A0A087X720_POEFO Loading...

Calsequestrin

Calsequestrin is a high-capacity, moderate affinity, calcium-binding protein and thus acts as an internal calcium store in muscle. Calcium ions are bound by clusters of acidic residues at the protein surface, especially at the interface between subunits. Can bind around 60 Ca(2+) ions. Regulates the release of lumenal Ca(2+) via the calcium release channel RYR2; this plays an important role in triggering muscle contraction. Plays a role in excitation-contraction coupling in the heart and in regulating the rate of heart beats.

AlphaFold DB , UniProt , Accession A0A087X720, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 427 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	43.3	Very low	48.4	Very low	226 Å²	226	165.2 Å²	165.2	100%	1.113	84%	0.835	S	S	*	*				0	144.8	0	-73.4	172.1	166.3	0	0	107.1
2	F	43.9	Very low	48.4	Very low	201 Å²	201	163.8 Å²	163.8	88%	0.882	83%	0.83	S	S	*	*			trans	59.5	91.2	-171.1	-54.5	-75.2	0	0	0	112.2
3	S	47.6	Very low	48.7	Very low	98 Å²	98	158.2 Å²	158.2	69%	0.685	82%	0.816	S	S	*	*			cis	76	122	22.4	-146	0	0	0	0	114.5
4	L	49.9	Very low	48.7	Very low	154 Å²	154	160.4 Å²	160.4	81%	0.806	82%	0.817	S	S	*	*			trans	57.9	107.3	177.1	-72.6	74.4	0	0	0	116.7
5	W	50.5	Low	48.9	Very low	259 Å²	259	157 Å²	157	98%	0.981	81%	0.806	S	S	*	*			trans	-174	59.9	139.9	-113.8	49.7	0	0	0	110.3
6	L	51.8	Low	49	Very low	159 Å²	159	153 Å²	153	83%	0.832	80%	0.796	S	S	*	*	S	Bend	trans	-153.8	22.6	-173.2	-121.8	171.5	0	0	0	115.2
7	F	49.1	Very low	49.4	Very low	195 Å²	195	151.7 Å²	151.7	86%	0.855	80%	0.796	S	S	*	*	S	Bend	trans	-142.5	36.7	-173.2	-84.1	-71.5	0	0	0	114.4
8	L	50.3	Low	49.8	Very low	163 Å²	163	151.8 Å²	151.8	85%	0.853	79%	0.794	S	S	*	*	S	Bend	trans	-139.7	47.3	177	-80.8	176.6	0	0	0	112.6
9	L	50.8	Low	50.5	Low	161 Å²	161	149.8 Å²	149.8	84%	0.843	79%	0.791	S	S	*	*	S	Bend	trans	-152.6	19.4	177.7	-116.2	162.7	0	0	0	117.7
10	P	48.5	Very low	51.3	Low	95 Å²	95	146.9 Å²	146.9	62%	0.617	79%	0.789	S	S	*	*	S	Bend	trans	-122.5	24.8	159.9	40.9	-31.8	0	0	0	113.7
11	C	46.3	Very low	52	Low	106 Å²	106	149 Å²	149	72%	0.716	79%	0.794	S	S	*	*	S	Bend	trans	-111.8	15.8	-175.5	-58.3	0	0	0	0	114.6
12	L	49.2	Very low	53.2	Low	148 Å²	148	145.9 Å²	145.9	78%	0.775	78%	0.775	S	S	*	*	S	Bend	trans	-109.6	-7.4	179.4	-83	164.6	0	0	0	114
13	S	51.2	Low	54.8	Low	92 Å²	92	139.2 Å²	139.2	64%	0.643	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	15.2	-178.1	49.2	0	0	0	0	114.4
14	F	49.6	Very low	56.2	Low	189 Å²	189	141.3 Å²	141.3	83%	0.829	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.6	41.1	171.3	-73.8	-72.4	0	0	0	111.5	S16	F14-S16 VanDerWaalsContact C-N 3.3Å; F14-S16 PolarHBondContact O-N 2.65Å
15	V	52.2	Low	57.4	Low	109 Å²	109	139.8 Å²	139.8	66%	0.661	75%	0.754	S	S	*	*			trans	-73.1	97.6	148.9	179.8	0	0	0	0	105.6	V17	V15-V17 PolarHBondContact O-N 3.42Å
16	S	50	Low	58.7	Low	93 Å²	93	135.1 Å²	135.1	65%	0.65	74%	0.741	S	S	*	*			trans	-60.5	111.1	160.2	-67.3	0	0	0	0	106.6	F14 M18	F14-S16 VanDerWaalsContact C-N 3.3Å; F14-S16 PolarHBondContact O-N 2.65Å; S16-M18 PolarHBondContact O-N 2.87Å
17	V	56.3	Low	59.8	Low	131 Å²	131	133.1 Å²	133.1	79%	0.794	74%	0.738	S	S	*	*			trans	-67.6	87.2	159.6	-177.4	0	0	0	0	105.1	V15	V15-V17 PolarHBondContact O-N 3.42Å
18	M	56	Low	61.6	Low	154 Å²	154	131.8 Å²	131.8	76%	0.759	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-61.8	130.6	163.6	-56.9	-156.1	71.7	0	0	105.4	S16 A20	S16-M18 PolarHBondContact O-N 2.87Å; M18-A20 PolarHBondContact O-N 3.49Å
19	P	63	Low	63.5	Low	113 Å²	113	128.1 Å²	128.1	73%	0.734	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-54.3	139	168.2	26.2	-33.3	0	0	0	107.1	E21	P19-E21 PolarHBondContact O-N 3.1Å
20	A	66.9	Low	65.5	Low	92 Å²	92	123.8 Å²	123.8	76%	0.76	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-53.1	137.9	171.6	0	0	0	0	0	108.1	M18 K22	M18-A20 PolarHBondContact O-N 3.49Å; A20-K22 PolarHBondContact O-N 2.72Å; A20-K22 VanDerWaalsContact O-N 3.14Å
21	E	64.9	Low	67.7	Low	191 Å²	191	121.6 Å²	121.6	89%	0.893	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-56.7	123.7	174	-63.8	-178.1	149.6	0	0	107.1	P19 G23	P19-E21 PolarHBondContact O-N 3.1Å; E21-G23 PolarHBondContact O-N 2.9Å
22	K	68.1	Low	70.1	Confident	161 Å²	161	121.6 Å²	121.6	70%	0.7	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-53.3	116.6	179.2	-85.1	179.1	163.1	-82.9	0	107.5	A20 E25	A20-K22 PolarHBondContact O-N 2.72Å; A20-K22 VanDerWaalsContact O-N 3.14Å; K22-E25 IonicContact NZ-OE1 2.64Å; K22-E25 PolarHBondContact NZ-OE1 2.78Å; K22-E25 IonicContact NZ-OE2 2.62Å; K22-E25 PolarHBondContact NZ-OE2 2.94Å
23	G	77.7	Confident	72.4	Confident	61 Å²	61	121.5 Å²	121.5	63%	0.629	67%	0.67	S	S	*	*			trans	-75.8	-157.7	179	0	0	0	0	0	111.4	E21 E25	E21-G23 PolarHBondContact O-N 2.9Å; G23-E25 PolarHBondContact O-N 2.63Å; G23-E25 VanDerWaalsContact O-N 3.08Å
24	L	77.8	Confident	74.5	Confident	141 Å²	141	119.1 Å²	119.1	74%	0.738	65%	0.647	S	S	*	*			trans	-66.2	106.4	163.7	-177.7	62.7	0	0	0	108.3	F26	L24-F26 HydrophobicContact CD2-CE1 3.95Å; L24-F26 HydrophobicContact CD2-CE2 4.25Å; L24-F26 HydrophobicContact CD2-CZ 3.75Å; L24-F26 HydrophobicContact CG-CE2 4.43Å; L24-F26 HydrophobicContact CG-CZ 4.36Å
25	E	75.4	Confident	76.8	Confident	122 Å²	122	111 Å²	111	57%	0.57	61%	0.613	S	S	*	*			trans	-87.4	105.4	171.6	-64.7	-173.7	149.2	0	0	107.5	K22 G23	K22-E25 IonicContact NZ-OE1 2.64Å; K22-E25 PolarHBondContact NZ-OE1 2.78Å; K22-E25 IonicContact NZ-OE2 2.62Å; K22-E25 PolarHBondContact NZ-OE2 2.94Å; G23-E25 PolarHBondContact O-N 2.63Å; G23-E25 VanDerWaalsContact O-N 3.08Å
26	F	77.4	Confident	79	Confident	161 Å²	161	108.9 Å²	108.9	71%	0.706	60%	0.597	S	S	*	*			trans	-63.7	136.6	175.3	-68.2	-86.5	0	0	0	109.9	L24	L24-F26 HydrophobicContact CD2-CE1 3.95Å; L24-F26 HydrophobicContact CD2-CE2 4.25Å; L24-F26 HydrophobicContact CD2-CZ 3.75Å; L24-F26 HydrophobicContact CG-CE2 4.43Å; L24-F26 HydrophobicContact CG-CZ 4.36Å
27	P	74.4	Confident	81.2	Confident	118 Å²	118	108.7 Å²	108.7	77%	0.766	59%	0.589	S	S	*	*			trans	-54.9	145	170.6	-25.1	35	0	0	0	111.6
28	Q	86.9	Confident	83.2	Confident	166 Å²	166	102.5 Å²	102.5	78%	0.776	55%	0.552	S	S	*	*			trans	-126.1	157.7	170.7	-65.3	-175.3	-24.3	0	0	107.8	D30 Q83	Q28-D30 PolarHBondContact O-N 3.03Å; Q28-Q83 PolarHBondContact O-NE2 3.26Å
29	Y	91.7	Very high	85.2	Confident	86 Å²	86	95.7 Å²	95.7	34%	0.337	52%	0.519	S	S	.	.			trans	-56.6	126.2	171.6	177.7	-123.6	0	0	0	109.8	L76 E79	Y29-L76 HydrophobicContact CD1-CD1 3.6Å; Y29-L76 HydrophobicContact CE1-CD1 3.45Å; Y29-L76 VanDerWaalsContact CE1-CD1 3.45Å; Y29-L76 HydrophobicContact CG-CD1 4.2Å; Y29-E79 HydrophobicContact CE2-CB 3.82Å
30	D	92.9	Very high	86.8	Confident	70 Å²	70	94.6 Å²	94.6	37%	0.374	51%	0.507	S	S	.	.			trans	-94.1	-0.3	-168.4	71.3	9.8	0	0	0	114.4	Q28 K32 R34 Q83	Q28-D30 PolarHBondContact O-N 3.03Å; D30-K32 VanDerWaalsContact C-N 3.35Å; D30-K32 PolarHBondContact O-N 3.27Å; D30-K32 WeakPolarHBondContact OD1-CG 3.09Å; D30-K32 PolarHBondContact OD1-N 2.91Å; D30-K32 VanDerWaalsContact OD1-N 3.16Å; D30-K32 IonicContact OD1-NZ 3Å; D30-K32 IonicContact OD2-NZ 2.71Å; D30-K32 PolarHBondContact OD2-NZ 3.16Å; D30-R34 IonicContact OD1-CZ 3.76Å; D30-R34 IonicContact OD1-NH1 2.61Å; D30-R34 PolarHBondContact OD1-NH1 3.2Å; D30-R34 IonicContact OD1-NH2 2.8Å; D30-R34 PolarHBondContact OD1-NH2 3.03Å; D30-R34 IonicContact OD2-CZ 2.7Å; D30-R34 IonicContact OD2-NH1 3.6Å; D30-R34 IonicContact OD2-NH2 3.91Å; D30-R34 PolarHBondContact OD2-NH2 3.3Å; D30-Q83 PolarHBondContact OD1-OE1 2.84Å
31	G	94.1	Very high	88.2	Confident	50 Å²	50	99.9 Å²	99.9	52%	0.515	51%	0.513	S	S	.	.			trans	71.2	24.4	175.4	0	0	0	0	0	114.5
32	K	96.1	Very high	89.7	Confident	106 Å²	106	92.9 Å²	92.9	46%	0.461	48%	0.482	S	S	.	.			trans	-102.4	128.5	170.1	-52.3	-165.9	-135.8	87.7	0	111.7	D30 R34	D30-K32 VanDerWaalsContact C-N 3.35Å; D30-K32 PolarHBondContact O-N 3.27Å; D30-K32 WeakPolarHBondContact OD1-CG 3.09Å; D30-K32 PolarHBondContact OD1-N 2.91Å; D30-K32 VanDerWaalsContact OD1-N 3.16Å; D30-K32 IonicContact OD1-NZ 3Å; D30-K32 IonicContact OD2-NZ 2.71Å; D30-K32 PolarHBondContact OD2-NZ 3.16Å; K32-R34 VanDerWaalsContact NZ-NH2 3.12Å; K32-R34 PolarHBondContact O-NH1 2.85Å
33	D	96.9	Very high	91.1	Very high	145 Å²	145	86.2 Å²	86.2	78%	0.775	45%	0.453	S	S	*	.			trans	-63.9	129.3	170.6	-23.5	-35.8	0	0	0	111.6	E79	D33-E79 WeakPolarHBondContact CA-OE1 3.38Å
34	R	96.9	Very high	91.9	Very high	42 Å²	42	89.6 Å²	89.6	16%	0.158	45%	0.45	C	S	.	.			trans	-132.5	-29.8	178.7	-59.8	172.1	171.1	86.9	-5.2	112.3	D30 K32 E79 A82 E86	D30-R34 IonicContact OD1-CZ 3.76Å; D30-R34 IonicContact OD1-NH1 2.61Å; D30-R34 PolarHBondContact OD1-NH1 3.2Å; D30-R34 IonicContact OD1-NH2 2.8Å; D30-R34 PolarHBondContact OD1-NH2 3.03Å; D30-R34 IonicContact OD2-CZ 2.7Å; D30-R34 IonicContact OD2-NH1 3.6Å; D30-R34 IonicContact OD2-NH2 3.91Å; D30-R34 PolarHBondContact OD2-NH2 3.3Å; K32-R34 VanDerWaalsContact NZ-NH2 3.12Å; K32-R34 PolarHBondContact O-NH1 2.85Å; R34-E79 VanDerWaalsContact CB-OE2 3.26Å; R34-E79 WeakPolarHBondContact CB-OE2 3.29Å; R34-E79 PolarHBondContact N-OE1 2.95Å; R34-E79 PolarHBondContact N-OE2 3.29Å; R34-A82 HydrophobicContact CB-CB 3.73Å; R34-A82 HydrophobicContact CG-CB 4.43Å; R34-E86 IonicContact CZ-OE1 2.75Å; R34-E86 IonicContact NE-OE1 3.19Å; R34-E86 PolarHBondContact NE-OE1 2.84Å; R34-E86 IonicContact NH2-OE1 3.77Å; R34-E86 PolarHBondContact NH2-OE1 3.11Å
35	V	97.8	Very high	92.8	Very high	19 Å²	19	90.5 Å²	90.5	12%	0.115	45%	0.448	C	S	.	.			trans	-70.8	136.7	177.7	-179.4	0	0	0	0	109	L78 E79 F92 M94	V35-L78 HydrophobicContact CG2-CB 3.7Å; V35-E79 HydrophobicContact CB-CG 4.4Å; V35-E79 WeakPolarHBondContact CB-OE1 3.13Å; V35-E79 HydrophobicContact CG2-CB 4.45Å; V35-E79 HydrophobicContact CG2-CG 3.8Å; V35-E79 WeakPolarHBondContact CG2-OE1 3.5Å; V35-E79 PolarHBondContact N-OE1 3.01Å; V35-F92 HydrophobicContact CG2-CB 4.15Å; V35-M94 HydrophobicContact CG1-CG 3.69Å; V35-M94 HydrophobicContact CG1-SD 3.91Å
36	L	97.4	Very high	93.8	Very high	64 Å²	64	85 Å²	85	34%	0.335	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.1	-175.7	-59.2	177.4	0	0	0	112	I38 F92 G93 M94	L36-I38 HydrophobicContact CB-CD1 3.68Å; L36-I38 HydrophobicContact CB-CG1 4.26Å; L36-I38 HydrophobicContact CD1-CD1 4.23Å; L36-I38 WeakPolarHBondContact O-CG1 3.43Å; L36-I38 PolarHBondContact O-N 2.88Å; L36-F92 PolarHBondContact N-O 3.39Å; L36-F92 VanDerWaalsContact N-O 3.07Å; L36-G93 CarbonylContact O-C 3.38Å; L36-G93 WeakPolarHBondContact O-CA 3.45Å; L36-M94 PolarHBondContact O-N 2.61Å
37	D	97.2	Very high	94.6	Very high	89 Å²	89	80.3 Å²	80.3	48%	0.476	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	103.7	159.1	174	19	0	0	0	109.5	N42 K99	D37-N42 PolarHBondContact O-ND2 2.93Å; D37-K99 IonicContact OD1-NZ 2.75Å; D37-K99 PolarHBondContact OD1-NZ 3.03Å; D37-K99 IonicContact OD2-NZ 2.71Å; D37-K99 PolarHBondContact OD2-NZ 3.49Å
38	I	97.9	Very high	95.5	Very high	1 Å²	1	83.2 Å²	83.2	1%	0.005	41%	0.406	C	S	.	.			trans	-91.3	119.1	-174.9	-66.5	-55.4	0	0	0	111.2	L36 N42 A46 L55 M94 V95 V103	L36-I38 HydrophobicContact CB-CD1 3.68Å; L36-I38 HydrophobicContact CB-CG1 4.26Å; L36-I38 HydrophobicContact CD1-CD1 4.23Å; L36-I38 WeakPolarHBondContact O-CG1 3.43Å; L36-I38 PolarHBondContact O-N 2.88Å; I38-N42 WeakPolarHBondContact CA-OD1 3.37Å; I38-A46 HydrophobicContact CD1-CB 3.83Å; I38-L55 HydrophobicContact CG1-CD2 3.7Å; I38-M94 WeakPolarHBondContact CB-O 3.32Å; I38-M94 PolarHBondContact N-O 2.5Å; I38-V95 HydrophobicContact CB-CG2 3.83Å; I38-V95 HydrophobicContact CG2-CG2 3.88Å; I38-V103 HydrophobicContact CG2-CG1 4.1Å
39	S	97.1	Very high	95.9	Very high	12 Å²	12	81.3 Å²	81.3	8%	0.084	40%	0.395	C	S	.	.			trans	-138.1	171.8	-176.9	61.1	0	0	0	0	112.7	K41 N42 Y43 D100	S39-K41 PolarHBondContact O-N 3.06Å; S39-N42 PolarHBondContact N-OD1 3.25Å; S39-N42 PolarHBondContact O-N 3.11Å; S39-N42 PolarHBondContact O-OD1 3.24Å; S39-Y43 PolarHBondContact O-N 2.8Å; S39-Y43 VanDerWaalsContact O-N 3.08Å; S39-D100 WeakPolarHBondContact CA-OD1 3.41Å; S39-D100 VanDerWaalsContact CB-CG 3.48Å; S39-D100 WeakPolarHBondContact CB-OD1 3.43Å; S39-D100 WeakPolarHBondContact CB-OD2 3.47Å
40	D	96.6	Very high	95.9	Very high	90 Å²	90	79 Å²	79	48%	0.481	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-16.9	-179.3	-165.2	54.7	0	0	0	113.5	D100 V103 K106	D40-D100 PolarHBondContact N-OD1 2.53Å; D40-V103 HydrophobicContact CB-CG2 4.16Å; D40-V103 VanDerWaalsContact N-CG2 3.27Å; D40-K106 IonicContact OD1-NZ 2.63Å; D40-K106 PolarHBondContact OD1-NZ 3.48Å
41	K	96.9	Very high	95.9	Very high	202 Å²	202	78.8 Å²	78.8	88%	0.878	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-35.9	176	-60	169.6	-171.3	159.1	0	114	S39	S39-K41 PolarHBondContact O-N 3.06Å
42	N	97.3	Very high	96	Very high	45 Å²	45	76.6 Å²	76.6	24%	0.241	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-18.7	-166	67	-2.9	0	0	0	115.2	D37 I38 S39 K44 K45 A46	D37-N42 PolarHBondContact O-ND2 2.93Å; I38-N42 WeakPolarHBondContact CA-OD1 3.37Å; S39-N42 PolarHBondContact N-OD1 3.25Å; S39-N42 PolarHBondContact O-N 3.11Å; S39-N42 PolarHBondContact O-OD1 3.24Å; N42-K44 VanDerWaalsContact C-N 3.31Å; N42-K44 PolarHBondContact O-N 3.17Å; N42-K44 VanDerWaalsContact O-N 3.16Å; N42-K45 WeakPolarHBondContact O-CA 3.47Å; N42-K45 VanDerWaalsContact O-CB 3.29Å; N42-K45 WeakPolarHBondContact O-CB 3.42Å; N42-K45 PolarHBondContact O-N 3.09Å; N42-A46 PolarHBondContact O-N 3.19Å; N42-A46 VanDerWaalsContact O-N 3.08Å
43	Y	96.3	Very high	96.1	Very high	21 Å²	21	71.8 Å²	71.8	8%	0.082	35%	0.347	C	S	.	.	H	α-helix	trans	-53.8	-42.4	-173.8	83.6	-83.1	0	0	0	113.9	S39 K45 A46 L47 V103 K106 L107	S39-Y43 PolarHBondContact O-N 2.8Å; S39-Y43 VanDerWaalsContact O-N 3.08Å; Y43-K45 PolarHBondContact O-N 3.29Å; Y43-K45 VanDerWaalsContact O-N 3.16Å; Y43-A46 PolarHBondContact O-N 2.84Å; Y43-A46 VanDerWaalsContact O-N 3.15Å; Y43-L47 HydrophobicContact CD2-CD1 4.15Å; Y43-L47 PolarHBondContact O-N 3.09Å; Y43-L47 VanDerWaalsContact O-N 3.07Å; Y43-V103 HydrophobicContact CD1-CG1 4.21Å; Y43-V103 HydrophobicContact CD1-CG2 4.39Å; Y43-V103 HydrophobicContact CD2-CG1 4.13Å; Y43-V103 HydrophobicContact CG-CG1 3.79Å; Y43-K106 WeakPolarHBondContact OH-CD 3.4Å; Y43-L107 HydrophobicContact CD2-CD2 3.95Å; Y43-L107 HydrophobicContact CE2-CD2 4.25Å
44	K	95.8	Very high	96.1	Very high	132 Å²	132	64.9 Å²	64.9	57%	0.574	31%	0.31	S	S	*	.	H	α-helix	trans	-66.2	-13.7	176.1	-60.6	-177.5	-175	174.2	0	115	N42 K48	N42-K44 VanDerWaalsContact C-N 3.31Å; N42-K44 PolarHBondContact O-N 3.17Å; N42-K44 VanDerWaalsContact O-N 3.16Å; K44-K48 WeakPolarHBondContact O-CD 3.21Å; K44-K48 WeakPolarHBondContact O-CG 3.41Å
45	K	96.6	Very high	96.2	Very high	160 Å²	160	63 Å²	63	70%	0.696	30%	0.303	S	S	*	.	H	α-helix	trans	-93.5	-38.2	173.6	-173.9	-164.9	171.1	-162	0	110.1	N42 Y43 K48 K49	N42-K45 WeakPolarHBondContact O-CA 3.47Å; N42-K45 VanDerWaalsContact O-CB 3.29Å; N42-K45 WeakPolarHBondContact O-CB 3.42Å; N42-K45 PolarHBondContact O-N 3.09Å; Y43-K45 PolarHBondContact O-N 3.29Å; Y43-K45 VanDerWaalsContact O-N 3.16Å; K45-K48 CarbonylContact O-C 3.49Å; K45-K48 PolarHBondContact O-N 3.26Å; K45-K49 WeakPolarHBondContact O-CB 3.28Å; K45-K49 PolarHBondContact O-N 2.85Å
46	A	95	Very high	96.2	Very high	5 Å²	5	62.8 Å²	62.8	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-58.6	-55.1	174.6	0	0	0	0	0	110.7	I38 N42 Y43 K48 K49 L53	I38-A46 HydrophobicContact CD1-CB 3.83Å; N42-A46 PolarHBondContact O-N 3.19Å; N42-A46 VanDerWaalsContact O-N 3.08Å; Y43-A46 PolarHBondContact O-N 2.84Å; Y43-A46 VanDerWaalsContact O-N 3.15Å; A46-K48 PolarHBondContact O-N 3.5Å; A46-K49 PolarHBondContact O-N 2.99Å; A46-K49 VanDerWaalsContact O-N 3.08Å; A46-L53 HydrophobicContact CB-CD1 3.91Å; A46-L53 HydrophobicContact CB-CD2 3.74Å
47	L	94.2	Very high	96.2	Very high	64 Å²	64	60.8 Å²	60.8	34%	0.335	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	3.8	174.1	-70.6	171.7	0	0	0	115.8	Y43 L53 L107 F118	Y43-L47 HydrophobicContact CD2-CD1 4.15Å; Y43-L47 PolarHBondContact O-N 3.09Å; Y43-L47 VanDerWaalsContact O-N 3.07Å; L47-L53 HydrophobicContact CD2-CB 4.48Å; L47-L53 HydrophobicContact CD2-CD2 3.63Å; L47-L53 HydrophobicContact CG-CD2 3.84Å; L47-L107 HydrophobicContact CD1-CD2 3.7Å; L47-F118 HydrophobicContact CD2-CB 3.86Å; L47-F118 HydrophobicContact CD2-CD1 3.85Å; L47-F118 HydrophobicContact CD2-CD2 4.42Å; L47-F118 HydrophobicContact CD2-CG 3.76Å
48	K	94.1	Very high	96.1	Very high	179 Å²	179	57.2 Å²	57.2	78%	0.778	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	2.3	-178.9	-63	-167.4	179.7	-145.2	0	113.7	K44 K45 A46	K44-K48 WeakPolarHBondContact O-CD 3.21Å; K44-K48 WeakPolarHBondContact O-CG 3.41Å; K45-K48 CarbonylContact O-C 3.49Å; K45-K48 PolarHBondContact O-N 3.26Å; A46-K48 PolarHBondContact O-N 3.5Å
49	K	94.7	Very high	95.8	Very high	126 Å²	126	63.3 Å²	63.3	55%	0.548	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-25.6	177.6	178.3	-176.3	164.9	-129.4	0	111.2	K45 A46	K45-K49 WeakPolarHBondContact O-CB 3.28Å; K45-K49 PolarHBondContact O-N 2.85Å; A46-K49 PolarHBondContact O-N 2.99Å; A46-K49 VanDerWaalsContact O-N 3.08Å
50	H	92.3	Very high	95.5	Very high	36 Å²	36	66.7 Å²	66.7	17%	0.167	31%	0.311	C	S	.	.	S	Bend	trans	-134.9	157.1	-163.2	-69.2	-60.1	0	0	0	110.6	M52 D89 G91	H50-M52 VanDerWaalsContact C-N 3.34Å; H50-M52 VanDerWaalsContact CB-O 3.24Å; H50-M52 WeakPolarHBondContact CB-O 3.42Å; H50-D89 VanDerWaalsContact CB-O 3.24Å; H50-D89 WeakPolarHBondContact CB-O 3.43Å; H50-D89 IonicContact CE1-OD1 3.9Å; H50-D89 IonicContact CG-OD1 2.58Å; H50-D89 PolarHBondContact ND1-O 2.71Å; H50-D89 IonicContact ND1-OD1 2.88Å; H50-D89 PolarHBondContact ND1-OD1 2.98Å; H50-G91 WeakPolarHBondContact CD2-CA 3.11Å
51	S	92.8	Very high	95	Very high	66 Å²	66	65 Å²	65	46%	0.462	30%	0.303	S	S	.	.	S	Bend	trans	-69.9	-32.4	167.6	52.1	0	0	0	0	112.4	D89	S51-D89 PolarHBondContact N-O 2.75Å; S51-D89 PolarHBondContact N-OD2 2.76Å; S51-D89 PolarHBondContact OG-O 2.88Å
52	M	96.2	Very high	94.3	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.02	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142.7	-178.4	-172.1	-171.5	-72.7	0	0	110.6	H50 I90 G91 V117 F118 K119 L139 L142 L143	H50-M52 VanDerWaalsContact C-N 3.34Å; H50-M52 VanDerWaalsContact CB-O 3.24Å; H50-M52 WeakPolarHBondContact CB-O 3.42Å; M52-I90 HydrophobicContact CB-CG1 4.24Å; M52-I90 HydrophobicContact CB-CG2 4.32Å; M52-I90 HydrophobicContact CG-CG2 4.26Å; M52-I90 WeakPolarHBondContact O-CA 3.42Å; M52-I90 HydrophobicContact SD-CD1 3.8Å; M52-I90 HydrophobicContact SD-CG1 4.03Å; M52-I90 HydrophobicContact SD-CG2 4.18Å; M52-G91 PolarHBondContact O-N 2.75Å; M52-V117 HydrophobicContact CE-CG1 4.46Å; M52-V117 HydrophobicContact CG-CG1 3.49Å; M52-V117 VanDerWaalsContact CG-CG1 3.49Å; M52-V117 HydrophobicContact SD-CG1 3.57Å; M52-V117 VanDerWaalsContact SD-CG1 3.57Å; M52-F118 CarbonylContact C-O 3.51Å; M52-F118 VanDerWaalsContact CA-O 3.26Å; M52-F118 WeakPolarHBondContact CA-O 3.14Å; M52-K119 HydrophobicContact CE-CD 4.31Å; M52-L139 HydrophobicContact SD-CD2 3.68Å; M52-L142 HydrophobicContact CE-CB 3.79Å; M52-L142 WeakPolarHBondContact CE-O 3.42Å; M52-L143 HydrophobicContact CE-CD2 3.95Å; M52-L143 HydrophobicContact CE-CG 4.14Å
53	L	97.6	Very high	93.8	Very high	5 Å²	5	61.2 Å²	61.2	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	114.8	175.6	-179.3	73.2	0	0	0	110	A46 L47 L55 G91 F118	A46-L53 HydrophobicContact CB-CD1 3.91Å; A46-L53 HydrophobicContact CB-CD2 3.74Å; L47-L53 HydrophobicContact CD2-CB 4.48Å; L47-L53 HydrophobicContact CD2-CD2 3.63Å; L47-L53 HydrophobicContact CG-CD2 3.84Å; L53-L55 HydrophobicContact CD1-CD2 4.1Å; L53-L55 HydrophobicContact CD2-CD1 3.95Å; L53-L55 HydrophobicContact CD2-CD2 3.93Å; L53-L55 HydrophobicContact CD2-CG 3.99Å; L53-L55 HydrophobicContact CG-CD1 4.45Å; L53-L55 HydrophobicContact CG-CD2 3.82Å; L53-L55 HydrophobicContact CG-CG 3.94Å; L53-G91 CarbonylContact C-O 3.58Å; L53-G91 WeakPolarHBondContact CA-O 3.5Å; L53-F118 HydrophobicContact CB-CB 4.29Å; L53-F118 PolarHBondContact N-O 3.17Å; L53-F118 WeakPolarHBondContact O-CD2 3.04Å; L53-F118 PolarHBondContact O-N 3.29Å
54	C	97.9	Very high	93.6	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122.8	174.5	173.3	0	0	0	0	109.7	I90 G91 F92 G93 V115 V117	C54-I90 HydrophobicContact CB-CG2 4.37Å; C54-G91 PolarHBondContact N-O 2.93Å; C54-F92 HydrophobicContact CB-CD1 3.76Å; C54-F92 HydrophobicContact CB-CE1 3.78Å; C54-F92 CarbonylContact O-C 3.56Å; C54-F92 WeakPolarHBondContact O-CA 3.45Å; C54-G93 PolarHBondContact O-N 3.37Å; C54-V115 WeakPolarHBondContact SG-CG1 3.36Å; C54-V117 HydrophobicContact CB-CG2 4.44Å
55	L	98.2	Very high	93.3	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	112.9	-177.5	-63	-174.2	0	0	0	111.7	I38 L53 Y57 G93 V95 L107 Y116 F118	I38-L55 HydrophobicContact CG1-CD2 3.7Å; L53-L55 HydrophobicContact CD1-CD2 4.1Å; L53-L55 HydrophobicContact CD2-CD1 3.95Å; L53-L55 HydrophobicContact CD2-CD2 3.93Å; L53-L55 HydrophobicContact CD2-CG 3.99Å; L53-L55 HydrophobicContact CG-CD1 4.45Å; L53-L55 HydrophobicContact CG-CD2 3.82Å; L53-L55 HydrophobicContact CG-CG 3.94Å; L55-Y57 PolarHBondContact O-N 3.35Å; L55-G93 WeakPolarHBondContact CA-O 3.38Å; L55-V95 HydrophobicContact CB-CG2 4.41Å; L55-V95 HydrophobicContact CD1-CG2 4.13Å; L55-L107 HydrophobicContact CD1-CD1 3.66Å; L55-Y116 PolarHBondContact N-O 3.3Å; L55-Y116 PolarHBondContact O-N 3.45Å; L55-F118 HydrophobicContact CB-CE2 4.42Å; L55-F118 HydrophobicContact CD1-CD2 4.15Å; L55-F118 HydrophobicContact CD1-CE2 3.77Å; L55-F118 HydrophobicContact CG-CD2 4.33Å; L55-F118 HydrophobicContact CG-CE2 4.22Å
56	F	97.9	Very high	93	Very high	16 Å²	16	63.6 Å²	63.6	7%	0.07	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.7	168.1	175.7	-116.5	0	0	0	110	H58 T74 L78 G93 M94 V95 G113 V115 L130	F56-H58 HydrophobicContact CD1-CB 3.85Å; F56-H58 HydrophobicContact CE1-CB 3.4Å; F56-H58 VanDerWaalsContact CE1-CB 3.4Å; F56-H58 HydrophobicContact CZ-CB 3.98Å; F56-T74 HydrophobicContact CD1-CG2 3.89Å; F56-T74 HydrophobicContact CD2-CG2 4.34Å; F56-T74 HydrophobicContact CE1-CG2 3.44Å; F56-T74 VanDerWaalsContact CE1-CG2 3.44Å; F56-T74 HydrophobicContact CE2-CG2 3.93Å; F56-T74 HydrophobicContact CG-CG2 4.33Å; F56-T74 HydrophobicContact CZ-CG2 3.49Å; F56-T74 VanDerWaalsContact CZ-CG2 3.49Å; F56-L78 HydrophobicContact CB-CD1 3.52Å; F56-L78 HydrophobicContact CB-CD2 4.35Å; F56-L78 HydrophobicContact CD1-CD1 4.05Å; F56-L78 HydrophobicContact CG-CD1 3.96Å; F56-G93 PolarHBondContact N-O 2.81Å; F56-M94 HydrophobicContact CB-CG 4.33Å; F56-M94 HydrophobicContact CD1-CE 3.7Å; F56-M94 HydrophobicContact CD1-CG 4.18Å; F56-M94 HydrophobicContact CE1-CE 3.98Å; F56-M94 CarbonylContact O-C 3.6Å; F56-M94 WeakPolarHBondContact O-CA 3.48Å; F56-V95 PolarHBondContact O-N 3.39Å; F56-G113 WeakPolarHBondContact CE2-O 3.4Å; F56-V115 HydrophobicContact CB-CG2 4.18Å; F56-V115 HydrophobicContact CD2-CG2 3.82Å; F56-V115 HydrophobicContact CG-CG2 4.48Å; F56-L130 HydrophobicContact CD2-CD2 3.82Å; F56-L130 HydrophobicContact CE2-CD2 3.43Å; F56-L130 VanDerWaalsContact CE2-CD2 3.43Å; F56-L130 HydrophobicContact CZ-CD2 4.15Å
57	Y	97	Very high	92.6	Very high	22 Å²	22	66.9 Å²	66.9	9%	0.086	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.9	177.3	-175.2	-140.9	0	0	0	109.1	L55 V95 S97 A104 L109 E111 E112 G113 S114 Y116	L55-Y57 PolarHBondContact O-N 3.35Å; Y57-V95 HydrophobicContact CD2-CB 4.06Å; Y57-V95 HydrophobicContact CD2-CG1 4.07Å; Y57-V95 WeakPolarHBondContact CD2-O 3.48Å; Y57-V95 HydrophobicContact CE2-CG1 4.36Å; Y57-S97 WeakPolarHBondContact OH-CB 3.47Å; Y57-A104 HydrophobicContact CD2-CB 4.19Å; Y57-A104 HydrophobicContact CE2-CB 3.42Å; Y57-A104 VanDerWaalsContact CE2-CB 3.42Å; Y57-L109 HydrophobicContact CD1-CB 3.43Å; Y57-L109 VanDerWaalsContact CD1-CB 3.43Å; Y57-L109 HydrophobicContact CD2-CB 4.05Å; Y57-L109 HydrophobicContact CD2-CD1 3.68Å; Y57-L109 HydrophobicContact CE1-CB 3.89Å; Y57-L109 HydrophobicContact CE2-CB 4.38Å; Y57-L109 HydrophobicContact CE2-CD1 4.34Å; Y57-L109 HydrophobicContact CG-CB 3.6Å; Y57-L109 HydrophobicContact CG-CD1 3.83Å; Y57-L109 HydrophobicContact CG-CG 4.34Å; Y57-E111 WeakPolarHBondContact CD1-O 3.48Å; Y57-E112 HydrophobicContact CE1-CG 4.2Å; Y57-G113 PolarHBondContact O-N 2.73Å; Y57-S114 PolarHBondContact N-O 3.04Å; Y57-Y116 HydrophobicContact CD1-CE2 4.01Å; Y57-Y116 HydrophobicContact CG-CE2 4.26Å
58	H	94.9	Very high	92.4	Very high	14 Å²	14	67.3 Å²	67.3	7%	0.065	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.8	-165.2	71.9	82.7	0	0	0	114.2	F56 H71 V95 D96 S97	F56-H58 HydrophobicContact CD1-CB 3.85Å; F56-H58 HydrophobicContact CE1-CB 3.4Å; F56-H58 VanDerWaalsContact CE1-CB 3.4Å; F56-H58 HydrophobicContact CZ-CB 3.98Å; H58-H71 AromaticContact CE1-CE1 3.55Å; H58-H71 AromaticContact CG-CE1 3.89Å; H58-H71 AromaticContact ND1-CE1 3.53Å; H58-H71 AromaticContact NE2-CE1 3.91Å; H58-V95 VanDerWaalsContact CD2-C 3.46Å; H58-V95 PolarHBondContact CD2-O 3.41Å; H58-V95 VanDerWaalsContact CD2-O 3.25Å; H58-V95 PolarHBondContact N-O 2.93Å; H58-D96 VanDerWaalsContact CE1-CA 3.49Å; H58-D96 WeakPolarHBondContact CE1-CA 3.48Å; H58-D96 VanDerWaalsContact CE1-CB 3.46Å; H58-D96 WeakPolarHBondContact CE1-CB 3.26Å; H58-D96 IonicContact CE1-OD2 3.74Å; H58-D96 PolarHBondContact NE2-N 3.25Å; H58-S97 WeakPolarHBondContact O-CB 3.4Å; H58-S97 PolarHBondContact O-N 2.92Å; H58-S97 PolarHBondContact O-OG 2.93Å
59	E	92.6	Very high	92.3	Very high	129 Å²	129	64.8 Å²	64.8	60%	0.603	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-51.2	151.2	168.1	-69.6	-167.2	-173.2	0	0	112.1	V61 E112	E59-V61 PolarHBondContact O-N 2.78Å; E59-E112 HydrophobicContact CG-CB 4.19Å
60	K	90.8	Very high	92	Very high	83 Å²	83	64.5 Å²	64.5	36%	0.361	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-47.5	124.1	170.2	176.9	-99.2	172.4	-152.8	0	110.9	P62 D63 V98	K60-P62 WeakPolarHBondContact O-CD 3.36Å; K60-P62 VanDerWaalsContact O-N 3.1Å; K60-D63 VanDerWaalsContact NZ-CG 3.32Å; K60-D63 IonicContact NZ-OD1 2.78Å; K60-D63 PolarHBondContact NZ-OD1 2.79Å; K60-D63 IonicContact NZ-OD2 3.21Å; K60-D63 PolarHBondContact NZ-OD2 3.32Å; K60-V98 HydrophobicContact CB-CB 3.94Å; K60-V98 HydrophobicContact CB-CG2 3.72Å; K60-V98 HydrophobicContact CG-CB 4.29Å; K60-V98 HydrophobicContact CG-CG2 4.44Å
61	V	86.7	Confident	92	Very high	54 Å²	54	64.4 Å²	64.4	33%	0.327	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-51.4	119.7	-176.5	-174.2	0	0	0	0	110.7	E59	E59-V61 PolarHBondContact O-N 2.78Å
62	P	82.4	Confident	92	Very high	27 Å²	27	66.7 Å²	66.7	18%	0.175	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-74.9	154.8	-169.1	25.1	-32.4	0	0	0	112.4	K60 N64 L67 Q68	K60-P62 WeakPolarHBondContact O-CD 3.36Å; K60-P62 VanDerWaalsContact O-N 3.1Å; P62-N64 VanDerWaalsContact C-N 3.3Å; P62-L67 HydrophobicContact CB-CB 3.87Å; P62-L67 HydrophobicContact CB-CD1 3.96Å; P62-L67 HydrophobicContact CG-CB 3.31Å; P62-L67 HydrophobicContact CG-CD1 4.25Å; P62-L67 HydrophobicContact CG-CG 4.42Å; P62-Q68 WeakPolarHBondContact O-CG 3.35Å; P62-Q68 PolarHBondContact O-NE2 2.76Å
63	D	84.8	Confident	91.8	Very high	140 Å²	140	72.2 Å²	72.2	75%	0.749	35%	0.347	S	S	*	.	S	Bend	trans	-84.6	-6.5	177.9	-52.9	-74	0	0	0	112.4	K60	K60-D63 VanDerWaalsContact NZ-CG 3.32Å; K60-D63 IonicContact NZ-OD1 2.78Å; K60-D63 PolarHBondContact NZ-OD1 2.79Å; K60-D63 IonicContact NZ-OD2 3.21Å; K60-D63 PolarHBondContact NZ-OD2 3.32Å
64	N	92	Very high	91.7	Very high	75 Å²	75	73.5 Å²	73.5	40%	0.401	36%	0.355	S	S	.	.	S	Bend	trans	-82.8	125.6	174.8	-179	-13.2	0	0	0	111.1	P62 E66 L67 Q68	P62-N64 VanDerWaalsContact C-N 3.3Å; N64-E66 PolarHBondContact O-N 2.93Å; N64-E66 PolarHBondContact OD1-N 3.28Å; N64-L67 HydrophobicContact CB-CB 4.42Å; N64-L67 HydrophobicContact CB-CD1 4.08Å; N64-L67 HydrophobicContact CB-CG 4.06Å; N64-L67 PolarHBondContact O-N 3.49Å; N64-Q68 WeakPolarHBondContact O-CG 3.38Å; N64-Q68 PolarHBondContact O-N 3.27Å
65	K	91.3	Very high	91.6	Very high	155 Å²	155	77.4 Å²	77.4	67%	0.674	37%	0.373	S	S	*	.	H	α-helix	trans	-55.5	-28	178.6	-175.3	175.4	-178.1	177.5	0	115	K69	K65-K69 WeakPolarHBondContact O-CG 3.34Å; K65-K69 PolarHBondContact O-N 3.16Å
66	E	88.9	Confident	91.5	Very high	134 Å²	134	80.9 Å²	80.9	63%	0.626	39%	0.392	S	S	*	.	H	α-helix	trans	-78.7	-47.3	179.2	-66.2	178.1	155.7	0	0	111	N64 Q68 K69 Q70	N64-E66 PolarHBondContact O-N 2.93Å; N64-E66 PolarHBondContact OD1-N 3.28Å; E66-Q68 VanDerWaalsContact C-N 3.27Å; E66-Q68 PolarHBondContact O-N 2.97Å; E66-K69 WeakPolarHBondContact O-CB 3.43Å; E66-K69 PolarHBondContact O-N 3.08Å; E66-Q70 PolarHBondContact O-N 3.08Å
67	L	86.8	Confident	91.4	Very high	74 Å²	74	81.5 Å²	81.5	39%	0.387	40%	0.397	S	S	.	.	H	α-helix	trans	-65.7	-31.3	175.3	-49.7	-179.5	0	0	0	111.8	P62 N64 K69 Q70 H71	P62-L67 HydrophobicContact CB-CB 3.87Å; P62-L67 HydrophobicContact CB-CD1 3.96Å; P62-L67 HydrophobicContact CG-CB 3.31Å; P62-L67 HydrophobicContact CG-CD1 4.25Å; P62-L67 HydrophobicContact CG-CG 4.42Å; N64-L67 HydrophobicContact CB-CB 4.42Å; N64-L67 HydrophobicContact CB-CD1 4.08Å; N64-L67 HydrophobicContact CB-CG 4.06Å; N64-L67 PolarHBondContact O-N 3.49Å; L67-K69 VanDerWaalsContact C-N 3.31Å; L67-K69 PolarHBondContact O-N 2.82Å; L67-Q70 WeakPolarHBondContact O-CB 3.48Å; L67-Q70 PolarHBondContact O-N 2.98Å; L67-H71 PolarHBondContact O-N 3.15Å
