-A373 PolarHBondContact O-N 3.33Å; A373-T376 WeakPolarHBondContact CA-OG1 3.35Å; A373-T376 PolarHBondContact O-OG1 3.42Å; A373-L377 VanDerWaalsContact O-CB 3.27Å; A373-L377 WeakPolarHBondContact O-CB 3.29Å; A373-L377 PolarHBondContact O-N 3.24Å
374	Y	81.3	Confident	75.3	Confident	152 Å²	152	89.3 Å²	89.3	60%	0.596	51%	0.509	S	S	*	.	H	α-helix	trans	-72.1	-42.7	177.8	-173.5	-96.5	0	0	0	111.5	L370 T376 L377 V378	L370-Y374 WeakPolarHBondContact O-CB 3.46Å; L370-Y374 PolarHBondContact O-N 3.48Å; Y374-T376 VanDerWaalsContact C-N 3.35Å; Y374-T376 PolarHBondContact O-N 3.29Å; Y374-L377 PolarHBondContact O-N 3.14Å; Y374-V378 HydrophobicContact CD1-CG2 3.97Å; Y374-V378 HydrophobicContact CE1-CG2 3.64Å; Y374-V378 HydrophobicContact CE2-CG2 4.44Å; Y374-V378 HydrophobicContact CG-CG2 4.5Å; Y374-V378 WeakPolarHBondContact O-CB 3.34Å; Y374-V378 VanDerWaalsContact O-CG2 3.26Å; Y374-V378 WeakPolarHBondContact O-CG2 3.07Å; Y374-V378 PolarHBondContact O-N 3.26Å
375	T	84	Confident	76.9	Confident	88 Å²	88	85.9 Å²	85.9	54%	0.54	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-38.5	175.5	52.2	0	0	0	0	111.9	N371 T372 G379	N371-T375 WeakPolarHBondContact O-CB 3.46Å; N371-T375 WeakPolarHBondContact O-CG2 3.1Å; N371-T375 PolarHBondContact O-N 2.76Å; N371-T375 PolarHBondContact O-OG1 3.28Å; T372-T375 WeakPolarHBondContact CA-OG1 3.4Å; T372-T375 PolarHBondContact O-OG1 2.96Å; T372-T375 VanDerWaalsContact O-OG1 3.05Å; T375-G379 PolarHBondContact O-N 2.84Å
376	T	87	Confident	79	Confident	82 Å²	82	88.7 Å²	88.7	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-42.6	172.6	50.3	0	0	0	0	111.9	T372 A373 Y374 G379 C380	T372-T376 WeakPolarHBondContact O-CB 3.41Å; T372-T376 VanDerWaalsContact O-CG2 3.25Å; T372-T376 WeakPolarHBondContact O-CG2 3.46Å; T372-T376 PolarHBondContact O-N 3.21Å; T372-T376 PolarHBondContact O-OG1 2.87Å; A373-T376 WeakPolarHBondContact CA-OG1 3.35Å; A373-T376 PolarHBondContact O-OG1 3.42Å; Y374-T376 VanDerWaalsContact C-N 3.35Å; Y374-T376 PolarHBondContact O-N 3.29Å; T376-G379 PolarHBondContact O-N 3.33Å; T376-C380 WeakPolarHBondContact O-CB 3.48Å; T376-C380 PolarHBondContact O-N 2.77Å; T376-C380 PolarHBondContact O-SG 3.27Å
377	L	90.8	Very high	81.1	Confident	97 Å²	97	87.6 Å²	87.6	51%	0.508	50%	0.5	S	S	.	.	H	α-helix	trans	-59.4	-48.5	174.2	-173.9	84	0	0	0	111.7	A373 Y374 G379 C380 I381	A373-L377 VanDerWaalsContact O-CB 3.27Å; A373-L377 WeakPolarHBondContact O-CB 3.29Å; A373-L377 PolarHBondContact O-N 3.24Å; Y374-L377 PolarHBondContact O-N 3.14Å; L377-G379 VanDerWaalsContact C-N 3.34Å; L377-G379 PolarHBondContact O-N 3.18Å; L377-C380 PolarHBondContact O-N 2.03Å; L377-I381 HydrophobicContact CD2-CD1 4.31Å; L377-I381 HydrophobicContact CG-CD1 4.01Å; L377-I381 WeakPolarHBondContact O-CG1 3.36Å; L377-I381 PolarHBondContact O-N 2.79Å
378	V	91.9	Very high	83	Confident	53 Å²	53	85.9 Å²	85.9	32%	0.321	50%	0.495	S	S	.	.	H	α-helix	trans	-62.1	-42	177.4	171.6	0	0	0	0	110.6	Y374 I381 L382	Y374-V378 HydrophobicContact CD1-CG2 3.97Å; Y374-V378 HydrophobicContact CE1-CG2 3.64Å; Y374-V378 HydrophobicContact CE2-CG2 4.44Å; Y374-V378 HydrophobicContact CG-CG2 4.5Å; Y374-V378 WeakPolarHBondContact O-CB 3.34Å; Y374-V378 VanDerWaalsContact O-CG2 3.26Å; Y374-V378 WeakPolarHBondContact O-CG2 3.07Å; Y374-V378 PolarHBondContact O-N 3.26Å; V378-I381 PolarHBondContact O-N 3.38Å; V378-L382 HydrophobicContact CG1-CD1 3.96Å; V378-L382 HydrophobicContact CG1-CG 4.43Å; V378-L382 WeakPolarHBondContact O-CB 3.38Å; V378-L382 WeakPolarHBondContact O-CG 3.36Å; V378-L382 PolarHBondContact O-N 2.87Å