68	Q	90.3	Very high	91.4	Very high	73 Å²	73	80.5 Å²	80.5	34%	0.341	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-35.6	169.9	-75.9	174.2	1.5	0	0	113	P62 N64 E66 Q72	P62-Q68 WeakPolarHBondContact O-CG 3.35Å; P62-Q68 PolarHBondContact O-NE2 2.76Å; N64-Q68 WeakPolarHBondContact O-CG 3.38Å; N64-Q68 PolarHBondContact O-N 3.27Å; E66-Q68 VanDerWaalsContact C-N 3.27Å; E66-Q68 PolarHBondContact O-N 2.97Å; Q68-Q72 WeakPolarHBondContact O-CB 3.45Å; Q68-Q72 VanDerWaalsContact O-CG 3.26Å; Q68-Q72 WeakPolarHBondContact O-CG 3.46Å; Q68-Q72 PolarHBondContact O-N 2.81Å
69	K	91.9	Very high	91.5	Very high	125 Å²	125	80.3 Å²	80.3	54%	0.543	39%	0.392	S	S	.	.	H	α-helix	trans	-70.1	-34.3	174.4	-69.1	169.4	177.3	178.7	0	112	K65 E66 L67 Q72 M73	K65-K69 WeakPolarHBondContact O-CG 3.34Å; K65-K69 PolarHBondContact O-N 3.16Å; E66-K69 WeakPolarHBondContact O-CB 3.43Å; E66-K69 PolarHBondContact O-N 3.08Å; L67-K69 VanDerWaalsContact C-N 3.31Å; L67-K69 PolarHBondContact O-N 2.82Å; K69-Q72 PolarHBondContact O-N 2.81Å; K69-M73 WeakPolarHBondContact O-CB 3.32Å; K69-M73 PolarHBondContact O-N 3.03Å
70	Q	89.4	Confident	91.7	Very high	120 Å²	120	77.2 Å²	77.2	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-63.3	-49.7	174.1	-69	172.1	-45.3	0	0	109.8	E66 L67 Q72 M73 T74	E66-Q70 PolarHBondContact O-N 3.08Å; L67-Q70 WeakPolarHBondContact O-CB 3.48Å; L67-Q70 PolarHBondContact O-N 2.98Å; Q70-Q72 VanDerWaalsContact C-N 3.32Å; Q70-Q72 PolarHBondContact O-N 3.23Å; Q70-M73 WeakPolarHBondContact O-CA 3.42Å; Q70-M73 WeakPolarHBondContact O-CB 3.32Å; Q70-M73 PolarHBondContact O-N 2.87Å; Q70-T74 PolarHBondContact O-N 2.74Å; Q70-T74 PolarHBondContact O-OG1 3.07Å
71	H	91.4	Very high	92	Very high	35 Å²	35	73.2 Å²	73.2	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-56.4	-43	175	-172.9	78.8	0	0	0	112.8	H58 L67 M73 T74 E75 M94	H58-H71 AromaticContact CE1-CE1 3.55Å; H58-H71 AromaticContact CG-CE1 3.89Å; H58-H71 AromaticContact ND1-CE1 3.53Å; H58-H71 AromaticContact NE2-CE1 3.91Å; L67-H71 PolarHBondContact O-N 3.15Å; H71-M73 VanDerWaalsContact C-N 3.34Å; H71-M73 PolarHBondContact O-N 3.08Å; H71-T74 PolarHBondContact O-N 3.05Å; H71-E75 WeakPolarHBondContact O-CB 3.19Å; H71-E75 PolarHBondContact O-N 2.98Å; H71-M94 VanDerWaalsContact CE1-CE 3.41Å; H71-M94 WeakPolarHBondContact CE1-CE 3.49Å
72	Q	93.1	Very high	92.5	Very high	114 Å²	114	70.9 Å²	70.9	53%	0.533	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-31.2	174.2	-74.5	169.9	-8.5	0	0	113.6	Q68 K69 Q70 L76	Q68-Q72 WeakPolarHBondContact O-CB 3.45Å; Q68-Q72 VanDerWaalsContact O-CG 3.26Å; Q68-Q72 WeakPolarHBondContact O-CG 3.46Å; Q68-Q72 PolarHBondContact O-N 2.81Å; K69-Q72 PolarHBondContact O-N 2.81Å; Q70-Q72 VanDerWaalsContact C-N 3.32Å; Q70-Q72 PolarHBondContact O-N 3.23Å; Q72-L76 VanDerWaalsContact O-CB 3.3Å; Q72-L76 WeakPolarHBondContact O-CB 3.19Å; Q72-L76 PolarHBondContact O-N 3.05Å
73	M	92.7	Very high	93.1	Very high	120 Å²	120	71.1 Å²	71.1	59%	0.591	35%	0.347	S	S	*	.	H	α-helix	trans	-69.2	-41.9	173.6	-168.4	67	71.9	0	0	110.6	K69 Q70 H71 L76 V77	K69-M73 WeakPolarHBondContact O-CB 3.32Å; K69-M73 PolarHBondContact O-N 3.03Å; Q70-M73 WeakPolarHBondContact O-CA 3.42Å; Q70-M73 WeakPolarHBondContact O-CB 3.32Å; Q70-M73 PolarHBondContact O-N 2.87Å; H71-M73 VanDerWaalsContact C-N 3.34Å; H71-M73 PolarHBondContact O-N 3.08Å; M73-L76 PolarHBondContact O-N 3.49Å; M73-V77 WeakPolarHBondContact O-CG2 3.35Å; M73-V77 PolarHBondContact O-N 3.09Å
74	T	93.9	Very high	93.6	Very high	32 Å²	32	68.5 Å²	68.5	20%	0.196	34%	0.336	C	S	.	.	H	α-helix	trans	-64.3	-44.4	175.3	-54.1	0	0	0	0	112.2	F56 Q70 H71 L76 V77 L78 L130	F56-T74 HydrophobicContact CD1-CG2 3.89Å; F56-T74 HydrophobicContact CD2-CG2 4.34Å; F56-T74 HydrophobicContact CE1-CG2 3.44Å; F56-T74 VanDerWaalsContact CE1-CG2 3.44Å; F56-T74 HydrophobicContact CE2-CG2 3.93Å; F56-T74 HydrophobicContact CG-CG2 4.33Å; F56-T74 HydrophobicContact CZ-CG2 3.49Å; F56-T74 VanDerWaalsContact CZ-CG2 3.49Å; Q70-T74 PolarHBondContact O-N 2.74Å; Q70-T74 PolarHBondContact O-OG1 3.07Å; H71-T74 PolarHBondContact O-N 3.05Å; T74-L76 VanDerWaalsContact C-N 3.29Å; T74-L76 PolarHBondContact O-N 3.17Å; T74-V77 PolarHBondContact O-N 2.81Å; T74-L78 HydrophobicContact CG2-CD1 4.41Å; T74-L78 WeakPolarHBondContact O-CG 3.34Å; T74-L78 PolarHBondContact O-N 2.93Å; T74-L130 HydrophobicContact CG2-CD2 3.54Å; T74-L130 HydrophobicContact CG2-CG 4.38Å
75	E	95.7	Very high	93.7	Very high	82 Å²	82	65.1 Å²	65.1	38%	0.383	32%	0.318	S	S	.	.	H	α-helix	trans	-56.3	-44	172	-174.8	174.8	-147.5	0	0	110.9	H71 V77 L78 E79 M94	H71-E75 WeakPolarHBondContact O-CB 3.19Å; H71-E75 PolarHBondContact O-N 2.98Å; E75-V77 PolarHBondContact O-N 3.18Å; E75-L78 PolarHBondContact O-N 3.14Å; E75-E79 WeakPolarHBondContact O-CG 3.15Å; E75-E79 PolarHBondContact O-N 3.31Å; E75-M94 HydrophobicContact CB-CE 4.16Å; E75-M94 HydrophobicContact CB-SD 3.97Å; E75-M94 HydrophobicContact CG-SD 3.95Å
76	L	96.1	Very high	93.8	Very high	75 Å²	75	63.4 Å²	63.4	39%	0.393	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-33.7	177.3	-177	61.5	0	0	0	113.8	Y29 Q72 M73 T74 L80	Y29-L76 HydrophobicContact CD1-CD1 3.6Å; Y29-L76 HydrophobicContact CE1-CD1 3.45Å; Y29-L76 VanDerWaalsContact CE1-CD1 3.45Å; Y29-L76 HydrophobicContact CG-CD1 4.2Å; Q72-L76 VanDerWaalsContact O-CB 3.3Å; Q72-L76 WeakPolarHBondContact O-CB 3.19Å; Q72-L76 PolarHBondContact O-N 3.05Å; M73-L76 PolarHBondContact O-N 3.49Å; T74-L76 VanDerWaalsContact C-N 3.29Å; T74-L76 PolarHBondContact O-N 3.17Å; L76-L80 WeakPolarHBondContact O-CB 3.22Å; L76-L80 PolarHBondContact O-N 3.14Å
77	V	96.1	Very high	94	Very high	28 Å²	28	66.3 Å²	66.3	17%	0.17	33%	0.326	C	S	.	.	H	α-helix	trans	-62.4	-49.5	171.2	166.5	0	0	0	0	109.8	M73 T74 E75 E79 L80 V81 A132	M73-V77 WeakPolarHBondContact O-CG2 3.35Å; M73-V77 PolarHBondContact O-N 3.09Å; T74-V77 PolarHBondContact O-N 2.81Å; E75-V77 PolarHBondContact O-N 3.18Å; V77-E79 VanDerWaalsContact C-N 3.33Å; V77-E79 PolarHBondContact O-N 3.4Å; V77-L80 PolarHBondContact O-N 2.99Å; V77-V81 WeakPolarHBondContact O-CG2 3.1Å; V77-V81 PolarHBondContact O-N 3.41Å; V77-A132 HydrophobicContact CG1-CB 4.31Å
78	L	97.4	Very high	94.3	Very high	2 Å²	2	67.1 Å²	67.1	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-62.9	-37.8	178.7	-64.5	167.8	0	0	0	112.1	V35 F56 T74 E75 V81 A82 M94 L135	V35-L78 HydrophobicContact CG2-CB 3.7Å; F56-L78 HydrophobicContact CB-CD1 3.52Å; F56-L78 HydrophobicContact CB-CD2 4.35Å; F56-L78 HydrophobicContact CD1-CD1 4.05Å; F56-L78 HydrophobicContact CG-CD1 3.96Å; T74-L78 HydrophobicContact CG2-CD1 4.41Å; T74-L78 WeakPolarHBondContact O-CG 3.34Å; T74-L78 PolarHBondContact O-N 2.93Å; E75-L78 PolarHBondContact O-N 3.14Å; L78-V81 PolarHBondContact O-N 3.31Å; L78-A82 WeakPolarHBondContact O-CB 3.49Å; L78-A82 PolarHBondContact O-N 2.82Å; L78-M94 HydrophobicContact CD1-CE 4.44Å; L78-M94 HydrophobicContact CD1-CG 3.75Å; L78-M94 HydrophobicContact CD1-SD 4.06Å; L78-L135 HydrophobicContact CD2-CD2 3.93Å
79	E	97.6	Very high	94.5	Very high	9 Å²	9	67.5 Å²	67.5	4%	0.042	33%	0.33	C	S	.	.	H	α-helix	trans	-64.7	-38.7	174	-78.5	-64	170	0	0	113	Y29 D33 R34 V35 E75 V77 A82 Q83	Y29-E79 HydrophobicContact CE2-CB 3.82Å; D33-E79 WeakPolarHBondContact CA-OE1 3.38Å; R34-E79 VanDerWaalsContact CB-OE2 3.26Å; R34-E79 WeakPolarHBondContact CB-OE2 3.29Å; R34-E79 PolarHBondContact N-OE1 2.95Å; R34-E79 PolarHBondContact N-OE2 3.29Å; V35-E79 HydrophobicContact CB-CG 4.4Å; V35-E79 WeakPolarHBondContact CB-OE1 3.13Å; V35-E79 HydrophobicContact CG2-CB 4.45Å; V35-E79 HydrophobicContact CG2-CG 3.8Å; V35-E79 WeakPolarHBondContact CG2-OE1 3.5Å; V35-E79 PolarHBondContact N-OE1 3.01Å; E75-E79 WeakPolarHBondContact O-CG 3.15Å; E75-E79 PolarHBondContact O-N 3.31Å; V77-E79 VanDerWaalsContact C-N 3.33Å; V77-E79 PolarHBondContact O-N 3.4Å; E79-A82 PolarHBondContact O-N 2.93Å; E79-Q83 WeakPolarHBondContact O-CB 3.32Å; E79-Q83 PolarHBondContact O-N 3.15Å
80	L	96.2	Very high	94.7	Very high	64 Å²	64	62.1 Å²	62.1	34%	0.335	31%	0.307	S	S	.	.	H	α-helix	trans	-67.3	-43.6	175.5	-178.9	56.9	0	0	0	111.5	L76 V77 A82 Q83 V84 A132	L76-L80 WeakPolarHBondContact O-CB 3.22Å; L76-L80 PolarHBondContact O-N 3.14Å; V77-L80 PolarHBondContact O-N 2.99Å; L80-A82 VanDerWaalsContact C-N 3.35Å; L80-Q83 PolarHBondContact O-N 3.22Å; L80-V84 WeakPolarHBondContact O-CG2 3.39Å; L80-V84 PolarHBondContact O-N 3.34Å; L80-A132 HydrophobicContact CB-CB 4.35Å; L80-A132 HydrophobicContact CD2-CB 3.72Å; L80-A132 HydrophobicContact CG-CB 4.05Å
81	V	96.8	Very high	95.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-44.8	173.5	178.8	0	0	0	0	110.4	V77 L78 Q83 V84 M85 F92 A132 L135 V136 L139	V77-V81 WeakPolarHBondContact O-CG2 3.1Å; V77-V81 PolarHBondContact O-N 3.41Å; L78-V81 PolarHBondContact O-N 3.31Å; V81-Q83 VanDerWaalsContact C-N 3.28Å; V81-Q83 PolarHBondContact O-N 2.89Å; V81-V84 PolarHBondContact O-N 3.35Å; V81-V84 VanDerWaalsContact O-N 3.15Å; V81-M85 HydrophobicContact CG1-CG 4.36Å; V81-M85 WeakPolarHBondContact O-CB 3.39Å; V81-M85 WeakPolarHBondContact O-CG 3.47Å; V81-M85 PolarHBondContact O-N 2.82Å; V81-F92 HydrophobicContact CB-CE1 4.25Å; V81-F92 HydrophobicContact CG1-CE1 3.51Å; V81-F92 HydrophobicContact CG1-CZ 3.73Å; V81-A132 HydrophobicContact CG2-CB 4.02Å; V81-L135 HydrophobicContact CG1-CG 4.31Å; V81-L135 HydrophobicContact CG2-CB 4.24Å; V81-L135 HydrophobicContact CG2-CD2 4.33Å; V81-L135 HydrophobicContact CG2-CG 4.44Å; V81-V136 HydrophobicContact CB-CG2 4.42Å; V81-V136 HydrophobicContact CG1-CG2 4.02Å; V81-V136 HydrophobicContact CG2-CG2 4.26Å; V81-L139 HydrophobicContact CG1-CD1 3.85Å
82	A	97.3	Very high	95.4	Very high	4 Å²	4	55.2 Å²	55.2	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-32.3	177.3	0	0	0	0	0	113.2	R34 L78 E79 L80 E86 F92	R34-A82 HydrophobicContact CB-CB 3.73Å; R34-A82 HydrophobicContact CG-CB 4.43Å; L78-A82 WeakPolarHBondContact O-CB 3.49Å; L78-A82 PolarHBondContact O-N 2.82Å; E79-A82 PolarHBondContact O-N 2.93Å; L80-A82 VanDerWaalsContact C-N 3.35Å; A82-E86 PolarHBondContact O-N 3.17Å; A82-F92 HydrophobicContact CB-CB 4.03Å; A82-F92 HydrophobicContact CB-CD1 4.39Å; A82-F92 HydrophobicContact CB-CD2 3.44Å; A82-F92 VanDerWaalsContact CB-CD2 3.44Å; A82-F92 HydrophobicContact CB-CE2 4.01Å; A82-F92 HydrophobicContact CB-CG 3.68Å
83	Q	95.8	Very high	95.7	Very high	32 Å²	32	49.9 Å²	49.9	15%	0.15	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-44.2	172	-179.8	177.9	-45.8	0	0	112.1	Q28 D30 E79 L80 V81 M85 E86	Q28-Q83 PolarHBondContact O-NE2 3.26Å; D30-Q83 PolarHBondContact OD1-OE1 2.84Å; E79-Q83 WeakPolarHBondContact O-CB 3.32Å; E79-Q83 PolarHBondContact O-N 3.15Å; L80-Q83 PolarHBondContact O-N 3.22Å; V81-Q83 VanDerWaalsContact C-N 3.28Å; V81-Q83 PolarHBondContact O-N 2.89Å; Q83-M85 VanDerWaalsContact C-N 3.3Å; Q83-M85 PolarHBondContact O-N 2.98Å; Q83-E86 WeakPolarHBondContact O-CB 3.37Å; Q83-E86 PolarHBondContact O-N 3.37Å
84	V	94.8	Very high	95.9	Very high	86 Å²	86	44.6 Å²	44.6	52%	0.521	23%	0.225	S	C	.	.	H	α-helix	trans	-66.4	-35.3	178.4	176.3	0	0	0	0	111	L80 V81 V136	L80-V84 WeakPolarHBondContact O-CG2 3.39Å; L80-V84 PolarHBondContact O-N 3.34Å; V81-V84 PolarHBondContact O-N 3.35Å; V81-V84 VanDerWaalsContact O-N 3.15Å; V84-V136 HydrophobicContact CB-CG2 4.07Å; V84-V136 HydrophobicContact CG1-CG1 4.34Å; V84-V136 HydrophobicContact CG1-CG2 3.93Å
85	M	95.4	Very high	96.1	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.02	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	9.1	-178.4	-64.8	-59.9	158.5	0	0	114.9	V81 Q83 E87 K88 I90 F92 V136 L140	V81-M85 HydrophobicContact CG1-CG 4.36Å; V81-M85 WeakPolarHBondContact O-CB 3.39Å; V81-M85 WeakPolarHBondContact O-CG 3.47Å; V81-M85 PolarHBondContact O-N 2.82Å; Q83-M85 VanDerWaalsContact C-N 3.3Å; Q83-M85 PolarHBondContact O-N 2.98Å; M85-E87 PolarHBondContact O-N 3.09Å; M85-E87 VanDerWaalsContact O-N 3.1Å; M85-K88 HydrophobicContact CB-CB 4.5Å; M85-K88 PolarHBondContact O-N 2.83Å; M85-K88 HydrophobicContact SD-CB 4.22Å; M85-K88 HydrophobicContact SD-CG 3.61Å; M85-I90 HydrophobicContact CB-CB 4.5Å; M85-I90 HydrophobicContact CB-CD1 4.26Å; M85-I90 HydrophobicContact CG-CD1 4.17Å; M85-I90 HydrophobicContact SD-CD1 4.21Å; M85-F92 HydrophobicContact CB-CE2 3.85Å; M85-F92 HydrophobicContact CB-CZ 3.89Å; M85-F92 HydrophobicContact CG-CZ 4.15Å; M85-V136 HydrophobicContact CE-CB 3.95Å; M85-V136 HydrophobicContact CE-CG1 3.62Å; M85-V136 HydrophobicContact CE-CG2 3.81Å; M85-V136 WeakPolarHBondContact CE-O 3.37Å; M85-L140 HydrophobicContact CE-CD1 4.12Å; M85-L140 HydrophobicContact CE-CD2 3.93Å; M85-L140 HydrophobicContact CE-CG 3.72Å; M85-L140 HydrophobicContact SD-CD2 4.36Å
86	E	92.1	Very high	96.2	Very high	119 Å²	119	39.8 Å²	39.8	56%	0.556	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-29.8	-175.8	-170.6	171.2	-83.8	0	0	113.3	R34 A82 Q83	R34-E86 IonicContact CZ-OE1 2.75Å; R34-E86 IonicContact NE-OE1 3.19Å; R34-E86 PolarHBondContact NE-OE1 2.84Å; R34-E86 IonicContact NH2-OE1 3.77Å; R34-E86 PolarHBondContact NH2-OE1 3.11Å; A82-E86 PolarHBondContact O-N 3.17Å; Q83-E86 WeakPolarHBondContact O-CB 3.37Å; Q83-E86 PolarHBondContact O-N 3.37Å
87	E	93.1	Very high	96.2	Very high	195 Å²	195	36.7 Å²	36.7	91%	0.911	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-4.8	176.7	-61.9	-161.2	153	0	0	114.9	M85	M85-E87 PolarHBondContact O-N 3.09Å; M85-E87 VanDerWaalsContact O-N 3.1Å
88	K	94	Very high	96.1	Very high	91 Å²	91	40.2 Å²	40.2	40%	0.396	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-0	-173.5	-65.3	-55.6	-163.6	104.9	0	115.5	M85 I90 L143	M85-K88 HydrophobicContact CB-CB 4.5Å; M85-K88 PolarHBondContact O-N 2.83Å; M85-K88 HydrophobicContact SD-CB 4.22Å; M85-K88 HydrophobicContact SD-CG 3.61Å; K88-I90 HydrophobicContact CB-CD1 4.22Å; K88-I90 HydrophobicContact CB-CG1 4Å; K88-I90 PolarHBondContact O-N 2.58Å; K88-L143 HydrophobicContact CB-CD1 3.93Å; K88-L143 HydrophobicContact CD-CD1 3.92Å; K88-L143 HydrophobicContact CG-CD1 3.9Å
89	D	93.3	Very high	96.1	Very high	81 Å²	81	45.7 Å²	45.7	43%	0.433	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	30.8	-171.7	-162.1	34.6	0	0	0	114.8	H50 S51	H50-D89 VanDerWaalsContact CB-O 3.24Å; H50-D89 WeakPolarHBondContact CB-O 3.43Å; H50-D89 IonicContact CE1-OD1 3.9Å; H50-D89 IonicContact CG-OD1 2.58Å; H50-D89 PolarHBondContact ND1-O 2.71Å; H50-D89 IonicContact ND1-OD1 2.88Å; H50-D89 PolarHBondContact ND1-OD1 2.98Å; S51-D89 PolarHBondContact N-O 2.75Å; S51-D89 PolarHBondContact N-OD2 2.76Å; S51-D89 PolarHBondContact OG-O 2.88Å
90	I	97.1	Very high	96.1	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.056	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	133.3	168.6	-51.3	-179.9	0	0	0	108.9	M52 C54 M85 K88 F92 L139 L143	M52-I90 HydrophobicContact CB-CG1 4.24Å; M52-I90 HydrophobicContact CB-CG2 4.32Å; M52-I90 HydrophobicContact CG-CG2 4.26Å; M52-I90 WeakPolarHBondContact O-CA 3.42Å; M52-I90 HydrophobicContact SD-CD1 3.8Å; M52-I90 HydrophobicContact SD-CG1 4.03Å; M52-I90 HydrophobicContact SD-CG2 4.18Å; C54-I90 HydrophobicContact CB-CG2 4.37Å; M85-I90 HydrophobicContact CB-CB 4.5Å; M85-I90 HydrophobicContact CB-CD1 4.26Å; M85-I90 HydrophobicContact CG-CD1 4.17Å; M85-I90 HydrophobicContact SD-CD1 4.21Å; K88-I90 HydrophobicContact CB-CD1 4.22Å; K88-I90 HydrophobicContact CB-CG1 4Å; K88-I90 PolarHBondContact O-N 2.58Å; I90-F92 HydrophobicContact CB-CE2 3.77Å; I90-F92 HydrophobicContact CB-CZ 4.1Å; I90-F92 HydrophobicContact CG2-CD2 4.26Å; I90-F92 HydrophobicContact CG2-CE1 4.3Å; I90-F92 HydrophobicContact CG2-CE2 3.54Å; I90-F92 HydrophobicContact CG2-CZ 3.57Å; I90-L139 HydrophobicContact CD1-CB 4.07Å; I90-L139 HydrophobicContact CD1-CD1 4.46Å; I90-L143 HydrophobicContact CD1-CD1 4.14Å; I90-L143 HydrophobicContact CD1-CG 4.45Å
91	G	97.1	Very high	96.1	Very high	3 Å²	3	45.1 Å²	45.1	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	148.7	167.7	0	0	0	0	0	111.9	H50 M52 L53 C54	H50-G91 WeakPolarHBondContact CD2-CA 3.11Å; M52-G91 PolarHBondContact O-N 2.75Å; L53-G91 CarbonylContact C-O 3.58Å; L53-G91 WeakPolarHBondContact CA-O 3.5Å; C54-G91 PolarHBondContact N-O 2.93Å
92	F	98.4	Very high	96.1	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.035	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	148.9	177.6	-66.2	-94	0	0	0	111.3	V35 L36 C54 V81 A82 M85 I90 L139	V35-F92 HydrophobicContact CG2-CB 4.15Å; L36-F92 PolarHBondContact N-O 3.39Å; L36-F92 VanDerWaalsContact N-O 3.07Å; C54-F92 HydrophobicContact CB-CD1 3.76Å; C54-F92 HydrophobicContact CB-CE1 3.78Å; C54-F92 CarbonylContact O-C 3.56Å; C54-F92 WeakPolarHBondContact O-CA 3.45Å; V81-F92 HydrophobicContact CB-CE1 4.25Å; V81-F92 HydrophobicContact CG1-CE1 3.51Å; V81-F92 HydrophobicContact CG1-CZ 3.73Å; A82-F92 HydrophobicContact CB-CB 4.03Å; A82-F92 HydrophobicContact CB-CD1 4.39Å; A82-F92 HydrophobicContact CB-CD2 3.44Å; A82-F92 VanDerWaalsContact CB-CD2 3.44Å; A82-F92 HydrophobicContact CB-CE2 4.01Å; A82-F92 HydrophobicContact CB-CG 3.68Å; M85-F92 HydrophobicContact CB-CE2 3.85Å; M85-F92 HydrophobicContact CB-CZ 3.89Å; M85-F92 HydrophobicContact CG-CZ 4.15Å; I90-F92 HydrophobicContact CB-CE2 3.77Å; I90-F92 HydrophobicContact CB-CZ 4.1Å; I90-F92 HydrophobicContact CG2-CD2 4.26Å; I90-F92 HydrophobicContact CG2-CE1 4.3Å; I90-F92 HydrophobicContact CG2-CE2 3.54Å; I90-F92 HydrophobicContact CG2-CZ 3.57Å; F92-L139 HydrophobicContact CE1-CD1 3.63Å; F92-L139 HydrophobicContact CZ-CD1 3.73Å
93	G	97.9	Very high	96.1	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	169.3	179.1	0	0	0	0	0	114.3	L36 C54 L55 F56	L36-G93 CarbonylContact O-C 3.38Å; L36-G93 WeakPolarHBondContact O-CA 3.45Å; C54-G93 PolarHBondContact O-N 3.37Å; L55-G93 WeakPolarHBondContact CA-O 3.38Å; F56-G93 PolarHBondContact N-O 2.81Å
94	M	98.2	Very high	96.2	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.049	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.5	178.1	-67.6	172.2	84.5	0	0	109.3	V35 L36 I38 F56 H71 E75 L78	V35-M94 HydrophobicContact CG1-CG 3.69Å; V35-M94 HydrophobicContact CG1-SD 3.91Å; L36-M94 PolarHBondContact O-N 2.61Å; I38-M94 WeakPolarHBondContact CB-O 3.32Å; I38-M94 PolarHBondContact N-O 2.5Å; F56-M94 HydrophobicContact CB-CG 4.33Å; F56-M94 HydrophobicContact CD1-CE 3.7Å; F56-M94 HydrophobicContact CD1-CG 4.18Å; F56-M94 HydrophobicContact CE1-CE 3.98Å; F56-M94 CarbonylContact O-C 3.6Å; F56-M94 WeakPolarHBondContact O-CA 3.48Å; H71-M94 VanDerWaalsContact CE1-CE 3.41Å; H71-M94 WeakPolarHBondContact CE1-CE 3.49Å; E75-M94 HydrophobicContact CB-CE 4.16Å; E75-M94 HydrophobicContact CB-SD 3.97Å; E75-M94 HydrophobicContact CG-SD 3.95Å; L78-M94 HydrophobicContact CD1-CE 4.44Å; L78-M94 HydrophobicContact CD1-CG 3.75Å; L78-M94 HydrophobicContact CD1-SD 4.06Å
95	V	98.1	Very high	96.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	115.2	-179.1	-175.4	0	0	0	0	109.7	I38 L55 F56 Y57 H58 A104 L109	I38-V95 HydrophobicContact CB-CG2 3.83Å; I38-V95 HydrophobicContact CG2-CG2 3.88Å; L55-V95 HydrophobicContact CB-CG2 4.41Å; L55-V95 HydrophobicContact CD1-CG2 4.13Å; F56-V95 PolarHBondContact O-N 3.39Å; Y57-V95 HydrophobicContact CD2-CB 4.06Å; Y57-V95 HydrophobicContact CD2-CG1 4.07Å; Y57-V95 WeakPolarHBondContact CD2-O 3.48Å; Y57-V95 HydrophobicContact CE2-CG1 4.36Å; H58-V95 VanDerWaalsContact CD2-C 3.46Å; H58-V95 PolarHBondContact CD2-O 3.41Å; H58-V95 VanDerWaalsContact CD2-O 3.25Å; H58-V95 PolarHBondContact N-O 2.93Å; V95-A104 HydrophobicContact CG1-CB 4.35Å; V95-L109 HydrophobicContact CB-CD1 3.87Å; V95-L109 HydrophobicContact CG1-CD1 3.83Å; V95-L109 HydrophobicContact CG2-CD1 3.87Å
96	D	96.8	Very high	96.3	Very high	12 Å²	12	60.2 Å²	60.2	6%	0.064	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.2	177.3	-179.5	-60.9	0	0	0	111	H58 V98 K99 D100 A101	H58-D96 VanDerWaalsContact CE1-CA 3.49Å; H58-D96 WeakPolarHBondContact CE1-CA 3.48Å; H58-D96 VanDerWaalsContact CE1-CB 3.46Å; H58-D96 WeakPolarHBondContact CE1-CB 3.26Å; H58-D96 IonicContact CE1-OD2 3.74Å; H58-D96 PolarHBondContact NE2-N 3.25Å; D96-V98 VanDerWaalsContact C-N 3.29Å; D96-V98 PolarHBondContact O-N 2.9Å; D96-V98 PolarHBondContact OD1-N 2.98Å; D96-K99 HydrophobicContact CB-CB 3.89Å; D96-K99 HydrophobicContact CB-CD 3.98Å; D96-K99 VanDerWaalsContact OD1-CB 3.22Å; D96-K99 WeakPolarHBondContact OD1-CB 3.19Å; D96-K99 PolarHBondContact OD1-N 3.05Å; D96-D100 CarbonylContact O-C 3.31Å; D96-D100 WeakPolarHBondContact O-CA 3.28Å; D96-D100 PolarHBondContact O-N 3Å; D96-A101 PolarHBondContact O-N 2.81Å
97	S	96.2	Very high	96.5	Very high	11 Å²	11	55.6 Å²	55.6	8%	0.077	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.5	-174.5	68.7	0	0	0	0	115.8	Y57 H58 A101 E112	Y57-S97 WeakPolarHBondContact OH-CB 3.47Å; H58-S97 WeakPolarHBondContact O-CB 3.4Å; H58-S97 PolarHBondContact O-N 2.92Å; H58-S97 PolarHBondContact O-OG 2.93Å; S97-A101 WeakPolarHBondContact O-CA 3.42Å; S97-A101 WeakPolarHBondContact O-CB 3.46Å; S97-E112 WeakPolarHBondContact CB-OE1 3.35Å; S97-E112 PolarHBondContact OG-OE1 2.65Å
98	V	95.6	Very high	96.6	Very high	102 Å²	102	48.2 Å²	48.2	62%	0.618	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.8	-46.2	-176.2	175.2	0	0	0	0	111.3	K60 D96	K60-V98 HydrophobicContact CB-CB 3.94Å; K60-V98 HydrophobicContact CB-CG2 3.72Å; K60-V98 HydrophobicContact CG-CB 4.29Å; K60-V98 HydrophobicContact CG-CG2 4.44Å; D96-V98 VanDerWaalsContact C-N 3.29Å; D96-V98 PolarHBondContact O-N 2.9Å; D96-V98 PolarHBondContact OD1-N 2.98Å
99	K	96.5	Very high	96.7	Very high	116 Å²	116	44.2 Å²	44.2	50%	0.504	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-46.2	178.8	171.9	-157.8	165.4	-165.3	0	111	D37 D96	D37-K99 IonicContact OD1-NZ 2.75Å; D37-K99 PolarHBondContact OD1-NZ 3.03Å; D37-K99 IonicContact OD2-NZ 2.71Å; D37-K99 PolarHBondContact OD2-NZ 3.49Å; D96-K99 HydrophobicContact CB-CB 3.89Å; D96-K99 HydrophobicContact CB-CD 3.98Å; D96-K99 VanDerWaalsContact OD1-CB 3.22Å; D96-K99 WeakPolarHBondContact OD1-CB 3.19Å; D96-K99 PolarHBondContact OD1-N 3.05Å
100	D	97.1	Very high	96.7	Very high	19 Å²	19	48.1 Å²	48.1	10%	0.102	25%	0.245	C	C	.	.	S	Bend	trans	-119.7	26.1	-174.5	-84.8	-72.2	0	0	0	113.3	S39 D40 D96 K102 V103 A104	S39-D100 WeakPolarHBondContact CA-OD1 3.41Å; S39-D100 VanDerWaalsContact CB-CG 3.48Å; S39-D100 WeakPolarHBondContact CB-OD1 3.43Å; S39-D100 WeakPolarHBondContact CB-OD2 3.47Å; D40-D100 PolarHBondContact N-OD1 2.53Å; D96-D100 CarbonylContact O-C 3.31Å; D96-D100 WeakPolarHBondContact O-CA 3.28Å; D96-D100 PolarHBondContact O-N 3Å; D100-K102 PolarHBondContact O-N 2.84Å; D100-V103 HydrophobicContact CB-CB 4.47Å; D100-V103 HydrophobicContact CB-CG2 4.18Å; D100-V103 WeakPolarHBondContact O-CA 3.47Å; D100-V103 WeakPolarHBondContact O-CB 3.26Å; D100-V103 PolarHBondContact O-N 2.89Å; D100-A104 PolarHBondContact O-N 2.99Å
101	A	96.9	Very high	96.5	Very high	42 Å²	42	51 Å²	51	35%	0.347	26%	0.258	S	S	.	.	H	α-helix	trans	-40.2	-33.3	167.9	0	0	0	0	0	115.5	D96 S97 V103 K105	D96-A101 PolarHBondContact O-N 2.81Å; S97-A101 WeakPolarHBondContact O-CA 3.42Å; S97-A101 WeakPolarHBondContact O-CB 3.46Å; A101-V103 VanDerWaalsContact C-N 3.28Å; A101-V103 PolarHBondContact O-N 2.83Å; A101-K105 WeakPolarHBondContact O-CB 3.41Å; A101-K105 PolarHBondContact O-N 2.82Å; A101-K105 VanDerWaalsContact O-N 3.1Å
102	K	97.3	Very high	96.3	Very high	164 Å²	164	55.8 Å²	55.8	71%	0.713	28%	0.28	S	S	*	.	H	α-helix	trans	-76.6	-12.1	178.3	-69.1	174.3	-173.2	151.7	0	113.6	D100 K106	D100-K102 PolarHBondContact O-N 2.84Å; K102-K106 VanDerWaalsContact O-CD 3.28Å; K102-K106 WeakPolarHBondContact O-CD 3.34Å; K102-K106 WeakPolarHBondContact O-CE 3.45Å; K102-K106 WeakPolarHBondContact O-CG 3.08Å; K102-K106 PolarHBondContact O-NZ 2.94Å
103	V	97.4	Very high	95.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-92.4	-51.9	171.9	-175	0	0	0	0	108	I38 D40 Y43 D100 A101 K105 K106 L107	I38-V103 HydrophobicContact CG2-CG1 4.1Å; D40-V103 HydrophobicContact CB-CG2 4.16Å; D40-V103 VanDerWaalsContact N-CG2 3.27Å; Y43-V103 HydrophobicContact CD1-CG1 4.21Å; Y43-V103 HydrophobicContact CD1-CG2 4.39Å; Y43-V103 HydrophobicContact CD2-CG1 4.13Å; Y43-V103 HydrophobicContact CG-CG1 3.79Å; D100-V103 HydrophobicContact CB-CB 4.47Å; D100-V103 HydrophobicContact CB-CG2 4.18Å; D100-V103 WeakPolarHBondContact O-CA 3.47Å; D100-V103 WeakPolarHBondContact O-CB 3.26Å; D100-V103 PolarHBondContact O-N 2.89Å; A101-V103 VanDerWaalsContact C-N 3.28Å; A101-V103 PolarHBondContact O-N 2.83Å; V103-K105 PolarHBondContact O-N 3.4Å; V103-K106 WeakPolarHBondContact O-CA 3.48Å; V103-K106 WeakPolarHBondContact O-CB 2.95Å; V103-K106 PolarHBondContact O-N 3.34Å; V103-L107 HydrophobicContact CG1-CD1 3.74Å; V103-L107 HydrophobicContact CG1-CG 4.12Å; V103-L107 WeakPolarHBondContact O-CG 3.16Å; V103-L107 PolarHBondContact O-N 2.78Å
104	A	97.1	Very high	95.8	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-46.1	-56.2	174.4	0	0	0	0	0	112.2	Y57 V95 D100 K106 L107 G108 L109	Y57-A104 HydrophobicContact CD2-CB 4.19Å; Y57-A104 HydrophobicContact CE2-CB 3.42Å; Y57-A104 VanDerWaalsContact CE2-CB 3.42Å; V95-A104 HydrophobicContact CG1-CB 4.35Å; D100-A104 PolarHBondContact O-N 2.99Å; A104-K106 PolarHBondContact O-N 2.75Å; A104-L107 PolarHBondContact O-N 2.78Å; A104-G108 PolarHBondContact O-N 3.46Å; A104-L109 HydrophobicContact CB-CB 4.14Å; A104-L109 HydrophobicContact CB-CD1 3.99Å; A104-L109 HydrophobicContact CB-CG 4.23Å; A104-L109 PolarHBondContact O-N 3.25Å
105	K	96.6	Very high	95.7	Very high	175 Å²	175	57 Å²	57	76%	0.761	30%	0.297	S	S	*	.	H	α-helix	trans	-64.4	-10.6	177.1	-169.4	163.7	-163.1	72.8	0	116	A101 V103	A101-K105 WeakPolarHBondContact O-CB 3.41Å; A101-K105 PolarHBondContact O-N 2.82Å; A101-K105 VanDerWaalsContact O-N 3.1Å; V103-K105 PolarHBondContact O-N 3.4Å
106	K	96.3	Very high	95.7	Very high	104 Å²	104	57.1 Å²	57.1	45%	0.452	30%	0.297	S	S	.	.	H	α-helix	trans	-97.8	-18.7	171.7	-69.2	180	-159.7	119.2	0	113	D40 Y43 K102 V103 A104	D40-K106 IonicContact OD1-NZ 2.63Å; D40-K106 PolarHBondContact OD1-NZ 3.48Å; Y43-K106 WeakPolarHBondContact OH-CD 3.4Å; K102-K106 VanDerWaalsContact O-CD 3.28Å; K102-K106 WeakPolarHBondContact O-CD 3.34Å; K102-K106 WeakPolarHBondContact O-CE 3.45Å; K102-K106 WeakPolarHBondContact O-CG 3.08Å; K102-K106 PolarHBondContact O-NZ 2.94Å; V103-K106 WeakPolarHBondContact O-CA 3.48Å; V103-K106 WeakPolarHBondContact O-CB 2.95Å; V103-K106 PolarHBondContact O-N 3.34Å; A104-K106 PolarHBondContact O-N 2.75Å
107	L	95.7	Very high	95.8	Very high	22 Å²	22	56.6 Å²	56.6	12%	0.115	29%	0.294	C	S	.	.	H	α-helix	trans	-96.1	-25.1	-179.9	-66.8	-174.7	0	0	0	112	Y43 L47 L55 V103 A104 L109 F118	Y43-L107 HydrophobicContact CD2-CD2 3.95Å; Y43-L107 HydrophobicContact CE2-CD2 4.25Å; L47-L107 HydrophobicContact CD1-CD2 3.7Å; L55-L107 HydrophobicContact CD1-CD1 3.66Å; V103-L107 HydrophobicContact CG1-CD1 3.74Å; V103-L107 HydrophobicContact CG1-CG 4.12Å; V103-L107 WeakPolarHBondContact O-CG 3.16Å; V103-L107 PolarHBondContact O-N 2.78Å; A104-L107 PolarHBondContact O-N 2.78Å; L107-L109 HydrophobicContact CB-CD2 3.84Å; L107-L109 HydrophobicContact CB-CG 3.95Å; L107-L109 HydrophobicContact CD1-CD1 4.37Å; L107-L109 HydrophobicContact CD1-CD2 4.44Å; L107-F118 HydrophobicContact CB-CE1 4.17Å; L107-F118 HydrophobicContact CB-CZ 3.82Å; L107-F118 HydrophobicContact CD1-CZ 4.34Å; L107-F118 HydrophobicContact CD2-CE1 4.27Å; L107-F118 HydrophobicContact CD2-CZ 4.44Å; L107-F118 HydrophobicContact CG-CZ 4.42Å
108	G	95.9	Very high	95.8	Very high	40 Å²	40	57.1 Å²	57.1	41%	0.412	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	24.2	-174.6	0	0	0	0	0	113.1	A104	A104-G108 PolarHBondContact O-N 3.46Å
109	L	96.3	Very high	95.7	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.031	27%	0.27	C	S	.	.			trans	-78.4	121.2	169.5	-27.7	174.6	0	0	0	107.1	Y57 V95 A104 L107 Y116 F118	Y57-L109 HydrophobicContact CD1-CB 3.43Å; Y57-L109 VanDerWaalsContact CD1-CB 3.43Å; Y57-L109 HydrophobicContact CD2-CB 4.05Å; Y57-L109 HydrophobicContact CD2-CD1 3.68Å; Y57-L109 HydrophobicContact CE1-CB 3.89Å; Y57-L109 HydrophobicContact CE2-CB 4.38Å; Y57-L109 HydrophobicContact CE2-CD1 4.34Å; Y57-L109 HydrophobicContact CG-CB 3.6Å; Y57-L109 HydrophobicContact CG-CD1 3.83Å; Y57-L109 HydrophobicContact CG-CG 4.34Å; V95-L109 HydrophobicContact CB-CD1 3.87Å; V95-L109 HydrophobicContact CG1-CD1 3.83Å; V95-L109 HydrophobicContact CG2-CD1 3.87Å; A104-L109 HydrophobicContact CB-CB 4.14Å; A104-L109 HydrophobicContact CB-CD1 3.99Å; A104-L109 HydrophobicContact CB-CG 4.23Å; A104-L109 PolarHBondContact O-N 3.25Å; L107-L109 HydrophobicContact CB-CD2 3.84Å; L107-L109 HydrophobicContact CB-CG 3.95Å; L107-L109 HydrophobicContact CD1-CD1 4.37Å; L107-L109 HydrophobicContact CD1-CD2 4.44Å; L109-Y116 HydrophobicContact CB-CD2 3.99Å; L109-Y116 HydrophobicContact CB-CE2 3.69Å; L109-Y116 HydrophobicContact CD2-CD1 4.05Å; L109-Y116 HydrophobicContact CD2-CD2 3.58Å; L109-Y116 HydrophobicContact CD2-CE2 4.16Å; L109-Y116 HydrophobicContact CD2-CG 3.48Å; L109-Y116 VanDerWaalsContact CD2-CG 3.48Å; L109-Y116 HydrophobicContact CG-CD2 4.24Å; L109-Y116 HydrophobicContact CG-CE2 4.44Å; L109-F118 HydrophobicContact CD2-CE2 4Å; L109-F118 HydrophobicContact CD2-CZ 3.73Å
110	E	93	Very high	95.3	Very high	164 Å²	164	54.1 Å²	54.1	77%	0.766	28%	0.28	S	S	*	.			trans	-118.6	-26.5	-176.2	-51.3	-140.1	138.7	0	0	112.4	Y116	E110-Y116 PolarHBondContact N-OH 2.92Å
111	E	92.2	Very high	94.9	Very high	70 Å²	70	61.6 Å²	61.6	33%	0.327	32%	0.32	S	S	.	.	S	Bend	trans	-111.9	124.6	-173.1	-170.7	-176	-169.5	0	0	114.7	Y57 G113 S114 Y116	Y57-E111 WeakPolarHBondContact CD1-O 3.48Å; E111-G113 PolarHBondContact O-N 2.84Å; E111-S114 WeakPolarHBondContact CB-OG 3.46Å; E111-S114 VanDerWaalsContact CG-OG 3.28Å; E111-S114 WeakPolarHBondContact CG-OG 3.49Å; E111-S114 PolarHBondContact OE2-OG 3.48Å; E111-Y116 PolarHBondContact N-OH 3.03Å
112	E	92.9	Very high	94.6	Very high	104 Å²	104	61.7 Å²	61.7	49%	0.486	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	99.5	-177.7	-62.9	-179.6	107.5	0	0	111.5	Y57 E59 S97	Y57-E112 HydrophobicContact CE1-CG 4.2Å; E59-E112 HydrophobicContact CG-CB 4.19Å; S97-E112 WeakPolarHBondContact CB-OE1 3.35Å; S97-E112 PolarHBondContact OG-OE1 2.65Å
113	G	90.9	Very high	94.5	Very high	40 Å²	40	57.3 Å²	57.3	41%	0.412	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	141.1	-24.9	-175.9	0	0	0	0	0	112.7	F56 Y57 E111	F56-G113 WeakPolarHBondContact CE2-O 3.4Å; Y57-G113 PolarHBondContact O-N 2.73Å; E111-G113 PolarHBondContact O-N 2.84Å
114	S	94.1	Very high	94.5	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.021	30%	0.303	C	S	.	.			trans	-86.1	155.4	-170.1	-35.4	0	0	0	0	112.4	Y57 E111	Y57-S114 PolarHBondContact N-O 3.04Å; E111-S114 WeakPolarHBondContact CB-OG 3.46Å; E111-S114 VanDerWaalsContact CG-OG 3.28Å; E111-S114 WeakPolarHBondContact CG-OG 3.49Å; E111-S114 PolarHBondContact OE2-OG 3.48Å
115	V	97.5	Very high	94.4	Very high	2 Å²	2	62 Å²	62	1%	0.012	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.3	178	172.4	0	0	0	0	110	C54 F56 V117 F126 L130 L135	C54-V115 WeakPolarHBondContact SG-CG1 3.36Å; F56-V115 HydrophobicContact CB-CG2 4.18Å; F56-V115 HydrophobicContact CD2-CG2 3.82Å; F56-V115 HydrophobicContact CG-CG2 4.48Å; V115-V117 HydrophobicContact CG1-CG2 4.45Å; V115-F126 HydrophobicContact CB-CB 4.08Å; V115-F126 HydrophobicContact CB-CD1 4.02Å; V115-F126 HydrophobicContact CB-CG 4.49Å; V115-F126 HydrophobicContact CG1-CB 4.45Å; V115-F126 HydrophobicContact CG2-CD1 4.38Å; V115-F126 PolarHBondContact N-O 3.45Å; V115-F126 WeakPolarHBondContact O-CB 3.48Å; V115-F126 PolarHBondContact O-N 2.71Å; V115-L130 HydrophobicContact CG2-CD1 3.8Å; V115-L135 HydrophobicContact CG1-CD1 4.24Å; V115-L135 HydrophobicContact CG1-CD2 4.49Å
116	Y	97.8	Very high	94.4	Very high	3 Å²	3	53.8 Å²	53.8	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.1	-178.5	-65	-90.1	0	0	0	111.5	L55 Y57 L109 E110 E111 V123 E125	L55-Y116 PolarHBondContact N-O 3.3Å; L55-Y116 PolarHBondContact O-N 3.45Å; Y57-Y116 HydrophobicContact CD1-CE2 4.01Å; Y57-Y116 HydrophobicContact CG-CE2 4.26Å; L109-Y116 HydrophobicContact CB-CD2 3.99Å; L109-Y116 HydrophobicContact CB-CE2 3.69Å; L109-Y116 HydrophobicContact CD2-CD1 4.05Å; L109-Y116 HydrophobicContact CD2-CD2 3.58Å; L109-Y116 HydrophobicContact CD2-CE2 4.16Å; L109-Y116 HydrophobicContact CD2-CG 3.48Å; L109-Y116 VanDerWaalsContact CD2-CG 3.48Å; L109-Y116 HydrophobicContact CG-CD2 4.24Å; L109-Y116 HydrophobicContact CG-CE2 4.44Å; E110-Y116 PolarHBondContact N-OH 2.92Å; E111-Y116 PolarHBondContact N-OH 3.03Å; Y116-V123 HydrophobicContact CD1-CG1 4.04Å; Y116-E125 HydrophobicContact CD1-CB 4.48Å; Y116-E125 HydrophobicContact CD1-CG 4.36Å; Y116-E125 HydrophobicContact CE1-CB 4.38Å; Y116-E125 HydrophobicContact CE1-CG 3.91Å; Y116-E125 WeakPolarHBondContact CE1-OE1 3.47Å; Y116-E125 PolarHBondContact OH-OE1 3.11Å
117	V	97.9	Very high	94.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.5	177.8	-173.8	0	0	0	0	110.3	M52 C54 V115 I124 F138 L139 L142	M52-V117 HydrophobicContact CE-CG1 4.46Å; M52-V117 HydrophobicContact CG-CG1 3.49Å; M52-V117 VanDerWaalsContact CG-CG1 3.49Å; M52-V117 HydrophobicContact SD-CG1 3.57Å; M52-V117 VanDerWaalsContact SD-CG1 3.57Å; C54-V117 HydrophobicContact CB-CG2 4.44Å; V115-V117 HydrophobicContact CG1-CG2 4.45Å; V117-I124 PolarHBondContact N-O 2.76Å; V117-I124 PolarHBondContact O-N 3.31Å; V117-F138 HydrophobicContact CG2-CE1 4.01Å; V117-L139 HydrophobicContact CG1-CD2 3.97Å; V117-L139 HydrophobicContact CG2-CD2 3.8Å; V117-L142 HydrophobicContact CB-CD1 4.01Å; V117-L142 HydrophobicContact CG1-CD1 3.8Å; V117-L142 HydrophobicContact CG2-CD1 4.24Å
118	F	97.1	Very high	94	Very high	23 Å²	23	49.1 Å²	49.1	10%	0.101	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	115.8	174.5	-63.6	-98.2	0	0	0	108.8	L47 M52 L53 L55 L107 L109 R122 V123	L47-F118 HydrophobicContact CD2-CB 3.86Å; L47-F118 HydrophobicContact CD2-CD1 3.85Å; L47-F118 HydrophobicContact CD2-CD2 4.42Å; L47-F118 HydrophobicContact CD2-CG 3.76Å; M52-F118 CarbonylContact C-O 3.51Å; M52-F118 VanDerWaalsContact CA-O 3.26Å; M52-F118 WeakPolarHBondContact CA-O 3.14Å; L53-F118 HydrophobicContact CB-CB 4.29Å; L53-F118 PolarHBondContact N-O 3.17Å; L53-F118 WeakPolarHBondContact O-CD2 3.04Å; L53-F118 PolarHBondContact O-N 3.29Å; L55-F118 HydrophobicContact CB-CE2 4.42Å; L55-F118 HydrophobicContact CD1-CD2 4.15Å; L55-F118 HydrophobicContact CD1-CE2 3.77Å; L55-F118 HydrophobicContact CG-CD2 4.33Å; L55-F118 HydrophobicContact CG-CE2 4.22Å; L107-F118 HydrophobicContact CB-CE1 4.17Å; L107-F118 HydrophobicContact CB-CZ 3.82Å; L107-F118 HydrophobicContact CD1-CZ 4.34Å; L107-F118 HydrophobicContact CD2-CE1 4.27Å; L107-F118 HydrophobicContact CD2-CZ 4.44Å; L107-F118 HydrophobicContact CG-CZ 4.42Å; L109-F118 HydrophobicContact CD2-CE2 4Å; L109-F118 HydrophobicContact CD2-CZ 3.73Å; F118-R122 WeakPolarHBondContact CA-O 3.3Å; F118-V123 HydrophobicContact CD1-CG1 4.33Å; F118-V123 HydrophobicContact CD1-CG2 3.68Å; F118-V123 HydrophobicContact CE1-CB 4.29Å; F118-V123 HydrophobicContact CE1-CG1 3.9Å; F118-V123 HydrophobicContact CE1-CG2 3.43Å; F118-V123 VanDerWaalsContact CE1-CG2 3.43Å; F118-V123 HydrophobicContact CE2-CG1 4.28Å; F118-V123 HydrophobicContact CZ-CG1 3.82Å; F118-V123 HydrophobicContact CZ-CG2 4.2Å
119	K	94.3	Very high	94	Very high	22 Å²	22	50.3 Å²	50.3	10%	0.096	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	119.7	177.6	179.1	-177.7	175.8	176.9	0	108.5	M52 D121 R122 I124 L142	M52-K119 HydrophobicContact CE-CD 4.31Å; K119-D121 PolarHBondContact O-N 3.04Å; K119-R122 PolarHBondContact N-O 2.64Å; K119-R122 VanDerWaalsContact N-O 3.09Å; K119-R122 WeakPolarHBondContact O-CA 3.38Å; K119-R122 WeakPolarHBondContact O-CB 3.34Å; K119-R122 PolarHBondContact O-N 3.09Å; K119-I124 HydrophobicContact CB-CD1 4Å; K119-L142 WeakPolarHBondContact CD-O 3.08Å; K119-L142 WeakPolarHBondContact CE-O 3.44Å; K119-L142 PolarHBondContact NZ-O 3.29Å
120	D	88.2	Confident	93.9	Very high	133 Å²	133	52.3 Å²	52.3	71%	0.711	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	-114.9	-174.2	-62.4	-69.1	0	0	0	113.1
121	D	87.9	Confident	94	Very high	176 Å²	176	45.5 Å²	45.5	94%	0.941	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.9	5.8	172.8	-80.4	-46.4	0	0	0	112.5	K119	K119-D121 PolarHBondContact O-N 3.04Å
122	R	91.4	Very high	94.1	Very high	44 Å²	44	43.2 Å²	43.2	17%	0.166	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	155	178.3	-67.1	-175.5	-87.7	143.5	-3.8	112.5	F118 K119 I124 E188 Q191	F118-R122 WeakPolarHBondContact CA-O 3.3Å; K119-R122 PolarHBondContact N-O 2.64Å; K119-R122 VanDerWaalsContact N-O 3.09Å; K119-R122 WeakPolarHBondContact O-CA 3.38Å; K119-R122 WeakPolarHBondContact O-CB 3.34Å; K119-R122 PolarHBondContact O-N 3.09Å; R122-I124 HydrophobicContact CB-CD1 4.19Å; R122-E188 WeakPolarHBondContact CD-O 3.28Å; R122-E188 IonicContact CZ-OE2 3.6Å; R122-E188 IonicContact NE-OE2 3.08Å; R122-E188 PolarHBondContact NE-OE2 3.05Å; R122-E188 PolarHBondContact NH1-O 3.45Å; R122-E188 VanDerWaalsContact NH2-CG 3.34Å; R122-E188 IonicContact NH2-OE2 3.97Å; R122-E188 PolarHBondContact NH2-OE2 3.07Å; R122-Q191 VanDerWaalsContact NH2-OE1 3.14Å
123	V	95.2	Very high	94.2	Very high	71 Å²	71	42.7 Å²	42.7	43%	0.43	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.9	164.3	-168.4	0	0	0	0	106.5	Y116 F118	Y116-V123 HydrophobicContact CD1-CG1 4.04Å; F118-V123 HydrophobicContact CD1-CG1 4.33Å; F118-V123 HydrophobicContact CD1-CG2 3.68Å; F118-V123 HydrophobicContact CE1-CB 4.29Å; F118-V123 HydrophobicContact CE1-CG1 3.9Å; F118-V123 HydrophobicContact CE1-CG2 3.43Å; F118-V123 VanDerWaalsContact CE1-CG2 3.43Å; F118-V123 HydrophobicContact CE2-CG1 4.28Å; F118-V123 HydrophobicContact CZ-CG1 3.82Å; F118-V123 HydrophobicContact CZ-CG2 4.2Å
124	I	95.8	Very high	94.4	Very high	19 Å²	19	41.3 Å²	41.3	10%	0.097	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.5	172.6	-54.7	86.6	0	0	0	106.5	V117 K119 R122 F138 L142	V117-I124 PolarHBondContact N-O 2.76Å; V117-I124 PolarHBondContact O-N 3.31Å; K119-I124 HydrophobicContact CB-CD1 4Å; R122-I124 HydrophobicContact CB-CD1 4.19Å; I124-F138 HydrophobicContact CG2-CZ 3.97Å; I124-L142 HydrophobicContact CB-CD1 4.43Å; I124-L142 HydrophobicContact CD1-CD2 4.37Å; I124-L142 HydrophobicContact CG1-CD2 4.23Å; I124-L142 HydrophobicContact CG2-CD1 4.47Å
125	E	95.8	Very high	94.6	Very high	80 Å²	80	41.1 Å²	41.1	37%	0.374	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	129.1	172.3	-165.3	144.7	-149.3	0	0	107.4	Y116 Y193	Y116-E125 HydrophobicContact CD1-CB 4.48Å; Y116-E125 HydrophobicContact CD1-CG 4.36Å; Y116-E125 HydrophobicContact CE1-CB 4.38Å; Y116-E125 HydrophobicContact CE1-CG 3.91Å; Y116-E125 WeakPolarHBondContact CE1-OE1 3.47Å; Y116-E125 PolarHBondContact OH-OE1 3.11Å; E125-Y193 PolarHBondContact O-OH 2.79Å
126	F	96.2	Very high	94.6	Very high	3 Å²	3	42 Å²	42	1%	0.013	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	110.8	170	170.1	-95.3	0	0	0	107.3	V115 G128 V134 L135 F138 E256	V115-F126 HydrophobicContact CB-CB 4.08Å; V115-F126 HydrophobicContact CB-CD1 4.02Å; V115-F126 HydrophobicContact CB-CG 4.49Å; V115-F126 HydrophobicContact CG1-CB 4.45Å; V115-F126 HydrophobicContact CG2-CD1 4.38Å; V115-F126 PolarHBondContact N-O 3.45Å; V115-F126 WeakPolarHBondContact O-CB 3.48Å; V115-F126 PolarHBondContact O-N 2.71Å; F126-G128 VanDerWaalsContact CE1-O 3.3Å; F126-G128 WeakPolarHBondContact CE1-O 3.49Å; F126-V134 HydrophobicContact CE2-CG1 3.92Å; F126-V134 HydrophobicContact CZ-CG1 3.77Å; F126-L135 HydrophobicContact CD1-CD1 4.12Å; F126-L135 HydrophobicContact CD2-CD1 4.42Å; F126-L135 HydrophobicContact CE1-CD1 4.34Å; F126-L135 HydrophobicContact CG-CD1 4.15Å; F126-F138 HydrophobicContact CB-CD1 4.2Å; F126-F138 HydrophobicContact CB-CE1 3.64Å; F126-F138 HydrophobicContact CB-CZ 3.83Å; F126-F138 HydrophobicContact CD2-CB 4.14Å; F126-F138 AromaticContact CD2-CD1 3.59Å; F126-F138 HydrophobicContact CD2-CD1 3.59Å; F126-F138 AromaticContact CD2-CD2 3.6Å; F126-F138 HydrophobicContact CD2-CD2 3.6Å; F126-F138 AromaticContact CD2-CE1 3.77Å; F126-F138 HydrophobicContact CD2-CE1 3.77Å; F126-F138 AromaticContact CD2-CE2 3.78Å; F126-F138 HydrophobicContact CD2-CE2 3.78Å; F126-F138 AromaticContact CD2-CG 3.5Å; F126-F138 HydrophobicContact CD2-CG 3.5Å; F126-F138 VanDerWaalsContact CD2-CG 3.5Å; F126-F138 AromaticContact CD2-CZ 3.85Å; F126-F138 HydrophobicContact CD2-CZ 3.85Å; F126-F138 HydrophobicContact CE2-CB 4.06Å; F126-F138 HydrophobicContact CE2-CD1 4.35Å; F126-F138 HydrophobicContact CE2-CD2 4.07Å; F126-F138 AromaticContact CE2-CG 3.91Å; F126-F138 HydrophobicContact CE2-CG 3.91Å; F126-F138 HydrophobicContact CG-CD1 4.18Å; F126-F138 HydrophobicContact CG-CE1 4.09Å; F126-F138 HydrophobicContact CG-CG 4.5Å; F126-F138 HydrophobicContact CG-CZ 4.34Å; F126-E256 HydrophobicContact CE2-CB 4.5Å
127	D	90.1	Very high	94.5	Very high	23 Å²	23	46.9 Å²	46.9	12%	0.123	25%	0.248	C	C	.	.			trans	-120.4	62.6	-177.5	-169.8	33.1	0	0	0	110.6	D257 F259 E260	D127-D257 CarbonylContact O-C 3.53Å; D127-D257 WeakPolarHBondContact O-CA 3.42Å; D127-F259 VanDerWaalsContact CG-CB 3.47Å; D127-F259 PolarHBondContact O-N 3.07Å; D127-F259 WeakPolarHBondContact OD1-CB 3.02Å; D127-F259 WeakPolarHBondContact OD2-CB 3.46Å; D127-E260 HydrophobicContact CB-CB 4.39Å; D127-E260 WeakPolarHBondContact OD2-CA 3.24Å; D127-E260 PolarHBondContact OD2-N 2.93Å
128	G	94.3	Very high	94.5	Very high	5 Å²	5	46.9 Å²	46.9	5%	0.052	25%	0.248	C	C	.	.	S	Bend	trans	-140.9	-178.5	-176.2	0	0	0	0	0	112.4	F126 L130 A255 F259	F126-G128 VanDerWaalsContact CE1-O 3.3Å; F126-G128 WeakPolarHBondContact CE1-O 3.49Å; G128-L130 PolarHBondContact O-N 2.91Å; G128-A255 CarbonylContact C-O 3.43Å; G128-A255 WeakPolarHBondContact CA-O 3.24Å; G128-F259 WeakPolarHBondContact O-CE2 3.26Å
129	L	94.9	Very high	94.5	Very high	66 Å²	66	45.8 Å²	45.8	35%	0.346	24%	0.243	S	C	.	.			trans	-60.8	109.2	-175.3	-176.5	61.6	0	0	0	111.3	S131 A255 M258	L129-S131 PolarHBondContact O-N 3.13Å; L129-S131 PolarHBondContact O-OG 3.05Å; L129-S131 VanDerWaalsContact O-OG 3.14Å; L129-A255 HydrophobicContact CB-CB 4.27Å; L129-A255 PolarHBondContact N-O 2.92Å; L129-M258 HydrophobicContact CB-SD 3.79Å; L129-M258 HydrophobicContact CD1-SD 4.25Å
130	L	94.3	Very high	94.7	Very high	48 Å²	48	47.5 Å²	47.5	25%	0.251	25%	0.253	S	S	.	.			trans	-69.6	75.3	-177.3	-170.9	52.1	0	0	0	112.5	F56 T74 V115 G128 L135	F56-L130 HydrophobicContact CD2-CD2 3.82Å; F56-L130 HydrophobicContact CE2-CD2 3.43Å; F56-L130 VanDerWaalsContact CE2-CD2 3.43Å; F56-L130 HydrophobicContact CZ-CD2 4.15Å; T74-L130 HydrophobicContact CG2-CD2 3.54Å; T74-L130 HydrophobicContact CG2-CG 4.38Å; V115-L130 HydrophobicContact CG2-CD1 3.8Å; G128-L130 PolarHBondContact O-N 2.91Å; L130-L135 HydrophobicContact CD1-CD2 4.1Å
131	S	94.9	Very high	95	Very high	20 Å²	20	44.1 Å²	44.1	14%	0.14	24%	0.235	C	C	.	.			trans	-129.6	154.3	-175.9	65.5	0	0	0	0	110.1	L129 N133 V134 L135	L129-S131 PolarHBondContact O-N 3.13Å; L129-S131 PolarHBondContact O-OG 3.05Å; L129-S131 VanDerWaalsContact O-OG 3.14Å; S131-N133 VanDerWaalsContact C-N 3.31Å; S131-N133 PolarHBondContact O-N 2.97Å; S131-V134 WeakPolarHBondContact OG-CB 3.26Å; S131-V134 WeakPolarHBondContact OG-CG2 3.48Å; S131-L135 WeakPolarHBondContact O-CB 3.43Å; S131-L135 PolarHBondContact O-N 2.69Å; S131-L135 VanDerWaalsContact O-N 3.14Å
132	A	94.8	Very high	95.4	Very high	23 Å²	23	35.7 Å²	35.7	19%	0.19	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-20.3	-172	0	0	0	0	0	114	V77 L80 V81 V136	V77-A132 HydrophobicContact CG1-CB 4.31Å; L80-A132 HydrophobicContact CB-CB 4.35Å; L80-A132 HydrophobicContact CD2-CB 3.72Å; L80-A132 HydrophobicContact CG-CB 4.05Å; V81-A132 HydrophobicContact CG2-CB 4.02Å; A132-V136 VanDerWaalsContact O-CB 3.24Å; A132-V136 WeakPolarHBondContact O-CB 3.4Å; A132-V136 WeakPolarHBondContact O-CG2 3.34Å
133	N	94.3	Very high	95.5	Very high	93 Å²	93	36.6 Å²	36.6	50%	0.497	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-55.4	173.9	52.8	-69.4	0	0	0	111.2	S131 L135 V136 E137	S131-N133 VanDerWaalsContact C-N 3.31Å; S131-N133 PolarHBondContact O-N 2.97Å; N133-L135 VanDerWaalsContact C-N 3.34Å; N133-L135 PolarHBondContact O-N 3.14Å; N133-V136 CarbonylContact O-C 3.59Å; N133-V136 WeakPolarHBondContact O-CA 3.45Å; N133-V136 VanDerWaalsContact O-CB 3.31Å; N133-V136 WeakPolarHBondContact O-CB 3.48Å; N133-V136 PolarHBondContact O-N 3.09Å; N133-E137 PolarHBondContact O-N 3.15Å
134	V	96.8	Very high	95.5	Very high	10 Å²	10	39.3 Å²	39.3	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-58.3	-45.7	-178.7	-179.6	0	0	0	0	111.1	F126 S131 V136 E137 F138 A255 E256	F126-V134 HydrophobicContact CE2-CG1 3.92Å; F126-V134 HydrophobicContact CZ-CG1 3.77Å; S131-V134 WeakPolarHBondContact OG-CB 3.26Å; S131-V134 WeakPolarHBondContact OG-CG2 3.48Å; V134-V136 VanDerWaalsContact C-N 3.27Å; V134-V136 PolarHBondContact O-N 2.85Å; V134-E137 PolarHBondContact O-N 2.62Å; V134-F138 VanDerWaalsContact O-CB 3.27Å; V134-F138 WeakPolarHBondContact O-CB 3.33Å; V134-F138 PolarHBondContact O-N 3.11Å; V134-A255 HydrophobicContact CG1-CB 4.37Å; V134-A255 WeakPolarHBondContact CG1-O 3.48Å; V134-A255 HydrophobicContact CG2-CB 3.68Å; V134-E256 HydrophobicContact CG1-CB 4.18Å
135	L	97.3	Very high	95.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.6	-22.1	178	-171.5	58.9	0	0	0	112.7	L78 V81 V115 F126 L130 S131 N133 F138 L139	L78-L135 HydrophobicContact CD2-CD2 3.93Å; V81-L135 HydrophobicContact CG1-CG 4.31Å; V81-L135 HydrophobicContact CG2-CB 4.24Å; V81-L135 HydrophobicContact CG2-CD2 4.33Å; V81-L135 HydrophobicContact CG2-CG 4.44Å; V115-L135 HydrophobicContact CG1-CD1 4.24Å; V115-L135 HydrophobicContact CG1-CD2 4.49Å; F126-L135 HydrophobicContact CD1-CD1 4.12Å; F126-L135 HydrophobicContact CD2-CD1 4.42Å; F126-L135 HydrophobicContact CE1-CD1 4.34Å; F126-L135 HydrophobicContact CG-CD1 4.15Å; L130-L135 HydrophobicContact CD1-CD2 4.1Å; S131-L135 WeakPolarHBondContact O-CB 3.43Å; S131-L135 PolarHBondContact O-N 2.69Å; S131-L135 VanDerWaalsContact O-N 3.14Å; N133-L135 VanDerWaalsContact C-N 3.34Å; N133-L135 PolarHBondContact O-N 3.14Å; L135-F138 HydrophobicContact CD1-CD1 4.24Å; L135-L139 HydrophobicContact CD1-CD1 4.19Å; L135-L139 HydrophobicContact CD1-CG 4.16Å; L135-L139 HydrophobicContact CG-CD1 4.08Å; L135-L139 HydrophobicContact CG-CG 4.48Å; L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.26Å; L135-L139 VanDerWaalsContact O-CD1 3.26Å; L135-L139 WeakPolarHBondContact O-CD1 3.48Å; L135-L139 WeakPolarHBondContact O-CG 3.32Å; L135-L139 PolarHBondContact O-N 3.36Å
136	V	97.1	Very high	95.5	Very high	20 Å²	20	41.3 Å²	41.3	12%	0.121	22%	0.215	C	C	.	.	H	α-helix	trans	-71.9	-44.7	169.2	149.9	0	0	0	0	110.9	V81 V84 M85 A132 N133 V134 L139 L140	V81-V136 HydrophobicContact CB-CG2 4.42Å; V81-V136 HydrophobicContact CG1-CG2 4.02Å; V81-V136 HydrophobicContact CG2-CG2 4.26Å; V84-V136 HydrophobicContact CB-CG2 4.07Å; V84-V136 HydrophobicContact CG1-CG1 4.34Å; V84-V136 HydrophobicContact CG1-CG2 3.93Å; M85-V136 HydrophobicContact CE-CB 3.95Å; M85-V136 HydrophobicContact CE-CG1 3.62Å; M85-V136 HydrophobicContact CE-CG2 3.81Å; M85-V136 WeakPolarHBondContact CE-O 3.37Å; A132-V136 VanDerWaalsContact O-CB 3.24Å; A132-V136 WeakPolarHBondContact O-CB 3.4Å; A132-V136 WeakPolarHBondContact O-CG2 3.34Å; N133-V136 CarbonylContact O-C 3.59Å; N133-V136 WeakPolarHBondContact O-CA 3.45Å; N133-V136 VanDerWaalsContact O-CB 3.31Å; N133-V136 WeakPolarHBondContact O-CB 3.48Å; N133-V136 PolarHBondContact O-N 3.09Å; V134-V136 VanDerWaalsContact C-N 3.27Å; V134-V136 PolarHBondContact O-N 2.85Å; V136-L139 PolarHBondContact O-N 3.2Å; V136-L140 HydrophobicContact CG1-CD1 4.05Å; V136-L140 VanDerWaalsContact O-CG 3.24Å; V136-L140 WeakPolarHBondContact O-CG 3.27Å; V136-L140 PolarHBondContact O-N 3.03Å
137	E	96.9	Very high	95.6	Very high	105 Å²	105	41.5 Å²	41.5	49%	0.491	22%	0.217	S	C	.	.	H	α-helix	trans	-66.8	-50.7	-179.3	-76.5	143.2	-169.3	0	0	110.7	N133 V134 L139 L140 D141	N133-E137 PolarHBondContact O-N 3.15Å; V134-E137 PolarHBondContact O-N 2.62Å; E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.07Å; E137-L140 WeakPolarHBondContact O-CA 3.4Å; E137-L140 WeakPolarHBondContact O-CB 3.41Å; E137-L140 PolarHBondContact O-N 2.93Å; E137-D141 PolarHBondContact O-N 3.24Å
138	F	97.7	Very high	96	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-53.5	-42.6	173.4	-179.1	-97.7	0	0	0	113.5	V117 I124 F126 V134 L135 L140 L142 P192 Y193	V117-F138 HydrophobicContact CG2-CE1 4.01Å; I124-F138 HydrophobicContact CG2-CZ 3.97Å; F126-F138 HydrophobicContact CB-CD1 4.2Å; F126-F138 HydrophobicContact CB-CE1 3.64Å; F126-F138 HydrophobicContact CB-CZ 3.83Å; F126-F138 HydrophobicContact CD2-CB 4.14Å; F126-F138 AromaticContact CD2-CD1 3.59Å; F126-F138 HydrophobicContact CD2-CD1 3.59Å; F126-F138 AromaticContact CD2-CD2 3.6Å; F126-F138 HydrophobicContact CD2-CD2 3.6Å; F126-F138 AromaticContact CD2-CE1 3.77Å; F126-F138 HydrophobicContact CD2-CE1 3.77Å; F126-F138 AromaticContact CD2-CE2 3.78Å; F126-F138 HydrophobicContact CD2-CE2 3.78Å; F126-F138 AromaticContact CD2-CG 3.5Å; F126-F138 HydrophobicContact CD2-CG 3.5Å; F126-F138 VanDerWaalsContact CD2-CG 3.5Å; F126-F138 AromaticContact CD2-CZ 3.85Å; F126-F138 HydrophobicContact CD2-CZ 3.85Å; F126-F138 HydrophobicContact CE2-CB 4.06Å; F126-F138 HydrophobicContact CE2-CD1 4.35Å; F126-F138 HydrophobicContact CE2-CD2 4.07Å; F126-F138 AromaticContact CE2-CG 3.91Å; F126-F138 HydrophobicContact CE2-CG 3.91Å; F126-F138 HydrophobicContact CG-CD1 4.18Å; F126-F138 HydrophobicContact CG-CE1 4.09Å; F126-F138 HydrophobicContact CG-CG 4.5Å; F126-F138 HydrophobicContact CG-CZ 4.34Å; V134-F138 VanDerWaalsContact O-CB 3.27Å; V134-F138 WeakPolarHBondContact O-CB 3.33Å; V134-F138 PolarHBondContact O-N 3.11Å; L135-F138 HydrophobicContact CD1-CD1 4.24Å; F138-L140 VanDerWaalsContact C-N 3.32Å; F138-L140 PolarHBondContact O-N 2.71Å; F138-L142 HydrophobicContact CD1-CD1 3.92Å; F138-L142 HydrophobicContact CE1-CD1 3.32Å; F138-L142 HydrophobicContact CE1-CG 4.19Å; F138-L142 HydrophobicContact CZ-CD1 3.74Å; F138-L142 HydrophobicContact CZ-CG 4.36Å; F138-L142 WeakPolarHBondContact O-CB 3.18Å; F138-L142 WeakPolarHBondContact O-CG 3.45Å; F138-L142 PolarHBondContact O-N 2.99Å; F138-P192 HydrophobicContact CD2-CG 3.36Å; F138-P192 HydrophobicContact CE2-CG 3.23Å; F138-P192 HydrophobicContact CG-CG 4.31Å; F138-P192 HydrophobicContact CZ-CG 4.09Å; F138-Y193 HydrophobicContact CD2-CE1 4.34Å; F138-Y193 AromaticContact CE2-CE1 3.81Å; F138-Y193 HydrophobicContact CE2-CE1 3.81Å; F138-Y193 AromaticContact CE2-CE2 3.93Å; F138-Y193 HydrophobicContact CE2-CE2 3.93Å; F138-Y193 AromaticContact CE2-CZ 3.45Å; F138-Y193 VanDerWaalsContact CE2-CZ 3.45Å; F138-Y193 WeakPolarHBondContact CE2-OH 3.25Å; F138-Y193 HydrophobicContact CZ-CE2 4.36Å
139	L	97.3	Very high	96.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-74.4	-18.9	176.7	-70.6	174	0	0	0	113.4	M52 V81 I90 F92 V117 L135 V136 E137 L143	M52-L139 HydrophobicContact SD-CD2 3.68Å; V81-L139 HydrophobicContact CG1-CD1 3.85Å; I90-L139 HydrophobicContact CD1-CB 4.07Å; I90-L139 HydrophobicContact CD1-CD1 4.46Å; F92-L139 HydrophobicContact CE1-CD1 3.63Å; F92-L139 HydrophobicContact CZ-CD1 3.73Å; V117-L139 HydrophobicContact CG1-CD2 3.97Å; V117-L139 HydrophobicContact CG2-CD2 3.8Å; L135-L139 HydrophobicContact CD1-CD1 4.19Å; L135-L139 HydrophobicContact CD1-CG 4.16Å; L135-L139 HydrophobicContact CG-CD1 4.08Å; L135-L139 HydrophobicContact CG-CG 4.48Å; L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.26Å; L135-L139 VanDerWaalsContact O-CD1 3.26Å; L135-L139 WeakPolarHBondContact O-CD1 3.48Å; L135-L139 WeakPolarHBondContact O-CG 3.32Å; L135-L139 PolarHBondContact O-N 3.36Å; V136-L139 PolarHBondContact O-N 3.2Å; E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.07Å; L139-L143 VanDerWaalsContact O-CG 3.3Å; L139-L143 WeakPolarHBondContact O-CG 3.27Å; L139-L143 PolarHBondContact O-N 2.81Å
140	L	96.8	Very high	96.4	Very high	59 Å²	59	44.8 Å²	44.8	31%	0.309	23%	0.232	S	C	.	.	H	α-helix	trans	-77.8	-47.5	170.7	-72.7	167.9	0	0	0	110.8	M85 V136 E137 F138 L142 L143 E144	M85-L140 HydrophobicContact CE-CD1 4.12Å; M85-L140 HydrophobicContact CE-CD2 3.93Å; M85-L140 HydrophobicContact CE-CG 3.72Å; M85-L140 HydrophobicContact SD-CD2 4.36Å; V136-L140 HydrophobicContact CG1-CD1 4.05Å; V136-L140 VanDerWaalsContact O-CG 3.24Å; V136-L140 WeakPolarHBondContact O-CG 3.27Å; V136-L140 PolarHBondContact O-N 3.03Å; E137-L140 WeakPolarHBondContact O-CA 3.4Å; E137-L140 WeakPolarHBondContact O-CB 3.41Å; E137-L140 PolarHBondContact O-N 2.93Å; F138-L140 VanDerWaalsContact C-N 3.32Å; F138-L140 PolarHBondContact O-N 2.71Å; L140-L142 VanDerWaalsContact C-N 3.28Å; L140-L142 PolarHBondContact O-N 2.68Å; L140-L143 HydrophobicContact CD2-CD1 4.47Å; L140-L143 WeakPolarHBondContact O-CA 3.32Å; L140-L143 WeakPolarHBondContact O-CB 3.47Å; L140-L143 PolarHBondContact O-N 3.36Å; L140-E144 WeakPolarHBondContact O-CG 3.33Å; L140-E144 PolarHBondContact O-N 2.99Å
141	D	96.1	Very high	96.5	Very high	61 Å²	61	49 Å²	49	33%	0.326	25%	0.251	S	S	.	.	H	α-helix	trans	-58	-40.9	173.1	-85.6	40.4	0	0	0	111.2	E137 L143 E144 P192 K195	E137-D141 PolarHBondContact O-N 3.24Å; D141-L143 PolarHBondContact O-N 2.92Å; D141-E144 WeakPolarHBondContact O-CB 3.18Å; D141-E144 PolarHBondContact O-N 2.81Å; D141-P192 HydrophobicContact CB-CB 3.54Å; D141-P192 HydrophobicContact CB-CG 4.4Å; D141-K195 IonicContact OD2-NZ 2.65Å; D141-K195 PolarHBondContact OD2-NZ 3.04Å
142	L	95.5	Very high	96.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.6	173.3	-80.3	-175.4	0	0	0	114.8	M52 V117 K119 I124 F138 L140 Q191 P192	M52-L142 HydrophobicContact CE-CB 3.79Å; M52-L142 WeakPolarHBondContact CE-O 3.42Å; V117-L142 HydrophobicContact CB-CD1 4.01Å; V117-L142 HydrophobicContact CG1-CD1 3.8Å; V117-L142 HydrophobicContact CG2-CD1 4.24Å; K119-L142 WeakPolarHBondContact CD-O 3.08Å; K119-L142 WeakPolarHBondContact CE-O 3.44Å; K119-L142 PolarHBondContact NZ-O 3.29Å; I124-L142 HydrophobicContact CB-CD1 4.43Å; I124-L142 HydrophobicContact CD1-CD2 4.37Å; I124-L142 HydrophobicContact CG1-CD2 4.23Å; I124-L142 HydrophobicContact CG2-CD1 4.47Å; F138-L142 HydrophobicContact CD1-CD1 3.92Å; F138-L142 HydrophobicContact CE1-CD1 3.32Å; F138-L142 HydrophobicContact CE1-CG 4.19Å; F138-L142 HydrophobicContact CZ-CD1 3.74Å; F138-L142 HydrophobicContact CZ-CG 4.36Å; F138-L142 WeakPolarHBondContact O-CB 3.18Å; F138-L142 WeakPolarHBondContact O-CG 3.45Å; F138-L142 PolarHBondContact O-N 2.99Å; L140-L142 VanDerWaalsContact C-N 3.28Å; L140-L142 PolarHBondContact O-N 2.68Å; L142-Q191 HydrophobicContact CD2-CB 3.83Å; L142-P192 HydrophobicContact CD2-CG 4.39Å; L142-P192 HydrophobicContact CG-CG 4.24Å
143	L	94.3	Very high	96.7	Very high	63 Å²	63	51.8 Å²	51.8	33%	0.33	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-14.1	169.4	-73.8	168.4	0	0	0	113.1	M52 K88 I90 L139 L140 D141	M52-L143 HydrophobicContact CE-CD2 3.95Å; M52-L143 HydrophobicContact CE-CG 4.14Å; K88-L143 HydrophobicContact CB-CD1 3.93Å; K88-L143 HydrophobicContact CD-CD1 3.92Å; K88-L143 HydrophobicContact CG-CD1 3.9Å; I90-L143 HydrophobicContact CD1-CD1 4.14Å; I90-L143 HydrophobicContact CD1-CG 4.45Å; L139-L143 VanDerWaalsContact O-CG 3.3Å; L139-L143 WeakPolarHBondContact O-CG 3.27Å; L139-L143 PolarHBondContact O-N 2.81Å; L140-L143 HydrophobicContact CD2-CD1 4.47Å; L140-L143 WeakPolarHBondContact O-CA 3.32Å; L140-L143 WeakPolarHBondContact O-CB 3.47Å; L140-L143 PolarHBondContact O-N 3.36Å; D141-L143 PolarHBondContact O-N 2.92Å
144	E	94.8	Very high	96.8	Very high	128 Å²	128	53.8 Å²	53.8	60%	0.598	28%	0.277	S	S	*	.	S	Bend	trans	-79.5	165.9	-179.1	-53.8	-116.6	137.8	0	0	111.4	L140 D141 Q191	L140-E144 WeakPolarHBondContact O-CG 3.33Å; L140-E144 PolarHBondContact O-N 2.99Å; D141-E144 WeakPolarHBondContact O-CB 3.18Å; D141-E144 PolarHBondContact O-N 2.81Å; E144-Q191 PolarHBondContact O-NE2 3.28Å; E144-Q191 VanDerWaalsContact O-NE2 3.09Å
145	E	95.4	Very high	96.9	Very high	128 Å²	128	57 Å²	57	60%	0.598	29%	0.291	S	S	*	.			trans	-67.6	140.2	175.2	-73.7	-75.5	165.8	0	0	109.7	V147 K184	E145-V147 PolarHBondContact O-N 3.34Å; E145-K184 WeakPolarHBondContact OE2-CE 3.41Å; E145-K184 IonicContact OE2-NZ 3.83Å; E145-K184 PolarHBondContact OE2-NZ 3.43Å
146	P	96.1	Very high	96.9	Very high	12 Å²	12	57.2 Å²	57.2	8%	0.078	29%	0.292	C	S	.	.	S	Bend	trans	-67.7	-6.4	-177.4	29.9	-38.8	0	0	0	114.4	K184 A187 E188 Q191 F196	P146-K184 HydrophobicContact CG-CD 4.18Å; P146-K184 HydrophobicContact CG-CG 3.66Å; P146-A187 HydrophobicContact CB-CB 4.02Å; P146-A187 VanDerWaalsContact O-CB 3.26Å; P146-A187 WeakPolarHBondContact O-CB 3.37Å; P146-E188 HydrophobicContact CB-CG 3.76Å; P146-E188 HydrophobicContact CG-CG 3.65Å; P146-Q191 HydrophobicContact CB-CG 3.71Å; P146-F196 WeakPolarHBondContact O-CB 3.46Å
147	V	98.4	Very high	96.9	Very high	8 Å²	8	62 Å²	62	5%	0.048	31%	0.311	C	S	.	.	S	Bend	trans	-141.3	119.9	178.3	-176.8	0	0	0	0	110	E145 Y180 F183 K184 A187 F196 A198	E145-V147 PolarHBondContact O-N 3.34Å; V147-Y180 HydrophobicContact CG1-CE2 3.98Å; V147-F183 HydrophobicContact CG1-CD1 4.18Å; V147-F183 HydrophobicContact CG1-CE1 3.79Å; V147-F183 HydrophobicContact CG2-CD1 4.05Å; V147-F183 HydrophobicContact CG2-CE1 4.13Å; V147-K184 HydrophobicContact CG2-CB 4.24Å; V147-K184 HydrophobicContact CG2-CG 4.1Å; V147-A187 HydrophobicContact CG2-CB 3.66Å; V147-F196 WeakPolarHBondContact CA-O 3.34Å; V147-F196 HydrophobicContact CG2-CB 4.15Å; V147-A198 HydrophobicContact CG1-CB 3.65Å