379	G	91.8	Very high	84.7	Confident	38 Å²	38	84.9 Å²	84.9	39%	0.392	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-41.8	173.5	0	0	0	0	0	113.2	T375 T376 L377 S383	T375-G379 PolarHBondContact O-N 2.84Å; T376-G379 PolarHBondContact O-N 3.33Å; L377-G379 VanDerWaalsContact C-N 3.34Å; L377-G379 PolarHBondContact O-N 3.18Å; G379-S383 WeakPolarHBondContact O-CB 3.29Å; G379-S383 PolarHBondContact O-N 3.23Å; G379-S383 PolarHBondContact O-OG 3.03Å; G379-S383 VanDerWaalsContact O-OG 3.1Å
380	C	94	Very high	86.1	Confident	77 Å²	77	88.5 Å²	88.5	52%	0.52	49%	0.494	S	S	.	.	H	α-helix	trans	-64	-45.4	174.5	-74.2	0	0	0	0	111.6	T376 L377 L382 S383 V384	T376-C380 WeakPolarHBondContact O-CB 3.48Å; T376-C380 PolarHBondContact O-N 2.77Å; T376-C380 PolarHBondContact O-SG 3.27Å; L377-C380 PolarHBondContact O-N 2.03Å; C380-L382 PolarHBondContact O-N 2.66Å; C380-S383 WeakPolarHBondContact CA-OG 3.32Å; C380-S383 PolarHBondContact O-N 3.26Å; C380-S383 PolarHBondContact O-OG 2.87Å; C380-V384 WeakPolarHBondContact O-CG2 3.45Å; C380-V384 PolarHBondContact O-N 2.86Å
381	I	95	Very high	87.4	Confident	97 Å²	97	89 Å²	89	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-63.1	-45.5	178.1	-68.9	169.1	0	0	0	110.5	L377 V378 S383 V384 V385	L377-I381 HydrophobicContact CD2-CD1 4.31Å; L377-I381 HydrophobicContact CG-CD1 4.01Å; L377-I381 WeakPolarHBondContact O-CG1 3.36Å; L377-I381 PolarHBondContact O-N 2.79Å; V378-I381 PolarHBondContact O-N 3.38Å; I381-S383 VanDerWaalsContact C-N 3.35Å; I381-S383 PolarHBondContact O-N 3.19Å; I381-V384 PolarHBondContact O-N 2.93Å; I381-V385 HydrophobicContact CG2-CG2 4.38Å; I381-V385 WeakPolarHBondContact O-CB 3.49Å; I381-V385 VanDerWaalsContact O-CG2 3.28Å; I381-V385 WeakPolarHBondContact O-CG2 3.3Å; I381-V385 PolarHBondContact O-N 3.48Å
382	L	94.9	Very high	88.1	Confident	103 Å²	103	94 Å²	94	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-41.2	177.6	-75.2	171.9	0	0	0	112.2	V378 C380 V385 L386	V378-L382 HydrophobicContact CG1-CD1 3.96Å; V378-L382 HydrophobicContact CG1-CG 4.43Å; V378-L382 WeakPolarHBondContact O-CB 3.38Å; V378-L382 WeakPolarHBondContact O-CG 3.36Å; V378-L382 PolarHBondContact O-N 2.87Å; C380-L382 PolarHBondContact O-N 2.66Å; L382-V385 PolarHBondContact O-N 3.45Å; L382-L386 WeakPolarHBondContact O-CB 3.33Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 2.95Å; L382-L386 PolarHBondContact O-N 3.19Å
383	S	94.1	Very high	88.1	Confident	61 Å²	61	95.9 Å²	95.9	43%	0.427	52%	0.517	S	S	.	.	H	α-helix	trans	-66.6	-41.2	177	58.4	0	0	0	0	112.6	G379 C380 I381 L386 V387	G379-S383 WeakPolarHBondContact O-CB 3.29Å; G379-S383 PolarHBondContact O-N 3.23Å; G379-S383 PolarHBondContact O-OG 3.03Å; G379-S383 VanDerWaalsContact O-OG 3.1Å; C380-S383 WeakPolarHBondContact CA-OG 3.32Å; C380-S383 PolarHBondContact O-N 3.26Å; C380-S383 PolarHBondContact O-OG 2.87Å; I381-S383 VanDerWaalsContact C-N 3.35Å; I381-S383 PolarHBondContact O-N 3.19Å; S383-L386 PolarHBondContact O-N 3.26Å; S383-V387 VanDerWaalsContact O-CG2 3.31Å; S383-V387 WeakPolarHBondContact O-CG2 3.36Å; S383-V387 PolarHBondContact O-N 2.02Å
384	V	94.1	Very high	87.5	Confident	85 Å²	85	96.1 Å²	96.1	52%	0.515	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-43.3	174	172.1	0	0	0	0	111.3	C380 I381 L386 V387 L388	C380-V384 WeakPolarHBondContact O-CG2 3.45Å; C380-V384 PolarHBondContact O-N 2.86Å; I381-V384 PolarHBondContact O-N 2.93Å; V384-L386 PolarHBondContact O-N 2.8Å; V384-V387 PolarHBondContact O-N 3.32Å; V384-L388 HydrophobicContact CG1-CD1 4.02Å; V384-L388 HydrophobicContact CG1-CG 4.46Å; V384-L388 WeakPolarHBondContact O-CG 2.97Å; V384-L388 PolarHBondContact O-N 3.44Å
385	V	93.4	Very high	86.4	Confident	70 Å²	70	94 Å²	94	42%	0.424	52%	0.517	S	S	.	.	H	α-helix	trans	-62.5	-42.1	176.8	170.7	0	0	0	0	111.2	I381 L382 L388 I389	I381-V385 HydrophobicContact CG2-CG2 4.38Å; I381-V385 WeakPolarHBondContact O-CB 3.49Å; I381-V385 VanDerWaalsContact O-CG2 3.28Å; I381-V385 WeakPolarHBondContact O-CG2 3.3Å; I381-V385 PolarHBondContact O-N 3.48Å; L382-V385 PolarHBondContact O-N 3.45Å; V385-L388 PolarHBondContact O-N 3.05Å; V385-I389 HydrophobicContact CG1-CD1 3.85Å; V385-I389 HydrophobicContact CG1-CG1 4.46Å; V385-I389 WeakPolarHBondContact O-CB 3.12Å; V385-I389 VanDerWaalsContact O-CG1 3.28Å; V385-I389 WeakPolarHBondContact O-CG1 3.43Å; V385-I389 PolarHBondContact O-N 2.78Å
386	L	92.1	Very high	85.1	Confident	114 Å²	114	95.6 Å²	95.6	60%	0.597	53%	0.531	S	S	*	.	H	α-helix	trans	-65.1	-39.8	176.3	-74.2	172.2	0	0	0	112.6	L382 S383 V384 I389 Y390	L382-L386 WeakPolarHBondContact O-CB 3.33Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 2.95Å; L382-L386 PolarHBondContact O-N 3.19Å; S383-L386 PolarHBondContact O-N 3.26Å; V384-L386 PolarHBondContact O-N 2.8Å; L386-I389 PolarHBondContact O-N 3.49Å; L386-Y390 WeakPolarHBondContact O-CB 3.44Å; L386-Y390 PolarHBondContact O-N 3.45Å
387	V	90.5	Very high	83.5	Confident	86 Å²	86	102.7 Å²	102.7	52%	0.521	55%	0.548	S	S	.	.	H	α-helix	trans	-64.1	-43.4	174.8	170.9	0	0	0	0	110.8	S383 V384 Y390 L391	S383-V387 VanDerWaalsContact O-CG2 3.31Å; S383-V387 WeakPolarHBondContact O-CG2 3.36Å; S383-V387 PolarHBondContact O-N 2.02Å; V384-V387 PolarHBondContact O-N 3.32Å; V387-Y390 PolarHBondContact O-N 3.31Å; V387-L391 HydrophobicContact CG1-CD1 3.88Å; V387-L391 HydrophobicContact CG1-CG 4.4Å; V387-L391 WeakPolarHBondContact O-CB 3.08Å; V387-L391 VanDerWaalsContact O-CG 3.31Å; V387-L391 WeakPolarHBondContact O-CG 3.45Å; V387-L391 PolarHBondContact O-N 2.69Å
388	L	89.8	Confident	81.6	Confident	84 Å²	84	104 Å²	104	44%	0.44	56%	0.564	S	S	.	*	H	α-helix	trans	-63.2	-43.7	175.2	-71.5	171.3	0	0	0	111.4	V384 V385 Y390 L391 Y392	V384-L388 HydrophobicContact CG1-CD1 4.02Å; V384-L388 HydrophobicContact CG1-CG 4.46Å; V384-L388 WeakPolarHBondContact O-CG 2.97Å; V384-L388 PolarHBondContact O-N 3.44Å; V385-L388 PolarHBondContact O-N 3.05Å; L388-Y390 VanDerWaalsContact C-N 3.34Å; L388-Y390 PolarHBondContact O-N 3.36Å; L388-L391 PolarHBondContact O-N 3.34Å; L388-Y392 HydrophobicContact CD2-CD2 4.43Å; L388-Y392 HydrophobicContact CD2-CE2 4.03Å; L388-Y392 WeakPolarHBondContact O-CB 3.09Å; L388-Y392 VanDerWaalsContact O-CD2 3.28Å; L388-Y392 WeakPolarHBondContact O-CD2 3.2Å; L388-Y392 PolarHBondContact O-N 3.05Å
389	I	88.1	Confident	79.3	Confident	80 Å²	80	112.9 Å²	112.9	41%	0.41	59%	0.592	S	S	.	*	H	α-helix	trans	-57	-48	173.5	-75.9	169.4	0	0	0	110.4	V385 L386 L391 Y392 L393	V385-I389 HydrophobicContact CG1-CD1 3.85Å; V385-I389 HydrophobicContact CG1-CG1 4.46Å; V385-I389 WeakPolarHBondContact O-CB 3.12Å; V385-I389 VanDerWaalsContact O-CG1 3.28Å; V385-I389 WeakPolarHBondContact O-CG1 3.43Å; V385-I389 PolarHBondContact O-N 2.78Å; L386-I389 PolarHBondContact O-N 3.49Å; I389-L391 PolarHBondContact O-N 2.99Å; I389-Y392 PolarHBondContact O-N 3.25Å; I389-L393 HydrophobicContact CB-CD1 4.38Å; I389-L393 HydrophobicContact CG1-CD1 4.41Å; I389-L393 HydrophobicContact CG2-CD1 3.84Å; I389-L393 WeakPolarHBondContact O-CA 3.36Å; I389-L393 VanDerWaalsContact O-CB 3.23Å; I389-L393 WeakPolarHBondContact O-CB 3.44Å; I389-L393 PolarHBondContact O-N 2.8Å