148	E	98.1	Very high	96.9	Very high	103 Å²	103	59.4 Å²	59.4	48%	0.481	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	148.2	172	-74.3	-171.7	-110.8	0	0	111.9	F196 F197 A198	E148-F196 PolarHBondContact N-O 2.92Å; E148-F197 HydrophobicContact CB-CD1 3.62Å; E148-F197 HydrophobicContact CB-CE1 3.77Å; E148-F197 HydrophobicContact CG-CE1 4.23Å; E148-F197 CarbonylContact O-C 3.54Å; E148-F197 WeakPolarHBondContact O-CA 3.46Å; E148-F197 WeakPolarHBondContact OE1-CE1 3.18Å; E148-A198 PolarHBondContact O-N 3.43Å
149	V	98.4	Very high	96.8	Very high	56 Å²	56	59.5 Å²	59.5	34%	0.339	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	112.1	-178.9	-177.9	0	0	0	0	111.2	E151 A198 F200	V149-E151 HydrophobicContact CG1-CG 4.3Å; V149-E151 PolarHBondContact O-N 2.76Å; V149-A198 CarbonylContact C-O 3.58Å; V149-A198 WeakPolarHBondContact CA-O 3.32Å; V149-F200 HydrophobicContact CG1-CD2 4.02Å; V149-F200 HydrophobicContact CG1-CE2 3.82Å; V149-F200 HydrophobicContact CG2-CE2 4.08Å
150	I	98.6	Very high	96.7	Very high	4 Å²	4	63.6 Å²	63.6	2%	0.021	33%	0.33	C	S	.	.			trans	-82.7	100.6	174.7	-52.6	178.5	0	0	0	108.8	E155 L156 F159 V169 F197 A198 T199 V204	I150-E155 HydrophobicContact CB-CB 4.47Å; I150-E155 HydrophobicContact CG2-CB 3.85Å; I150-L156 HydrophobicContact CG2-CB 4.03Å; I150-F159 HydrophobicContact CD1-CB 3.81Å; I150-F159 HydrophobicContact CD1-CD2 3.94Å; I150-F159 HydrophobicContact CD1-CG 3.87Å; I150-V169 HydrophobicContact CD1-CG2 4.48Å; I150-F197 HydrophobicContact CD1-CB 3.95Å; I150-F197 HydrophobicContact CD1-CD1 3.94Å; I150-F197 HydrophobicContact CD1-CG 4.16Å; I150-F197 HydrophobicContact CG1-CB 4.32Å; I150-F197 HydrophobicContact CG1-CD1 3.96Å; I150-A198 PolarHBondContact N-O 2.85Å; I150-T199 WeakPolarHBondContact O-CB 3.41Å; I150-T199 PolarHBondContact O-OG1 2.91Å; I150-V204 HydrophobicContact CB-CG1 4.16Å; I150-V204 HydrophobicContact CG2-CG1 3.56Å; I150-V204 HydrophobicContact CG2-CG2 4.23Å
151	E	97.5	Very high	96.6	Very high	136 Å²	136	70.4 Å²	70.4	64%	0.636	35%	0.352	S	S	*	.			trans	-84.4	-33.4	176.5	-63.8	-160.3	139	0	0	112.2	V149 E155	V149-E151 HydrophobicContact CG1-CG 4.3Å; V149-E151 PolarHBondContact O-N 2.76Å; E151-E155 WeakPolarHBondContact CA-OE2 3.33Å; E151-E155 PolarHBondContact N-OE2 3.19Å
152	N	97.1	Very high	96.6	Very high	59 Å²	59	70 Å²	70	32%	0.316	35%	0.348	S	S	.	.	S	Bend	trans	-146.8	172.4	-169.7	73.6	77.6	0	0	0	116.2	L154 E155 L156	N152-L154 PolarHBondContact O-N 2.79Å; N152-L154 VanDerWaalsContact O-N 3.1Å; N152-L154 WeakPolarHBondContact OD1-CB 3.34Å; N152-L154 PolarHBondContact OD1-N 3.17Å; N152-E155 VanDerWaalsContact CG-OE2 3.31Å; N152-E155 PolarHBondContact N-OE2 3.1Å; N152-E155 PolarHBondContact ND2-OE1 3.43Å; N152-E155 PolarHBondContact ND2-OE2 3.23Å; N152-E155 PolarHBondContact O-N 2.93Å; N152-L156 PolarHBondContact O-N 2.92Å
153	A	96.4	Very high	96.6	Very high	43 Å²	43	73 Å²	73	36%	0.355	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	15.6	-174.5	0	0	0	0	0	115.3	K157	A153-K157 WeakPolarHBondContact O-CD 3.26Å; A153-K157 WeakPolarHBondContact O-CG 3.49Å
154	L	96.9	Very high	96.7	Very high	134 Å²	134	72.8 Å²	72.8	70%	0.702	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-42.7	161.9	-62.4	177.5	0	0	0	110.8	N152 L156 K157 A158	N152-L154 PolarHBondContact O-N 2.79Å; N152-L154 VanDerWaalsContact O-N 3.1Å; N152-L154 WeakPolarHBondContact OD1-CB 3.34Å; N152-L154 PolarHBondContact OD1-N 3.17Å; L154-L156 VanDerWaalsContact C-N 3.32Å; L154-K157 PolarHBondContact O-N 3.37Å; L154-K157 VanDerWaalsContact O-N 3.12Å; L154-A158 PolarHBondContact O-N 3.39Å
155	E	98.1	Very high	96.7	Very high	77 Å²	77	67.8 Å²	67.8	36%	0.36	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-40.7	169.3	-71.1	109.2	-135	0	0	111.4	I150 E151 N152 K157 A158 F159	I150-E155 HydrophobicContact CB-CB 4.47Å; I150-E155 HydrophobicContact CG2-CB 3.85Å; E151-E155 WeakPolarHBondContact CA-OE2 3.33Å; E151-E155 PolarHBondContact N-OE2 3.19Å; N152-E155 VanDerWaalsContact CG-OE2 3.31Å; N152-E155 PolarHBondContact N-OE2 3.1Å; N152-E155 PolarHBondContact ND2-OE1 3.43Å; N152-E155 PolarHBondContact ND2-OE2 3.23Å; N152-E155 PolarHBondContact O-N 2.93Å; E155-K157 PolarHBondContact O-N 2.85Å; E155-K157 VanDerWaalsContact O-N 3.15Å; E155-A158 WeakPolarHBondContact O-CA 3.09Å; E155-A158 WeakPolarHBondContact O-CB 3.3Å; E155-A158 PolarHBondContact O-N 2.66Å; E155-F159 PolarHBondContact O-N 3.12Å
156	L	97.2	Very high	96.8	Very high	6 Å²	6	62.8 Å²	62.8	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-56.1	-34.1	174.6	-178.3	59.4	0	0	0	111.5	I150 N152 L154 A158 F159 D160 V204 E207 L208	I150-L156 HydrophobicContact CG2-CB 4.03Å; N152-L156 PolarHBondContact O-N 2.92Å; L154-L156 VanDerWaalsContact C-N 3.32Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 2.96Å; L156-F159 HydrophobicContact CD1-CD1 4.02Å; L156-F159 WeakPolarHBondContact O-CB 3.27Å; L156-F159 PolarHBondContact O-N 2.81Å; L156-D160 WeakPolarHBondContact O-CB 3.21Å; L156-D160 PolarHBondContact O-N 3.08Å; L156-V204 HydrophobicContact CD1-CG1 4.37Å; L156-V204 HydrophobicContact CD2-CG1 4.44Å; L156-E207 HydrophobicContact CD2-CB 3.75Å; L156-E207 HydrophobicContact CD2-CG 3.79Å; L156-L208 HydrophobicContact CD1-CD1 4.1Å; L156-L208 HydrophobicContact CD1-CD2 3.67Å; L156-L208 HydrophobicContact CD1-CG 3.78Å
157	K	96.8	Very high	96.9	Very high	119 Å²	119	62.6 Å²	62.6	52%	0.517	31%	0.312	S	S	.	.	H	α-helix	trans	-82.5	-5.8	177.2	-64.9	-176	-179.9	-164.8	0	114.6	A153 L154 E155 R161	A153-K157 WeakPolarHBondContact O-CD 3.26Å; A153-K157 WeakPolarHBondContact O-CG 3.49Å; L154-K157 PolarHBondContact O-N 3.37Å; L154-K157 VanDerWaalsContact O-N 3.12Å; E155-K157 PolarHBondContact O-N 2.85Å; E155-K157 VanDerWaalsContact O-N 3.15Å; K157-R161 WeakPolarHBondContact O-CD 3.37Å; K157-R161 VanDerWaalsContact O-CG 3.23Å; K157-R161 WeakPolarHBondContact O-CG 3.41Å; K157-R161 PolarHBondContact O-NE 3.5Å
158	A	97.1	Very high	96.9	Very high	51 Å²	51	62.2 Å²	62.2	42%	0.421	31%	0.31	S	S	.	.	H	α-helix	trans	-84	-50.1	163.4	0	0	0	0	0	108.6	L154 E155 L156 D160 R161 M162	L154-A158 PolarHBondContact O-N 3.39Å; E155-A158 WeakPolarHBondContact O-CA 3.09Å; E155-A158 WeakPolarHBondContact O-CB 3.3Å; E155-A158 PolarHBondContact O-N 2.66Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 2.96Å; A158-D160 VanDerWaalsContact C-N 3.32Å; A158-D160 PolarHBondContact O-N 3.03Å; A158-R161 WeakPolarHBondContact O-CB 3.31Å; A158-R161 PolarHBondContact O-N 3.09Å; A158-M162 PolarHBondContact O-N 2.83Å
159	F	96.6	Very high	97	Very high	3 Å²	3	57.3 Å²	57.3	1%	0.013	29%	0.287	C	S	.	.	H	α-helix	trans	-50.6	-46.9	171.9	170.7	-88.6	0	0	0	113.1	I150 E155 L156 R161 M162 R167 V169 F197 L208 Y218	I150-F159 HydrophobicContact CD1-CB 3.81Å; I150-F159 HydrophobicContact CD1-CD2 3.94Å; I150-F159 HydrophobicContact CD1-CG 3.87Å; E155-F159 PolarHBondContact O-N 3.12Å; L156-F159 HydrophobicContact CD1-CD1 4.02Å; L156-F159 WeakPolarHBondContact O-CB 3.27Å; L156-F159 PolarHBondContact O-N 2.81Å; F159-R161 PolarHBondContact O-N 3.16Å; F159-R161 VanDerWaalsContact O-N 3.15Å; F159-M162 PolarHBondContact O-N 2.73Å; F159-R167 HydrophobicContact CE2-CB 3.84Å; F159-R167 HydrophobicContact CE2-CG 4.39Å; F159-R167 HydrophobicContact CZ-CB 4.3Å; F159-R167 PolarHBondContact O-NH1 3.27Å; F159-V169 HydrophobicContact CE1-CG1 4.45Å; F159-V169 HydrophobicContact CE2-CB 3.87Å; F159-V169 HydrophobicContact CE2-CG1 4.14Å; F159-V169 HydrophobicContact CE2-CG2 4.47Å; F159-V169 HydrophobicContact CZ-CB 3.91Å; F159-V169 HydrophobicContact CZ-CG1 3.65Å; F159-F197 HydrophobicContact CD2-CB 4.22Å; F159-F197 HydrophobicContact CD2-CD1 4.06Å; F159-F197 AromaticContact CD2-CD2 3.45Å; F159-F197 HydrophobicContact CD2-CD2 3.45Å; F159-F197 VanDerWaalsContact CD2-CD2 3.45Å; F159-F197 HydrophobicContact CD2-CE1 4.32Å; F159-F197 AromaticContact CD2-CE2 3.74Å; F159-F197 HydrophobicContact CD2-CE2 3.74Å; F159-F197 AromaticContact CD2-CG 3.63Å; F159-F197 HydrophobicContact CD2-CG 3.63Å; F159-F197 HydrophobicContact CD2-CZ 4.18Å; F159-F197 HydrophobicContact CE2-CB 4.3Å; F159-F197 AromaticContact CE2-CD2 3.61Å; F159-F197 HydrophobicContact CE2-CD2 3.61Å; F159-F197 HydrophobicContact CE2-CE2 4.15Å; F159-F197 HydrophobicContact CE2-CG 4.01Å; F159-L208 HydrophobicContact CD1-CD2 4.35Å; F159-L208 HydrophobicContact CE1-CD2 3.83Å; F159-Y218 HydrophobicContact CE1-CD2 4.45Å; F159-Y218 HydrophobicContact CE1-CE2 4.09Å; F159-Y218 AromaticContact CZ-CD2 3.79Å; F159-Y218 HydrophobicContact CZ-CD2 3.79Å; F159-Y218 AromaticContact CZ-CE2 3.74Å; F159-Y218 HydrophobicContact CZ-CE2 3.74Å; F159-Y218 HydrophobicContact CZ-CG 4.43Å
160	D	94.8	Very high	97	Very high	85 Å²	85	54.6 Å²	54.6	46%	0.455	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.7	179	-65.4	-26.8	0	0	0	112.5	L156 A158	L156-D160 WeakPolarHBondContact O-CB 3.21Å; L156-D160 PolarHBondContact O-N 3.08Å; A158-D160 VanDerWaalsContact C-N 3.32Å; A158-D160 PolarHBondContact O-N 3.03Å
161	R	95.4	Very high	97	Very high	203 Å²	203	56.1 Å²	56.1	77%	0.766	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-17.5	-173.7	-70.3	170.2	169.5	-131.5	-18.9	115	K157 A158 F159 E163	K157-R161 WeakPolarHBondContact O-CD 3.37Å; K157-R161 VanDerWaalsContact O-CG 3.23Å; K157-R161 WeakPolarHBondContact O-CG 3.41Å; K157-R161 PolarHBondContact O-NE 3.5Å; A158-R161 WeakPolarHBondContact O-CB 3.31Å; A158-R161 PolarHBondContact O-N 3.09Å; F159-R161 PolarHBondContact O-N 3.16Å; F159-R161 VanDerWaalsContact O-N 3.15Å; R161-E163 PolarHBondContact O-N 3.45Å
162	M	95.6	Very high	97	Very high	51 Å²	51	49.8 Å²	49.8	25%	0.251	25%	0.247	S	C	.	.			trans	-78.7	53.6	-178	-68.9	167.9	71.6	0	0	109.3	A158 F159 E164 D165 R167 K195 F197	A158-M162 PolarHBondContact O-N 2.83Å; F159-M162 PolarHBondContact O-N 2.73Å; M162-E164 VanDerWaalsContact C-N 3.26Å; M162-E164 PolarHBondContact O-N 2.79Å; M162-D165 HydrophobicContact CB-CB 4.43Å; M162-D165 VanDerWaalsContact CE-OD2 3.26Å; M162-D165 WeakPolarHBondContact CE-OD2 3.47Å; M162-D165 PolarHBondContact O-N 2.87Å; M162-R167 WeakPolarHBondContact O-CD 3.33Å; M162-R167 PolarHBondContact O-NE 3.47Å; M162-R167 PolarHBondContact O-NH1 3.46Å; M162-K195 HydrophobicContact CE-CB 4.23Å; M162-K195 HydrophobicContact CE-CG 3.87Å; M162-F197 HydrophobicContact CE-CZ 4.08Å; M162-F197 HydrophobicContact SD-CZ 3.96Å
163	E	95.2	Very high	97	Very high	65 Å²	65	53.9 Å²	53.9	30%	0.304	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-18.4	-171.2	66.6	175.8	-131	0	0	113.7	R161 P220 F221 K290	R161-E163 PolarHBondContact O-N 3.45Å; E163-P220 CarbonylContact O-C 3.52Å; E163-P220 VanDerWaalsContact O-CA 3.25Å; E163-P220 WeakPolarHBondContact O-CA 3.38Å; E163-F221 HydrophobicContact CG-CD1 4.2Å; E163-F221 HydrophobicContact CG-CE1 4.39Å; E163-F221 PolarHBondContact O-N 3.29Å; E163-K290 WeakPolarHBondContact OE1-CE 3.01Å; E163-K290 IonicContact OE1-NZ 3.48Å; E163-K290 PolarHBondContact OE1-NZ 3.46Å
164	E	95.6	Very high	97.1	Very high	57 Å²	57	53 Å²	53	27%	0.266	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-23.7	173.5	-42.1	-166.7	134.9	0	0	112.7	M162 P220 F221 K252 W306	M162-E164 VanDerWaalsContact C-N 3.26Å; M162-E164 PolarHBondContact O-N 2.79Å; E164-P220 WeakPolarHBondContact O-CG 3.49Å; E164-F221 HydrophobicContact CB-CE1 4.37Å; E164-F221 HydrophobicContact CB-CZ 4.1Å; E164-F221 HydrophobicContact CG-CE1 4Å; E164-F221 HydrophobicContact CG-CZ 4.09Å; E164-K252 VanDerWaalsContact CD-CD 3.45Å; E164-K252 HydrophobicContact CG-CD 4.49Å; E164-K252 WeakPolarHBondContact OE1-CD 3.11Å; E164-K252 IonicContact OE1-NZ 2.73Å; E164-K252 PolarHBondContact OE1-NZ 3.44Å; E164-K252 VanDerWaalsContact OE2-CD 3.29Å; E164-K252 WeakPolarHBondContact OE2-CD 3.29Å; E164-K252 IonicContact OE2-NZ 2.77Å; E164-K252 PolarHBondContact OE2-NZ 3.42Å; E164-W306 VanDerWaalsContact OE1-CH2 3.28Å; E164-W306 WeakPolarHBondContact OE1-CH2 3.4Å; E164-W306 WeakPolarHBondContact OE1-CZ3 3.37Å
165	D	96.1	Very high	97	Very high	24 Å²	24	52.9 Å²	52.9	13%	0.128	25%	0.249	C	C	.	.	S	Bend	trans	-88.8	141.4	-174.9	-71.8	-58.1	0	0	0	112.8	M162 R167 K195 R254	M162-D165 HydrophobicContact CB-CB 4.43Å; M162-D165 VanDerWaalsContact CE-OD2 3.26Å; M162-D165 WeakPolarHBondContact CE-OD2 3.47Å; M162-D165 PolarHBondContact O-N 2.87Å; D165-R167 HydrophobicContact CB-CG 4.02Å; D165-R167 PolarHBondContact O-N 2.93Å; D165-R167 PolarHBondContact O-NE 2.68Å; D165-K195 HydrophobicContact CB-CG 4.22Å; D165-R254 IonicContact OD1-NH1 2.92Å; D165-R254 PolarHBondContact OD1-NH1 2.85Å
166	I	97.9	Very high	96.9	Very high	22 Å²	22	56.9 Å²	56.9	11%	0.113	27%	0.273	C	S	.	.			trans	-66.2	117.8	159.1	-54.4	168.6	0	0	0	107.4	I168 I194 K195 F217 P220 R246 P248	I166-I168 HydrophobicContact CG2-CD1 4.35Å; I166-I194 HydrophobicContact CB-CG1 4.29Å; I166-I194 HydrophobicContact CB-CG2 4.13Å; I166-I194 HydrophobicContact CD1-CD1 4.25Å; I166-I194 HydrophobicContact CD1-CG1 4.29Å; I166-I194 HydrophobicContact CG2-CD1 4.33Å; I166-I194 HydrophobicContact CG2-CG1 4.43Å; I166-I194 HydrophobicContact CG2-CG2 3.83Å; I166-I194 WeakPolarHBondContact O-CG2 3.47Å; I166-K195 PolarHBondContact O-N 3.13Å; I166-K195 VanDerWaalsContact O-N 3.13Å; I166-F217 HydrophobicContact CG2-CD2 4.5Å; I166-F217 HydrophobicContact CG2-CE1 4.39Å; I166-F217 HydrophobicContact CG2-CE2 3.67Å; I166-F217 HydrophobicContact CG2-CZ 3.6Å; I166-P220 HydrophobicContact CG1-CG 3.82Å; I166-R246 WeakPolarHBondContact CD1-O 3.32Å; I166-P248 HydrophobicContact CD1-CG 4.3Å; I166-P248 HydrophobicContact CG1-CG 4.32Å
167	R	97.9	Very high	96.9	Very high	8 Å²	8	57.2 Å²	57.2	3%	0.03	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.2	-176.5	-63.9	158.9	-71.9	172.2	-1.2	111.2	F159 M162 D165 K195 F197 Y218	F159-R167 HydrophobicContact CE2-CB 3.84Å; F159-R167 HydrophobicContact CE2-CG 4.39Å; F159-R167 HydrophobicContact CZ-CB 4.3Å; F159-R167 PolarHBondContact O-NH1 3.27Å; M162-R167 WeakPolarHBondContact O-CD 3.33Å; M162-R167 PolarHBondContact O-NE 3.47Å; M162-R167 PolarHBondContact O-NH1 3.46Å; D165-R167 HydrophobicContact CB-CG 4.02Å; D165-R167 PolarHBondContact O-N 2.93Å; D165-R167 PolarHBondContact O-NE 2.68Å; R167-K195 WeakPolarHBondContact CA-O 3.41Å; R167-F197 HydrophobicContact CB-CE2 4.46Å; R167-F197 HydrophobicContact CG-CE2 4.2Å; R167-Y218 PolarHBondContact N-O 3.35Å; R167-Y218 PolarHBondContact O-N 3.36Å
168	I	98.5	Very high	96.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.9	176	-43.8	-61.3	0	0	0	108.5	I166 F183 I194 K195 F196 F197 V215 F217 I242	I166-I168 HydrophobicContact CG2-CD1 4.35Å; I168-F183 HydrophobicContact CB-CZ 4.47Å; I168-F183 HydrophobicContact CG2-CE2 3.66Å; I168-F183 HydrophobicContact CG2-CZ 3.96Å; I168-I194 HydrophobicContact CD1-CG2 4.17Å; I168-I194 HydrophobicContact CG1-CG2 3.74Å; I168-K195 PolarHBondContact N-O 2.77Å; I168-F196 HydrophobicContact CB-CD1 3.88Å; I168-F196 HydrophobicContact CB-CD2 4.27Å; I168-F196 HydrophobicContact CB-CE1 4.08Å; I168-F196 HydrophobicContact CB-CE2 4.44Å; I168-F196 HydrophobicContact CB-CG 4Å; I168-F196 HydrophobicContact CB-CZ 4.37Å; I168-F196 HydrophobicContact CG1-CD1 4.22Å; I168-F196 HydrophobicContact CG1-CD2 3.93Å; I168-F196 HydrophobicContact CG1-CE1 4.07Å; I168-F196 HydrophobicContact CG1-CE2 3.74Å; I168-F196 HydrophobicContact CG1-CG 4.17Å; I168-F196 HydrophobicContact CG1-CZ 3.85Å; I168-F196 HydrophobicContact CG2-CD1 4.09Å; I168-F196 HydrophobicContact CG2-CE1 4.05Å; I168-F197 PolarHBondContact O-N 2.61Å; I168-V215 HydrophobicContact CG2-CG1 3.58Å; I168-F217 HydrophobicContact CD1-CB 4.3Å; I168-F217 HydrophobicContact CD1-CD2 3.27Å; I168-F217 HydrophobicContact CD1-CE2 3.83Å; I168-F217 HydrophobicContact CD1-CG 4.03Å; I168-I242 HydrophobicContact CD1-CD1 3.83Å; I168-I242 HydrophobicContact CD1-CG1 3.94Å; I168-I242 HydrophobicContact CG1-CD1 3.88Å; I168-I242 HydrophobicContact CG2-CD1 4.32Å
169	V	98.6	Very high	96.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	128.2	178	64.4	0	0	0	0	113.9	I150 F159 F197 L208 L210 V215 D216 Y218	I150-V169 HydrophobicContact CD1-CG2 4.48Å; F159-V169 HydrophobicContact CE1-CG1 4.45Å; F159-V169 HydrophobicContact CE2-CB 3.87Å; F159-V169 HydrophobicContact CE2-CG1 4.14Å; F159-V169 HydrophobicContact CE2-CG2 4.47Å; F159-V169 HydrophobicContact CZ-CB 3.91Å; F159-V169 HydrophobicContact CZ-CG1 3.65Å; V169-F197 VanDerWaalsContact CA-O 3.32Å; V169-F197 WeakPolarHBondContact CA-O 3.35Å; V169-F197 HydrophobicContact CB-CB 4.16Å; V169-F197 HydrophobicContact CG2-CB 3.99Å; V169-L208 HydrophobicContact CG1-CD1 4.28Å; V169-L208 HydrophobicContact CG1-CD2 4.42Å; V169-L208 HydrophobicContact CG2-CD1 3.65Å; V169-L210 HydrophobicContact CG1-CD1 4.27Å; V169-L210 HydrophobicContact CG2-CD1 4.19Å; V169-V215 WeakPolarHBondContact O-CA 3.46Å; V169-D216 HydrophobicContact CG1-CB 4.28Å; V169-D216 PolarHBondContact N-O 2.85Å; V169-D216 PolarHBondContact O-N 3.32Å; V169-Y218 HydrophobicContact CG1-CD2 4.12Å; V169-Y218 HydrophobicContact CG1-CE2 3.64Å
170	G	98.4	Very high	97	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.8	-178.6	0	0	0	0	0	114.7	F172 F197 A198 T199	G170-F172 WeakPolarHBondContact O-CD2 3.41Å; G170-F197 PolarHBondContact N-O 3.21Å; G170-A198 WeakPolarHBondContact O-CA 3.49Å; G170-T199 PolarHBondContact O-N 3.43Å
171	Y	98.6	Very high	97.1	Very high	35 Å²	35	61.2 Å²	61.2	14%	0.137	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	108.7	172.3	174.6	-143.4	0	0	0	111.6	T199 A205 L212 N213 E214	Y171-T199 HydrophobicContact CD2-CG2 4.02Å; Y171-T199 WeakPolarHBondContact CD2-O 3.26Å; Y171-A205 HydrophobicContact CD1-CB 3.41Å; Y171-A205 VanDerWaalsContact CD1-CB 3.41Å; Y171-A205 HydrophobicContact CD2-CB 3.56Å; Y171-A205 HydrophobicContact CE1-CB 3.85Å; Y171-A205 HydrophobicContact CE2-CB 4Å; Y171-A205 HydrophobicContact CG-CB 3.28Å; Y171-L212 HydrophobicContact CD1-CB 4.4Å; Y171-L212 HydrophobicContact CE1-CB 4.21Å; Y171-L212 HydrophobicContact CE1-CD1 4.28Å; Y171-N213 PolarHBondContact O-N 3.46Å; Y171-E214 PolarHBondContact N-O 2.79Å; Y171-E214 VanDerWaalsContact N-O 3.13Å
172	F	98.5	Very high	97.3	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.018	25%	0.252	C	S	.	.			trans	-112.4	173.2	-177.5	-58	-74	0	0	0	112.6	G170 H179 Y180 F183 A198 T199 F200 V215	G170-F172 WeakPolarHBondContact O-CD2 3.41Å; F172-H179 HydrophobicContact CD1-CB 4Å; F172-H179 HydrophobicContact CE1-CB 4.04Å; F172-H179 WeakPolarHBondContact CE1-O 3.45Å; F172-Y180 AromaticContact CD2-CD2 3.72Å; F172-Y180 HydrophobicContact CD2-CD2 3.72Å; F172-Y180 HydrophobicContact CD2-CG 4.49Å; F172-Y180 HydrophobicContact CE2-CD2 4.17Å; F172-Y180 HydrophobicContact CG-CD2 4.21Å; F172-F183 HydrophobicContact CE1-CB 4.24Å; F172-F183 HydrophobicContact CE2-CB 3.99Å; F172-F183 AromaticContact CE2-CD1 3.62Å; F172-F183 HydrophobicContact CE2-CD1 3.62Å; F172-F183 HydrophobicContact CE2-CD2 4.06Å; F172-F183 HydrophobicContact CE2-CE1 4.03Å; F172-F183 HydrophobicContact CE2-CE2 4.43Å; F172-F183 AromaticContact CE2-CG 3.64Å; F172-F183 HydrophobicContact CE2-CG 3.64Å; F172-F183 HydrophobicContact CE2-CZ 4.41Å; F172-F183 HydrophobicContact CZ-CB 3.52Å; F172-F183 AromaticContact CZ-CD1 3.97Å; F172-F183 HydrophobicContact CZ-CD1 3.97Å; F172-F183 AromaticContact CZ-CD2 3.67Å; F172-F183 HydrophobicContact CZ-CD2 3.67Å; F172-F183 HydrophobicContact CZ-CE2 4.32Å; F172-F183 AromaticContact CZ-CG 3.46Å; F172-F183 HydrophobicContact CZ-CG 3.46Å; F172-F183 VanDerWaalsContact CZ-CG 3.46Å; F172-A198 HydrophobicContact CD2-CB 4.06Å; F172-A198 HydrophobicContact CE2-CB 4.31Å; F172-T199 PolarHBondContact N-O 3.06Å; F172-F200 HydrophobicContact CB-CD1 3.95Å; F172-F200 HydrophobicContact CB-CE1 3.9Å; F172-V215 HydrophobicContact CZ-CG2 3.99Å
173	K	97.5	Very high	97.4	Very high	144 Å²	144	49.7 Å²	49.7	63%	0.626	24%	0.24	S	C	*	.	S	Bend	trans	-81.7	-33.9	-177.1	-179.7	177.1	151.3	-75.6	0	113	L212	K173-L212 HydrophobicContact CB-CD1 4.13Å
174	S	97.1	Very high	97.5	Very high	25 Å²	25	48.8 Å²	48.8	18%	0.175	24%	0.235	C	C	.	.			trans	175.8	160	-170.9	48.5	0	0	0	0	108.4	D176 S177 F200	S174-D176 PolarHBondContact O-N 2.82Å; S174-S177 VanDerWaalsContact O-CB 3.32Å; S174-S177 WeakPolarHBondContact O-CB 3.49Å; S174-S177 PolarHBondContact O-N 3.25Å; S174-S177 PolarHBondContact O-OG 2.9Å; S174-F200 VanDerWaalsContact C-CE1 3.41Å
175	E	96.1	Very high	97.6	Very high	131 Å²	131	50.6 Å²	50.6	61%	0.612	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-44.9	167.4	-64.7	160	-150.2	0	0	112	S177 Y180 F200	E175-S177 PolarHBondContact O-N 3.04Å; E175-Y180 HydrophobicContact CB-CD1 4.5Å; E175-Y180 HydrophobicContact CB-CE1 4.39Å; E175-Y180 HydrophobicContact CG-CE1 4.39Å; E175-Y180 WeakPolarHBondContact O-CD1 3.14Å; E175-F200 HydrophobicContact CB-CZ 4.42Å; E175-F200 HydrophobicContact CG-CE2 3.62Å; E175-F200 HydrophobicContact CG-CZ 3.65Å
176	D	95.7	Very high	97.7	Very high	162 Å²	162	49.5 Å²	49.5	87%	0.866	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	20.4	176.8	-62.8	-54.7	0	0	0	115.5	S174	S174-D176 PolarHBondContact O-N 2.82Å
177	S	96.6	Very high	97.7	Very high	13 Å²	13	48.5 Å²	48.5	9%	0.091	23%	0.232	C	C	.	.			trans	-109.7	130.3	-176.1	72.2	0	0	0	0	113.4	S174 E175 H179 Y180 E181	S174-S177 VanDerWaalsContact O-CB 3.32Å; S174-S177 WeakPolarHBondContact O-CB 3.49Å; S174-S177 PolarHBondContact O-N 3.25Å; S174-S177 PolarHBondContact O-OG 2.9Å; E175-S177 PolarHBondContact O-N 3.04Å; S177-H179 PolarHBondContact O-N 3.31Å; S177-Y180 WeakPolarHBondContact O-CA 3.48Å; S177-Y180 WeakPolarHBondContact O-CB 3.46Å; S177-Y180 PolarHBondContact O-N 2.81Å; S177-Y180 WeakPolarHBondContact OG-CB 3.42Å; S177-E181 PolarHBondContact O-N 2.96Å
178	E	97.1	Very high	97.6	Very high	162 Å²	162	51 Å²	51	76%	0.757	25%	0.245	S	C	*	.	H	α-helix	trans	-51.3	-25.3	178.7	-173.4	176.8	178.4	0	0	113.9	A182	E178-A182 WeakPolarHBondContact O-CB 3.33Å; E178-A182 PolarHBondContact O-N 2.99Å
179	H	97.3	Very high	97.4	Very high	52 Å²	52	56.1 Å²	56.1	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-87.7	-24.8	177.2	-48.7	-46.2	0	0	0	113.6	F172 S177 F183 N213 P232	F172-H179 HydrophobicContact CD1-CB 4Å; F172-H179 HydrophobicContact CE1-CB 4.04Å; F172-H179 WeakPolarHBondContact CE1-O 3.45Å; S177-H179 PolarHBondContact O-N 3.31Å; H179-F183 WeakPolarHBondContact O-CB 3.44Å; H179-F183 PolarHBondContact O-N 3.1Å; H179-N213 PolarHBondContact CD2-ND2 2.84Å; H179-N213 PolarHBondContact NE2-ND2 3.31Å; H179-P232 VanDerWaalsContact CE1-CB 3.47Å; H179-P232 WeakPolarHBondContact CE1-CB 3.39Å; H179-P232 WeakPolarHBondContact ND1-CB 3.29Å
180	Y	98.4	Very high	97.3	Very high	22 Å²	22	57 Å²	57	9%	0.086	27%	0.272	C	S	.	.	H	α-helix	trans	-77.1	-40	169.2	176.3	-104.7	0	0	0	110.5	V147 F172 E175 S177 A182 F183 K184 A198 F200	V147-Y180 HydrophobicContact CG1-CE2 3.98Å; F172-Y180 AromaticContact CD2-CD2 3.72Å; F172-Y180 HydrophobicContact CD2-CD2 3.72Å; F172-Y180 HydrophobicContact CD2-CG 4.49Å; F172-Y180 HydrophobicContact CE2-CD2 4.17Å; F172-Y180 HydrophobicContact CG-CD2 4.21Å; E175-Y180 HydrophobicContact CB-CD1 4.5Å; E175-Y180 HydrophobicContact CB-CE1 4.39Å; E175-Y180 HydrophobicContact CG-CE1 4.39Å; E175-Y180 WeakPolarHBondContact O-CD1 3.14Å; S177-Y180 WeakPolarHBondContact O-CA 3.48Å; S177-Y180 WeakPolarHBondContact O-CB 3.46Å; S177-Y180 PolarHBondContact O-N 2.81Å; S177-Y180 WeakPolarHBondContact OG-CB 3.42Å; Y180-A182 PolarHBondContact O-N 2.88Å; Y180-F183 CarbonylContact O-C 3.48Å; Y180-F183 WeakPolarHBondContact O-CB 3.37Å; Y180-F183 PolarHBondContact O-N 3.13Å; Y180-F183 VanDerWaalsContact O-N 3.09Å; Y180-K184 PolarHBondContact O-N 3.3Å; Y180-A198 HydrophobicContact CD2-CB 3.99Å; Y180-A198 HydrophobicContact CE2-CB 3.53Å; Y180-F200 HydrophobicContact CD1-CZ 4.43Å; Y180-F200 AromaticContact CD2-CE1 3.86Å; Y180-F200 HydrophobicContact CD2-CE1 3.86Å; Y180-F200 AromaticContact CD2-CZ 3.97Å; Y180-F200 HydrophobicContact CD2-CZ 3.97Å; Y180-F200 HydrophobicContact CE1-CZ 4.27Å; Y180-F200 HydrophobicContact CE2-CE1 4.16Å; Y180-F200 AromaticContact CE2-CZ 3.8Å; Y180-F200 HydrophobicContact CE2-CZ 3.8Å; Y180-F200 HydrophobicContact CG-CE1 4.09Å; Y180-F200 HydrophobicContact CG-CZ 4.27Å; Y180-F200 AromaticContact CZ-CZ 3.95Å
181	E	97.9	Very high	97	Very high	106 Å²	106	57.7 Å²	57.7	50%	0.495	28%	0.276	S	S	.	.	H	α-helix	trans	-58	-51.1	173.6	-164.3	82.8	144.9	0	0	110.5	S177 F183 K184 E185	S177-E181 PolarHBondContact O-N 2.96Å; E181-F183 PolarHBondContact O-N 3.39Å; E181-F183 VanDerWaalsContact O-N 3.17Å; E181-K184 WeakPolarHBondContact O-CB 3.29Å; E181-K184 PolarHBondContact O-N 3.03Å; E181-E185 WeakPolarHBondContact O-CG 3.44Å; E181-E185 PolarHBondContact O-N 2.92Å
182	A	97.8	Very high	96.8	Very high	11 Å²	11	56.3 Å²	56.3	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-21.6	176.2	0	0	0	0	0	114.4	E178 Y180 A186 E235	E178-A182 WeakPolarHBondContact O-CB 3.33Å; E178-A182 PolarHBondContact O-N 2.99Å; Y180-A182 PolarHBondContact O-N 2.88Å; A182-A186 WeakPolarHBondContact O-CB 3.39Å; A182-A186 PolarHBondContact O-N 3.12Å; A182-E235 WeakPolarHBondContact O-CA 3.43Å
183	F	98.5	Very high	96.7	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-81.2	-37.9	173.2	-179.5	-99.2	0	0	0	111.5	V147 I168 F172 H179 Y180 E181 A186 A187 F196 F197 A198 V215 L238	V147-F183 HydrophobicContact CG1-CD1 4.18Å; V147-F183 HydrophobicContact CG1-CE1 3.79Å; V147-F183 HydrophobicContact CG2-CD1 4.05Å; V147-F183 HydrophobicContact CG2-CE1 4.13Å; I168-F183 HydrophobicContact CB-CZ 4.47Å; I168-F183 HydrophobicContact CG2-CE2 3.66Å; I168-F183 HydrophobicContact CG2-CZ 3.96Å; F172-F183 HydrophobicContact CE1-CB 4.24Å; F172-F183 HydrophobicContact CE2-CB 3.99Å; F172-F183 AromaticContact CE2-CD1 3.62Å; F172-F183 HydrophobicContact CE2-CD1 3.62Å; F172-F183 HydrophobicContact CE2-CD2 4.06Å; F172-F183 HydrophobicContact CE2-CE1 4.03Å; F172-F183 HydrophobicContact CE2-CE2 4.43Å; F172-F183 AromaticContact CE2-CG 3.64Å; F172-F183 HydrophobicContact CE2-CG 3.64Å; F172-F183 HydrophobicContact CE2-CZ 4.41Å; F172-F183 HydrophobicContact CZ-CB 3.52Å; F172-F183 AromaticContact CZ-CD1 3.97Å; F172-F183 HydrophobicContact CZ-CD1 3.97Å; F172-F183 AromaticContact CZ-CD2 3.67Å; F172-F183 HydrophobicContact CZ-CD2 3.67Å; F172-F183 HydrophobicContact CZ-CE2 4.32Å; F172-F183 AromaticContact CZ-CG 3.46Å; F172-F183 HydrophobicContact CZ-CG 3.46Å; F172-F183 VanDerWaalsContact CZ-CG 3.46Å; H179-F183 WeakPolarHBondContact O-CB 3.44Å; H179-F183 PolarHBondContact O-N 3.1Å; Y180-F183 CarbonylContact O-C 3.48Å; Y180-F183 WeakPolarHBondContact O-CB 3.37Å; Y180-F183 PolarHBondContact O-N 3.13Å; Y180-F183 VanDerWaalsContact O-N 3.09Å; E181-F183 PolarHBondContact O-N 3.39Å; E181-F183 VanDerWaalsContact O-N 3.17Å; F183-A186 PolarHBondContact O-N 2.83Å; F183-A187 WeakPolarHBondContact O-CB 3.41Å; F183-A187 PolarHBondContact O-N 3.17Å; F183-F196 HydrophobicContact CD1-CD1 4.45Å; F183-F196 HydrophobicContact CD2-CD1 4.43Å; F183-F196 HydrophobicContact CE1-CB 4.42Å; F183-F196 AromaticContact CE1-CD1 3.9Å; F183-F196 HydrophobicContact CE1-CD1 3.9Å; F183-F196 AromaticContact CE2-CD1 3.87Å; F183-F196 HydrophobicContact CE2-CD1 3.87Å; F183-F196 HydrophobicContact CE2-CE1 4.19Å; F183-F196 AromaticContact CZ-CD1 3.58Å; F183-F196 HydrophobicContact CZ-CD1 3.58Å; F183-F196 HydrophobicContact CZ-CE1 4.35Å; F183-F196 HydrophobicContact CZ-CG 4.45Å; F183-F197 VanDerWaalsContact CE1-O 3.27Å; F183-F197 WeakPolarHBondContact CE1-O 3.17Å; F183-F197 VanDerWaalsContact CZ-O 3.26Å; F183-F197 WeakPolarHBondContact CZ-O 3.47Å; F183-A198 HydrophobicContact CE1-CB 4.39Å; F183-V215 HydrophobicContact CD2-CG1 4.39Å; F183-V215 HydrophobicContact CD2-CG2 3.99Å; F183-V215 HydrophobicContact CE2-CG1 3.73Å; F183-V215 HydrophobicContact CE2-CG2 4.01Å; F183-L238 HydrophobicContact CB-CD1 4.16Å; F183-L238 HydrophobicContact CD2-CD1 3.85Å; F183-L238 HydrophobicContact CG-CD1 4.47Å
184	K	98.1	Very high	96.7	Very high	47 Å²	47	50.6 Å²	50.6	20%	0.204	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-45.8	172.3	-164.8	-173.9	-178.6	178.7	0	111.4	E145 P146 V147 Y180 E181 A186 A187 E188	E145-K184 WeakPolarHBondContact OE2-CE 3.41Å; E145-K184 IonicContact OE2-NZ 3.83Å; E145-K184 PolarHBondContact OE2-NZ 3.43Å; P146-K184 HydrophobicContact CG-CD 4.18Å; P146-K184 HydrophobicContact CG-CG 3.66Å; V147-K184 HydrophobicContact CG2-CB 4.24Å; V147-K184 HydrophobicContact CG2-CG 4.1Å; Y180-K184 PolarHBondContact O-N 3.3Å; E181-K184 WeakPolarHBondContact O-CB 3.29Å; E181-K184 PolarHBondContact O-N 3.03Å; K184-A186 VanDerWaalsContact C-N 3.25Å; K184-A186 PolarHBondContact O-N 3.26Å; K184-A187 WeakPolarHBondContact O-CB 3.5Å; K184-A187 PolarHBondContact O-N 2.92Å; K184-A187 VanDerWaalsContact O-N 3.15Å; K184-E188 WeakPolarHBondContact O-CG 3.49Å; K184-E188 PolarHBondContact O-N 3.38Å
185	E	96.8	Very high	96.7	Very high	95 Å²	95	50.8 Å²	50.8	44%	0.444	24%	0.244	S	C	.	.	H	α-helix	trans	-55.1	-41.5	172.4	-71.5	176.3	146.3	0	0	110.8	E181 H189 E235	E181-E185 WeakPolarHBondContact O-CG 3.44Å; E181-E185 PolarHBondContact O-N 2.92Å; E185-H189 PolarHBondContact O-CD2 3.33Å; E185-E235 HydrophobicContact CB-CB 4.18Å; E185-E235 HydrophobicContact CB-CG 3.94Å
186	A	97.5	Very high	96.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.4	-44	175	0	0	0	0	0	113	A182 F183 K184 E188 H189 F190 F196 L238 V239	A182-A186 WeakPolarHBondContact O-CB 3.39Å; A182-A186 PolarHBondContact O-N 3.12Å; F183-A186 PolarHBondContact O-N 2.83Å; K184-A186 VanDerWaalsContact C-N 3.25Å; K184-A186 PolarHBondContact O-N 3.26Å; A186-E188 PolarHBondContact O-N 3.01Å; A186-H189 PolarHBondContact O-N 3.21Å; A186-H189 VanDerWaalsContact O-N 3.14Å; A186-F190 VanDerWaalsContact O-CD2 3.32Å; A186-F190 WeakPolarHBondContact O-CD2 3.37Å; A186-F196 HydrophobicContact CB-CE1 4.48Å; A186-L238 HydrophobicContact CB-CB 3.67Å; A186-L238 HydrophobicContact CB-CD1 3.85Å; A186-L238 HydrophobicContact CB-CG 4.43Å; A186-V239 HydrophobicContact CB-CG2 3.97Å
187	A	97.8	Very high	96.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-32.1	178.9	0	0	0	0	0	113	P146 V147 F183 K184 H189 F190 Q191 F196	P146-A187 HydrophobicContact CB-CB 4.02Å; P146-A187 VanDerWaalsContact O-CB 3.26Å; P146-A187 WeakPolarHBondContact O-CB 3.37Å; V147-A187 HydrophobicContact CG2-CB 3.66Å; F183-A187 WeakPolarHBondContact O-CB 3.41Å; F183-A187 PolarHBondContact O-N 3.17Å; K184-A187 WeakPolarHBondContact O-CB 3.5Å; K184-A187 PolarHBondContact O-N 2.92Å; K184-A187 VanDerWaalsContact O-N 3.15Å; A187-H189 PolarHBondContact O-N 2.91Å; A187-F190 PolarHBondContact O-N 3.46Å; A187-Q191 PolarHBondContact O-N 3.49Å; A187-F196 HydrophobicContact CB-CB 3.78Å; A187-F196 HydrophobicContact CB-CD1 3.39Å; A187-F196 HydrophobicContact CB-CD2 3.88Å; A187-F196 HydrophobicContact CB-CE1 3.77Å; A187-F196 HydrophobicContact CB-CE2 4.22Å; A187-F196 HydrophobicContact CB-CG 3.43Å; A187-F196 VanDerWaalsContact CB-CG 3.43Å; A187-F196 HydrophobicContact CB-CZ 4.15Å
188	E	95.9	Very high	97	Very high	62 Å²	62	36.8 Å²	36.8	29%	0.29	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.1	176.4	-76.3	-163.6	-148.9	0	0	114.5	R122 P146 K184 A186	R122-E188 WeakPolarHBondContact CD-O 3.28Å; R122-E188 IonicContact CZ-OE2 3.6Å; R122-E188 IonicContact NE-OE2 3.08Å; R122-E188 PolarHBondContact NE-OE2 3.05Å; R122-E188 PolarHBondContact NH1-O 3.45Å; R122-E188 VanDerWaalsContact NH2-CG 3.34Å; R122-E188 IonicContact NH2-OE2 3.97Å; R122-E188 PolarHBondContact NH2-OE2 3.07Å; P146-E188 HydrophobicContact CB-CG 3.76Å; P146-E188 HydrophobicContact CG-CG 3.65Å; K184-E188 WeakPolarHBondContact O-CG 3.49Å; K184-E188 PolarHBondContact O-N 3.38Å; A186-E188 PolarHBondContact O-N 3.01Å
189	H	95.6	Very high	97.1	Very high	106 Å²	106	29.1 Å²	29.1	49%	0.491	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-13.5	172.4	-63.5	-96.5	0	0	0	113.8	E185 A186 A187 E235 V239	E185-H189 PolarHBondContact O-CD2 3.33Å; A186-H189 PolarHBondContact O-N 3.21Å; A186-H189 VanDerWaalsContact O-N 3.14Å; A187-H189 PolarHBondContact O-N 2.91Å; H189-E235 IonicContact CD2-OE1 3.54Å; H189-E235 IonicContact CE1-OE1 3.36Å; H189-E235 IonicContact NE2-OE1 2.71Å; H189-E235 PolarHBondContact NE2-OE1 2.91Å; H189-V239 HydrophobicContact CB-CG2 4.26Å
190	F	95.6	Very high	97.2	Very high	19 Å²	19	28.6 Å²	28.6	8%	0.083	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.3	7.8	-173	-51.6	-80.8	0	0	0	114.6	A186 A187 P192 Y193 I194 F196 V239 I242	A186-F190 VanDerWaalsContact O-CD2 3.32Å; A186-F190 WeakPolarHBondContact O-CD2 3.37Å; A187-F190 PolarHBondContact O-N 3.46Å; F190-P192 CarbonylContact O-C 3.59Å; F190-Y193 PolarHBondContact O-N 3.3Å; F190-I194 HydrophobicContact CB-CB 3.85Å; F190-I194 HydrophobicContact CB-CD1 4.18Å; F190-I194 HydrophobicContact CB-CG1 4.15Å; F190-I194 HydrophobicContact CD1-CD1 3.79Å; F190-I194 HydrophobicContact CE1-CD1 4.4Å; F190-I194 HydrophobicContact CG-CD1 4.09Å; F190-I194 PolarHBondContact O-N 3.48Å; F190-I194 VanDerWaalsContact O-N 3.11Å; F190-F196 HydrophobicContact CB-CE2 4.04Å; F190-F196 AromaticContact CD2-CE2 3.75Å; F190-F196 HydrophobicContact CD2-CE2 3.75Å; F190-F196 AromaticContact CD2-CZ 3.65Å; F190-F196 HydrophobicContact CD2-CZ 3.65Å; F190-F196 HydrophobicContact CE2-CZ 4.17Å; F190-F196 HydrophobicContact CG-CE2 4.24Å; F190-V239 HydrophobicContact CE2-CB 4.3Å; F190-V239 HydrophobicContact CE2-CG1 4.33Å; F190-V239 HydrophobicContact CE2-CG2 4.02Å; F190-V239 HydrophobicContact CZ-CB 4.3Å; F190-V239 HydrophobicContact CZ-CG1 3.96Å; F190-V239 HydrophobicContact CZ-CG2 4.47Å; F190-I242 HydrophobicContact CD1-CG2 4.19Å; F190-I242 HydrophobicContact CD2-CG2 4.29Å; F190-I242 HydrophobicContact CE1-CB 4.37Å; F190-I242 HydrophobicContact CE1-CG2 3.74Å; F190-I242 HydrophobicContact CE2-CB 4.02Å; F190-I242 HydrophobicContact CE2-CD1 4.14Å; F190-I242 HydrophobicContact CE2-CG2 3.85Å; F190-I242 HydrophobicContact CG-CG2 4.44Å; F190-I242 HydrophobicContact CZ-CB 3.73Å; F190-I242 HydrophobicContact CZ-CG2 3.54Å
191	Q	93.5	Very high	97.2	Very high	15 Å²	15	32.2 Å²	32.2	7%	0.07	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	137.7	171.4	-70.4	-163	-79.2	0	0	110.8	R122 L142 E144 P146 A187	R122-Q191 VanDerWaalsContact NH2-OE1 3.14Å; L142-Q191 HydrophobicContact CD2-CB 3.83Å; E144-Q191 PolarHBondContact O-NE2 3.28Å; E144-Q191 VanDerWaalsContact O-NE2 3.09Å; P146-Q191 HydrophobicContact CB-CG 3.71Å; A187-Q191 PolarHBondContact O-N 3.49Å
192	P	94.4	Very high	97.1	Very high	6 Å²	6	34.6 Å²	34.6	4%	0.039	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.1	-2.2	-5.4	37.4	-31.5	0	0	0	113.7	F138 D141 L142 F190 I194 K195	F138-P192 HydrophobicContact CD2-CG 3.36Å; F138-P192 HydrophobicContact CE2-CG 3.23Å; F138-P192 HydrophobicContact CG-CG 4.31Å; F138-P192 HydrophobicContact CZ-CG 4.09Å; D141-P192 HydrophobicContact CB-CB 3.54Å; D141-P192 HydrophobicContact CB-CG 4.4Å; L142-P192 HydrophobicContact CD2-CG 4.39Å; L142-P192 HydrophobicContact CG-CG 4.24Å; F190-P192 CarbonylContact O-C 3.59Å; P192-I194 PolarHBondContact O-N 2.96Å; P192-K195 WeakPolarHBondContact O-CD 3.3Å; P192-K195 WeakPolarHBondContact O-CE 3.44Å; P192-K195 PolarHBondContact O-NZ 2.88Å
193	Y	94.9	Very high	97.1	Very high	19 Å²	19	37.8 Å²	37.8	8%	0.075	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-32.8	-165.2	-63.2	-60.1	0	0	0	115.8	E125 F138 F190 R254 E256 D257	E125-Y193 PolarHBondContact O-OH 2.79Å; F138-Y193 HydrophobicContact CD2-CE1 4.34Å; F138-Y193 AromaticContact CE2-CE1 3.81Å; F138-Y193 HydrophobicContact CE2-CE1 3.81Å; F138-Y193 AromaticContact CE2-CE2 3.93Å; F138-Y193 HydrophobicContact CE2-CE2 3.93Å; F138-Y193 AromaticContact CE2-CZ 3.45Å; F138-Y193 VanDerWaalsContact CE2-CZ 3.45Å; F138-Y193 WeakPolarHBondContact CE2-OH 3.25Å; F138-Y193 HydrophobicContact CZ-CE2 4.36Å; F190-Y193 PolarHBondContact O-N 3.3Å; Y193-R254 PolarHBondContact O-NH2 2.87Å; Y193-E256 HydrophobicContact CD1-CG 4.37Å; Y193-E256 HydrophobicContact CE1-CB 4.33Å; Y193-E256 HydrophobicContact CE1-CG 4.2Å; Y193-E256 WeakPolarHBondContact CE1-O 3.23Å; Y193-E256 PolarHBondContact OH-O 2.77Å; Y193-E256 VanDerWaalsContact OH-O 3.1Å; Y193-D257 HydrophobicContact CD1-CB 4Å; Y193-D257 HydrophobicContact CE1-CB 3.71Å
194	I	97.3	Very high	97.1	Very high	9 Å²	9	37.9 Å²	37.9	5%	0.046	18%	0.181	C	C	.	.	S	Bend	trans	-113.1	124.3	176.2	-58.4	-176	0	0	0	108.5	I166 I168 F190 P192 F196 I242	I166-I194 HydrophobicContact CB-CG1 4.29Å; I166-I194 HydrophobicContact CB-CG2 4.13Å; I166-I194 HydrophobicContact CD1-CD1 4.25Å; I166-I194 HydrophobicContact CD1-CG1 4.29Å; I166-I194 HydrophobicContact CG2-CD1 4.33Å; I166-I194 HydrophobicContact CG2-CG1 4.43Å; I166-I194 HydrophobicContact CG2-CG2 3.83Å; I166-I194 WeakPolarHBondContact O-CG2 3.47Å; I168-I194 HydrophobicContact CD1-CG2 4.17Å; I168-I194 HydrophobicContact CG1-CG2 3.74Å; F190-I194 HydrophobicContact CB-CB 3.85Å; F190-I194 HydrophobicContact CB-CD1 4.18Å; F190-I194 HydrophobicContact CB-CG1 4.15Å; F190-I194 HydrophobicContact CD1-CD1 3.79Å; F190-I194 HydrophobicContact CE1-CD1 4.4Å; F190-I194 HydrophobicContact CG-CD1 4.09Å; F190-I194 PolarHBondContact O-N 3.48Å; F190-I194 VanDerWaalsContact O-N 3.11Å; P192-I194 PolarHBondContact O-N 2.96Å; I194-F196 HydrophobicContact CB-CD2 4.49Å; I194-F196 HydrophobicContact CB-CE2 4.19Å; I194-F196 HydrophobicContact CG2-CD2 4Å; I194-F196 HydrophobicContact CG2-CE2 3.73Å; I194-I242 HydrophobicContact CD1-CG2 3.57Å
195	K	97.6	Very high	97.1	Very high	29 Å²	29	35.7 Å²	35.7	13%	0.126	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	114.5	-173.4	-49.6	-59.8	-175.3	-166.5	0	110	D141 M162 D165 I166 R167 I168 P192 F197	D141-K195 IonicContact OD2-NZ 2.65Å; D141-K195 PolarHBondContact OD2-NZ 3.04Å; M162-K195 HydrophobicContact CE-CB 4.23Å; M162-K195 HydrophobicContact CE-CG 3.87Å; D165-K195 HydrophobicContact CB-CG 4.22Å; I166-K195 PolarHBondContact O-N 3.13Å; I166-K195 VanDerWaalsContact O-N 3.13Å; R167-K195 WeakPolarHBondContact CA-O 3.41Å; I168-K195 PolarHBondContact N-O 2.77Å; P192-K195 WeakPolarHBondContact O-CD 3.3Å; P192-K195 WeakPolarHBondContact O-CE 3.44Å; P192-K195 PolarHBondContact O-NZ 2.88Å; K195-F197 HydrophobicContact CB-CE2 3.67Å; K195-F197 HydrophobicContact CB-CZ 4.17Å
196	F	98.6	Very high	97.2	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.026	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.2	-178.7	-83.7	-118.5	0	0	0	111.8	P146 V147 E148 I168 F183 A186 A187 F190 I194 I242	P146-F196 WeakPolarHBondContact O-CB 3.46Å; V147-F196 WeakPolarHBondContact CA-O 3.34Å; V147-F196 HydrophobicContact CG2-CB 4.15Å; E148-F196 PolarHBondContact N-O 2.92Å; I168-F196 HydrophobicContact CB-CD1 3.88Å; I168-F196 HydrophobicContact CB-CD2 4.27Å; I168-F196 HydrophobicContact CB-CE1 4.08Å; I168-F196 HydrophobicContact CB-CE2 4.44Å; I168-F196 HydrophobicContact CB-CG 4Å; I168-F196 HydrophobicContact CB-CZ 4.37Å; I168-F196 HydrophobicContact CG1-CD1 4.22Å; I168-F196 HydrophobicContact CG1-CD2 3.93Å; I168-F196 HydrophobicContact CG1-CE1 4.07Å; I168-F196 HydrophobicContact CG1-CE2 3.74Å; I168-F196 HydrophobicContact CG1-CG 4.17Å; I168-F196 HydrophobicContact CG1-CZ 3.85Å; I168-F196 HydrophobicContact CG2-CD1 4.09Å; I168-F196 HydrophobicContact CG2-CE1 4.05Å; F183-F196 HydrophobicContact CD1-CD1 4.45Å; F183-F196 HydrophobicContact CD2-CD1 4.43Å; F183-F196 HydrophobicContact CE1-CB 4.42Å; F183-F196 AromaticContact CE1-CD1 3.9Å; F183-F196 HydrophobicContact CE1-CD1 3.9Å; F183-F196 AromaticContact CE2-CD1 3.87Å; F183-F196 HydrophobicContact CE2-CD1 3.87Å; F183-F196 HydrophobicContact CE2-CE1 4.19Å; F183-F196 AromaticContact CZ-CD1 3.58Å; F183-F196 HydrophobicContact CZ-CD1 3.58Å; F183-F196 HydrophobicContact CZ-CE1 4.35Å; F183-F196 HydrophobicContact CZ-CG 4.45Å; A186-F196 HydrophobicContact CB-CE1 4.48Å; A187-F196 HydrophobicContact CB-CB 3.78Å; A187-F196 HydrophobicContact CB-CD1 3.39Å; A187-F196 HydrophobicContact CB-CD2 3.88Å; A187-F196 HydrophobicContact CB-CE1 3.77Å; A187-F196 HydrophobicContact CB-CE2 4.22Å; A187-F196 HydrophobicContact CB-CG 3.43Å; A187-F196 VanDerWaalsContact CB-CG 3.43Å; A187-F196 HydrophobicContact CB-CZ 4.15Å; F190-F196 HydrophobicContact CB-CE2 4.04Å; F190-F196 AromaticContact CD2-CE2 3.75Å; F190-F196 HydrophobicContact CD2-CE2 3.75Å; F190-F196 AromaticContact CD2-CZ 3.65Å; F190-F196 HydrophobicContact CD2-CZ 3.65Å; F190-F196 HydrophobicContact CE2-CZ 4.17Å; F190-F196 HydrophobicContact CG-CE2 4.24Å; I194-F196 HydrophobicContact CB-CD2 4.49Å; I194-F196 HydrophobicContact CB-CE2 4.19Å; I194-F196 HydrophobicContact CG2-CD2 4Å; I194-F196 HydrophobicContact CG2-CE2 3.73Å; F196-I242 HydrophobicContact CE1-CD1 3.91Å; F196-I242 HydrophobicContact CE2-CD1 4.29Å; F196-I242 HydrophobicContact CZ-CD1 3.39Å
197	F	98.7	Very high	97.1	Very high	6 Å²	6	44 Å²	44	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147	-178.3	-62.5	-90.4	0	0	0	111.3	E148 I150 F159 M162 R167 I168 V169 G170 F183 K195	E148-F197 HydrophobicContact CB-CD1 3.62Å; E148-F197 HydrophobicContact CB-CE1 3.77Å; E148-F197 HydrophobicContact CG-CE1 4.23Å; E148-F197 CarbonylContact O-C 3.54Å; E148-F197 WeakPolarHBondContact O-CA 3.46Å; E148-F197 WeakPolarHBondContact OE1-CE1 3.18Å; I150-F197 HydrophobicContact CD1-CB 3.95Å; I150-F197 HydrophobicContact CD1-CD1 3.94Å; I150-F197 HydrophobicContact CD1-CG 4.16Å; I150-F197 HydrophobicContact CG1-CB 4.32Å; I150-F197 HydrophobicContact CG1-CD1 3.96Å; F159-F197 HydrophobicContact CD2-CB 4.22Å; F159-F197 HydrophobicContact CD2-CD1 4.06Å; F159-F197 AromaticContact CD2-CD2 3.45Å; F159-F197 HydrophobicContact CD2-CD2 3.45Å; F159-F197 VanDerWaalsContact CD2-CD2 3.45Å; F159-F197 HydrophobicContact CD2-CE1 4.32Å; F159-F197 AromaticContact CD2-CE2 3.74Å; F159-F197 HydrophobicContact CD2-CE2 3.74Å; F159-F197 AromaticContact CD2-CG 3.63Å; F159-F197 HydrophobicContact CD2-CG 3.63Å; F159-F197 HydrophobicContact CD2-CZ 4.18Å; F159-F197 HydrophobicContact CE2-CB 4.3Å; F159-F197 AromaticContact CE2-CD2 3.61Å; F159-F197 HydrophobicContact CE2-CD2 3.61Å; F159-F197 HydrophobicContact CE2-CE2 4.15Å; F159-F197 HydrophobicContact CE2-CG 4.01Å; M162-F197 HydrophobicContact CE-CZ 4.08Å; M162-F197 HydrophobicContact SD-CZ 3.96Å; R167-F197 HydrophobicContact CB-CE2 4.46Å; R167-F197 HydrophobicContact CG-CE2 4.2Å; I168-F197 PolarHBondContact O-N 2.61Å; V169-F197 VanDerWaalsContact CA-O 3.32Å; V169-F197 WeakPolarHBondContact CA-O 3.35Å; V169-F197 HydrophobicContact CB-CB 4.16Å; V169-F197 HydrophobicContact CG2-CB 3.99Å; G170-F197 PolarHBondContact N-O 3.21Å; F183-F197 VanDerWaalsContact CE1-O 3.27Å; F183-F197 WeakPolarHBondContact CE1-O 3.17Å; F183-F197 VanDerWaalsContact CZ-O 3.26Å; F183-F197 WeakPolarHBondContact CZ-O 3.47Å; K195-F197 HydrophobicContact CB-CE2 3.67Å; K195-F197 HydrophobicContact CB-CZ 4.17Å
198	A	98.6	Very high	97.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	155.4	170	0	0	0	0	0	110.8	V147 E148 V149 I150 G170 F172 Y180 F183	V147-A198 HydrophobicContact CG1-CB 3.65Å; E148-A198 PolarHBondContact O-N 3.43Å; V149-A198 CarbonylContact C-O 3.58Å; V149-A198 WeakPolarHBondContact CA-O 3.32Å; I150-A198 PolarHBondContact N-O 2.85Å; G170-A198 WeakPolarHBondContact O-CA 3.49Å; F172-A198 HydrophobicContact CD2-CB 4.06Å; F172-A198 HydrophobicContact CE2-CB 4.31Å; Y180-A198 HydrophobicContact CD2-CB 3.99Å; Y180-A198 HydrophobicContact CE2-CB 3.53Å; F183-A198 HydrophobicContact CE1-CB 4.39Å
199	T	98.6	Very high	97.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.2	160.6	-168.6	0	0	0	0	110.6	I150 G170 Y171 F172 E201 V204 A205	I150-T199 WeakPolarHBondContact O-CB 3.41Å; I150-T199 PolarHBondContact O-OG1 2.91Å; G170-T199 PolarHBondContact O-N 3.43Å; Y171-T199 HydrophobicContact CD2-CG2 4.02Å; Y171-T199 WeakPolarHBondContact CD2-O 3.26Å; F172-T199 PolarHBondContact N-O 3.06Å; T199-E201 PolarHBondContact OG1-N 3.42Å; T199-V204 HydrophobicContact CG2-CB 4.15Å; T199-V204 HydrophobicContact CG2-CG1 4Å; T199-A205 HydrophobicContact CG2-CB 3.98Å
200	F	98.4	Very high	97.3	Very high	42 Å²	42	41.8 Å²	41.8	18%	0.184	21%	0.206	C	C	.	.			trans	-106.8	-8.4	165.9	-44.8	-59.9	0	0	0	110.8	V149 F172 S174 E175 Y180	V149-F200 HydrophobicContact CG1-CD2 4.02Å; V149-F200 HydrophobicContact CG1-CE2 3.82Å; V149-F200 HydrophobicContact CG2-CE2 4.08Å; F172-F200 HydrophobicContact CB-CD1 3.95Å; F172-F200 HydrophobicContact CB-CE1 3.9Å; S174-F200 VanDerWaalsContact C-CE1 3.41Å; E175-F200 HydrophobicContact CB-CZ 4.42Å; E175-F200 HydrophobicContact CG-CE2 3.62Å; E175-F200 HydrophobicContact CG-CZ 3.65Å; Y180-F200 HydrophobicContact CD1-CZ 4.43Å; Y180-F200 AromaticContact CD2-CE1 3.86Å; Y180-F200 HydrophobicContact CD2-CE1 3.86Å; Y180-F200 AromaticContact CD2-CZ 3.97Å; Y180-F200 HydrophobicContact CD2-CZ 3.97Å; Y180-F200 HydrophobicContact CE1-CZ 4.27Å; Y180-F200 HydrophobicContact CE2-CE1 4.16Å; Y180-F200 AromaticContact CE2-CZ 3.8Å; Y180-F200 HydrophobicContact CE2-CZ 3.8Å; Y180-F200 HydrophobicContact CG-CE1 4.09Å; Y180-F200 HydrophobicContact CG-CZ 4.27Å; Y180-F200 AromaticContact CZ-CZ 3.95Å
201	E	98.3	Very high	97.3	Very high	97 Å²	97	46 Å²	46	45%	0.453	22%	0.224	S	C	.	.			trans	-90.6	122.1	-171.6	-89.6	-58.6	154.3	0	0	112.6	T199 S203 V204 A205	T199-E201 PolarHBondContact OG1-N 3.42Å; E201-S203 PolarHBondContact O-N 3.46Å; E201-S203 VanDerWaalsContact O-N 3.09Å; E201-V204 HydrophobicContact CB-CG2 4.22Å; E201-V204 PolarHBondContact O-N 3.26Å; E201-V204 VanDerWaalsContact O-N 3.14Å; E201-A205 PolarHBondContact O-N 3.34Å; E201-A205 VanDerWaalsContact O-N 3.11Å
202	K	97.6	Very high	97.5	Very high	156 Å²	156	49.2 Å²	49.2	68%	0.678	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.9	-175.3	-175.3	164.7	-179.6	170.3	0	112.8	K206	K202-K206 WeakPolarHBondContact O-CB 3.47Å
203	S	97.7	Very high	97.7	Very high	79 Å²	79	50.4 Å²	50.4	55%	0.552	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-58.6	169.5	-37.2	0	0	0	0	110.2	E201 K206 E207	E201-S203 PolarHBondContact O-N 3.46Å; E201-S203 VanDerWaalsContact O-N 3.09Å; S203-K206 WeakPolarHBondContact O-CB 3.47Å; S203-K206 PolarHBondContact O-N 3.01Å; S203-K206 VanDerWaalsContact O-N 3.12Å; S203-E207 PolarHBondContact O-N 3.15Å
204	V	98.2	Very high	97.8	Very high	2 Å²	2	50 Å²	50	1%	0.012	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-62.9	-49.7	-174.6	179.4	0	0	0	0	110.1	I150 L156 T199 E201 K206 E207 L208	I150-V204 HydrophobicContact CB-CG1 4.16Å; I150-V204 HydrophobicContact CG2-CG1 3.56Å; I150-V204 HydrophobicContact CG2-CG2 4.23Å; L156-V204 HydrophobicContact CD1-CG1 4.37Å; L156-V204 HydrophobicContact CD2-CG1 4.44Å; T199-V204 HydrophobicContact CG2-CB 4.15Å; T199-V204 HydrophobicContact CG2-CG1 4Å; E201-V204 HydrophobicContact CB-CG2 4.22Å; E201-V204 PolarHBondContact O-N 3.26Å; E201-V204 VanDerWaalsContact O-N 3.14Å; V204-K206 PolarHBondContact O-N 3.19Å; V204-K206 VanDerWaalsContact O-N 3.1Å; V204-E207 WeakPolarHBondContact O-CA 3.37Å; V204-E207 WeakPolarHBondContact O-CB 3.4Å; V204-E207 PolarHBondContact O-N 2.78Å; V204-L208 HydrophobicContact CG1-CD1 4.01Å; V204-L208 PolarHBondContact O-N 2.89Å
205	A	97.9	Very high	97.9	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.008	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.9	-23.3	177	0	0	0	0	0	113.9	Y171 T199 E201 T209 L210	Y171-A205 HydrophobicContact CD1-CB 3.41Å; Y171-A205 VanDerWaalsContact CD1-CB 3.41Å; Y171-A205 HydrophobicContact CD2-CB 3.56Å; Y171-A205 HydrophobicContact CE1-CB 3.85Å; Y171-A205 HydrophobicContact CE2-CB 4Å; Y171-A205 HydrophobicContact CG-CB 3.28Å; T199-A205 HydrophobicContact CG2-CB 3.98Å; E201-A205 PolarHBondContact O-N 3.34Å; E201-A205 VanDerWaalsContact O-N 3.11Å; A205-T209 CarbonylContact O-C 3.57Å; A205-T209 VanDerWaalsContact O-C 3.31Å; A205-T209 WeakPolarHBondContact O-CA 3.22Å; A205-T209 PolarHBondContact O-N 2.76Å; A205-T209 VanDerWaalsContact O-N 3.15Å; A205-L210 HydrophobicContact CB-CB 4.26Å; A205-L210 PolarHBondContact O-N 3.49Å; A205-L210 VanDerWaalsContact O-O 3.13Å
206	K	97.8	Very high	98	Very high	152 Å²	152	48.3 Å²	48.3	66%	0.661	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-85.9	-10.9	175.1	-156.3	-146.4	109.1	-59.9	0	112.8	K202 S203 V204	K202-K206 WeakPolarHBondContact O-CB 3.47Å; S203-K206 WeakPolarHBondContact O-CB 3.47Å; S203-K206 PolarHBondContact O-N 3.01Å; S203-K206 VanDerWaalsContact O-N 3.12Å; V204-K206 PolarHBondContact O-N 3.19Å; V204-K206 VanDerWaalsContact O-N 3.1Å
207	E	96.9	Very high	97.9	Very high	116 Å²	116	48.1 Å²	48.1	54%	0.542	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-47.8	176	-152.8	147.3	178.2	0	0	108.3	L156 S203 V204 T209	L156-E207 HydrophobicContact CD2-CB 3.75Å; L156-E207 HydrophobicContact CD2-CG 3.79Å; S203-E207 PolarHBondContact O-N 3.15Å; V204-E207 WeakPolarHBondContact O-CA 3.37Å; V204-E207 WeakPolarHBondContact O-CB 3.4Å; V204-E207 PolarHBondContact O-N 2.78Å; E207-T209 PolarHBondContact O-N 3.1Å; E207-T209 VanDerWaalsContact O-N 3.13Å
208	L	96.7	Very high	97.9	Very high	10 Å²	10	49.1 Å²	49.1	5%	0.052	24%	0.242	C	C	.	.	S	Bend	trans	-64.3	-5.1	164.2	-66.9	169.6	0	0	0	114.8	L156 F159 V169 V204 L210	L156-L208 HydrophobicContact CD1-CD1 4.1Å; L156-L208 HydrophobicContact CD1-CD2 3.67Å; L156-L208 HydrophobicContact CD1-CG 3.78Å; F159-L208 HydrophobicContact CD1-CD2 4.35Å; F159-L208 HydrophobicContact CE1-CD2 3.83Å; V169-L208 HydrophobicContact CG1-CD1 4.28Å; V169-L208 HydrophobicContact CG1-CD2 4.42Å; V169-L208 HydrophobicContact CG2-CD1 3.65Å; V204-L208 HydrophobicContact CG1-CD1 4.01Å; V204-L208 PolarHBondContact O-N 2.89Å; L208-L210 HydrophobicContact CB-CB 4.47Å; L208-L210 HydrophobicContact CB-CD1 3.92Å; L208-L210 HydrophobicContact CB-CG 4.08Å; L208-L210 HydrophobicContact CD1-CD1 3.82Å; L208-L210 PolarHBondContact O-N 3.48Å
209	T	97.4	Very high	97.9	Very high	104 Å²	104	50.2 Å²	50.2	64%	0.638	25%	0.247	S	C	*	.			trans	62.4	-8.8	-175.1	83.3	0	0	0	0	117.8	A205 E207	A205-T209 CarbonylContact O-C 3.57Å; A205-T209 VanDerWaalsContact O-C 3.31Å; A205-T209 WeakPolarHBondContact O-CA 3.22Å; A205-T209 PolarHBondContact O-N 2.76Å; A205-T209 VanDerWaalsContact O-N 3.15Å; E207-T209 PolarHBondContact O-N 3.1Å; E207-T209 VanDerWaalsContact O-N 3.13Å
210	L	97.7	Very high	97.8	Very high	10 Å²	10	50.4 Å²	50.4	5%	0.052	25%	0.248	C	C	.	.			trans	-41.3	141.4	171.5	-77	169.5	0	0	0	115.6	V169 A205 L208 E214 D216	V169-L210 HydrophobicContact CG1-CD1 4.27Å; V169-L210 HydrophobicContact CG2-CD1 4.19Å; A205-L210 HydrophobicContact CB-CB 4.26Å; A205-L210 PolarHBondContact O-N 3.49Å; A205-L210 VanDerWaalsContact O-O 3.13Å; L208-L210 HydrophobicContact CB-CB 4.47Å; L208-L210 HydrophobicContact CB-CD1 3.92Å; L208-L210 HydrophobicContact CB-CG 4.08Å; L208-L210 HydrophobicContact CD1-CD1 3.82Å; L208-L210 PolarHBondContact O-N 3.48Å; L210-E214 HydrophobicContact CD2-CB 4.09Å; L210-E214 HydrophobicContact CD2-CG 4.47Å; L210-D216 HydrophobicContact CD2-CB 4.12Å; L210-D216 VanDerWaalsContact CD2-CG 3.5Å; L210-D216 WeakPolarHBondContact CD2-OD2 3.3Å; L210-D216 WeakPolarHBondContact CG-OD2 3.48Å
211	K	97.4	Very high	97.8	Very high	107 Å²	107	48.5 Å²	48.5	47%	0.465	24%	0.24	S	C	.	.			trans	-108.4	165.2	172.7	-55.7	159.2	-137.7	71.1	0	108.8	N213 E214	K211-N213 PolarHBondContact O-N 3.16Å; K211-E214 WeakPolarHBondContact CA-OE1 3.46Å; K211-E214 HydrophobicContact CB-CB 4.35Å; K211-E214 WeakPolarHBondContact CB-OE1 3.41Å; K211-E214 WeakPolarHBondContact CD-OE1 3.44Å; K211-E214 WeakPolarHBondContact CD-OE2 3.22Å; K211-E214 VanDerWaalsContact CG-OE1 3.26Å; K211-E214 WeakPolarHBondContact CG-OE1 3.31Å; K211-E214 PolarHBondContact N-OE1 3.3Å; K211-E214 IonicContact NZ-OE1 3.78Å; K211-E214 PolarHBondContact NZ-OE1 2.93Å; K211-E214 IonicContact NZ-OE2 2.66Å; K211-E214 PolarHBondContact NZ-OE2 2.79Å; K211-E214 WeakPolarHBondContact O-CB 3.45Å; K211-E214 PolarHBondContact O-N 3.28Å; K211-E214 VanDerWaalsContact O-N 3.09Å
212	L	97.6	Very high	97.7	Very high	82 Å²	82	44.9 Å²	44.9	43%	0.429	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	132.1	-174.2	-175.7	66.8	0	0	0	111.7	Y171 K173 E214	Y171-L212 HydrophobicContact CD1-CB 4.4Å; Y171-L212 HydrophobicContact CE1-CB 4.21Å; Y171-L212 HydrophobicContact CE1-CD1 4.28Å; K173-L212 HydrophobicContact CB-CD1 4.13Å; L212-E214 VanDerWaalsContact C-N 3.25Å
213	N	97.6	Very high	97.4	Very high	31 Å²	31	45.2 Å²	45.2	17%	0.166	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	39.8	-172.2	-43.5	-23.1	0	0	0	112.2	Y171 H179 K211 R231 P232	Y171-N213 PolarHBondContact O-N 3.46Å; H179-N213 PolarHBondContact CD2-ND2 2.84Å; H179-N213 PolarHBondContact NE2-ND2 3.31Å; K211-N213 PolarHBondContact O-N 3.16Å; N213-R231 WeakPolarHBondContact O-CB 3.27Å; N213-P232 HydrophobicContact CB-CB 4.31Å
214	E	98.2	Very high	97.2	Very high	10 Å²	10	49.8 Å²	49.8	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	145.4	168.6	-153.5	166.4	51.6	0	0	106.9	Y171 L210 K211 L212 T227 R231	Y171-E214 PolarHBondContact N-O 2.79Å; Y171-E214 VanDerWaalsContact N-O 3.13Å; L210-E214 HydrophobicContact CD2-CB 4.09Å; L210-E214 HydrophobicContact CD2-CG 4.47Å; K211-E214 WeakPolarHBondContact CA-OE1 3.46Å; K211-E214 HydrophobicContact CB-CB 4.35Å; K211-E214 WeakPolarHBondContact CB-OE1 3.41Å; K211-E214 WeakPolarHBondContact CD-OE1 3.44Å; K211-E214 WeakPolarHBondContact CD-OE2 3.22Å; K211-E214 VanDerWaalsContact CG-OE1 3.26Å; K211-E214 WeakPolarHBondContact CG-OE1 3.31Å; K211-E214 PolarHBondContact N-OE1 3.3Å; K211-E214 IonicContact NZ-OE1 3.78Å; K211-E214 PolarHBondContact NZ-OE1 2.93Å; K211-E214 IonicContact NZ-OE2 2.66Å; K211-E214 PolarHBondContact NZ-OE2 2.79Å; K211-E214 WeakPolarHBondContact O-CB 3.45Å; K211-E214 PolarHBondContact O-N 3.28Å; K211-E214 VanDerWaalsContact O-N 3.09Å; L212-E214 VanDerWaalsContact C-N 3.25Å; E214-T227 HydrophobicContact CG-CG2 3.67Å; E214-R231 VanDerWaalsContact CD-NH1 3.27Å; E214-R231 IonicContact OE1-NH1 2.98Å; E214-R231 IonicContact OE2-CZ 2.85Å; E214-R231 IonicContact OE2-NH1 2.74Å; E214-R231 PolarHBondContact OE2-NH1 2.99Å; E214-R231 IonicContact OE2-NH2 3.15Å; E214-R231 PolarHBondContact OE2-NH2 3.38Å
215	V	98.6	Very high	97.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.9	-179.5	176.7	0	0	0	0	107.3	I168 V169 F172 F183 V228 L238	I168-V215 HydrophobicContact CG2-CG1 3.58Å; V169-V215 WeakPolarHBondContact O-CA 3.46Å; F172-V215 HydrophobicContact CZ-CG2 3.99Å; F183-V215 HydrophobicContact CD2-CG1 4.39Å; F183-V215 HydrophobicContact CD2-CG2 3.99Å; F183-V215 HydrophobicContact CE2-CG1 3.73Å; F183-V215 HydrophobicContact CE2-CG2 4.01Å; V215-V228 HydrophobicContact CB-CB 4.39Å; V215-V228 HydrophobicContact CB-CG2 4.03Å; V215-V228 HydrophobicContact CG1-CG2 3.84Å; V215-V228 WeakPolarHBondContact O-CG2 3.4Å; V215-V228 PolarHBondContact O-N 3.03Å; V215-L238 HydrophobicContact CB-CD2 4.34Å; V215-L238 HydrophobicContact CG1-CD2 4.19Å; V215-L238 HydrophobicContact CG2-CD2 4.23Å
216	D	98.5	Very high	97.1	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.8	178.7	-73.1	-24.1	0	0	0	109	V169 L210 Y218 P225 T227	V169-D216 HydrophobicContact CG1-CB 4.28Å; V169-D216 PolarHBondContact N-O 2.85Å; V169-D216 PolarHBondContact O-N 3.32Å; L210-D216 HydrophobicContact CD2-CB 4.12Å; L210-D216 VanDerWaalsContact CD2-CG 3.5Å; L210-D216 WeakPolarHBondContact CD2-OD2 3.3Å; L210-D216 WeakPolarHBondContact CG-OD2 3.48Å; D216-Y218 HydrophobicContact CB-CE2 4.21Å; D216-P225 HydrophobicContact CB-CB 3.92Å; D216-P225 HydrophobicContact CB-CG 4.11Å; D216-T227 WeakPolarHBondContact OD1-CA 3.33Å; D216-T227 WeakPolarHBondContact OD1-CB 3.32Å; D216-T227 WeakPolarHBondContact OD1-CG2 3.33Å; D216-T227 PolarHBondContact OD1-OG1 2.93Å
217	F	98.4	Very high	97	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.6	173.8	176.3	-76.1	0	0	0	108.6	I166 I168 E219 P225 I226 F241 I242 H245	I166-F217 HydrophobicContact CG2-CD2 4.5Å; I166-F217 HydrophobicContact CG2-CE1 4.39Å; I166-F217 HydrophobicContact CG2-CE2 3.67Å; I166-F217 HydrophobicContact CG2-CZ 3.6Å; I168-F217 HydrophobicContact CD1-CB 4.3Å; I168-F217 HydrophobicContact CD1-CD2 3.27Å; I168-F217 HydrophobicContact CD1-CE2 3.83Å; I168-F217 HydrophobicContact CD1-CG 4.03Å; F217-E219 HydrophobicContact CE1-CB 3.95Å; F217-P225 CarbonylContact O-C 3.6Å; F217-P225 VanDerWaalsContact O-CA 3.25Å; F217-P225 WeakPolarHBondContact O-CA 3.42Å; F217-P225 VanDerWaalsContact O-CB 3.23Å; F217-P225 WeakPolarHBondContact O-CB 3.27Å; F217-I226 WeakPolarHBondContact CB-O 3.49Å; F217-I226 PolarHBondContact N-O 3.06Å; F217-I226 PolarHBondContact O-N 3.21Å; F217-F241 HydrophobicContact CB-CE1 3.81Å; F217-F241 HydrophobicContact CD2-CD1 4.49Å; F217-F241 HydrophobicContact CD2-CE1 4.04Å; F217-F241 HydrophobicContact CG-CE1 4.03Å; F217-I242 HydrophobicContact CD2-CG1 4.23Å; F217-I242 HydrophobicContact CE2-CG1 4.5Å; F217-I242 HydrophobicContact CE2-CG2 4.41Å; F217-H245 HydrophobicContact CE1-CB 4.15Å; F217-H245 HydrophobicContact CE2-CB 4.06Å; F217-H245 HydrophobicContact CZ-CB 3.78Å; F217-H245 VanDerWaalsContact CZ-O 3.27Å; F217-H245 WeakPolarHBondContact CZ-O 3.31Å
218	Y	98.1	Very high	97.1	Very high	28 Å²	28	45.2 Å²	45.2	11%	0.11	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	114.4	171.5	-72.6	-101.5	0	0	0	108.6	F159 R167 V169 D216 P225	F159-Y218 HydrophobicContact CE1-CD2 4.45Å; F159-Y218 HydrophobicContact CE1-CE2 4.09Å; F159-Y218 AromaticContact CZ-CD2 3.79Å; F159-Y218 HydrophobicContact CZ-CD2 3.79Å; F159-Y218 AromaticContact CZ-CE2 3.74Å; F159-Y218 HydrophobicContact CZ-CE2 3.74Å; F159-Y218 HydrophobicContact CZ-CG 4.43Å; R167-Y218 PolarHBondContact N-O 3.35Å; R167-Y218 PolarHBondContact O-N 3.36Å; V169-Y218 HydrophobicContact CG1-CD2 4.12Å; V169-Y218 HydrophobicContact CG1-CE2 3.64Å; D216-Y218 HydrophobicContact CB-CE2 4.21Å; Y218-P225 HydrophobicContact CD1-CB 3.95Å; Y218-P225 HydrophobicContact CD2-CB 3.74Å; Y218-P225 HydrophobicContact CE1-CB 3.82Å; Y218-P225 HydrophobicContact CE1-CG 3.95Å; Y218-P225 HydrophobicContact CE2-CB 3.58Å; Y218-P225 HydrophobicContact CE2-CG 3.93Å; Y218-P225 HydrophobicContact CG-CB 3.93Å