390	Y	85.7	Confident	77.3	Confident	156 Å²	156	117.4 Å²	117.4	61%	0.612	62%	0.616	S	S	*	*	H	α-helix	trans	-60.1	-45.9	178.7	-179.5	-98.3	0	0	0	112	L386 V387 L388 Y392 T394	L386-Y390 WeakPolarHBondContact O-CB 3.44Å; L386-Y390 PolarHBondContact O-N 3.45Å; V387-Y390 PolarHBondContact O-N 3.31Å; L388-Y390 VanDerWaalsContact C-N 3.34Å; L388-Y390 PolarHBondContact O-N 3.36Å; Y390-Y392 PolarHBondContact O-N 2.76Å; Y390-T394 HydrophobicContact CD2-CG2 3.84Å; Y390-T394 HydrophobicContact CE2-CG2 3.87Å; Y390-T394 WeakPolarHBondContact O-CB 3.3Å; Y390-T394 PolarHBondContact O-N 3.05Å; Y390-T394 PolarHBondContact O-OG1 3.42Å
391	L	83.5	Confident	74.7	Confident	114 Å²	114	125.2 Å²	125.2	60%	0.597	63%	0.634	S	S	*	*	H	α-helix	trans	-68.3	-33.2	-179.1	-70.4	171.9	0	0	0	113.6	V387 L388 I389	V387-L391 HydrophobicContact CG1-CD1 3.88Å; V387-L391 HydrophobicContact CG1-CG 4.4Å; V387-L391 WeakPolarHBondContact O-CB 3.08Å; V387-L391 VanDerWaalsContact O-CG 3.31Å; V387-L391 WeakPolarHBondContact O-CG 3.45Å; V387-L391 PolarHBondContact O-N 2.69Å; L388-L391 PolarHBondContact O-N 3.34Å; I389-L391 PolarHBondContact O-N 2.99Å
392	Y	79.5	Confident	72.2	Confident	192 Å²	192	123.7 Å²	123.7	75%	0.753	64%	0.643	S	S	*	*	H	α-helix	trans	-96.9	-23	-176.4	-78.5	-90.1	0	0	0	114.2	L388 I389 Y390	L388-Y392 HydrophobicContact CD2-CD2 4.43Å; L388-Y392 HydrophobicContact CD2-CE2 4.03Å; L388-Y392 WeakPolarHBondContact O-CB 3.09Å; L388-Y392 VanDerWaalsContact O-CD2 3.28Å; L388-Y392 WeakPolarHBondContact O-CD2 3.2Å; L388-Y392 PolarHBondContact O-N 3.05Å; I389-Y392 PolarHBondContact O-N 3.25Å; Y390-Y392 PolarHBondContact O-N 2.76Å
393	L	72.9	Confident	69.7	Low	129 Å²	129	125 Å²	125	68%	0.675	66%	0.655	S	S	*	*	H	α-helix	trans	-110.1	-3.3	-176.5	-69	158.6	0	0	0	114.3	I389 P395	I389-L393 HydrophobicContact CB-CD1 4.38Å; I389-L393 HydrophobicContact CG1-CD1 4.41Å; I389-L393 HydrophobicContact CG2-CD1 3.84Å; I389-L393 WeakPolarHBondContact O-CA 3.36Å; I389-L393 VanDerWaalsContact O-CB 3.23Å; I389-L393 WeakPolarHBondContact O-CB 3.44Å; I389-L393 PolarHBondContact O-N 2.8Å; L393-P395 VanDerWaalsContact O-CD 3.27Å; L393-P395 WeakPolarHBondContact O-CD 3.41Å
394	T	62.8	Low	67	Low	61 Å²	61	130 Å²	130	37%	0.374	67%	0.672	S	S	.	*	S	Bend	trans	-92.6	107.2	164.9	59	0	0	0	0	110.2	Y390 C396	Y390-T394 HydrophobicContact CD2-CG2 3.84Å; Y390-T394 HydrophobicContact CE2-CG2 3.87Å; Y390-T394 WeakPolarHBondContact O-CB 3.3Å; Y390-T394 PolarHBondContact O-N 3.05Å; Y390-T394 PolarHBondContact O-OG1 3.42Å; T394-C396 PolarHBondContact O-N 2.88Å; T394-C396 VanDerWaalsContact O-N 3.09Å
395	P	58.3	Low	64.2	Low	107 Å²	107	135.1 Å²	135.1	70%	0.695	69%	0.687	S	S	*	*			trans	-72.5	108.7	178	28.2	-30.7	0	0	0	108.4	L393 R397	L393-P395 VanDerWaalsContact O-CD 3.27Å; L393-P395 WeakPolarHBondContact O-CD 3.41Å; P395-R397 PolarHBondContact O-N 3.5Å
396	C	56.8	Low	61.5	Low	122 Å²	122	137.6 Å²	137.6	82%	0.824	70%	0.704	S	S	*	*			trans	-61.2	89.2	163.5	-70.9	0	0	0	0	109.3	T394 C398	T394-C396 PolarHBondContact O-N 2.88Å; T394-C396 VanDerWaalsContact O-N 3.09Å; C396-C398 PolarHBondContact O-N 2.95Å
397	R	53.2	Low	58.9	Low	231 Å²	231	137.9 Å²	137.9	87%	0.872	72%	0.716	S	S	*	*			trans	-85.2	84.1	161.3	-77	-172.1	175.5	-149.9	0.5	108.2	P395	P395-R397 PolarHBondContact O-N 3.5Å
398	C	51.3	Low	56.4	Low	123 Å²	123	138.2 Å²	138.2	83%	0.831	72%	0.722	S	S	*	*			trans	-85.2	108.7	165.6	-74.7	0	0	0	0	109.2	C396	C396-C398 PolarHBondContact O-N 2.95Å
399	W	44.3	Very low	54.2	Low	240 Å²	240	141.6 Å²	141.6	91%	0.909	74%	0.735	S	S	*	*			trans	-133.7	91.8	167.2	-138.1	-3.6	0	0	0	108.4
400	C	49.3	Very low	52.1	Low	133 Å²	133	146.6 Å²	146.6	90%	0.899	76%	0.757	S	S	*	*			trans	-139.7	101.1	164.9	-74.8	0	0	0	0	109.3
401	R	40	Very low	50	Low	241 Å²	241	142.4 Å²	142.4	91%	0.909	76%	0.761	S	S	*	*			trans	-66.8	132.7	144.2	-75.1	177.5	173.7	-174.7	-2.2	105.3
402	G	42	Very low	48.1	Very low	65 Å²	65	144.3 Å²	144.3	67%	0.67	77%	0.772	S	S	*	*			cis	105	136.6	47.3	0	0	0	0	0	107.9
403	V	41.3	Very low	46.6	Very low	132 Å²	132	140.2 Å²	140.2	80%	0.8	77%	0.771	S	S	*	*			trans	93.5	117	179	-166.8	0	0	0	0	111.8
404	E	37.3	Very low	45.5	Very low	166 Å²	166	141.7 Å²	141.7	78%	0.776	78%	0.779	S	S	*	*			cis	-166.9	151.1	35.8	-135.2	158.4	-138.4	0	0	113.8
405	K	36.5	Very low	44.6	Very low	192 Å²	192	144 Å²	144	84%	0.835	80%	0.797	S	S	*	*			trans	74.6	127.1	153	-94.3	173	175.8	170.1	0	123.4
406	P	36.6	Very low	43.8	Very low	121 Å²	121	143.8 Å²	143.8	79%	0.786	80%	0.799	S	S	*	*			trans	-132.8	175.2	153.9	38.6	-23.2	0	0	0	115.7
407	S	38.2	Very low	43	Very low	121 Å²	121	143 Å²	143	85%	0.846	79%	0.794	S	S	*	*			trans	93.9	131.5	176.8	80	0	0	0	0	114.4
408	S	37.6	Very low	42.5	Very low	93 Å²	93	140.3 Å²	140.3	65%	0.65	79%	0.794	S	S	*	*			cis	-169.3	163.4	24.1	49.4	0	0	0	0	112.1
409	H	43.8	Very low	41.9	Very low	155 Å²	155	140.9 Å²	140.9	72%	0.718	79%	0.788	S	S	*	*			trans	101.9	116.4	150.2	-69.2	-61	0	0	0	122.9
410	Q	42.8	Very low	41.5	Very low	184 Å²	184	133.6 Å²	133.6	86%	0.86	77%	0.774	S	S	*	*			trans	67.2	120.1	138.5	-69.3	170.4	-15.2	0	0	116.7
411	G	41.3	Very low	41.1	Very low	68 Å²	68	133.3 Å²	133.3	70%	0.701	77%	0.768	S	S	*	*				121	132	51	0	0	0	0	0	103.7
412	D	43.4	Very low	41.2	Very low	155 Å²	155	128 Å²	128	83%	0.829	76%	0.763	S	S	*	*			cis	-159.8	165.9	25.5	-90.2	-42.1	0	0	0	109.1
413	S	48.4	Very low	41.3	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	77%	0.769	S	S	*	*			trans	66.8	130	145.8	49.8	0	0	0	0	119.7
414	L	49.4	Very low	41.2	Very low	159 Å²	159	131.6 Å²	131.6	83%	0.832	77%	0.769	S	S	*	*			cis	-160.6	145	1.8	-87.6	147.4	0	0	0	107.1
415	S	44.7	Very low	41.5	Very low	109 Å²	109	131.3 Å²	131.3	76%	0.762	77%	0.767	S	S	*	*			trans	145.4	24	157.3	51.1	0	0	0	0	119.8
416	S	41.7	Very low	41.8	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	76%	0.763	S	S	*	*			trans	25.1	107.7	146.6	-36.7	0	0	0	0	120.4
417	S	40.7	Very low	42.1	Very low	105 Å²	105	128 Å²	128	73%	0.734	76%	0.757	S	S	*	*				73	112.4	78.1	64.9	0	0	0	0	115
418	M	41.9	Very low	42.3	Very low	175 Å²	175	130.9 Å²	130.9	86%	0.862	76%	0.76	S	S	*	*				84.9	129.6	70	-89.2	-154	167.8	0	0	116.6
419	L	38.7	Very low	42.6	Very low	136 Å²	136	131.1 Å²	131.1	71%	0.712	77%	0.768	S	S	*	*			trans	70.7	117.7	148.4	-84.4	96.4	0	0	0	123.4
420	S	36.6	Very low	42.2	Very low	86 Å²	86	127.9 Å²	127.9	60%	0.601	78%	0.776	S	S	*	*				10.6	135.8	129	58.9	0	0	0	0	120.3
421	T	39.4	Very low	42	Very low	127 Å²	127	122.6 Å²	122.6	78%	0.779	77%	0.771	S	S	*	*				-177	130.7	108.3	27	0	0	0	0	112
422	T	43.8	Very low	41.9	Very low	131 Å²	131	126.7 Å²	126.7	80%	0.804	78%	0.777	S	S	*	*			trans	43.3	132.4	148.9	53.1	0	0	0	0	122.3
423	P	43.2	Very low	41.7	Very low	123 Å²	123	128.7 Å²	128.7	80%	0.799	78%	0.778	S	S	*	*			trans	-100.5	155.5	171.4	38	-29.1	0	0	0	113.2
424	N	39.4	Very low	41.2	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	79%	0.785	S	S	*	*			trans	-155.6	129.2	155.3	-111.4	-4.6	0	0	0	110.9
425	H	44	Very low	40.5	Very low	159 Å²	159	131.3 Å²	131.3	74%	0.736	79%	0.785	S	S	*	*			trans	60.9	136.3	158.2	-83	-87.2	0	0	0	117.5
426	D	41.7	Very low	40.2	Very low	140 Å²	140	129 Å²	129	75%	0.749	78%	0.777	S	S	*	*			cis	-157.3	165.7	30.4	-95.4	-44.5	0	0	0	110.6
427	P	43.7	Very low	39.9	Very low	103 Å²	103	132.7 Å²	132.7	67%	0.669	78%	0.781	S	S	*	*			trans	-102.4	157.1	-170.3	38.1	-30	0	0	0	114.1
428	M	42.6	Very low	39.8	Very low	182 Å²	182	134.1 Å²	134.1	90%	0.897	78%	0.78	S	S	*	*				152.6	140	126	-79.9	-139.8	-160.4	0	0	113.6