219	E	97.9	Very high	96.9	Very high	23 Å²	23	49.1 Å²	49.1	11%	0.107	26%	0.256	C	S	.	.			trans	-70	146.8	165.8	-170.8	-179.8	153	0	0	109.5	F217 F221 M222 P248 T249 T297	F217-E219 HydrophobicContact CE1-CB 3.95Å; E219-F221 PolarHBondContact O-N 3.26Å; E219-M222 HydrophobicContact CB-CB 4.29Å; E219-M222 HydrophobicContact CB-CG 3.74Å; E219-M222 HydrophobicContact CG-CG 4.06Å; E219-M222 PolarHBondContact O-N 2.88Å; E219-M222 WeakPolarHBondContact OE1-CE 3.24Å; E219-P248 HydrophobicContact CG-CB 3.94Å; E219-T249 WeakPolarHBondContact OE1-CB 3.44Å; E219-T249 PolarHBondContact OE1-N 3.49Å; E219-T249 PolarHBondContact OE1-OG1 2.77Å; E219-T297 PolarHBondContact OE2-OG1 2.85Å
220	P	97.9	Very high	96.4	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.019	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47	138.9	170.5	-33.1	37	0	0	0	113.1	E163 E164 I166 M222 P248	E163-P220 CarbonylContact O-C 3.52Å; E163-P220 VanDerWaalsContact O-CA 3.25Å; E163-P220 WeakPolarHBondContact O-CA 3.38Å; E164-P220 WeakPolarHBondContact O-CG 3.49Å; I166-P220 HydrophobicContact CG1-CG 3.82Å; P220-M222 PolarHBondContact O-N 3.49Å; P220-P248 HydrophobicContact CB-CB 4.43Å; P220-P248 HydrophobicContact CG-CB 4.1Å; P220-P248 HydrophobicContact CG-CG 3.82Å
221	F	97.3	Very high	95.7	Very high	3 Å²	3	52.4 Å²	52.4	1%	0.013	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	-3.6	178.3	-47.1	-71	0	0	0	117.1	E163 E164 E219 L250 K290 R294 W306	E163-F221 HydrophobicContact CG-CD1 4.2Å; E163-F221 HydrophobicContact CG-CE1 4.39Å; E163-F221 PolarHBondContact O-N 3.29Å; E164-F221 HydrophobicContact CB-CE1 4.37Å; E164-F221 HydrophobicContact CB-CZ 4.1Å; E164-F221 HydrophobicContact CG-CE1 4Å; E164-F221 HydrophobicContact CG-CZ 4.09Å; E219-F221 PolarHBondContact O-N 3.26Å; F221-L250 HydrophobicContact CB-CD2 4.43Å; F221-L250 HydrophobicContact CD2-CB 3.99Å; F221-L250 HydrophobicContact CD2-CD2 3.65Å; F221-L250 HydrophobicContact CD2-CG 3.68Å; F221-L250 WeakPolarHBondContact CD2-O 3.38Å; F221-L250 HydrophobicContact CE2-CD2 4.1Å; F221-L250 HydrophobicContact CE2-CG 3.87Å; F221-L250 HydrophobicContact CG-CD2 4.03Å; F221-K290 HydrophobicContact CB-CD 4.44Å; F221-K290 HydrophobicContact CB-CG 4Å; F221-K290 HydrophobicContact CD1-CD 3.91Å; F221-K290 HydrophobicContact CD1-CG 3.99Å; F221-K290 HydrophobicContact CG-CD 4.45Å; F221-K290 HydrophobicContact CG-CG 4.08Å; F221-R294 VanDerWaalsContact O-CZ 3.29Å; F221-R294 PolarHBondContact O-NE 2.7Å; F221-R294 PolarHBondContact O-NH2 2.92Å; F221-W306 HydrophobicContact CE1-CE3 4.41Å; F221-W306 HydrophobicContact CE1-CZ3 4.09Å; F221-W306 AromaticContact CZ-CE3 3.78Å; F221-W306 HydrophobicContact CZ-CE3 3.78Å; F221-W306 AromaticContact CZ-CZ3 3.79Å; F221-W306 HydrophobicContact CZ-CZ3 3.79Å
222	M	95.9	Very high	95.2	Very high	21 Å²	21	50.6 Å²	50.6	10%	0.103	27%	0.274	C	S	.	.			trans	-84.5	137.8	179.7	-55.7	-51.7	166.8	0	0	113.1	E219 P220 A293 R294	E219-M222 HydrophobicContact CB-CB 4.29Å; E219-M222 HydrophobicContact CB-CG 3.74Å; E219-M222 HydrophobicContact CG-CG 4.06Å; E219-M222 PolarHBondContact O-N 2.88Å; E219-M222 WeakPolarHBondContact OE1-CE 3.24Å; P220-M222 PolarHBondContact O-N 3.49Å; M222-A293 HydrophobicContact CE-CB 4.26Å; M222-R294 HydrophobicContact SD-CB 4.27Å; M222-R294 HydrophobicContact SD-CG 3.64Å
223	E	90.8	Very high	95	Very high	163 Å²	163	47.5 Å²	47.5	76%	0.762	26%	0.258	S	S	*	.	S	Bend	trans	-79.9	-39.4	179.4	-66.6	-165.5	172.7	0	0	114
224	E	93.9	Very high	95	Very high	174 Å²	174	48.5 Å²	48.5	81%	0.813	27%	0.267	S	S	*	.	S	Bend	trans	-101.4	131.3	-179.5	-67.6	-157.9	159.2	0	0	111.1
225	P	96.9	Very high	94.9	Very high	40 Å²	40	51.4 Å²	51.4	26%	0.26	28%	0.281	S	S	.	.			trans	-83.3	157.6	179.4	33.5	-36.6	0	0	0	113.7	D216 F217 Y218	D216-P225 HydrophobicContact CB-CB 3.92Å; D216-P225 HydrophobicContact CB-CG 4.11Å; F217-P225 CarbonylContact O-C 3.6Å; F217-P225 VanDerWaalsContact O-CA 3.25Å; F217-P225 WeakPolarHBondContact O-CA 3.42Å; F217-P225 VanDerWaalsContact O-CB 3.23Å; F217-P225 WeakPolarHBondContact O-CB 3.27Å; Y218-P225 HydrophobicContact CD1-CB 3.95Å; Y218-P225 HydrophobicContact CD2-CB 3.74Å; Y218-P225 HydrophobicContact CE1-CB 3.82Å; Y218-P225 HydrophobicContact CE1-CG 3.95Å; Y218-P225 HydrophobicContact CE2-CB 3.58Å; Y218-P225 HydrophobicContact CE2-CG 3.93Å; Y218-P225 HydrophobicContact CG-CB 3.93Å
226	I	96.8	Very high	94.8	Very high	66 Å²	66	59.4 Å²	59.4	34%	0.338	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	105	169.6	-48.1	177	0	0	0	108.9	F217 V228 F241	F217-I226 WeakPolarHBondContact CB-O 3.49Å; F217-I226 PolarHBondContact N-O 3.06Å; F217-I226 PolarHBondContact O-N 3.21Å; I226-V228 PolarHBondContact O-N 2.89Å; I226-F241 HydrophobicContact CB-CZ 4.41Å; I226-F241 HydrophobicContact CG2-CZ 3.81Å
227	T	97.7	Very high	94.8	Very high	64 Å²	64	64.7 Å²	64.7	39%	0.393	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	122	171.2	-57.7	0	0	0	0	110.6	E214 D216	E214-T227 HydrophobicContact CG-CG2 3.67Å; D216-T227 WeakPolarHBondContact OD1-CA 3.33Å; D216-T227 WeakPolarHBondContact OD1-CB 3.32Å; D216-T227 WeakPolarHBondContact OD1-CG2 3.33Å; D216-T227 PolarHBondContact OD1-OG1 2.93Å
228	V	97.1	Very high	94.8	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.03	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-56.9	129.5	179.9	-177.4	0	0	0	0	110	V215 I226 H233 L238 F241	V215-V228 HydrophobicContact CB-CB 4.39Å; V215-V228 HydrophobicContact CB-CG2 4.03Å; V215-V228 HydrophobicContact CG1-CG2 3.84Å; V215-V228 WeakPolarHBondContact O-CG2 3.4Å; V215-V228 PolarHBondContact O-N 3.03Å; I226-V228 PolarHBondContact O-N 2.89Å; V228-H233 PolarHBondContact O-CE1 3.25Å; V228-L238 HydrophobicContact CG1-CD2 4.35Å; V228-F241 HydrophobicContact CG1-CB 4.28Å; V228-F241 HydrophobicContact CG1-CD1 4.22Å; V228-F241 HydrophobicContact CG1-CD2 4.31Å; V228-F241 HydrophobicContact CG1-CG 3.99Å; V228-F241 HydrophobicContact CG2-CD1 3.84Å; V228-F241 HydrophobicContact CG2-CE1 3.89Å; V228-F241 HydrophobicContact CG2-CG 4.45Å
229	P	93.6	Very high	94.8	Very high	93 Å²	93	64.8 Å²	64.8	60%	0.604	34%	0.343	S	S	*	.	S	Bend	trans	-71.4	144.7	-174.3	26.9	-34.1	0	0	0	112.9	F241	P229-F241 HydrophobicContact CG-CD2 4.11Å; P229-F241 HydrophobicContact CG-CE2 4.18Å
230	G	86.8	Confident	94.8	Very high	62 Å²	62	65.5 Å²	65.5	64%	0.639	36%	0.357	S	S	*	.	S	Bend	trans	88.1	-175.3	-174.2	0	0	0	0	0	112.8	H233	G230-H233 PolarHBondContact O-CE1 2.98Å
231	R	83.6	Confident	94.8	Very high	121 Å²	121	66.1 Å²	66.1	46%	0.457	36%	0.359	S	S	.	.	S	Bend	trans	170.3	154.5	159.4	53.8	168.2	157.9	-140.5	-28.9	112	N213 E214	N213-R231 WeakPolarHBondContact O-CB 3.27Å; E214-R231 VanDerWaalsContact CD-NH1 3.27Å; E214-R231 IonicContact OE1-NH1 2.98Å; E214-R231 IonicContact OE2-CZ 2.85Å; E214-R231 IonicContact OE2-NH1 2.74Å; E214-R231 PolarHBondContact OE2-NH1 2.99Å; E214-R231 IonicContact OE2-NH2 3.15Å; E214-R231 PolarHBondContact OE2-NH2 3.38Å
232	P	86.6	Confident	94.8	Very high	68 Å²	68	66 Å²	66	44%	0.442	36%	0.359	S	S	.	.	S	Bend	cis	-63.6	157.3	-14.2	30.9	-35.9	0	0	0	110.6	H179 N213	H179-P232 VanDerWaalsContact CE1-CB 3.47Å; H179-P232 WeakPolarHBondContact CE1-CB 3.39Å; H179-P232 WeakPolarHBondContact ND1-CB 3.29Å; N213-P232 HydrophobicContact CB-CB 4.31Å
233	H	93.6	Very high	94.8	Very high	18 Å²	18	69 Å²	69	8%	0.083	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-90.7	155.7	178.5	-42.3	-84.3	0	0	0	110.1	V228 G230 L238	V228-H233 PolarHBondContact O-CE1 3.25Å; G230-H233 PolarHBondContact O-CE1 2.98Å; H233-L238 HydrophobicContact CB-CD1 4.32Å; H233-L238 HydrophobicContact CB-CD2 3.86Å; H233-L238 HydrophobicContact CB-CG 3.81Å
234	S	96.6	Very high	95	Very high	52 Å²	52	68.7 Å²	68.7	36%	0.364	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-101.9	160.9	161.7	57.5	0	0	0	0	110.9	K236 E237 L238	S234-K236 VanDerWaalsContact C-N 3.3Å; S234-K236 PolarHBondContact O-N 2.97Å; S234-E237 WeakPolarHBondContact CB-OE2 3.38Å; S234-E237 PolarHBondContact N-OE2 2.82Å; S234-E237 PolarHBondContact O-N 3Å; S234-E237 VanDerWaalsContact OG-CD 3.29Å; S234-E237 WeakPolarHBondContact OG-CG 3.46Å; S234-E237 PolarHBondContact OG-OE2 3.23Å; S234-L238 PolarHBondContact O-N 2.77Å; S234-L238 VanDerWaalsContact O-N 3.09Å
235	E	97	Very high	95.1	Very high	71 Å²	71	63.2 Å²	63.2	33%	0.332	35%	0.352	S	S	.	.	H	α-helix	trans	-39.8	-58.4	173.7	170.4	-137.5	-162.3	0	0	111.3	A182 E185 H189 E237 L238 V239	A182-E235 WeakPolarHBondContact O-CA 3.43Å; E185-E235 HydrophobicContact CB-CB 4.18Å; E185-E235 HydrophobicContact CB-CG 3.94Å; H189-E235 IonicContact CD2-OE1 3.54Å; H189-E235 IonicContact CE1-OE1 3.36Å; H189-E235 IonicContact NE2-OE1 2.71Å; H189-E235 PolarHBondContact NE2-OE1 2.91Å; E235-E237 VanDerWaalsContact C-N 3.29Å; E235-E237 PolarHBondContact O-N 3.06Å; E235-L238 WeakPolarHBondContact O-CB 3.34Å; E235-L238 PolarHBondContact O-N 2.97Å; E235-L238 VanDerWaalsContact O-N 3.11Å; E235-V239 HydrophobicContact CG-CG2 4.43Å; E235-V239 WeakPolarHBondContact O-CG2 3.45Å; E235-V239 PolarHBondContact O-N 3.33Å
236	K	97	Very high	94.9	Very high	168 Å²	168	65.8 Å²	65.8	73%	0.73	36%	0.356	S	S	*	.	H	α-helix	trans	-60.5	-30.8	-179.5	178.2	164.5	-179.1	158.1	0	114.9	S234 G240	S234-K236 VanDerWaalsContact C-N 3.3Å; S234-K236 PolarHBondContact O-N 2.97Å; K236-G240 PolarHBondContact O-N 3.26Å
237	E	97.4	Very high	94.9	Very high	114 Å²	114	67 Å²	67	53%	0.533	36%	0.356	S	S	.	.	H	α-helix	trans	-75.2	-34.3	177.3	-71.9	163.9	136.7	0	0	111.3	S234 E235 F241	S234-E237 WeakPolarHBondContact CB-OE2 3.38Å; S234-E237 PolarHBondContact N-OE2 2.82Å; S234-E237 PolarHBondContact O-N 3Å; S234-E237 VanDerWaalsContact OG-CD 3.29Å; S234-E237 WeakPolarHBondContact OG-CG 3.46Å; S234-E237 PolarHBondContact OG-OE2 3.23Å; E235-E237 VanDerWaalsContact C-N 3.29Å; E235-E237 PolarHBondContact O-N 3.06Å; E237-F241 WeakPolarHBondContact O-CB 3.35Å; E237-F241 PolarHBondContact O-N 3.1Å
238	L	97.9	Very high	94.9	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-69.7	-52.2	172.6	-65.8	168.6	0	0	0	111.1	F183 A186 V215 V228 H233 S234 E235 G240 F241 I242	F183-L238 HydrophobicContact CB-CD1 4.16Å; F183-L238 HydrophobicContact CD2-CD1 3.85Å; F183-L238 HydrophobicContact CG-CD1 4.47Å; A186-L238 HydrophobicContact CB-CB 3.67Å; A186-L238 HydrophobicContact CB-CD1 3.85Å; A186-L238 HydrophobicContact CB-CG 4.43Å; V215-L238 HydrophobicContact CB-CD2 4.34Å; V215-L238 HydrophobicContact CG1-CD2 4.19Å; V215-L238 HydrophobicContact CG2-CD2 4.23Å; V228-L238 HydrophobicContact CG1-CD2 4.35Å; H233-L238 HydrophobicContact CB-CD1 4.32Å; H233-L238 HydrophobicContact CB-CD2 3.86Å; H233-L238 HydrophobicContact CB-CG 3.81Å; S234-L238 PolarHBondContact O-N 2.77Å; S234-L238 VanDerWaalsContact O-N 3.09Å; E235-L238 WeakPolarHBondContact O-CB 3.34Å; E235-L238 PolarHBondContact O-N 2.97Å; E235-L238 VanDerWaalsContact O-N 3.11Å; L238-G240 VanDerWaalsContact C-N 3.33Å; L238-G240 PolarHBondContact O-N 3.35Å; L238-F241 PolarHBondContact O-N 3.36Å; L238-I242 WeakPolarHBondContact O-CB 3.48Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.48Å; L238-I242 PolarHBondContact O-N 2.78Å
239	V	98	Very high	94.9	Very high	27 Å²	27	64.5 Å²	64.5	16%	0.164	34%	0.341	C	S	.	.	H	α-helix	trans	-56.3	-48.6	178.1	174.6	0	0	0	0	110.5	A186 H189 F190 E235 F241 I242 T243	A186-V239 HydrophobicContact CB-CG2 3.97Å; H189-V239 HydrophobicContact CB-CG2 4.26Å; F190-V239 HydrophobicContact CE2-CB 4.3Å; F190-V239 HydrophobicContact CE2-CG1 4.33Å; F190-V239 HydrophobicContact CE2-CG2 4.02Å; F190-V239 HydrophobicContact CZ-CB 4.3Å; F190-V239 HydrophobicContact CZ-CG1 3.96Å; F190-V239 HydrophobicContact CZ-CG2 4.47Å; E235-V239 HydrophobicContact CG-CG2 4.43Å; E235-V239 WeakPolarHBondContact O-CG2 3.45Å; E235-V239 PolarHBondContact O-N 3.33Å; V239-F241 PolarHBondContact O-N 3.38Å; V239-I242 PolarHBondContact O-N 2.68Å; V239-T243 PolarHBondContact O-N 2.84Å; V239-T243 PolarHBondContact O-OG1 2.87Å
240	G	97.9	Very high	95.2	Very high	39 Å²	39	60.1 Å²	60.1	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-60.6	-41	179.1	0	0	0	0	0	113.8	K236 L238 E244	K236-G240 PolarHBondContact O-N 3.26Å; L238-G240 VanDerWaalsContact C-N 3.33Å; L238-G240 PolarHBondContact O-N 3.35Å; G240-E244 WeakPolarHBondContact O-CB 3.39Å; G240-E244 PolarHBondContact O-N 3.07Å; G240-E244 VanDerWaalsContact O-N 3.14Å
241	F	97.9	Very high	95.7	Very high	15 Å²	15	58 Å²	58	7%	0.066	29%	0.285	C	S	.	.	H	α-helix	trans	-67.7	-43.7	176.9	178.6	-89.2	0	0	0	112.1	F217 I226 V228 P229 E237 L238 V239 E244 H245	F217-F241 HydrophobicContact CB-CE1 3.81Å; F217-F241 HydrophobicContact CD2-CD1 4.49Å; F217-F241 HydrophobicContact CD2-CE1 4.04Å; F217-F241 HydrophobicContact CG-CE1 4.03Å; I226-F241 HydrophobicContact CB-CZ 4.41Å; I226-F241 HydrophobicContact CG2-CZ 3.81Å; V228-F241 HydrophobicContact CG1-CB 4.28Å; V228-F241 HydrophobicContact CG1-CD1 4.22Å; V228-F241 HydrophobicContact CG1-CD2 4.31Å; V228-F241 HydrophobicContact CG1-CG 3.99Å; V228-F241 HydrophobicContact CG2-CD1 3.84Å; V228-F241 HydrophobicContact CG2-CE1 3.89Å; V228-F241 HydrophobicContact CG2-CG 4.45Å; P229-F241 HydrophobicContact CG-CD2 4.11Å; P229-F241 HydrophobicContact CG-CE2 4.18Å; E237-F241 WeakPolarHBondContact O-CB 3.35Å; E237-F241 PolarHBondContact O-N 3.1Å; L238-F241 PolarHBondContact O-N 3.36Å; V239-F241 PolarHBondContact O-N 3.38Å; F241-E244 WeakPolarHBondContact O-CB 3.26Å; F241-E244 PolarHBondContact O-N 2.88Å; F241-H245 AromaticContact CD2-CE1 3.58Å; F241-H245 AromaticContact CD2-ND1 3.86Å; F241-H245 AromaticContact CE1-ND1 3.91Å; F241-H245 AromaticContact CE2-CE1 3.19Å; F241-H245 WeakPolarHBondContact CE2-CE1 3.46Å; F241-H245 AromaticContact CE2-ND1 3.69Å; F241-H245 AromaticContact CE2-NE2 3.69Å; F241-H245 AromaticContact CZ-CE1 3.53Å; F241-H245 AromaticContact CZ-ND1 3.71Å; F241-H245 AromaticContact CZ-NE2 3.76Å; F241-H245 PolarHBondContact O-N 2.96Å; F241-H245 VanDerWaalsContact O-N 3.17Å; F241-H245 PolarHBondContact O-ND1 3.25Å
242	I	97.7	Very high	96.4	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-69	-37.8	-177.9	-66.3	168.1	0	0	0	110.7	I168 F190 I194 F196 F217 L238 V239 E244 H245 R246	I168-I242 HydrophobicContact CD1-CD1 3.83Å; I168-I242 HydrophobicContact CD1-CG1 3.94Å; I168-I242 HydrophobicContact CG1-CD1 3.88Å; I168-I242 HydrophobicContact CG2-CD1 4.32Å; F190-I242 HydrophobicContact CD1-CG2 4.19Å; F190-I242 HydrophobicContact CD2-CG2 4.29Å; F190-I242 HydrophobicContact CE1-CB 4.37Å; F190-I242 HydrophobicContact CE1-CG2 3.74Å; F190-I242 HydrophobicContact CE2-CB 4.02Å; F190-I242 HydrophobicContact CE2-CD1 4.14Å; F190-I242 HydrophobicContact CE2-CG2 3.85Å; F190-I242 HydrophobicContact CG-CG2 4.44Å; F190-I242 HydrophobicContact CZ-CB 3.73Å; F190-I242 HydrophobicContact CZ-CG2 3.54Å; I194-I242 HydrophobicContact CD1-CG2 3.57Å; F196-I242 HydrophobicContact CE1-CD1 3.91Å; F196-I242 HydrophobicContact CE2-CD1 4.29Å; F196-I242 HydrophobicContact CZ-CD1 3.39Å; F217-I242 HydrophobicContact CD2-CG1 4.23Å; F217-I242 HydrophobicContact CE2-CG1 4.5Å; F217-I242 HydrophobicContact CE2-CG2 4.41Å; L238-I242 WeakPolarHBondContact O-CB 3.48Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.48Å; L238-I242 PolarHBondContact O-N 2.78Å; V239-I242 PolarHBondContact O-N 2.68Å; I242-E244 VanDerWaalsContact C-N 3.33Å; I242-E244 PolarHBondContact O-N 2.87Å; I242-H245 CarbonylContact O-C 3.53Å; I242-H245 PolarHBondContact O-N 3.45Å; I242-R246 WeakPolarHBondContact O-CA 3.39Å; I242-R246 PolarHBondContact O-N 3.39Å; I242-R246 VanDerWaalsContact O-N 3.07Å
243	T	96.6	Very high	96.9	Very high	84 Å²	84	50.1 Å²	50.1	52%	0.515	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-36.1	170.8	-53.6	0	0	0	0	112.3	V239 H245	V239-T243 PolarHBondContact O-N 2.84Å; V239-T243 PolarHBondContact O-OG1 2.87Å; T243-H245 VanDerWaalsContact C-N 3.27Å; T243-H245 PolarHBondContact O-N 3.33Å
244	E	95.6	Very high	97.1	Very high	156 Å²	156	51.4 Å²	51.4	73%	0.729	25%	0.252	S	S	*	.	H	α-helix	trans	-68.8	-22.6	177.7	-174.1	171.1	-152.1	0	0	113.1	G240 F241 I242	G240-E244 WeakPolarHBondContact O-CB 3.39Å; G240-E244 PolarHBondContact O-N 3.07Å; G240-E244 VanDerWaalsContact O-N 3.14Å; F241-E244 WeakPolarHBondContact O-CB 3.26Å; F241-E244 PolarHBondContact O-N 2.88Å; I242-E244 VanDerWaalsContact C-N 3.33Å; I242-E244 PolarHBondContact O-N 2.87Å
245	H	95.3	Very high	97.1	Very high	59 Å²	59	50 Å²	50	27%	0.273	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	21.5	179.9	-56.6	70.3	0	0	0	112.2	F217 F241 I242 T243 R247	F217-H245 HydrophobicContact CE1-CB 4.15Å; F217-H245 HydrophobicContact CE2-CB 4.06Å; F217-H245 HydrophobicContact CZ-CB 3.78Å; F217-H245 VanDerWaalsContact CZ-O 3.27Å; F217-H245 WeakPolarHBondContact CZ-O 3.31Å; F241-H245 AromaticContact CD2-CE1 3.58Å; F241-H245 AromaticContact CD2-ND1 3.86Å; F241-H245 AromaticContact CE1-ND1 3.91Å; F241-H245 AromaticContact CE2-CE1 3.19Å; F241-H245 WeakPolarHBondContact CE2-CE1 3.46Å; F241-H245 AromaticContact CE2-ND1 3.69Å; F241-H245 AromaticContact CE2-NE2 3.69Å; F241-H245 AromaticContact CZ-CE1 3.53Å; F241-H245 AromaticContact CZ-ND1 3.71Å; F241-H245 AromaticContact CZ-NE2 3.76Å; F241-H245 PolarHBondContact O-N 2.96Å; F241-H245 VanDerWaalsContact O-N 3.17Å; F241-H245 PolarHBondContact O-ND1 3.25Å; I242-H245 CarbonylContact O-C 3.53Å; I242-H245 PolarHBondContact O-N 3.45Å; T243-H245 VanDerWaalsContact C-N 3.27Å; T243-H245 PolarHBondContact O-N 3.33Å; H245-R247 PolarHBondContact O-N 2.77Å
246	R	93.2	Very high	97.1	Very high	93 Å²	93	48.1 Å²	48.1	35%	0.351	24%	0.235	S	C	.	.			trans	-69	-32.2	-171.2	-170.8	178.4	-175.8	-154.8	1.9	113.7	I166 I242 P248 E260	I166-R246 WeakPolarHBondContact CD1-O 3.32Å; I242-R246 WeakPolarHBondContact O-CA 3.39Å; I242-R246 PolarHBondContact O-N 3.39Å; I242-R246 VanDerWaalsContact O-N 3.07Å; R246-P248 VanDerWaalsContact O-CD 3.29Å; R246-P248 WeakPolarHBondContact O-CD 3.25Å; R246-E260 IonicContact CZ-OE1 3.89Å; R246-E260 IonicContact CZ-OE2 2.76Å; R246-E260 IonicContact NH1-OE1 2.79Å; R246-E260 PolarHBondContact NH1-OE1 2.84Å; R246-E260 IonicContact NH1-OE2 3.38Å; R246-E260 IonicContact NH2-OE1 2.73Å; R246-E260 PolarHBondContact NH2-OE1 3.15Å; R246-E260 IonicContact NH2-OE2 3.52Å; R246-E260 PolarHBondContact NH2-OE2 3.49Å
247	R	96.4	Very high	96.9	Very high	92 Å²	92	40.8 Å²	40.8	35%	0.347	20%	0.203	S	C	.	.	S	Bend	trans	-88.6	111.6	-178.4	-175.7	-173.7	-68.9	-178.2	-14.5	109.6	H245 D264 D265	H245-R247 PolarHBondContact O-N 2.77Å; R247-D264 IonicContact CZ-OD1 2.77Å; R247-D264 IonicContact CZ-OD2 3.36Å; R247-D264 IonicContact NE-OD1 3.52Å; R247-D264 PolarHBondContact NE-OD1 2.94Å; R247-D264 IonicContact NE-OD2 3.35Å; R247-D264 PolarHBondContact NE-OD2 3.19Å; R247-D264 VanDerWaalsContact NH2-CG 3.25Å; R247-D264 PolarHBondContact NH2-O 2.6Å; R247-D264 IonicContact NH2-OD1 2.81Å; R247-D264 PolarHBondContact NH2-OD1 3.09Å; R247-D264 IonicContact NH2-OD2 3.79Å; R247-D264 PolarHBondContact NH2-OD2 2.87Å; R247-D265 PolarHBondContact NH2-O 3.36Å
248	P	96.9	Very high	96.8	Very high	11 Å²	11	36.2 Å²	36.2	7%	0.071	18%	0.182	C	C	.	.			trans	-76.6	160.2	177.3	-16.2	33.4	0	0	0	112.8	I166 E219 P220 R246 L250 R251 S303	I166-P248 HydrophobicContact CD1-CG 4.3Å; I166-P248 HydrophobicContact CG1-CG 4.32Å; E219-P248 HydrophobicContact CG-CB 3.94Å; P220-P248 HydrophobicContact CB-CB 4.43Å; P220-P248 HydrophobicContact CG-CB 4.1Å; P220-P248 HydrophobicContact CG-CG 3.82Å; R246-P248 VanDerWaalsContact O-CD 3.29Å; R246-P248 WeakPolarHBondContact O-CD 3.25Å; P248-L250 VanDerWaalsContact C-N 3.32Å; P248-L250 WeakPolarHBondContact CB-O 3.47Å; P248-R251 HydrophobicContact CB-CB 4.29Å; P248-R251 HydrophobicContact CG-CB 4.06Å; P248-S303 WeakPolarHBondContact O-CB 3.35Å; P248-S303 PolarHBondContact O-OG 3.43Å
249	T	98	Very high	96.7	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.037	20%	0.2	C	C	.	.	S	Bend	trans	-65.7	-36.4	171.9	-39.8	0	0	0	0	111.7	E219 A293 T297 L302 S303 I304	E219-T249 WeakPolarHBondContact OE1-CB 3.44Å; E219-T249 PolarHBondContact OE1-N 3.49Å; E219-T249 PolarHBondContact OE1-OG1 2.77Å; T249-A293 HydrophobicContact CG2-CB 4.19Å; T249-T297 VanDerWaalsContact OG1-CA 3.29Å; T249-T297 WeakPolarHBondContact OG1-CA 3.17Å; T249-T297 PolarHBondContact OG1-OG1 2.95Å; T249-L302 HydrophobicContact CG2-CD2 3.84Å; T249-L302 HydrophobicContact CG2-CG 4.01Å; T249-S303 WeakPolarHBondContact O-CA 3.29Å; T249-I304 PolarHBondContact O-N 2.9Å
250	L	98.5	Very high	96.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	120.7	172.5	177.1	64.6	0	0	0	107.8	F221 P248 L289 K290 A293 I304 W306	F221-L250 HydrophobicContact CB-CD2 4.43Å; F221-L250 HydrophobicContact CD2-CB 3.99Å; F221-L250 HydrophobicContact CD2-CD2 3.65Å; F221-L250 HydrophobicContact CD2-CG 3.68Å; F221-L250 WeakPolarHBondContact CD2-O 3.38Å; F221-L250 HydrophobicContact CE2-CD2 4.1Å; F221-L250 HydrophobicContact CE2-CG 3.87Å; F221-L250 HydrophobicContact CG-CD2 4.03Å; P248-L250 VanDerWaalsContact C-N 3.32Å; P248-L250 WeakPolarHBondContact CB-O 3.47Å; L250-L289 HydrophobicContact CD2-CB 4.2Å; L250-K290 HydrophobicContact CD2-CG 3.97Å; L250-A293 HydrophobicContact CB-CB 3.7Å; L250-A293 HydrophobicContact CD2-CB 4.26Å; L250-I304 WeakPolarHBondContact CA-O 3.28Å; L250-I304 HydrophobicContact CD1-CB 3.86Å; L250-I304 HydrophobicContact CD1-CG2 3.88Å; L250-W306 HydrophobicContact CD1-CB 4.04Å
251	R	97.8	Very high	96.3	Very high	18 Å²	18	40.4 Å²	40.4	7%	0.068	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.4	-177.5	56.2	-176.9	177.9	-174.8	-5.6	110.2	P248 T261 D264 H270 S303 I304 I305 W306	P248-R251 HydrophobicContact CB-CB 4.29Å; P248-R251 HydrophobicContact CG-CB 4.06Å; R251-T261 HydrophobicContact CG-CG2 4.46Å; R251-T261 PolarHBondContact NH2-O 3.37Å; R251-D264 IonicContact CZ-OD2 2.68Å; R251-D264 IonicContact NH1-OD2 3.31Å; R251-D264 PolarHBondContact NH1-OD2 2.93Å; R251-D264 PolarHBondContact NH2-O 2.68Å; R251-D264 IonicContact NH2-OD2 3.26Å; R251-H270 PolarHBondContact NH2-CE1 2.9Å; R251-H270 PolarHBondContact NH2-ND1 3.48Å; R251-S303 PolarHBondContact NE-OG 3.3Å; R251-I304 WeakPolarHBondContact CG-O 3.5Å; R251-I304 PolarHBondContact N-O 2.85Å; R251-I305 HydrophobicContact CG-CG1 4.11Å; R251-I305 CarbonylContact O-C 3.59Å; R251-I305 WeakPolarHBondContact O-CA 3.3Å; R251-W306 PolarHBondContact O-N 3.44Å
252	K	98.3	Very high	96.3	Very high	20 Å²	20	43 Å²	43	9%	0.087	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133.9	171.7	-167.4	174.8	-170.3	170.8	0	109	E164 R254 W306 D311	E164-K252 VanDerWaalsContact CD-CD 3.45Å; E164-K252 HydrophobicContact CG-CD 4.49Å; E164-K252 WeakPolarHBondContact OE1-CD 3.11Å; E164-K252 IonicContact OE1-NZ 2.73Å; E164-K252 PolarHBondContact OE1-NZ 3.44Å; E164-K252 VanDerWaalsContact OE2-CD 3.29Å; E164-K252 WeakPolarHBondContact OE2-CD 3.29Å; E164-K252 IonicContact OE2-NZ 2.77Å; E164-K252 PolarHBondContact OE2-NZ 3.42Å; K252-R254 HydrophobicContact CB-CG 4.41Å; K252-R254 HydrophobicContact CG-CG 4.49Å; K252-R254 PolarHBondContact O-N 3.41Å; K252-W306 CarbonylContact C-O 3.56Å; K252-W306 WeakPolarHBondContact CA-O 3.41Å; K252-W306 HydrophobicContact CB-CE3 4.01Å; K252-W306 HydrophobicContact CB-CZ3 4.38Å; K252-W306 HydrophobicContact CD-CE3 3.99Å; K252-W306 HydrophobicContact CD-CH2 3.99Å; K252-W306 HydrophobicContact CD-CZ3 3.64Å; K252-W306 HydrophobicContact CG-CD2 4.31Å; K252-W306 HydrophobicContact CG-CE3 3.87Å; K252-W306 HydrophobicContact CG-CZ3 4.07Å; K252-D311 WeakPolarHBondContact CE-OD2 3.37Å; K252-D311 IonicContact NZ-OD2 2.65Å
253	L	98.3	Very high	96.2	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	23%	0.229	C	C	.	.			trans	-72.3	115.4	167.6	-170.2	71.8	0	0	0	107.9	M258 T261 I305 W306 I307 F312	L253-M258 HydrophobicContact CD1-CB 3.96Å; L253-M258 HydrophobicContact CG-CB 4.11Å; L253-T261 HydrophobicContact CD1-CG2 3.7Å; L253-I305 HydrophobicContact CB-CG2 3.81Å; L253-I305 HydrophobicContact CD1-CG2 4.32Å; L253-W306 PolarHBondContact N-O 2.95Å; L253-I307 HydrophobicContact CB-CG1 3.92Å; L253-I307 HydrophobicContact CD2-CD1 3.76Å; L253-I307 HydrophobicContact CD2-CG1 3.86Å; L253-I307 HydrophobicContact CD2-CG2 4.25Å; L253-F312 HydrophobicContact CB-CE2 4.31Å; L253-F312 HydrophobicContact CB-CZ 4.41Å; L253-F312 HydrophobicContact CD2-CE2 4.08Å; L253-F312 HydrophobicContact CD2-CZ 3.96Å; L253-F312 HydrophobicContact CG-CE2 4.17Å; L253-F312 HydrophobicContact CG-CZ 3.87Å; L253-F312 VanDerWaalsContact O-CE2 3.29Å; L253-F312 WeakPolarHBondContact O-CE2 3.29Å
254	R	97.3	Very high	96.2	Very high	45 Å²	45	48.4 Å²	48.4	17%	0.17	22%	0.22	C	C	.	.			trans	-112.3	148.6	-179.5	-47.6	174.4	-65.2	173.5	2.1	109.6	D165 Y193 K252 E256 D257 M258	D165-R254 IonicContact OD1-NH1 2.92Å; D165-R254 PolarHBondContact OD1-NH1 2.85Å; Y193-R254 PolarHBondContact O-NH2 2.87Å; K252-R254 HydrophobicContact CB-CG 4.41Å; K252-R254 HydrophobicContact CG-CG 4.49Å; K252-R254 PolarHBondContact O-N 3.41Å; R254-E256 HydrophobicContact CB-CG 4.24Å; R254-E256 IonicContact CZ-OE1 3.44Å; R254-E256 VanDerWaalsContact CZ-OE1 3.31Å; R254-E256 IonicContact NE-OE1 2.61Å; R254-E256 IonicContact NH1-OE1 3.83Å; R254-E256 PolarHBondContact NH1-OE1 3.17Å; R254-E256 IonicContact NH2-OE1 3.22Å; R254-E256 PolarHBondContact NH2-OE1 2.83Å; R254-E256 PolarHBondContact O-N 3.02Å; R254-D257 WeakPolarHBondContact CB-OD1 3.47Å; R254-D257 IonicContact CZ-OD2 2.96Å; R254-D257 IonicContact NE-OD1 3.95Å; R254-D257 IonicContact NE-OD2 2.61Å; R254-D257 PolarHBondContact NE-OD2 3.36Å; R254-D257 IonicContact NH2-OD2 2.78Å; R254-D257 PolarHBondContact NH2-OD2 3.12Å; R254-D257 PolarHBondContact O-N 2.61Å; R254-M258 WeakPolarHBondContact O-CA 3.37Å; R254-M258 WeakPolarHBondContact O-CB 3.45Å; R254-M258 PolarHBondContact O-N 3.21Å
255	A	96.9	Very high	96.2	Very high	23 Å²	23	43.7 Å²	43.7	19%	0.19	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-17.2	-176.7	0	0	0	0	0	113.7	G128 L129 V134 F312	G128-A255 CarbonylContact C-O 3.43Å; G128-A255 WeakPolarHBondContact CA-O 3.24Å; L129-A255 HydrophobicContact CB-CB 4.27Å; L129-A255 PolarHBondContact N-O 2.92Å; V134-A255 HydrophobicContact CG1-CB 4.37Å; V134-A255 WeakPolarHBondContact CG1-O 3.48Å; V134-A255 HydrophobicContact CG2-CB 3.68Å; A255-F312 HydrophobicContact CB-CE1 4.22Å; A255-F312 HydrophobicContact CB-CZ 4.48Å
256	E	95.3	Very high	96.2	Very high	31 Å²	31	42.2 Å²	42.2	15%	0.145	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-21.2	178.5	63.6	174.9	-151.2	0	0	115.4	F126 V134 Y193 R254	F126-E256 HydrophobicContact CE2-CB 4.5Å; V134-E256 HydrophobicContact CG1-CB 4.18Å; Y193-E256 HydrophobicContact CD1-CG 4.37Å; Y193-E256 HydrophobicContact CE1-CB 4.33Å; Y193-E256 HydrophobicContact CE1-CG 4.2Å; Y193-E256 WeakPolarHBondContact CE1-O 3.23Å; Y193-E256 PolarHBondContact OH-O 2.77Å; Y193-E256 VanDerWaalsContact OH-O 3.1Å; R254-E256 HydrophobicContact CB-CG 4.24Å; R254-E256 IonicContact CZ-OE1 3.44Å; R254-E256 VanDerWaalsContact CZ-OE1 3.31Å; R254-E256 IonicContact NE-OE1 2.61Å; R254-E256 IonicContact NH1-OE1 3.83Å; R254-E256 PolarHBondContact NH1-OE1 3.17Å; R254-E256 IonicContact NH2-OE1 3.22Å; R254-E256 PolarHBondContact NH2-OE1 2.83Å; R254-E256 PolarHBondContact O-N 3.02Å
257	D	94.3	Very high	96.1	Very high	13 Å²	13	47.4 Å²	47.4	7%	0.07	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.1	23.2	-175.8	60.6	-0.5	0	0	0	113	D127 Y193 R254 F259 E260 T261	D127-D257 CarbonylContact O-C 3.53Å; D127-D257 WeakPolarHBondContact O-CA 3.42Å; Y193-D257 HydrophobicContact CD1-CB 4Å; Y193-D257 HydrophobicContact CE1-CB 3.71Å; R254-D257 WeakPolarHBondContact CB-OD1 3.47Å; R254-D257 IonicContact CZ-OD2 2.96Å; R254-D257 IonicContact NE-OD1 3.95Å; R254-D257 IonicContact NE-OD2 2.61Å; R254-D257 PolarHBondContact NE-OD2 3.36Å; R254-D257 IonicContact NH2-OD2 2.78Å; R254-D257 PolarHBondContact NH2-OD2 3.12Å; R254-D257 PolarHBondContact O-N 2.61Å; D257-F259 VanDerWaalsContact C-N 3.26Å; D257-F259 PolarHBondContact O-N 3.48Å; D257-E260 PolarHBondContact O-N 2.89Å; D257-T261 VanDerWaalsContact O-CB 3.27Å; D257-T261 WeakPolarHBondContact O-CB 3.42Å; D257-T261 PolarHBondContact O-N 2.89Å; D257-T261 PolarHBondContact O-OG1 3.04Å
258	M	95.2	Very high	96	Very high	18 Å²	18	43.9 Å²	43.9	9%	0.089	21%	0.214	C	C	.	.	H	α-helix	trans	-63.8	-28	-172.6	66.7	169.6	-64.4	0	0	114.2	L129 L253 R254 W262 F312 L315	L129-M258 HydrophobicContact CB-SD 3.79Å; L129-M258 HydrophobicContact CD1-SD 4.25Å; L253-M258 HydrophobicContact CD1-CB 3.96Å; L253-M258 HydrophobicContact CG-CB 4.11Å; R254-M258 WeakPolarHBondContact O-CA 3.37Å; R254-M258 WeakPolarHBondContact O-CB 3.45Å; R254-M258 PolarHBondContact O-N 3.21Å; M258-W262 WeakPolarHBondContact O-CB 3.36Å; M258-W262 PolarHBondContact O-N 3.01Å; M258-F312 HydrophobicContact CB-CE1 4.26Å; M258-F312 HydrophobicContact CB-CZ 4.42Å; M258-F312 HydrophobicContact CE-CE1 4.22Å; M258-F312 HydrophobicContact SD-CD1 4.47Å; M258-F312 HydrophobicContact SD-CE1 3.85Å; M258-L315 HydrophobicContact CE-CD1 4.02Å