429	A	42.6	Very low	39.6	Very low	99 Å²	99	136.5 Å²	136.5	82%	0.818	78%	0.78	S	S	*	*			trans	89.5	103.5	148.5	0	0	0	0	0	120.1
430	G	37.3	Very low	39.4	Very low	87 Å²	87	141.5 Å²	141.5	90%	0.897	79%	0.789	S	S	*	*			trans	82.1	128.9	142.4	0	0	0	0	0	115.7
431	G	37.4	Very low	39.5	Very low	72 Å²	72	143.6 Å²	143.6	74%	0.742	80%	0.798	S	S	*	*			cis	172.9	154.5	5.4	0	0	0	0	0	107.3
432	D	38.9	Very low	39.4	Very low	155 Å²	155	141.4 Å²	141.4	83%	0.829	79%	0.793	S	S	*	*			trans	65.3	90.9	160.3	-72.8	-9	0	0	0	120.3
433	K	38.8	Very low	39.3	Very low	196 Å²	196	144.6 Å²	144.6	85%	0.852	80%	0.796	S	S	*	*	S	Bend		166	143.9	97.5	-91.4	174.2	179.3	177.7	0	111.5
434	D	38.6	Very low	39.3	Very low	167 Å²	167	146 Å²	146	89%	0.893	80%	0.796	S	S	*	*			trans	80.8	83.2	179.7	-72.3	-7.7	0	0	0	117.3
435	D	35.6	Very low	39	Very low	154 Å²	154	147.6 Å²	147.6	82%	0.824	80%	0.799	S	S	*	*			trans	-84.7	129.3	162.5	-109.6	-20.2	0	0	0	110.4
436	G	37	Very low	39.1	Very low	59 Å²	59	146.4 Å²	146.4	61%	0.608	81%	0.805	S	S	*	*			trans	-74.6	-178.9	154.6	0	0	0	0	0	110.9
437	F	36	Very low	38.7	Very low	182 Å²	182	144.7 Å²	144.7	80%	0.798	81%	0.81	S	S	*	*				159.8	129.8	127.3	-92	-76.3	0	0	0	111.5
438	D	38	Very low	38.5	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	81%	0.813	S	S	*	*			trans	63.1	122.4	137.4	-91.5	-33.6	0	0	0	124.7
439	R	38.9	Very low	38.3	Very low	225 Å²	225	141.2 Å²	141.2	85%	0.849	81%	0.814	S	S	*	*			trans	-10.3	139.7	141.6	-79	172.6	161.3	171.2	-3.6	119
440	R	34.5	Very low	38	Very low	240 Å²	240	139.6 Å²	139.6	91%	0.906	81%	0.807	S	S	*	*			trans	95	106.2	157.2	-63.9	-177.3	-178.1	-177.1	1.6	116
441	V	38	Very low	38	Very low	131 Å²	131	145.3 Å²	145.3	79%	0.794	81%	0.811	S	S	*	*			trans	-139.8	123.8	150.3	-176.8	0	0	0	0	109.4	F443	V441-F443 HydrophobicContact CG1-CD2 4.34Å; V441-F443 HydrophobicContact CG1-CE2 4.38Å
442	A	38.1	Very low	37.9	Very low	81 Å²	81	145.5 Å²	145.5	67%	0.669	81%	0.813	S	S	*	*			trans	-86.3	146.3	163.3	0	0	0	0	0	109.4
443	F	41.8	Very low	37.8	Very low	198 Å²	198	146.6 Å²	146.6	87%	0.868	81%	0.813	S	S	*	*			trans	-114.8	100.4	162.5	-98.1	-94.5	0	0	0	106.4	V441	V441-F443 HydrophobicContact CG1-CD2 4.34Å; V441-F443 HydrophobicContact CG1-CE2 4.38Å
444	L	42.2	Very low	37.6	Very low	153 Å²	153	145.1 Å²	145.1	80%	0.801	81%	0.814	S	S	*	*				63.7	95.3	78.7	-78.5	157.2	0	0	0	114.1
445	E	33.5	Very low	37.4	Very low	182 Å²	182	141 Å²	141	85%	0.85	81%	0.811	S	S	*	*			trans	-57.2	149.7	154.1	-100.8	173.4	152.5	0	0	111.7
446	P	46.2	Very low	37.2	Very low	134 Å²	134	143.4 Å²	143.4	87%	0.87	81%	0.814	S	S	*	*			trans	-99.2	112	160.1	31.9	-20.9	0	0	0	110.5
447	A	33	Very low	37	Very low	103 Å²	103	149 Å²	149	85%	0.851	83%	0.83	S	S	*	*			trans	-112.3	129.2	164.2	0	0	0	0	0	110.4
448	G	40.3	Very low	37	Very low	72 Å²	72	149.6 Å²	149.6	74%	0.742	83%	0.832	S	S	*	*			trans	118.2	165	156.2	0	0	0	0	0	115.6
449	P	38.5	Very low	36.9	Very low	140 Å²	140	149.4 Å²	149.4	91%	0.909	84%	0.838	S	S	*	*			cis	-139.6	172.3	-24.2	36.1	-17.8	0	0	0	113
450	G	35.8	Very low	36.4	Very low	66 Å²	66	141.6 Å²	141.6	68%	0.68	83%	0.828	S	S	*	*			trans	142.4	90.1	163.2	0	0	0	0	0	113.4
451	Q	36.1	Very low	36.5	Very low	206 Å²	206	137.3 Å²	137.3	96%	0.963	82%	0.823	S	S	*	*				63.8	112.7	100.7	-78.4	-175.8	-12.1	0	0	115
452	G	35.4	Very low	36.2	Very low	77 Å²	77	137.9 Å²	137.9	79%	0.794	83%	0.827	S	S	*	*			trans	170.1	64.4	170.2	0	0	0	0	0	116.7
453	Q	38.4	Very low	36.1	Very low	177 Å²	177	141.1 Å²	141.1	83%	0.827	83%	0.832	S	S	*	*			trans	24.2	120.5	148.1	-65.4	176.1	5.3	0	0	122.1
454	N	34.2	Very low	35.7	Very low	165 Å²	165	137.2 Å²	137.2	88%	0.882	83%	0.827	S	S	*	*				48.7	125.3	125.6	-61.6	-18	0	0	0	122
455	G	33	Very low	35.4	Very low	80 Å²	80	136.1 Å²	136.1	83%	0.825	83%	0.826	S	S	*	*			trans	163	93.8	151.1	0	0	0	0	0	115.7
456	K	31.8	Very low	35.7	Very low	205 Å²	205	132.9 Å²	132.9	89%	0.891	82%	0.821	S	S	*	*			trans	-56.9	142.5	165.6	-85.6	171.7	170	170.3	0	111.6
457	L	33.1	Very low	34.9	Very low	178 Å²	178	135.1 Å²	135.1	93%	0.932	82%	0.82	S	S	*	*			trans	-169.2	155.3	131.2	-100	150.3	0	0	0	112.2
458	K	36.1	Very low	34.9	Very low	193 Å²	193	134.8 Å²	134.8	84%	0.839	82%	0.816	S	S	*	*			trans	-75.3	169.5	-159.4	-90.6	176.8	175.6	-179.5	0	116.1
459	P	35.7	Very low	34.3	Very low	131 Å²	131	137.9 Å²	137.9	85%	0.851	82%	0.821	S	S	*	*			trans	-85.2	153.1	-170.4	36.1	-34.2	0	0	0	113
460	G	29.4	Very low	33.9	Very low	62 Å²	62	134 Å²	134	64%	0.639	81%	0.807	S	S	*	*			trans	146.6	106.3	173.8	0	0	0	0	0	110.3
461	N	34.8	Very low	33.5	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	82%	0.822	S	S	*	*			trans	172.5	95.9	139.6	-84.5	-4.7	0	0	0	108.8	L463	N461-L463 PolarHBondContact O-N 3.33Å
462	T	32.6	Very low	33.1	Very low	144 Å²	144	134.9 Å²	134.9	88%	0.883	81%	0.806	S	S	*	*			trans	-42.7	121.9	142.7	22	0	0	0	0	109.7
463	L	35.2	Very low	32.9	Very low	149 Å²	149	140.5 Å²	140.5	78%	0.78	81%	0.812	S	S	*	*			trans	-133.8	146.4	165.6	-80.7	170.8	0	0	0	108.7	N461	N461-L463 PolarHBondContact O-N 3.33Å
464	P	34.8	Very low	32.8	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-91.8	147.6	-139	-2.3	22.2	0	0	0	112.1
465	V	36.2	Very low	32.8	Very low	129 Å²	129	147.3 Å²	147.3	78%	0.782	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-59.3	136.5	157.7	177.3	0	0	0	0	107.4	E467	V465-E467 PolarHBondContact O-N 2.97Å; V465-E467 VanDerWaalsContact O-N 3.1Å
466	P	38.4	Very low	33.2	Very low	114 Å²	114	149.8 Å²	149.8	74%	0.74	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-64.4	116.4	178.2	-10.2	24.2	0	0	0	109.2	A468	P466-A468 VanDerWaalsContact C-N 3.31Å; P466-A468 PolarHBondContact O-N 2.91Å
467	E	30.7	Very low	33.5	Very low	182 Å²	182	142.4 Å²	142.4	85%	0.85	78%	0.783	S	S	*	*			trans	-63.7	96.7	159.6	-81.6	-177.9	149.4	0	0	107.8	V465 T469	V465-E467 PolarHBondContact O-N 2.97Å; V465-E467 VanDerWaalsContact O-N 3.1Å; E467-T469 PolarHBondContact O-N 2.81Å
468	A	32.1	Very low	33.6	Very low	95 Å²	95	139.4 Å²	139.4	79%	0.785	77%	0.768	S	S	*	*			trans	-73.2	83.5	160.3	0	0	0	0	0	108.1	P466 G470	P466-A468 VanDerWaalsContact C-N 3.31Å; P466-A468 PolarHBondContact O-N 2.91Å; A468-G470 PolarHBondContact O-N 2.76Å
469	T	28.1	Very low	33.5	Very low	138 Å²	138	133.1 Å²	133.1	85%	0.847	75%	0.747	S	S	*	*			trans	-65.1	89.7	154.7	41.2	0	0	0	0	108.1	E467	E467-T469 PolarHBondContact O-N 2.81Å
470	G	29.9	Very low	33.6	Very low	59 Å²	59	133.1 Å²	133.1	61%	0.608	74%	0.736	S	S	*	*			trans	-147.5	107.7	174.9	0	0	0	0	0	108.6	A468 G472	A468-G470 PolarHBondContact O-N 2.76Å; G470-G472 PolarHBondContact O-N 3.12Å
471	K	27.2	Very low	33.6	Very low	230 Å²	230	135.3 Å²	135.3	100%	1	74%	0.741	S	S	*	*			trans	-52.7	105.8	170.7	-69.7	172.8	175.1	177.2	0	108.9
472	G	28.9	Very low	33.5	Very low	60 Å²	60	135 Å²	135	62%	0.619	74%	0.744	S	S	*	*			trans	-164.7	116.1	174.4	0	0	0	0	0	108.1	G470 R474	G470-G472 PolarHBondContact O-N 3.12Å; G472-R474 PolarHBondContact O-N 3.43Å
473	Q	30.2	Very low	33.3	Very low	195 Å²	195	133.2 Å²	133.2	91%	0.911	74%	0.738	S	S	*	*			trans	-50	110.6	174.1	-78.6	159.3	-54.7	0	0	109	R475	Q473-R475 PolarHBondContact O-N 3.05Å