259	F	94.4	Very high	96	Very high	88 Å²	88	46 Å²	46	39%	0.386	22%	0.224	S	C	.	.	H	α-helix	trans	-83.7	-48.2	179.2	-63.5	-58.3	0	0	0	109.6	D127 G128 D257 T261 W262 E263	D127-F259 VanDerWaalsContact CG-CB 3.47Å; D127-F259 PolarHBondContact O-N 3.07Å; D127-F259 WeakPolarHBondContact OD1-CB 3.02Å; D127-F259 WeakPolarHBondContact OD2-CB 3.46Å; G128-F259 WeakPolarHBondContact O-CE2 3.26Å; D257-F259 VanDerWaalsContact C-N 3.26Å; D257-F259 PolarHBondContact O-N 3.48Å; F259-T261 PolarHBondContact O-N 3.15Å; F259-T261 VanDerWaalsContact O-N 3.17Å; F259-W262 CarbonylContact O-C 3.49Å; F259-W262 WeakPolarHBondContact O-CA 3.37Å; F259-W262 PolarHBondContact O-N 3.34Å; F259-E263 PolarHBondContact O-N 3.1Å
260	E	93.2	Very high	96	Very high	58 Å²	58	45.9 Å²	45.9	27%	0.271	22%	0.223	S	C	.	.	H	α-helix	trans	-55.2	-38.8	174.5	-175.9	176.5	-139.6	0	0	112.1	D127 R246 D257 W262 D264	D127-E260 HydrophobicContact CB-CB 4.39Å; D127-E260 WeakPolarHBondContact OD2-CA 3.24Å; D127-E260 PolarHBondContact OD2-N 2.93Å; R246-E260 IonicContact CZ-OE1 3.89Å; R246-E260 IonicContact CZ-OE2 2.76Å; R246-E260 IonicContact NH1-OE1 2.79Å; R246-E260 PolarHBondContact NH1-OE1 2.84Å; R246-E260 IonicContact NH1-OE2 3.38Å; R246-E260 IonicContact NH2-OE1 2.73Å; R246-E260 PolarHBondContact NH2-OE1 3.15Å; R246-E260 IonicContact NH2-OE2 3.52Å; R246-E260 PolarHBondContact NH2-OE2 3.49Å; D257-E260 PolarHBondContact O-N 2.89Å; E260-W262 VanDerWaalsContact C-N 3.33Å; E260-D264 VanDerWaalsContact O-CB 3.31Å; E260-D264 WeakPolarHBondContact O-CB 3.45Å; E260-D264 PolarHBondContact O-N 2.84Å
261	T	96.2	Very high	96	Very high	12 Å²	12	46.2 Å²	46.2	7%	0.074	23%	0.225	C	C	.	.	H	α-helix	trans	-67.2	-32.2	175.4	-60.3	0	0	0	0	112.8	R251 L253 D257 F259 I305	R251-T261 HydrophobicContact CG-CG2 4.46Å; R251-T261 PolarHBondContact NH2-O 3.37Å; L253-T261 HydrophobicContact CD1-CG2 3.7Å; D257-T261 VanDerWaalsContact O-CB 3.27Å; D257-T261 WeakPolarHBondContact O-CB 3.42Å; D257-T261 PolarHBondContact O-N 2.89Å; D257-T261 PolarHBondContact O-OG1 3.04Å; F259-T261 PolarHBondContact O-N 3.15Å; F259-T261 VanDerWaalsContact O-N 3.17Å; T261-I305 HydrophobicContact CG2-CD1 4.03Å; T261-I305 HydrophobicContact CG2-CG1 4.27Å
262	W	97.1	Very high	96	Very high	71 Å²	71	45.4 Å²	45.4	27%	0.269	22%	0.222	S	C	.	.	H	α-helix	trans	-89.7	-24.4	-178.8	-166.8	-88.1	0	0	0	113.4	M258 F259 E260 H270 V272 I305 V335	M258-W262 WeakPolarHBondContact O-CB 3.36Å; M258-W262 PolarHBondContact O-N 3.01Å; F259-W262 CarbonylContact O-C 3.49Å; F259-W262 WeakPolarHBondContact O-CA 3.37Å; F259-W262 PolarHBondContact O-N 3.34Å; E260-W262 VanDerWaalsContact C-N 3.33Å; W262-H270 PolarHBondContact O-NE2 3.21Å; W262-V272 HydrophobicContact CH2-CG2 4.06Å; W262-V272 HydrophobicContact CZ3-CG2 3.92Å; W262-I305 HydrophobicContact CE3-CD1 4.2Å; W262-V335 HydrophobicContact CH2-CB 4.25Å; W262-V335 HydrophobicContact CH2-CG1 4.01Å; W262-V335 HydrophobicContact CZ2-CG1 3.98Å
263	E	95.3	Very high	96	Very high	139 Å²	139	44.4 Å²	44.4	65%	0.65	22%	0.218	S	C	*	.	H	α-helix	trans	-82.3	-20.5	171.5	-62.4	-141.6	152.6	0	0	112.8	F259 D265	F259-E263 PolarHBondContact O-N 3.1Å; E263-D265 PolarHBondContact O-N 2.89Å
264	D	96.1	Very high	96	Very high	60 Å²	60	44.2 Å²	44.2	32%	0.321	22%	0.217	S	C	.	.	S	Bend	trans	-78.6	60.5	175.6	-174.1	53.3	0	0	0	112.4	R247 R251 E260	R247-D264 IonicContact CZ-OD1 2.77Å; R247-D264 IonicContact CZ-OD2 3.36Å; R247-D264 IonicContact NE-OD1 3.52Å; R247-D264 PolarHBondContact NE-OD1 2.94Å; R247-D264 IonicContact NE-OD2 3.35Å; R247-D264 PolarHBondContact NE-OD2 3.19Å; R247-D264 VanDerWaalsContact NH2-CG 3.25Å; R247-D264 PolarHBondContact NH2-O 2.6Å; R247-D264 IonicContact NH2-OD1 2.81Å; R247-D264 PolarHBondContact NH2-OD1 3.09Å; R247-D264 IonicContact NH2-OD2 3.79Å; R247-D264 PolarHBondContact NH2-OD2 2.87Å; R251-D264 IonicContact CZ-OD2 2.68Å; R251-D264 IonicContact NH1-OD2 3.31Å; R251-D264 PolarHBondContact NH1-OD2 2.93Å; R251-D264 PolarHBondContact NH2-O 2.68Å; R251-D264 IonicContact NH2-OD2 3.26Å; E260-D264 VanDerWaalsContact O-CB 3.31Å; E260-D264 WeakPolarHBondContact O-CB 3.45Å; E260-D264 PolarHBondContact O-N 2.84Å
265	D	96.4	Very high	96.1	Very high	57 Å²	57	42.2 Å²	42.2	31%	0.305	21%	0.209	S	C	.	.			trans	-70.7	169.3	-176.5	82.9	-119	0	0	0	115	R247 E263 E267 G268 V337	R247-D265 PolarHBondContact NH2-O 3.36Å; E263-D265 PolarHBondContact O-N 2.89Å; D265-E267 PolarHBondContact OD2-N 3.45Å; D265-E267 VanDerWaalsContact OD2-N 3.16Å; D265-G268 PolarHBondContact OD2-N 3.43Å; D265-V337 HydrophobicContact CB-CG1 4.22Å; D265-V337 HydrophobicContact CB-CG2 4.49Å
266	I	94.3	Very high	96.1	Very high	28 Å²	28	44.2 Å²	44.2	14%	0.144	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-120.1	104.9	167.3	-50.3	-164.2	0	0	0	109.4	G268 I269 D301	I266-G268 PolarHBondContact O-N 3.24Å; I266-G268 VanDerWaalsContact O-N 3.12Å; I266-I269 PolarHBondContact N-O 3.04Å; I266-I269 VanDerWaalsContact N-O 3.08Å; I266-I269 WeakPolarHBondContact O-CG1 3.46Å; I266-I269 PolarHBondContact O-N 2.99Å; I266-I269 VanDerWaalsContact O-N 3.09Å; I266-D301 WeakPolarHBondContact CD1-O 3.39Å
267	E	92.6	Very high	96.1	Very high	201 Å²	201	46.8 Å²	46.8	94%	0.939	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	27.1	179.1	-53.8	-153.9	139.6	0	0	114.8	D265	D265-E267 PolarHBondContact OD2-N 3.45Å; D265-E267 VanDerWaalsContact OD2-N 3.16Å
268	G	94.1	Very high	96.2	Very high	18 Å²	18	55.2 Å²	55.2	19%	0.186	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	3.2	180	0	0	0	0	0	115.4	D265 I266 V337	D265-G268 PolarHBondContact OD2-N 3.43Å; I266-G268 PolarHBondContact O-N 3.24Å; I266-G268 VanDerWaalsContact O-N 3.12Å; G268-V337 PolarHBondContact O-N 3.31Å
269	I	95.8	Very high	96.3	Very high	56 Å²	56	57 Å²	57	29%	0.287	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	159.6	179.3	59.3	164.7	0	0	0	113	I266 V334 V335	I266-I269 PolarHBondContact N-O 3.04Å; I266-I269 VanDerWaalsContact N-O 3.08Å; I266-I269 WeakPolarHBondContact O-CG1 3.46Å; I266-I269 PolarHBondContact O-N 2.99Å; I266-I269 VanDerWaalsContact O-N 3.09Å; I269-V334 HydrophobicContact CB-CG1 3.81Å; I269-V334 HydrophobicContact CD1-CG1 3.72Å; I269-V334 HydrophobicContact CG1-CG1 4.34Å; I269-V334 HydrophobicContact CG2-CG1 3.95Å; I269-V335 WeakPolarHBondContact CA-O 3.41Å
270	H	98.1	Very high	96.4	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145	159.5	-68.5	-71.1	0	0	0	110.3	R251 W262 V272 I305 V334 V335 V337	R251-H270 PolarHBondContact NH2-CE1 2.9Å; R251-H270 PolarHBondContact NH2-ND1 3.48Å; W262-H270 PolarHBondContact O-NE2 3.21Å; H270-V272 HydrophobicContact CB-CG2 3.81Å; H270-I305 HydrophobicContact CB-CD1 4.11Å; H270-I305 VanDerWaalsContact ND1-CD1 3.34Å; H270-I305 WeakPolarHBondContact ND1-CD1 3.48Å; H270-V334 WeakPolarHBondContact O-CA 3.38Å; H270-V335 PolarHBondContact N-O 2.86Å; H270-V335 PolarHBondContact O-N 2.9Å; H270-V337 VanDerWaalsContact CD2-CG1 3.49Å; H270-V337 WeakPolarHBondContact CD2-CG1 3.42Å
271	I	98.4	Very high	96.5	Very high	8 Å²	8	57 Å²	57	4%	0.041	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118.9	159	-56	-179.9	0	0	0	106.6	L302 I304 I305 I332 G333 W362 I363 V366	I271-L302 HydrophobicContact CD1-CD1 3.91Å; I271-I304 HydrophobicContact CB-CG1 4.4Å; I271-I304 HydrophobicContact CG2-CG1 4.18Å; I271-I304 HydrophobicContact CG2-CG2 4.27Å; I271-I304 WeakPolarHBondContact O-CA 3.17Å; I271-I305 PolarHBondContact O-N 2.97Å; I271-I332 HydrophobicContact CG2-CD1 3.84Å; I271-I332 HydrophobicContact CG2-CG1 4.03Å; I271-G333 CarbonylContact C-O 3.57Å; I271-G333 WeakPolarHBondContact CA-O 3.05Å; I271-W362 HydrophobicContact CG2-CZ3 4.27Å; I271-I363 HydrophobicContact CD1-CG2 4.38Å; I271-V366 HydrophobicContact CD1-CG1 4Å; I271-V366 HydrophobicContact CG1-CG1 4.2Å
272	V	98.6	Very high	96.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.3	-174.2	-178.5	0	0	0	0	109.4	W262 H270 F274 I305 I307 I332 G333 V335 W344	W262-V272 HydrophobicContact CH2-CG2 4.06Å; W262-V272 HydrophobicContact CZ3-CG2 3.92Å; H270-V272 HydrophobicContact CB-CG2 3.81Å; V272-F274 HydrophobicContact CG1-CD2 4.46Å; V272-F274 HydrophobicContact CG1-CE2 4.12Å; V272-F274 HydrophobicContact CG1-CZ 4.4Å; V272-I305 CarbonylContact C-O 3.57Å; V272-I305 WeakPolarHBondContact CA-O 3.3Å; V272-I307 HydrophobicContact CG1-CD1 3.62Å; V272-I307 HydrophobicContact CG1-CG1 4.16Å; V272-I332 CarbonylContact O-C 3.54Å; V272-I332 WeakPolarHBondContact O-CA 3.26Å; V272-I332 WeakPolarHBondContact O-CG1 3.38Å; V272-G333 PolarHBondContact N-O 2.99Å; V272-G333 PolarHBondContact O-N 3.3Å; V272-V335 HydrophobicContact CB-CG2 4.23Å; V272-V335 HydrophobicContact CG2-CB 4.25Å; V272-V335 HydrophobicContact CG2-CG2 3.85Å; V272-W344 HydrophobicContact CB-CH2 4.24Å; V272-W344 HydrophobicContact CG1-CH2 4.26Å
273	A	98.7	Very high	96.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128	174.8	0	0	0	0	0	110.6	F285 L289 I304 I305 W306 I307 Q331 I332	A273-F285 HydrophobicContact CB-CE1 4.37Å; A273-L289 HydrophobicContact CB-CD1 3.72Å; A273-L289 HydrophobicContact CB-CD2 4Å; A273-I304 HydrophobicContact CB-CG2 4.14Å; A273-I305 PolarHBondContact N-O 2.91Å; A273-W306 CarbonylContact O-C 3.27Å; A273-W306 WeakPolarHBondContact O-CA 3.5Å; A273-I307 PolarHBondContact O-N 3.02Å; A273-Q331 CarbonylContact C-O 3.48Å; A273-Q331 VanDerWaalsContact CA-O 3.23Å; A273-Q331 WeakPolarHBondContact CA-O 3.42Å; A273-I332 HydrophobicContact CB-CB 4.27Å; A273-I332 HydrophobicContact CB-CD1 4.34Å; A273-I332 HydrophobicContact CB-CG1 4.03Å
274	F	98.6	Very high	96.7	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.5	171	-69.2	-80.8	0	0	0	110	V272 I307 P309 W319 F323 L327 P330 Q331 W344	V272-F274 HydrophobicContact CG1-CD2 4.46Å; V272-F274 HydrophobicContact CG1-CE2 4.12Å; V272-F274 HydrophobicContact CG1-CZ 4.4Å; F274-I307 WeakPolarHBondContact CA-O 3.36Å; F274-I307 HydrophobicContact CD1-CB 3.72Å; F274-I307 HydrophobicContact CD1-CD1 4.43Å; F274-I307 HydrophobicContact CD1-CG2 3.97Å; F274-I307 HydrophobicContact CE1-CB 3.79Å; F274-I307 HydrophobicContact CE1-CD1 3.74Å; F274-I307 HydrophobicContact CE1-CG1 4.3Å; F274-I307 HydrophobicContact CE1-CG2 3.78Å; F274-I307 HydrophobicContact CZ-CD1 3.96Å; F274-P309 HydrophobicContact CD1-CG 4.38Å; F274-W319 AromaticContact CE1-CD2 3.81Å; F274-W319 HydrophobicContact CE1-CD2 3.81Å; F274-W319 AromaticContact CE1-CE3 3.55Å; F274-W319 HydrophobicContact CE1-CE3 3.55Å; F274-W319 HydrophobicContact CE1-CG 4.36Å; F274-W319 HydrophobicContact CE1-CH2 4.27Å; F274-W319 AromaticContact CE1-CZ3 3.8Å; F274-W319 HydrophobicContact CE1-CZ3 3.8Å; F274-W319 HydrophobicContact CZ-CB 4.11Å; F274-W319 AromaticContact CZ-CD2 3.75Å; F274-W319 HydrophobicContact CZ-CD2 3.75Å; F274-W319 AromaticContact CZ-CE3 3.97Å; F274-W319 HydrophobicContact CZ-CE3 3.97Å; F274-W319 AromaticContact CZ-CG 3.85Å; F274-W319 HydrophobicContact CZ-CG 3.85Å; F274-F323 HydrophobicContact CE2-CD2 4.19Å; F274-F323 HydrophobicContact CE2-CE2 4.34Å; F274-F323 HydrophobicContact CZ-CD2 4.46Å; F274-F323 HydrophobicContact CZ-CE2 4.3Å; F274-L327 HydrophobicContact CB-CD2 3.8Å; F274-L327 HydrophobicContact CD1-CD1 4.37Å; F274-L327 HydrophobicContact CD1-CD2 3.85Å; F274-L327 HydrophobicContact CD2-CD2 3.49Å; F274-L327 VanDerWaalsContact CD2-CD2 3.49Å; F274-L327 HydrophobicContact CE1-CD1 4.19Å; F274-L327 HydrophobicContact CE1-CD2 4.26Å; F274-L327 HydrophobicContact CE2-CD2 3.92Å; F274-L327 HydrophobicContact CG-CD2 3.45Å; F274-L327 VanDerWaalsContact CG-CD2 3.45Å; F274-L327 HydrophobicContact CZ-CD1 4.39Å; F274-L327 HydrophobicContact CZ-CD2 4.28Å; F274-P330 WeakPolarHBondContact O-CA 3.33Å; F274-Q331 HydrophobicContact CB-CB 4.17Å; F274-Q331 HydrophobicContact CD2-CB 4.28Å; F274-Q331 PolarHBondContact N-O 3.15Å; F274-Q331 PolarHBondContact O-N 3.46Å; F274-W344 AromaticContact CD2-CH2 3.85Å; F274-W344 HydrophobicContact CD2-CH2 3.85Å; F274-W344 AromaticContact CD2-CZ3 3.92Å; F274-W344 HydrophobicContact CD2-CZ3 3.92Å; F274-W344 AromaticContact CE2-CH2 3.6Å; F274-W344 HydrophobicContact CE2-CH2 3.6Å; F274-W344 HydrophobicContact CE2-CZ2 4.41Å; F274-W344 HydrophobicContact CE2-CZ3 4.15Å
275	A	98	Very high	96.8	Very high	2 Å²	2	54.8 Å²	54.8	2%	0.017	27%	0.273	C	S	.	.			trans	-160.7	131.1	172.2	0	0	0	0	0	110.8	F285 W306 I307 D308	A275-F285 HydrophobicContact CB-CD1 4.26Å; A275-W306 PolarHBondContact O-NE1 3.44Å; A275-I307 PolarHBondContact N-O 3.46Å; A275-I307 VanDerWaalsContact N-O 3.15Å; A275-D308 WeakPolarHBondContact O-CA 3.46Å
276	E	97.6	Very high	96.8	Very high	66 Å²	66	52.1 Å²	52.1	31%	0.308	26%	0.259	S	S	.	.			trans	-81.2	124.7	173.2	-178.3	-176.4	146.4	0	0	109.9	D279 G282	E276-D279 HydrophobicContact CB-CB 4.01Å; E276-D279 HydrophobicContact CG-CB 4.07Å; E276-D279 PolarHBondContact O-N 3.25Å; E276-G282 CarbonylContact O-C 3.52Å; E276-G282 WeakPolarHBondContact O-CA 3.46Å
277	E	96.3	Very high	97	Very high	85 Å²	85	53.9 Å²	53.9	40%	0.397	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-29	-177.7	-157.6	-157.8	159.3	0	0	112.9	Y283 L286 W306 D308	E277-Y283 HydrophobicContact CG-CD2 4.49Å; E277-L286 HydrophobicContact CG-CD2 3.94Å; E277-W306 HydrophobicContact CB-CH2 4.4Å; E277-W306 HydrophobicContact CB-CZ2 4.24Å; E277-W306 HydrophobicContact CG-CH2 4.4Å; E277-D308 PolarHBondContact N-OD2 2.98Å
278	E	96	Very high	97.3	Very high	190 Å²	190	45.5 Å²	45.5	89%	0.888	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.8	178.4	-67	-146.2	161.5	0	0	113.6
279	D	96.5	Very high	97.5	Very high	55 Å²	55	44.7 Å²	44.7	29%	0.294	22%	0.219	S	C	.	.	S	Bend	trans	-85.3	141.2	175.8	-176.8	76.3	0	0	0	112.2	E276 D281 G282 Y283	E276-D279 HydrophobicContact CB-CB 4.01Å; E276-D279 HydrophobicContact CG-CB 4.07Å; E276-D279 PolarHBondContact O-N 3.25Å; D279-D281 PolarHBondContact O-N 3.26Å; D279-D281 PolarHBondContact OD2-N 3.01Å; D279-G282 PolarHBondContact OD2-N 3.4Å; D279-G282 VanDerWaalsContact OD2-N 3.11Å; D279-Y283 VanDerWaalsContact O-CB 3.26Å; D279-Y283 WeakPolarHBondContact O-CB 3.46Å; D279-Y283 PolarHBondContact O-N 3.16Å
280	P	96.1	Very high	97.6	Very high	91 Å²	91	42.2 Å²	42.2	59%	0.591	21%	0.206	S	C	*	.	H	α-helix	trans	-62.4	-37.2	-178.9	-23.9	36.2	0	0	0	115.1	E284	P280-E284 PolarHBondContact O-N 3.2Å; P280-E284 VanDerWaalsContact O-N 3.07Å
281	D	95.8	Very high	97.6	Very high	54 Å²	54	47.4 Å²	47.4	29%	0.289	23%	0.23	S	C	.	.	H	α-helix	trans	-86.9	-34.7	-173.7	-54.3	-31.1	0	0	0	109.3	D279 E284 F285	D279-D281 PolarHBondContact O-N 3.26Å; D279-D281 PolarHBondContact OD2-N 3.01Å; D281-E284 PolarHBondContact O-N 3.22Å; D281-F285 WeakPolarHBondContact O-CB 3.36Å; D281-F285 PolarHBondContact O-N 2.61Å
282	G	97.1	Very high	97.5	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-55.4	-47.9	163	0	0	0	0	0	113.1	E276 D279 F285 L286	E276-G282 CarbonylContact O-C 3.52Å; E276-G282 WeakPolarHBondContact O-CA 3.46Å; D279-G282 PolarHBondContact OD2-N 3.4Å; D279-G282 VanDerWaalsContact OD2-N 3.11Å; G282-F285 PolarHBondContact O-N 2.8Å; G282-L286 VanDerWaalsContact O-CB 3.31Å; G282-L286 WeakPolarHBondContact O-CB 3.37Å; G282-L286 PolarHBondContact O-N 3.19Å
283	Y	97.3	Very high	97.5	Very high	108 Å²	108	47.2 Å²	47.2	42%	0.424	23%	0.23	S	C	.	.	H	α-helix	trans	-64.3	-41.6	176.3	-175.5	-81.4	0	0	0	112.9	E277 D279 L286 E287	E277-Y283 HydrophobicContact CG-CD2 4.49Å; D279-Y283 VanDerWaalsContact O-CB 3.26Å; D279-Y283 WeakPolarHBondContact O-CB 3.46Å; D279-Y283 PolarHBondContact O-N 3.16Å; Y283-L286 PolarHBondContact O-N 3.02Å; Y283-E287 HydrophobicContact CD1-CG 4.18Å; Y283-E287 HydrophobicContact CE1-CG 3.56Å; Y283-E287 PolarHBondContact O-N 3.5Å
284	E	97.6	Very high	97.4	Very high	126 Å²	126	50.5 Å²	50.5	59%	0.589	24%	0.242	S	C	*	.	H	α-helix	trans	-65.6	-40.8	177.6	-173	154.9	165.8	0	0	111.4	P280 D281 E287 I288 L353	P280-E284 PolarHBondContact O-N 3.2Å; P280-E284 VanDerWaalsContact O-N 3.07Å; D281-E284 PolarHBondContact O-N 3.22Å; E284-E287 PolarHBondContact O-N 3.14Å; E284-I288 HydrophobicContact CG-CD1 4.4Å; E284-I288 WeakPolarHBondContact O-CD1 3.44Å; E284-I288 WeakPolarHBondContact O-CG1 3.24Å; E284-I288 PolarHBondContact O-N 3.06Å; E284-L353 HydrophobicContact CB-CD1 4.03Å; E284-L353 HydrophobicContact CG-CD1 4.17Å
285	F	98.1	Very high	97.3	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-39	173.1	-169.8	-112.5	0	0	0	112.9	A273 A275 D281 G282 I288 L289 P330 I332 L353 P354	A273-F285 HydrophobicContact CB-CE1 4.37Å; A275-F285 HydrophobicContact CB-CD1 4.26Å; D281-F285 WeakPolarHBondContact O-CB 3.36Å; D281-F285 PolarHBondContact O-N 2.61Å; G282-F285 PolarHBondContact O-N 2.8Å; F285-I288 WeakPolarHBondContact O-CB 3.46Å; F285-I288 PolarHBondContact O-N 2.92Å; F285-L289 HydrophobicContact CD1-CD1 3.77Å; F285-L289 HydrophobicContact CD1-CG 4.25Å; F285-L289 HydrophobicContact CE1-CD1 3.73Å; F285-L289 HydrophobicContact CE1-CD2 4.35Å; F285-L289 HydrophobicContact CE1-CG 4.08Å; F285-L289 HydrophobicContact CZ-CG 4.5Å; F285-L289 PolarHBondContact O-N 2.99Å; F285-P330 HydrophobicContact CB-CB 3.74Å; F285-P330 HydrophobicContact CB-CG 3.96Å; F285-P330 HydrophobicContact CD1-CB 3.64Å; F285-P330 HydrophobicContact CD2-CB 4.3Å; F285-P330 HydrophobicContact CE1-CB 4.27Å; F285-P330 HydrophobicContact CG-CB 3.64Å; F285-P330 HydrophobicContact CG-CG 4.4Å; F285-I332 HydrophobicContact CE1-CB 4.41Å; F285-I332 HydrophobicContact CZ-CB 3.96Å; F285-I332 HydrophobicContact CZ-CG2 3.96Å; F285-L353 HydrophobicContact CB-CD1 4.23Å; F285-L353 HydrophobicContact CB-CD2 4.32Å; F285-L353 HydrophobicContact CD2-CD2 4.25Å; F285-P354 HydrophobicContact CD2-CG 4.43Å; F285-P354 HydrophobicContact CE2-CG 3.78Å
286	L	98.1	Very high	97.2	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-40.8	176.6	176.9	60.2	0	0	0	112.4	E277 G282 Y283 I288 L289 K290 W306	E277-L286 HydrophobicContact CG-CD2 3.94Å; G282-L286 VanDerWaalsContact O-CB 3.31Å; G282-L286 WeakPolarHBondContact O-CB 3.37Å; G282-L286 PolarHBondContact O-N 3.19Å; Y283-L286 PolarHBondContact O-N 3.02Å; L286-I288 VanDerWaalsContact C-N 3.29Å; L286-I288 PolarHBondContact O-N 2.83Å; L286-L289 WeakPolarHBondContact O-CB 3.28Å; L286-L289 PolarHBondContact O-N 2.71Å; L286-K290 VanDerWaalsContact O-CG 3.31Å; L286-K290 WeakPolarHBondContact O-CG 3.08Å; L286-K290 PolarHBondContact O-N 3.38Å; L286-W306 HydrophobicContact CD1-CD2 3.66Å; L286-W306 HydrophobicContact CD1-CE3 3.69Å; L286-W306 HydrophobicContact CD1-CG 4.23Å; L286-W306 HydrophobicContact CD1-CH2 4.19Å; L286-W306 HydrophobicContact CD1-CZ2 4.18Å; L286-W306 HydrophobicContact CD1-CZ3 3.94Å; L286-W306 HydrophobicContact CD2-CH2 3.51Å; L286-W306 HydrophobicContact CD2-CZ2 3.63Å; L286-W306 HydrophobicContact CD2-CZ3 3.98Å
287	E	98.1	Very high	97.1	Very high	65 Å²	65	55.9 Å²	55.9	30%	0.304	28%	0.275	S	S	.	.	H	α-helix	trans	-66.1	-31.7	174.2	-70.5	-67.8	113.6	0	0	112.3	Y283 E284 K290 E291	Y283-E287 HydrophobicContact CD1-CG 4.18Å; Y283-E287 HydrophobicContact CE1-CG 3.56Å; Y283-E287 PolarHBondContact O-N 3.5Å; E284-E287 PolarHBondContact O-N 3.14Å; E287-K290 PolarHBondContact O-N 3.06Å; E287-K290 WeakPolarHBondContact OE1-CD 3.31Å; E287-K290 WeakPolarHBondContact OE1-CE 3.13Å; E287-K290 IonicContact OE1-NZ 3.45Å; E287-K290 PolarHBondContact OE1-NZ 2.68Å; E287-E291 PolarHBondContact O-N 2.92Å
288	I	98.2	Very high	96.9	Very high	26 Å²	26	58.2 Å²	58.2	13%	0.133	29%	0.286	C	S	.	.	H	α-helix	trans	-67.2	-44.2	172.7	-65.9	159.5	0	0	0	111	E284 F285 L286 K290 E291 V292 L353 A356 L359	E284-I288 HydrophobicContact CG-CD1 4.4Å; E284-I288 WeakPolarHBondContact O-CD1 3.44Å; E284-I288 WeakPolarHBondContact O-CG1 3.24Å; E284-I288 PolarHBondContact O-N 3.06Å; F285-I288 WeakPolarHBondContact O-CB 3.46Å; F285-I288 PolarHBondContact O-N 2.92Å; L286-I288 VanDerWaalsContact C-N 3.29Å; L286-I288 PolarHBondContact O-N 2.83Å; I288-K290 VanDerWaalsContact C-N 3.3Å; I288-K290 PolarHBondContact O-N 3.14Å; I288-E291 PolarHBondContact O-N 3.12Å; I288-E291 VanDerWaalsContact O-N 3.16Å; I288-V292 PolarHBondContact O-N 2.82Å; I288-L353 HydrophobicContact CD1-CB 4.46Å; I288-A356 HydrophobicContact CG2-CB 4.28Å; I288-L359 HydrophobicContact CG2-CD2 3.91Å
289	L	98.2	Very high	96.7	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.1	-43.7	173	-74	165.7	0	0	0	111.4	L250 A273 F285 L286 V292 A293 I304 I332 L359	L250-L289 HydrophobicContact CD2-CB 4.2Å; A273-L289 HydrophobicContact CB-CD1 3.72Å; A273-L289 HydrophobicContact CB-CD2 4Å; F285-L289 HydrophobicContact CD1-CD1 3.77Å; F285-L289 HydrophobicContact CD1-CG 4.25Å; F285-L289 HydrophobicContact CE1-CD1 3.73Å; F285-L289 HydrophobicContact CE1-CD2 4.35Å; F285-L289 HydrophobicContact CE1-CG 4.08Å; F285-L289 HydrophobicContact CZ-CG 4.5Å; F285-L289 PolarHBondContact O-N 2.99Å; L286-L289 WeakPolarHBondContact O-CB 3.28Å; L286-L289 PolarHBondContact O-N 2.71Å; L289-V292 PolarHBondContact O-N 2.85Å; L289-A293 VanDerWaalsContact O-CB 3.29Å; L289-A293 WeakPolarHBondContact O-CB 3.29Å; L289-A293 PolarHBondContact O-N 3.19Å; L289-I304 HydrophobicContact CD2-CD1 4.46Å; L289-I304 HydrophobicContact CD2-CG2 4.4Å; L289-I332 HydrophobicContact CD2-CD1 4.09Å; L289-L359 HydrophobicContact CD2-CD2 3.99Å
290	K	98.2	Very high	96.4	Very high	5 Å²	5	54.1 Å²	54.1	2%	0.022	28%	0.275	C	S	.	.	H	α-helix	trans	-65.1	-36.8	176.1	-66.1	175.2	-166.5	169.5	0	112.4	E163 F221 L250 L286 E287 I288 R294	E163-K290 WeakPolarHBondContact OE1-CE 3.01Å; E163-K290 IonicContact OE1-NZ 3.48Å; E163-K290 PolarHBondContact OE1-NZ 3.46Å; F221-K290 HydrophobicContact CB-CD 4.44Å; F221-K290 HydrophobicContact CB-CG 4Å; F221-K290 HydrophobicContact CD1-CD 3.91Å; F221-K290 HydrophobicContact CD1-CG 3.99Å; F221-K290 HydrophobicContact CG-CD 4.45Å; F221-K290 HydrophobicContact CG-CG 4.08Å; L250-K290 HydrophobicContact CD2-CG 3.97Å; L286-K290 VanDerWaalsContact O-CG 3.31Å; L286-K290 WeakPolarHBondContact O-CG 3.08Å; L286-K290 PolarHBondContact O-N 3.38Å; E287-K290 PolarHBondContact O-N 3.06Å; E287-K290 WeakPolarHBondContact OE1-CD 3.31Å; E287-K290 WeakPolarHBondContact OE1-CE 3.13Å; E287-K290 IonicContact OE1-NZ 3.45Å; E287-K290 PolarHBondContact OE1-NZ 2.68Å; I288-K290 VanDerWaalsContact C-N 3.3Å; I288-K290 PolarHBondContact O-N 3.14Å; K290-R294 WeakPolarHBondContact O-CB 3.21Å; K290-R294 WeakPolarHBondContact O-CD 3.38Å; K290-R294 WeakPolarHBondContact O-CG 3.38Å; K290-R294 PolarHBondContact O-N 2.85Å; K290-R294 VanDerWaalsContact O-N 3.12Å
291	E	97.8	Very high	96.2	Very high	111 Å²	111	55 Å²	55	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-50.9	174.4	-172.5	167.4	139.4	0	0	111.1	E287 I288 A293 R294 D295 A356	E287-E291 PolarHBondContact O-N 2.92Å; I288-E291 PolarHBondContact O-N 3.12Å; I288-E291 VanDerWaalsContact O-N 3.16Å; E291-A293 PolarHBondContact O-N 2.83Å; E291-R294 PolarHBondContact O-N 2.84Å; E291-D295 PolarHBondContact O-N 3.13Å; E291-A356 HydrophobicContact CB-CB 4.4Å; E291-A356 HydrophobicContact CG-CB 4.16Å
292	V	97.8	Very high	96.2	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-42	-179.7	176.4	0	0	0	0	112.1	I288 L289 R294 D295 N296 A356 L359 E360 I363	I288-V292 PolarHBondContact O-N 2.82Å; L289-V292 PolarHBondContact O-N 2.85Å; V292-R294 PolarHBondContact O-N 3Å; V292-D295 PolarHBondContact O-N 2.82Å; V292-N296 WeakPolarHBondContact O-CB 3.42Å; V292-N296 PolarHBondContact O-N 3.15Å; V292-N296 PolarHBondContact O-ND2 2.94Å; V292-N296 VanDerWaalsContact O-ND2 3.17Å; V292-A356 HydrophobicContact CG2-CB 3.74Å; V292-A356 VanDerWaalsContact CG2-O 3.28Å; V292-A356 WeakPolarHBondContact CG2-O 3.46Å; V292-L359 HydrophobicContact CG2-CB 4.17Å; V292-L359 HydrophobicContact CG2-CD2 4.09Å; V292-L359 HydrophobicContact CG2-CG 4.28Å; V292-E360 HydrophobicContact CG1-CB 4.38Å; V292-I363 HydrophobicContact CG1-CD1 3.97Å
293	A	97.6	Very high	96.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-38.7	176.5	0	0	0	0	0	112.5	M222 T249 L250 L289 E291 N296 T297	M222-A293 HydrophobicContact CE-CB 4.26Å; T249-A293 HydrophobicContact CG2-CB 4.19Å; L250-A293 HydrophobicContact CB-CB 3.7Å; L250-A293 HydrophobicContact CD2-CB 4.26Å; L289-A293 VanDerWaalsContact O-CB 3.29Å; L289-A293 WeakPolarHBondContact O-CB 3.29Å; L289-A293 PolarHBondContact O-N 3.19Å; E291-A293 PolarHBondContact O-N 2.83Å; A293-N296 CarbonylContact O-C 3.54Å; A293-N296 PolarHBondContact O-N 2.87Å; A293-T297 WeakPolarHBondContact O-CB 3.33Å; A293-T297 PolarHBondContact O-N 3.4Å
294	R	96.9	Very high	96.3	Very high	69 Å²	69	47.6 Å²	47.6	26%	0.26	24%	0.242	S	C	.	.	H	α-helix	trans	-66.8	-38.3	178.3	-74.6	162.7	-172.3	150.1	0.6	113.1	F221 M222 K290 E291 V292 T297	F221-R294 VanDerWaalsContact O-CZ 3.29Å; F221-R294 PolarHBondContact O-NE 2.7Å; F221-R294 PolarHBondContact O-NH2 2.92Å; M222-R294 HydrophobicContact SD-CB 4.27Å; M222-R294 HydrophobicContact SD-CG 3.64Å; K290-R294 WeakPolarHBondContact O-CB 3.21Å; K290-R294 WeakPolarHBondContact O-CD 3.38Å; K290-R294 WeakPolarHBondContact O-CG 3.38Å; K290-R294 PolarHBondContact O-N 2.85Å; K290-R294 VanDerWaalsContact O-N 3.12Å; E291-R294 PolarHBondContact O-N 2.84Å; V292-R294 PolarHBondContact O-N 3Å; R294-T297 VanDerWaalsContact O-CG2 3.3Å; R294-T297 WeakPolarHBondContact O-CG2 3.49Å
295	D	96.3	Very high	96.4	Very high	110 Å²	110	41.6 Å²	41.6	59%	0.588	21%	0.214	S	C	*	.	H	α-helix	trans	-75	-30.4	176.1	-83.8	-15.8	0	0	0	111.6	E291 V292 H298	E291-D295 PolarHBondContact O-N 3.13Å; V292-D295 PolarHBondContact O-N 2.82Å; D295-H298 PolarHBondContact O-CE1 2.98Å; D295-H298 PolarHBondContact O-ND1 3.47Å
296	N	95.8	Very high	96.4	Very high	14 Å²	14	41.6 Å²	41.6	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-102.1	3.3	-175.4	-70.9	-77.7	0	0	0	116.5	V292 A293 H298 L299 L302 E360	V292-N296 WeakPolarHBondContact O-CB 3.42Å; V292-N296 PolarHBondContact O-N 3.15Å; V292-N296 PolarHBondContact O-ND2 2.94Å; V292-N296 VanDerWaalsContact O-ND2 3.17Å; A293-N296 CarbonylContact O-C 3.54Å; A293-N296 PolarHBondContact O-N 2.87Å; N296-H298 PolarHBondContact O-N 3.34Å; N296-L299 HydrophobicContact CB-CD1 4.13Å; N296-L299 WeakPolarHBondContact O-CB 3.5Å; N296-L299 WeakPolarHBondContact O-CG 3.44Å; N296-L299 PolarHBondContact O-N 3.31Å; N296-L299 WeakPolarHBondContact OD1-CD1 3.35Å; N296-L302 HydrophobicContact CB-CD2 3.6Å; N296-E360 PolarHBondContact ND2-OE1 3.22Å
297	T	95.1	Very high	96.4	Very high	56 Å²	56	41.6 Å²	41.6	34%	0.344	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-13.8	174.5	-178.6	0	0	0	0	115.9	E219 T249 A293 R294 L299	E219-T297 PolarHBondContact OE2-OG1 2.85Å; T249-T297 VanDerWaalsContact OG1-CA 3.29Å; T249-T297 WeakPolarHBondContact OG1-CA 3.17Å; T249-T297 PolarHBondContact OG1-OG1 2.95Å; A293-T297 WeakPolarHBondContact O-CB 3.33Å; A293-T297 PolarHBondContact O-N 3.4Å; R294-T297 VanDerWaalsContact O-CG2 3.3Å; R294-T297 WeakPolarHBondContact O-CG2 3.49Å; T297-L299 VanDerWaalsContact C-N 3.34Å
298	H	92.4	Very high	96.4	Very high	135 Å²	135	39.1 Å²	39.1	63%	0.625	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.2	176	72.5	-81.7	0	0	0	114.3	D295 N296	D295-H298 PolarHBondContact O-CE1 2.98Å; D295-H298 PolarHBondContact O-ND1 3.47Å; N296-H298 PolarHBondContact O-N 3.34Å
299	L	92.7	Very high	96.4	Very high	58 Å²	58	38.2 Å²	38.2	30%	0.304	20%	0.199	S	C	.	.			trans	-98.8	109.6	177.9	-59.4	-176.2	0	0	0	110.1	N296 T297 D301 L302 L367	N296-L299 HydrophobicContact CB-CD1 4.13Å; N296-L299 WeakPolarHBondContact O-CB 3.5Å; N296-L299 WeakPolarHBondContact O-CG 3.44Å; N296-L299 PolarHBondContact O-N 3.31Å; N296-L299 WeakPolarHBondContact OD1-CD1 3.35Å; T297-L299 VanDerWaalsContact C-N 3.34Å; L299-D301 PolarHBondContact O-N 3.06Å; L299-L302 HydrophobicContact CB-CB 4.08Å; L299-L302 PolarHBondContact O-N 3.35Å; L299-L367 HydrophobicContact CD1-CD1 4.45Å
300	P	89.3	Confident	96.4	Very high	101 Å²	101	43.7 Å²	43.7	66%	0.656	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-15	-175.3	31.9	-36.7	0	0	0	113.7
301	D	91.1	Very high	96.3	Very high	108 Å²	108	47.4 Å²	47.4	58%	0.578	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	4.4	-177	-45	-54.8	0	0	0	111.7	I266 L299	I266-D301 WeakPolarHBondContact CD1-O 3.39Å; L299-D301 PolarHBondContact O-N 3.06Å
302	L	96.6	Very high	96.3	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	23%	0.225	C	C	.	.			trans	-104.8	121.1	174.5	176.2	59.8	0	0	0	110.5	T249 I271 N296 L299 I304 I363 L367	T249-L302 HydrophobicContact CG2-CD2 3.84Å; T249-L302 HydrophobicContact CG2-CG 4.01Å; I271-L302 HydrophobicContact CD1-CD1 3.91Å; N296-L302 HydrophobicContact CB-CD2 3.6Å; L299-L302 HydrophobicContact CB-CB 4.08Å; L299-L302 PolarHBondContact O-N 3.35Å; L302-I304 HydrophobicContact CD1-CD1 4.36Å; L302-I304 HydrophobicContact CD1-CG1 3.92Å; L302-I363 HydrophobicContact CD1-CG2 3.76Å; L302-I363 HydrophobicContact CD2-CG2 4.41Å; L302-L367 HydrophobicContact CB-CD1 4.27Å; L302-L367 HydrophobicContact CD1-CD1 4.38Å
303	S	98.1	Very high	96.2	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.028	25%	0.247	C	C	.	.			trans	-144.5	123.8	164	-168	0	0	0	0	109.2	P248 T249 R251	P248-S303 WeakPolarHBondContact O-CB 3.35Å; P248-S303 PolarHBondContact O-OG 3.43Å; T249-S303 WeakPolarHBondContact O-CA 3.29Å; R251-S303 PolarHBondContact NE-OG 3.3Å