474	R	36.3	Very low	33	Very low	242 Å²	242	131.5 Å²	131.5	91%	0.913	74%	0.738	S	S	*	*			trans	-60.6	111.8	165.1	-81	-178.5	176.4	168	-1.1	106.4	G472 M476	G472-R474 PolarHBondContact O-N 3.43Å; R474-M476 PolarHBondContact O-N 3.2Å
475	R	35	Very low	32.7	Very low	242 Å²	242	131.9 Å²	131.9	91%	0.913	74%	0.738	S	S	*	*			trans	-64.7	103.2	169.3	-77.3	-176.5	174	-179.4	-2.2	106.8	Q473	Q473-R475 PolarHBondContact O-N 3.05Å
476	M	39.7	Very low	32.4	Very low	132 Å²	132	135.4 Å²	135.4	65%	0.65	74%	0.743	S	S	*	*			trans	-57	139.6	166.6	-159.5	89.6	119.1	0	0	107.6	R474 D478	R474-M476 PolarHBondContact O-N 3.2Å; M476-D478 PolarHBondContact O-N 3.24Å
477	S	38.9	Very low	32	Very low	50 Å²	50	135 Å²	135	35%	0.35	74%	0.743	S	S	.	*			trans	-66.5	78.5	164	50.5	0	0	0	0	109	P479	S477-P479 WeakPolarHBondContact O-CD 3.37Å
478	D	35.3	Very low	32	Very low	116 Å²	116	133.2 Å²	133.2	62%	0.62	74%	0.739	S	S	*	*			trans	-105.7	98.3	167.8	-100.7	-37.4	0	0	0	108.7	M476	M476-D478 PolarHBondContact O-N 3.24Å
479	P	34.5	Very low	32.3	Very low	60 Å²	60	135 Å²	135	39%	0.39	74%	0.741	S	S	.	*			trans	-105.8	70.7	159.7	35.8	-23.6	0	0	0	108.4	L189 S477	L189-P479 HydrophobicContact CD1-CG 4.36Å; S477-P479 WeakPolarHBondContact O-CD 3.37Å
480	E	36.8	Very low	32.6	Very low	132 Å²	132	134.1 Å²	134.1	62%	0.617	74%	0.737	S	S	*	*			trans	-178.9	59	155.4	-105.5	163.2	-158.3	0	0	112.6	K162 V482	K162-E480 IonicContact NZ-OE1 2.81Å; K162-E480 PolarHBondContact NZ-OE1 2.77Å; K162-E480 IonicContact NZ-OE2 3.53Å; K162-E480 PolarHBondContact NZ-OE2 3.09Å; E480-V482 VanDerWaalsContact C-N 3.27Å; E480-V482 PolarHBondContact O-N 3.18Å
481	S	30.6	Very low	32.6	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	75%	0.75	S	S	*	*			trans	-89.3	65.9	159.2	-67.3	0	0	0	0	110
482	V	32.1	Very low	33.4	Very low	144 Å²	144	134.5 Å²	134.5	87%	0.873	74%	0.739	S	S	*	*			trans	-135.3	57.1	163.4	-158.6	0	0	0	0	109.1	E480	E480-V482 VanDerWaalsContact C-N 3.27Å; E480-V482 PolarHBondContact O-N 3.18Å
483	S	28.6	Very low	33.9	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	77%	0.768	S	S	*	*	S	Bend	trans	-144.9	77.2	163.2	70.5	0	0	0	0	110.2
484	S	28.1	Very low	34.1	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	76%	0.761	S	S	*	*	S	Bend	trans	163.2	150.3	148.2	53.1	0	0	0	0	108.6
485	V	29.1	Very low	33.9	Very low	123 Å²	123	133.3 Å²	133.3	75%	0.745	75%	0.753	S	S	*	*			trans	89.6	64	-171.6	-158.9	0	0	0	0	114.4
486	F	30.1	Very low	33.9	Very low	203 Å²	203	127.2 Å²	127.2	89%	0.89	74%	0.744	S	S	*	*			trans	-143.8	82	134.9	-94.3	-75.9	0	0	0	107.8
487	S	30.3	Very low	33.5	Very low	105 Å²	105	126.9 Å²	126.9	73%	0.734	75%	0.75	S	S	*	*			trans	-87.4	90.2	159.8	48.5	0	0	0	0	107.1
488	D	30	Very low	33.2	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	78%	0.775	S	S	*	*			trans	-156.9	77.9	164.2	-86.6	-34.9	0	0	0	109
489	T	38.5	Very low	33.1	Very low	133 Å²	133	132.8 Å²	132.8	82%	0.816	79%	0.785	S	S	*	*			trans	-131	129.7	154.6	45.4	0	0	0	0	108.7
490	P	34.4	Very low	33	Very low	119 Å²	119	138 Å²	138	77%	0.773	81%	0.813	S	S	*	*			trans	-75.6	135.5	-174.5	30.6	-32	0	0	0	110.1	V492	P490-V492 PolarHBondContact O-N 3.1Å
491	I	29.7	Very low	32.7	Very low	170 Å²	170	138.5 Å²	138.5	87%	0.872	83%	0.828	S	S	*	*			trans	-61.3	122.7	165.4	-67.1	168	0	0	0	108.1
492	V	44.3	Very low	32.8	Very low	126 Å²	126	141.1 Å²	141.1	76%	0.764	84%	0.835	S	S	*	*			trans	-126.8	114.4	156.2	-174.5	0	0	0	0	106.9	P490	P490-V492 PolarHBondContact O-N 3.1Å
493	V	39	Very low	32.9	Very low	205 Å²	205	140.8 Å²	140.8	100%	1.242	83%	0.832	S	S	*	*			trans	12.8	0	164	-171.5	0	0	0	0	118.2

Retrieved 493 of 493 residues in 215.2 ms (Link to these results)

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