304	I	98.7	Very high	96.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.1	178.7	-54.2	173.5	0	0	0	108.2	T249 L250 R251 I271 A273 L289 L302 I363	T249-I304 PolarHBondContact O-N 2.9Å; L250-I304 WeakPolarHBondContact CA-O 3.28Å; L250-I304 HydrophobicContact CD1-CB 3.86Å; L250-I304 HydrophobicContact CD1-CG2 3.88Å; R251-I304 WeakPolarHBondContact CG-O 3.5Å; R251-I304 PolarHBondContact N-O 2.85Å; I271-I304 HydrophobicContact CB-CG1 4.4Å; I271-I304 HydrophobicContact CG2-CG1 4.18Å; I271-I304 HydrophobicContact CG2-CG2 4.27Å; I271-I304 WeakPolarHBondContact O-CA 3.17Å; A273-I304 HydrophobicContact CB-CG2 4.14Å; L289-I304 HydrophobicContact CD2-CD1 4.46Å; L289-I304 HydrophobicContact CD2-CG2 4.4Å; L302-I304 HydrophobicContact CD1-CD1 4.36Å; L302-I304 HydrophobicContact CD1-CG1 3.92Å; I304-I363 HydrophobicContact CD1-CD1 3.86Å
305	I	98.8	Very high	96.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.2	168	-60.8	179.6	0	0	0	108	R251 L253 T261 W262 H270 I271 V272 A273 I307	R251-I305 HydrophobicContact CG-CG1 4.11Å; R251-I305 CarbonylContact O-C 3.59Å; R251-I305 WeakPolarHBondContact O-CA 3.3Å; L253-I305 HydrophobicContact CB-CG2 3.81Å; L253-I305 HydrophobicContact CD1-CG2 4.32Å; T261-I305 HydrophobicContact CG2-CD1 4.03Å; T261-I305 HydrophobicContact CG2-CG1 4.27Å; W262-I305 HydrophobicContact CE3-CD1 4.2Å; H270-I305 HydrophobicContact CB-CD1 4.11Å; H270-I305 VanDerWaalsContact ND1-CD1 3.34Å; H270-I305 WeakPolarHBondContact ND1-CD1 3.48Å; I271-I305 PolarHBondContact O-N 2.97Å; V272-I305 CarbonylContact C-O 3.57Å; V272-I305 WeakPolarHBondContact CA-O 3.3Å; A273-I305 PolarHBondContact N-O 2.91Å; I305-I307 HydrophobicContact CG2-CD1 4.41Å; I305-I307 HydrophobicContact CG2-CG1 3.84Å
306	W	98.8	Very high	96.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.5	163	167.4	40.9	0	0	0	109.4	E164 F221 L250 R251 K252 L253 A273 A275 E277 L286 D308	E164-W306 VanDerWaalsContact OE1-CH2 3.28Å; E164-W306 WeakPolarHBondContact OE1-CH2 3.4Å; E164-W306 WeakPolarHBondContact OE1-CZ3 3.37Å; F221-W306 HydrophobicContact CE1-CE3 4.41Å; F221-W306 HydrophobicContact CE1-CZ3 4.09Å; F221-W306 AromaticContact CZ-CE3 3.78Å; F221-W306 HydrophobicContact CZ-CE3 3.78Å; F221-W306 AromaticContact CZ-CZ3 3.79Å; F221-W306 HydrophobicContact CZ-CZ3 3.79Å; L250-W306 HydrophobicContact CD1-CB 4.04Å; R251-W306 PolarHBondContact O-N 3.44Å; K252-W306 CarbonylContact C-O 3.56Å; K252-W306 WeakPolarHBondContact CA-O 3.41Å; K252-W306 HydrophobicContact CB-CE3 4.01Å; K252-W306 HydrophobicContact CB-CZ3 4.38Å; K252-W306 HydrophobicContact CD-CE3 3.99Å; K252-W306 HydrophobicContact CD-CH2 3.99Å; K252-W306 HydrophobicContact CD-CZ3 3.64Å; K252-W306 HydrophobicContact CG-CD2 4.31Å; K252-W306 HydrophobicContact CG-CE3 3.87Å; K252-W306 HydrophobicContact CG-CZ3 4.07Å; L253-W306 PolarHBondContact N-O 2.95Å; A273-W306 CarbonylContact O-C 3.27Å; A273-W306 WeakPolarHBondContact O-CA 3.5Å; A275-W306 PolarHBondContact O-NE1 3.44Å; E277-W306 HydrophobicContact CB-CH2 4.4Å; E277-W306 HydrophobicContact CB-CZ2 4.24Å; E277-W306 HydrophobicContact CG-CH2 4.4Å; L286-W306 HydrophobicContact CD1-CD2 3.66Å; L286-W306 HydrophobicContact CD1-CE3 3.69Å; L286-W306 HydrophobicContact CD1-CG 4.23Å; L286-W306 HydrophobicContact CD1-CH2 4.19Å; L286-W306 HydrophobicContact CD1-CZ2 4.18Å; L286-W306 HydrophobicContact CD1-CZ3 3.94Å; L286-W306 HydrophobicContact CD2-CH2 3.51Å; L286-W306 HydrophobicContact CD2-CZ2 3.63Å; L286-W306 HydrophobicContact CD2-CZ3 3.98Å; W306-D308 HydrophobicContact CZ2-CB 4.21Å
307	I	98.8	Very high	96.3	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.4	172.4	-50.5	179.8	0	0	0	107.6	L253 V272 A273 F274 A275 I305 F312 W319	L253-I307 HydrophobicContact CB-CG1 3.92Å; L253-I307 HydrophobicContact CD2-CD1 3.76Å; L253-I307 HydrophobicContact CD2-CG1 3.86Å; L253-I307 HydrophobicContact CD2-CG2 4.25Å; V272-I307 HydrophobicContact CG1-CD1 3.62Å; V272-I307 HydrophobicContact CG1-CG1 4.16Å; A273-I307 PolarHBondContact O-N 3.02Å; F274-I307 WeakPolarHBondContact CA-O 3.36Å; F274-I307 HydrophobicContact CD1-CB 3.72Å; F274-I307 HydrophobicContact CD1-CD1 4.43Å; F274-I307 HydrophobicContact CD1-CG2 3.97Å; F274-I307 HydrophobicContact CE1-CB 3.79Å; F274-I307 HydrophobicContact CE1-CD1 3.74Å; F274-I307 HydrophobicContact CE1-CG1 4.3Å; F274-I307 HydrophobicContact CE1-CG2 3.78Å; F274-I307 HydrophobicContact CZ-CD1 3.96Å; A275-I307 PolarHBondContact N-O 3.46Å; A275-I307 VanDerWaalsContact N-O 3.15Å; I305-I307 HydrophobicContact CG2-CD1 4.41Å; I305-I307 HydrophobicContact CG2-CG1 3.84Å; I307-F312 HydrophobicContact CG2-CD2 3.89Å; I307-F312 HydrophobicContact CG2-CE2 4.2Å; I307-W319 HydrophobicContact CD1-CZ2 4.27Å; I307-W319 HydrophobicContact CG2-CH2 3.66Å; I307-W319 HydrophobicContact CG2-CZ2 4.41Å; I307-W319 HydrophobicContact CG2-CZ3 4.01Å
308	D	98.4	Very high	96.4	Very high	13 Å²	13	54.4 Å²	54.4	7%	0.07	29%	0.291	C	S	.	.			trans	-80.1	122.1	162	-165.2	-49.1	0	0	0	108.5	A275 E277 W306 D310 D311	A275-D308 WeakPolarHBondContact O-CA 3.46Å; E277-D308 PolarHBondContact N-OD2 2.98Å; W306-D308 HydrophobicContact CZ2-CB 4.21Å; D308-D310 PolarHBondContact O-N 3.16Å; D308-D310 PolarHBondContact OD1-N 3.41Å; D308-D311 PolarHBondContact O-N 3.43Å
309	P	97.8	Very high	96.7	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.039	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-57.9	-33.9	178.4	-24.6	35.1	0	0	0	113.6	F274 D311 F312 I316	F274-P309 HydrophobicContact CD1-CG 4.38Å; P309-D311 VanDerWaalsContact C-N 3.34Å; P309-D311 PolarHBondContact O-N 2.89Å; P309-F312 CarbonylContact O-C 3.48Å; P309-F312 VanDerWaalsContact O-C 3.27Å; P309-F312 PolarHBondContact O-N 2.83Å; P309-I316 HydrophobicContact CB-CD1 3.86Å; P309-I316 HydrophobicContact CB-CG1 4.04Å; P309-I316 WeakPolarHBondContact O-CD1 3.23Å
310	D	97	Very high	96.9	Very high	115 Å²	115	48.8 Å²	48.8	62%	0.615	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-80.1	-15.6	-170.9	-135.7	40.1	0	0	0	112.8	D308 F312 P313	D308-D310 PolarHBondContact O-N 3.16Å; D308-D310 PolarHBondContact OD1-N 3.41Å; D310-F312 VanDerWaalsContact C-N 3.28Å; D310-P313 WeakPolarHBondContact O-CD 3.28Å
311	D	96.9	Very high	97.3	Very high	84 Å²	84	51.5 Å²	51.5	45%	0.449	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-69.4	-24.8	164.1	-85.5	-32.4	0	0	0	112	K252 D308 P309 P313	K252-D311 WeakPolarHBondContact CE-OD2 3.37Å; K252-D311 IonicContact NZ-OD2 2.65Å; D308-D311 PolarHBondContact O-N 3.43Å; P309-D311 VanDerWaalsContact C-N 3.34Å; P309-D311 PolarHBondContact O-N 2.89Å; D311-P313 VanDerWaalsContact C-CD 3.44Å
312	F	97.4	Very high	97.6	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.022	25%	0.248	C	C	.	.			trans	-128.9	52.8	-173.6	-58.8	-87.7	0	0	0	114.3	L253 A255 M258 I307 P309 D310 L314 L315 I316 W319	L253-F312 HydrophobicContact CB-CE2 4.31Å; L253-F312 HydrophobicContact CB-CZ 4.41Å; L253-F312 HydrophobicContact CD2-CE2 4.08Å; L253-F312 HydrophobicContact CD2-CZ 3.96Å; L253-F312 HydrophobicContact CG-CE2 4.17Å; L253-F312 HydrophobicContact CG-CZ 3.87Å; L253-F312 VanDerWaalsContact O-CE2 3.29Å; L253-F312 WeakPolarHBondContact O-CE2 3.29Å; A255-F312 HydrophobicContact CB-CE1 4.22Å; A255-F312 HydrophobicContact CB-CZ 4.48Å; M258-F312 HydrophobicContact CB-CE1 4.26Å; M258-F312 HydrophobicContact CB-CZ 4.42Å; M258-F312 HydrophobicContact CE-CE1 4.22Å; M258-F312 HydrophobicContact SD-CD1 4.47Å; M258-F312 HydrophobicContact SD-CE1 3.85Å; I307-F312 HydrophobicContact CG2-CD2 3.89Å; I307-F312 HydrophobicContact CG2-CE2 4.2Å; P309-F312 CarbonylContact O-C 3.48Å; P309-F312 VanDerWaalsContact O-C 3.27Å; P309-F312 PolarHBondContact O-N 2.83Å; D310-F312 VanDerWaalsContact C-N 3.28Å; F312-L314 PolarHBondContact O-N 3.26Å; F312-L315 HydrophobicContact CB-CB 4.23Å; F312-L315 HydrophobicContact CB-CD1 4.19Å; F312-L315 HydrophobicContact CB-CG 4.38Å; F312-L315 HydrophobicContact CD1-CD1 3.97Å; F312-L315 HydrophobicContact CG-CD1 4.39Å; F312-L315 PolarHBondContact O-N 3.12Å; F312-I316 PolarHBondContact O-N 3.41Å; F312-W319 HydrophobicContact CB-CH2 3.47Å; F312-W319 VanDerWaalsContact CB-CH2 3.47Å; F312-W319 HydrophobicContact CB-CZ3 3.68Å; F312-W319 HydrophobicContact CD1-CH2 4.49Å; F312-W319 HydrophobicContact CD2-CH2 4.07Å; F312-W319 AromaticContact CG-CH2 3.79Å; F312-W319 HydrophobicContact CG-CH2 3.79Å; F312-W319 HydrophobicContact CG-CZ3 4.43Å
313	P	96.3	Very high	97.6	Very high	76 Å²	76	48.3 Å²	48.3	49%	0.494	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.8	-171.2	28.5	-37.1	0	0	0	114.7	D310 D311	D310-P313 WeakPolarHBondContact O-CD 3.28Å; D311-P313 VanDerWaalsContact C-CD 3.44Å
314	L	96.3	Very high	97.5	Very high	159 Å²	159	56 Å²	56	83%	0.832	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-17	172	-61.2	-178.4	0	0	0	113.3	F312	F312-L314 PolarHBondContact O-N 3.26Å
315	L	97.3	Very high	97.3	Very high	50 Å²	50	56.8 Å²	56.8	26%	0.262	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-22.2	-178.7	-59.6	-177.5	0	0	0	113	M258 F312 Y318 W319	M258-L315 HydrophobicContact CE-CD1 4.02Å; F312-L315 HydrophobicContact CB-CB 4.23Å; F312-L315 HydrophobicContact CB-CD1 4.19Å; F312-L315 HydrophobicContact CB-CG 4.38Å; F312-L315 HydrophobicContact CD1-CD1 3.97Å; F312-L315 HydrophobicContact CG-CD1 4.39Å; F312-L315 PolarHBondContact O-N 3.12Å; L315-Y318 WeakPolarHBondContact O-CA 3.42Å; L315-Y318 WeakPolarHBondContact O-CB 3.11Å; L315-Y318 PolarHBondContact O-N 3.24Å; L315-W319 HydrophobicContact CB-CD2 3.86Å; L315-W319 HydrophobicContact CB-CE3 3.76Å; L315-W319 HydrophobicContact CB-CH2 3.64Å; L315-W319 HydrophobicContact CB-CZ2 3.71Å; L315-W319 HydrophobicContact CB-CZ3 3.65Å; L315-W319 HydrophobicContact CD1-CH2 3.8Å; L315-W319 HydrophobicContact CD1-CZ2 3.56Å; L315-W319 HydrophobicContact CG-CH2 4.34Å; L315-W319 HydrophobicContact CG-CZ2 4.28Å; L315-W319 PolarHBondContact O-N 2.91Å
316	I	97.2	Very high	97.1	Very high	28 Å²	28	60.5 Å²	60.5	14%	0.144	31%	0.306	C	S	.	.	H	α-helix	trans	-44	-53.7	174.7	-59.2	176.3	0	0	0	112.2	P309 F312 Y318 W319 E320 L327	P309-I316 HydrophobicContact CB-CD1 3.86Å; P309-I316 HydrophobicContact CB-CG1 4.04Å; P309-I316 WeakPolarHBondContact O-CD1 3.23Å; F312-I316 PolarHBondContact O-N 3.41Å; I316-Y318 PolarHBondContact O-N 3.49Å; I316-Y318 VanDerWaalsContact O-N 3.16Å; I316-W319 PolarHBondContact O-N 3.3Å; I316-E320 HydrophobicContact CG2-CG 4.15Å; I316-E320 WeakPolarHBondContact O-CG 3.19Å; I316-E320 PolarHBondContact O-N 2.98Å; I316-L327 HydrophobicContact CB-CD1 4.44Å; I316-L327 HydrophobicContact CG2-CB 4.15Å; I316-L327 HydrophobicContact CG2-CD1 4.06Å
317	P	97.9	Very high	96.9	Very high	78 Å²	78	60.9 Å²	60.9	51%	0.506	31%	0.308	S	S	.	.	H	α-helix	trans	-74.9	-8.6	-176.5	-12.7	31.1	0	0	0	113.9	K321	P317-K321 VanDerWaalsContact O-CB 3.3Å; P317-K321 WeakPolarHBondContact O-CB 3.47Å
318	Y	97.4	Very high	96.6	Very high	115 Å²	115	68.5 Å²	68.5	45%	0.451	34%	0.341	S	S	.	.	H	α-helix	trans	-84.6	-48.7	168.7	167.4	-98.4	0	0	0	110.1	L315 I316 K321 T322	L315-Y318 WeakPolarHBondContact O-CA 3.42Å; L315-Y318 WeakPolarHBondContact O-CB 3.11Å; L315-Y318 PolarHBondContact O-N 3.24Å; I316-Y318 PolarHBondContact O-N 3.49Å; I316-Y318 VanDerWaalsContact O-N 3.16Å; Y318-K321 PolarHBondContact O-N 2.71Å; Y318-T322 WeakPolarHBondContact CE2-OG1 3.48Å; Y318-T322 WeakPolarHBondContact O-CB 3.35Å; Y318-T322 PolarHBondContact O-N 3.18Å; Y318-T322 PolarHBondContact O-OG1 3.35Å
319	W	98.1	Very high	96.3	Very high	15 Å²	15	71.7 Å²	71.7	6%	0.057	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-50.3	179.5	-67.2	-42.5	0	0	0	112.6	F274 I307 F312 L315 I316 K321 T322 F323 L327	F274-W319 AromaticContact CE1-CD2 3.81Å; F274-W319 HydrophobicContact CE1-CD2 3.81Å; F274-W319 AromaticContact CE1-CE3 3.55Å; F274-W319 HydrophobicContact CE1-CE3 3.55Å; F274-W319 HydrophobicContact CE1-CG 4.36Å; F274-W319 HydrophobicContact CE1-CH2 4.27Å; F274-W319 AromaticContact CE1-CZ3 3.8Å; F274-W319 HydrophobicContact CE1-CZ3 3.8Å; F274-W319 HydrophobicContact CZ-CB 4.11Å; F274-W319 AromaticContact CZ-CD2 3.75Å; F274-W319 HydrophobicContact CZ-CD2 3.75Å; F274-W319 AromaticContact CZ-CE3 3.97Å; F274-W319 HydrophobicContact CZ-CE3 3.97Å; F274-W319 AromaticContact CZ-CG 3.85Å; F274-W319 HydrophobicContact CZ-CG 3.85Å; I307-W319 HydrophobicContact CD1-CZ2 4.27Å; I307-W319 HydrophobicContact CG2-CH2 3.66Å; I307-W319 HydrophobicContact CG2-CZ2 4.41Å; I307-W319 HydrophobicContact CG2-CZ3 4.01Å; F312-W319 HydrophobicContact CB-CH2 3.47Å; F312-W319 VanDerWaalsContact CB-CH2 3.47Å; F312-W319 HydrophobicContact CB-CZ3 3.68Å; F312-W319 HydrophobicContact CD1-CH2 4.49Å; F312-W319 HydrophobicContact CD2-CH2 4.07Å; F312-W319 AromaticContact CG-CH2 3.79Å; F312-W319 HydrophobicContact CG-CH2 3.79Å; F312-W319 HydrophobicContact CG-CZ3 4.43Å; L315-W319 HydrophobicContact CB-CD2 3.86Å; L315-W319 HydrophobicContact CB-CE3 3.76Å; L315-W319 HydrophobicContact CB-CH2 3.64Å; L315-W319 HydrophobicContact CB-CZ2 3.71Å; L315-W319 HydrophobicContact CB-CZ3 3.65Å; L315-W319 HydrophobicContact CD1-CH2 3.8Å; L315-W319 HydrophobicContact CD1-CZ2 3.56Å; L315-W319 HydrophobicContact CG-CH2 4.34Å; L315-W319 HydrophobicContact CG-CZ2 4.28Å; L315-W319 PolarHBondContact O-N 2.91Å; I316-W319 PolarHBondContact O-N 3.3Å; W319-K321 PolarHBondContact O-N 2.89Å; W319-T322 PolarHBondContact O-N 2.84Å; W319-T322 VanDerWaalsContact O-N 3.16Å; W319-F323 HydrophobicContact CB-CD2 3.99Å; W319-F323 HydrophobicContact CB-CE2 4.19Å; W319-F323 AromaticContact CD1-CE2 3.39Å; W319-F323 HydrophobicContact CG-CD2 4.33Å; W319-F323 HydrophobicContact CG-CE2 4.02Å; W319-F323 WeakPolarHBondContact O-CB 3.32Å; W319-F323 PolarHBondContact O-N 3.47Å; W319-L327 HydrophobicContact CB-CD1 3.7Å; W319-L327 HydrophobicContact CE3-CD1 3.98Å
320	E	97.3	Very high	96.3	Very high	60 Å²	60	71.8 Å²	71.8	28%	0.28	35%	0.353	S	S	.	.	H	α-helix	trans	-50.9	-44.6	173.3	-69	174.9	145.1	0	0	111.5	I316 K324 L327	I316-E320 HydrophobicContact CG2-CG 4.15Å; I316-E320 WeakPolarHBondContact O-CG 3.19Å; I316-E320 PolarHBondContact O-N 2.98Å; E320-K324 WeakPolarHBondContact O-CA 3.48Å; E320-K324 PolarHBondContact O-N 2.87Å; E320-L327 HydrophobicContact CG-CB 4.26Å; E320-L327 HydrophobicContact CG-CD1 4.26Å; E320-L327 HydrophobicContact CG-CG 4.05Å
321	K	97.4	Very high	96.4	Very high	158 Å²	158	67.3 Å²	67.3	69%	0.687	33%	0.328	S	S	*	.	H	α-helix	trans	-72	-37.7	-177.7	-179.3	-173.6	167.4	-118.5	0	112.8	P317 Y318 W319 K324	P317-K321 VanDerWaalsContact O-CB 3.3Å; P317-K321 WeakPolarHBondContact O-CB 3.47Å; Y318-K321 PolarHBondContact O-N 2.71Å; W319-K321 PolarHBondContact O-N 2.89Å; K321-K324 PolarHBondContact O-NZ 2.9Å
322	T	96.6	Very high	96.4	Very high	37 Å²	37	63.3 Å²	63.3	23%	0.227	31%	0.307	C	S	.	.	H	α-helix	trans	-78.6	-59.3	-177.7	-61.4	0	0	0	0	109.8	Y318 W319 K324 A340	Y318-T322 WeakPolarHBondContact CE2-OG1 3.48Å; Y318-T322 WeakPolarHBondContact O-CB 3.35Å; Y318-T322 PolarHBondContact O-N 3.18Å; Y318-T322 PolarHBondContact O-OG1 3.35Å; W319-T322 PolarHBondContact O-N 2.84Å; W319-T322 VanDerWaalsContact O-N 3.16Å; T322-K324 PolarHBondContact O-N 2.95Å; T322-K324 PolarHBondContact O-NZ 3.4Å; T322-A340 HydrophobicContact CG2-CB 4.22Å
323	F	96.4	Very high	96.4	Very high	11 Å²	11	63.1 Å²	63.1	5%	0.048	31%	0.306	C	S	.	.	H	α-helix	trans	-83	-9.1	-173.7	-55.2	-36.3	0	0	0	114.7	F274 W319 V325 V335 S342 W344	F274-F323 HydrophobicContact CE2-CD2 4.19Å; F274-F323 HydrophobicContact CE2-CE2 4.34Å; F274-F323 HydrophobicContact CZ-CD2 4.46Å; F274-F323 HydrophobicContact CZ-CE2 4.3Å; W319-F323 HydrophobicContact CB-CD2 3.99Å; W319-F323 HydrophobicContact CB-CE2 4.19Å; W319-F323 AromaticContact CD1-CE2 3.39Å; W319-F323 HydrophobicContact CG-CD2 4.33Å; W319-F323 HydrophobicContact CG-CE2 4.02Å; W319-F323 WeakPolarHBondContact O-CB 3.32Å; W319-F323 PolarHBondContact O-N 3.47Å; F323-V325 HydrophobicContact CB-CG1 4.46Å; F323-V325 HydrophobicContact CB-CG2 4.14Å; F323-V325 PolarHBondContact O-N 2.83Å; F323-V325 VanDerWaalsContact O-N 3.14Å; F323-V335 HydrophobicContact CE1-CG1 3.76Å; F323-V335 HydrophobicContact CE1-CG2 4.04Å; F323-V335 HydrophobicContact CE2-CG2 4.47Å; F323-V335 HydrophobicContact CZ-CG1 3.9Å; F323-V335 HydrophobicContact CZ-CG2 3.96Å; F323-S342 WeakPolarHBondContact CD1-OG 3.33Å; F323-W344 HydrophobicContact CB-CZ2 3.88Å; F323-W344 HydrophobicContact CD1-CZ2 4.31Å; F323-W344 HydrophobicContact CD2-CH2 4.34Å; F323-W344 AromaticContact CD2-CZ2 3.71Å; F323-W344 HydrophobicContact CD2-CZ2 3.71Å; F323-W344 HydrophobicContact CE2-CZ2 4.28Å; F323-W344 AromaticContact CG-CZ2 3.72Å; F323-W344 HydrophobicContact CG-CZ2 3.72Å
324	K	96.1	Very high	96.5	Very high	164 Å²	164	59.5 Å²	59.5	71%	0.713	28%	0.283	S	S	*	.			trans	67.3	3.4	178.9	-46.3	-61.7	-178.8	-75.6	0	115.9	E320 K321 T322	E320-K324 WeakPolarHBondContact O-CA 3.48Å; E320-K324 PolarHBondContact O-N 2.87Å; K321-K324 PolarHBondContact O-NZ 2.9Å; T322-K324 PolarHBondContact O-N 2.95Å; T322-K324 PolarHBondContact O-NZ 3.4Å
325	V	95.3	Very high	96.6	Very high	18 Å²	18	52 Å²	52	11%	0.109	24%	0.243	C	C	.	.			trans	-75.4	161.4	175.6	-60.9	0	0	0	0	113.2	F323 L327 Q331 W344	F323-V325 HydrophobicContact CB-CG1 4.46Å; F323-V325 HydrophobicContact CB-CG2 4.14Å; F323-V325 PolarHBondContact O-N 2.83Å; F323-V325 VanDerWaalsContact O-N 3.14Å; V325-L327 HydrophobicContact CG2-CD2 3.62Å; V325-L327 HydrophobicContact CG2-CG 4.12Å; V325-Q331 HydrophobicContact CB-CG 3.96Å; V325-Q331 HydrophobicContact CG1-CG 4.31Å; V325-Q331 HydrophobicContact CG2-CG 4.29Å; V325-W344 HydrophobicContact CG1-CB 4.31Å; V325-W344 HydrophobicContact CG1-CD2 3.52Å; V325-W344 HydrophobicContact CG1-CE3 3.91Å; V325-W344 HydrophobicContact CG1-CG 3.64Å
326	D	94.5	Very high	96.5	Very high	77 Å²	77	50.8 Å²	50.8	41%	0.412	24%	0.237	S	C	.	.			trans	-99.5	113.5	169.6	-172.1	-17.6	0	0	0	108.8	F328 Q331	D326-F328 VanDerWaalsContact C-N 3.31Å; D326-F328 WeakPolarHBondContact OD1-CB 3.4Å; D326-F328 WeakPolarHBondContact OD1-CD2 3.34Å; D326-F328 PolarHBondContact OD1-N 3.03Å; D326-F328 VanDerWaalsContact OD1-N 3.08Å; D326-Q331 PolarHBondContact O-NE2 2.81Å
327	L	95.6	Very high	96.4	Very high	9 Å²	9	51.9 Å²	51.9	5%	0.047	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	3	-176.2	-66.9	-172.8	0	0	0	114.1	F274 I316 W319 E320 V325 R329 Q331	F274-L327 HydrophobicContact CB-CD2 3.8Å; F274-L327 HydrophobicContact CD1-CD1 4.37Å; F274-L327 HydrophobicContact CD1-CD2 3.85Å; F274-L327 HydrophobicContact CD2-CD2 3.49Å; F274-L327 VanDerWaalsContact CD2-CD2 3.49Å; F274-L327 HydrophobicContact CE1-CD1 4.19Å; F274-L327 HydrophobicContact CE1-CD2 4.26Å; F274-L327 HydrophobicContact CE2-CD2 3.92Å; F274-L327 HydrophobicContact CG-CD2 3.45Å; F274-L327 VanDerWaalsContact CG-CD2 3.45Å; F274-L327 HydrophobicContact CZ-CD1 4.39Å; F274-L327 HydrophobicContact CZ-CD2 4.28Å; I316-L327 HydrophobicContact CB-CD1 4.44Å; I316-L327 HydrophobicContact CG2-CB 4.15Å; I316-L327 HydrophobicContact CG2-CD1 4.06Å; W319-L327 HydrophobicContact CB-CD1 3.7Å; W319-L327 HydrophobicContact CE3-CD1 3.98Å; E320-L327 HydrophobicContact CG-CB 4.26Å; E320-L327 HydrophobicContact CG-CD1 4.26Å; E320-L327 HydrophobicContact CG-CG 4.05Å; V325-L327 HydrophobicContact CG2-CD2 3.62Å; V325-L327 HydrophobicContact CG2-CG 4.12Å; L327-R329 PolarHBondContact O-N 3.47Å; L327-Q331 HydrophobicContact CD2-CG 4.26Å
328	F	91	Very high	96.1	Very high	161 Å²	161	53.7 Å²	53.7	71%	0.706	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	13.3	164.6	-65.1	-81.9	0	0	0	112.5	D326	D326-F328 VanDerWaalsContact C-N 3.31Å; D326-F328 WeakPolarHBondContact OD1-CB 3.4Å; D326-F328 WeakPolarHBondContact OD1-CD2 3.34Å; D326-F328 PolarHBondContact OD1-N 3.03Å; D326-F328 VanDerWaalsContact OD1-N 3.08Å
329	R	93.6	Very high	95.9	Very high	80 Å²	80	53 Å²	53	30%	0.302	26%	0.259	S	S	.	.	S	Bend	trans	-144.3	155.3	-178.7	-67.5	-177.9	163.8	-172.1	-11	110.1	L327 E350	L327-R329 PolarHBondContact O-N 3.47Å; R329-E350 HydrophobicContact CG-CB 4.29Å; R329-E350 IonicContact CZ-OE2 3.12Å; R329-E350 IonicContact NE-OE2 2.78Å; R329-E350 PolarHBondContact NE-OE2 3.08Å; R329-E350 IonicContact NH2-OE2 2.67Å; R329-E350 PolarHBondContact NH2-OE2 2.85Å
330	P	97.5	Very high	95.7	Very high	7 Å²	7	53.7 Å²	53.7	5%	0.045	27%	0.268	C	S	.	.			trans	-59.3	143.5	171.1	-23.4	35.6	0	0	0	111.9	F274 F285 M347 L353	F274-P330 WeakPolarHBondContact O-CA 3.33Å; F285-P330 HydrophobicContact CB-CB 3.74Å; F285-P330 HydrophobicContact CB-CG 3.96Å; F285-P330 HydrophobicContact CD1-CB 3.64Å; F285-P330 HydrophobicContact CD2-CB 4.3Å; F285-P330 HydrophobicContact CE1-CB 4.27Å; F285-P330 HydrophobicContact CG-CB 3.64Å; F285-P330 HydrophobicContact CG-CG 4.4Å; P330-M347 VanDerWaalsContact O-CE 3.23Å; P330-M347 WeakPolarHBondContact O-CE 3.41Å; P330-L353 HydrophobicContact CB-CD2 4.12Å; P330-L353 HydrophobicContact CG-CD2 3.9Å
331	Q	97.8	Very high	95.5	Very high	22 Å²	22	54 Å²	54	10%	0.103	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.4	177.7	-56.2	-65.7	-19.1	0	0	109.8	A273 F274 V325 D326 L327 W344	A273-Q331 CarbonylContact C-O 3.48Å; A273-Q331 VanDerWaalsContact CA-O 3.23Å; A273-Q331 WeakPolarHBondContact CA-O 3.42Å; F274-Q331 HydrophobicContact CB-CB 4.17Å; F274-Q331 HydrophobicContact CD2-CB 4.28Å; F274-Q331 PolarHBondContact N-O 3.15Å; F274-Q331 PolarHBondContact O-N 3.46Å; V325-Q331 HydrophobicContact CB-CG 3.96Å; V325-Q331 HydrophobicContact CG1-CG 4.31Å; V325-Q331 HydrophobicContact CG2-CG 4.29Å; D326-Q331 PolarHBondContact O-NE2 2.81Å; L327-Q331 HydrophobicContact CD2-CG 4.26Å; Q331-W344 HydrophobicContact CB-CE3 3.87Å; Q331-W344 HydrophobicContact CB-CZ3 3.9Å
332	I	98.2	Very high	95.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	141.1	160.2	-168.3	176.1	0	0	0	110.6	I271 V272 A273 F285 L289 L345 L359 W362	I271-I332 HydrophobicContact CG2-CD1 3.84Å; I271-I332 HydrophobicContact CG2-CG1 4.03Å; V272-I332 CarbonylContact O-C 3.54Å; V272-I332 WeakPolarHBondContact O-CA 3.26Å; V272-I332 WeakPolarHBondContact O-CG1 3.38Å; A273-I332 HydrophobicContact CB-CB 4.27Å; A273-I332 HydrophobicContact CB-CD1 4.34Å; A273-I332 HydrophobicContact CB-CG1 4.03Å; F285-I332 HydrophobicContact CE1-CB 4.41Å; F285-I332 HydrophobicContact CZ-CB 3.96Å; F285-I332 HydrophobicContact CZ-CG2 3.96Å; L289-I332 HydrophobicContact CD2-CD1 4.09Å; I332-L345 HydrophobicContact CG2-CB 3.75Å; I332-L345 HydrophobicContact CG2-CD2 3.72Å; I332-L345 HydrophobicContact CG2-CG 4.39Å; I332-L345 PolarHBondContact O-N 3.05Å; I332-L359 HydrophobicContact CD1-CD1 3.82Å; I332-L359 HydrophobicContact CG2-CD1 3.87Å; I332-W362 HydrophobicContact CD1-CZ3 3.93Å; I332-W362 HydrophobicContact CG1-CH2 4.36Å; I332-W362 HydrophobicContact CG1-CZ3 3.93Å; I332-W362 HydrophobicContact CG2-CZ3 4.23Å
333	G	97.6	Very high	95.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	178.3	-177.6	0	0	0	0	0	112.6	I271 V272 V343 W344	I271-G333 CarbonylContact C-O 3.57Å; I271-G333 WeakPolarHBondContact CA-O 3.05Å; V272-G333 PolarHBondContact N-O 2.99Å; V272-G333 PolarHBondContact O-N 3.3Å; G333-V343 CarbonylContact C-O 3.59Å; G333-V343 WeakPolarHBondContact CA-O 3.31Å; G333-W344 VanDerWaalsContact N-CE3 3.31Å
334	V	97.7	Very high	95.5	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133	171.2	-173.2	0	0	0	0	107.5	I269 H270 S342 V343 W362 V366	I269-V334 HydrophobicContact CB-CG1 3.81Å; I269-V334 HydrophobicContact CD1-CG1 3.72Å; I269-V334 HydrophobicContact CG1-CG1 4.34Å; I269-V334 HydrophobicContact CG2-CG1 3.95Å; H270-V334 WeakPolarHBondContact O-CA 3.38Å; V334-S342 WeakPolarHBondContact O-CA 3.42Å; V334-S342 WeakPolarHBondContact O-CB 3.49Å; V334-V343 HydrophobicContact CB-CG1 3.95Å; V334-V343 HydrophobicContact CG2-CG1 4.21Å; V334-V343 PolarHBondContact N-O 3.41Å; V334-V343 PolarHBondContact O-N 2.87Å; V334-V343 VanDerWaalsContact O-N 3.12Å; V334-W362 HydrophobicContact CG2-CH2 3.96Å; V334-W362 HydrophobicContact CG2-CZ2 4.34Å; V334-V366 HydrophobicContact CG2-CB 4.28Å; V334-V366 HydrophobicContact CG2-CG1 3.58Å; V334-V366 HydrophobicContact CG2-CG2 3.61Å
335	V	97.7	Very high	95.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.4	177.2	-176.6	0	0	0	0	109.7	W262 I269 H270 V272 F323 D341 W344	W262-V335 HydrophobicContact CH2-CB 4.25Å; W262-V335 HydrophobicContact CH2-CG1 4.01Å; W262-V335 HydrophobicContact CZ2-CG1 3.98Å; I269-V335 WeakPolarHBondContact CA-O 3.41Å; H270-V335 PolarHBondContact N-O 2.86Å; H270-V335 PolarHBondContact O-N 2.9Å; V272-V335 HydrophobicContact CB-CG2 4.23Å; V272-V335 HydrophobicContact CG2-CB 4.25Å; V272-V335 HydrophobicContact CG2-CG2 3.85Å; F323-V335 HydrophobicContact CE1-CG1 3.76Å; F323-V335 HydrophobicContact CE1-CG2 4.04Å; F323-V335 HydrophobicContact CE2-CG2 4.47Å; F323-V335 HydrophobicContact CZ-CG1 3.9Å; F323-V335 HydrophobicContact CZ-CG2 3.96Å; V335-D341 WeakPolarHBondContact CA-O 3.31Å; V335-W344 HydrophobicContact CG2-CH2 4.33Å; V335-W344 HydrophobicContact CG2-CZ2 3.88Å
336	N	96	Very high	95.3	Very high	25 Å²	25	49.7 Å²	49.7	13%	0.134	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	125.1	172.5	179.7	-16	0	0	0	109.8	T338 D339 A340 D341 T373	N336-T338 PolarHBondContact O-N 3.43Å; N336-T338 WeakPolarHBondContact OD1-CB 3.47Å; N336-T338 PolarHBondContact OD1-N 2.99Å; N336-T338 PolarHBondContact OD1-OG1 2.91Å; N336-D339 WeakPolarHBondContact CB-OD1 3.33Å; N336-D339 PolarHBondContact ND2-OD1 3.17Å; N336-D339 PolarHBondContact ND2-OD2 2.73Å; N336-A340 VanDerWaalsContact O-CA 3.28Å; N336-A340 WeakPolarHBondContact O-CA 3.48Å; N336-A340 PolarHBondContact O-N 3.35Å; N336-D341 HydrophobicContact CB-CB 4.42Å; N336-D341 PolarHBondContact N-O 2.86Å; N336-T373 HydrophobicContact CB-CG2 4.43Å
337	V	94.5	Very high	95.1	Very high	51 Å²	51	48 Å²	48	31%	0.309	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-12.3	-175.3	-52.4	0	0	0	0	113.5	D265 G268 H270	D265-V337 HydrophobicContact CB-CG1 4.22Å; D265-V337 HydrophobicContact CB-CG2 4.49Å; G268-V337 PolarHBondContact O-N 3.31Å; H270-V337 VanDerWaalsContact CD2-CG1 3.49Å; H270-V337 WeakPolarHBondContact CD2-CG1 3.42Å
338	T	92.1	Very high	94.4	Very high	117 Å²	117	55.9 Å²	55.9	72%	0.718	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-36.4	-172.7	-47.9	0	0	0	0	113	N336	N336-T338 PolarHBondContact O-N 3.43Å; N336-T338 WeakPolarHBondContact OD1-CB 3.47Å; N336-T338 PolarHBondContact OD1-N 2.99Å; N336-T338 PolarHBondContact OD1-OG1 2.91Å
339	D	92.7	Very high	93.9	Very high	101 Å²	101	51.7 Å²	51.7	54%	0.54	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138	-7.2	-169.2	40.8	37.3	0	0	0	113.3	N336 D341	N336-D339 WeakPolarHBondContact CB-OD1 3.33Å; N336-D339 PolarHBondContact ND2-OD1 3.17Å; N336-D339 PolarHBondContact ND2-OD2 2.73Å; D339-D341 VanDerWaalsContact C-N 3.26Å; D339-D341 VanDerWaalsContact OD1-CB 3.31Å; D339-D341 WeakPolarHBondContact OD1-CB 3.23Å; D339-D341 PolarHBondContact OD1-N 2.77Å; D339-D341 VanDerWaalsContact OD1-N 3.16Å
340	A	93.7	Very high	93.1	Very high	28 Å²	28	51.8 Å²	51.8	23%	0.231	27%	0.27	C	S	.	.			trans	62.8	27.4	-173.8	0	0	0	0	0	114.3	T322 N336	T322-A340 HydrophobicContact CG2-CB 4.22Å; N336-A340 VanDerWaalsContact O-CA 3.28Å; N336-A340 WeakPolarHBondContact O-CA 3.48Å; N336-A340 PolarHBondContact O-N 3.35Å
341	D	94.6	Very high	92.2	Very high	67 Å²	67	60 Å²	60	36%	0.358	31%	0.308	S	S	.	.			trans	-68	152.1	164.6	-175.5	30.2	0	0	0	111.5	V335 N336 D339 T373	V335-D341 WeakPolarHBondContact CA-O 3.31Å; N336-D341 HydrophobicContact CB-CB 4.42Å; N336-D341 PolarHBondContact N-O 2.86Å; D339-D341 VanDerWaalsContact C-N 3.26Å; D339-D341 VanDerWaalsContact OD1-CB 3.31Å; D339-D341 WeakPolarHBondContact OD1-CB 3.23Å; D339-D341 PolarHBondContact OD1-N 2.77Å; D339-D341 VanDerWaalsContact OD1-N 3.16Å; D341-T373 WeakPolarHBondContact OD2-CB 3.34Å; D341-T373 PolarHBondContact OD2-OG1 2.94Å
342	S	96.4	Very high	91.7	Very high	20 Å²	20	63 Å²	63	14%	0.14	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	135.2	-169.9	67.4	0	0	0	0	116.3	F323 V334 W344	F323-S342 WeakPolarHBondContact CD1-OG 3.33Å; V334-S342 WeakPolarHBondContact O-CA 3.42Å; V334-S342 WeakPolarHBondContact O-CB 3.49Å; S342-W344 VanDerWaalsContact CB-NE1 3.31Å; S342-W344 PolarHBondContact OG-NE1 3.07Å
343	V	96.7	Very high	91.5	Very high	18 Å²	18	64.5 Å²	64.5	11%	0.109	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	140.3	170.7	60.5	0	0	0	0	110.5	G333 V334 V371 T373 D376	G333-V343 CarbonylContact C-O 3.59Å; G333-V343 WeakPolarHBondContact CA-O 3.31Å; V334-V343 HydrophobicContact CB-CG1 3.95Å; V334-V343 HydrophobicContact CG2-CG1 4.21Å; V334-V343 PolarHBondContact N-O 3.41Å; V334-V343 PolarHBondContact O-N 2.87Å; V334-V343 VanDerWaalsContact O-N 3.12Å; V343-V371 HydrophobicContact CG1-CG1 3.66Å; V343-V371 HydrophobicContact CG2-CG1 4.14Å; V343-T373 HydrophobicContact CG1-CG2 4.3Å; V343-D376 WeakPolarHBondContact CB-OD2 3.47Å; V343-D376 VanDerWaalsContact CG2-OD2 3.26Å; V343-D376 WeakPolarHBondContact CG2-OD2 3.49Å
344	W	96.6	Very high	91.4	Very high	38 Å²	38	64.9 Å²	64.9	14%	0.144	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149	-173.8	-62.8	82.8	0	0	0	112.2	V272 F274 F323 V325 Q331 G333 V335 S342 E346	V272-W344 HydrophobicContact CB-CH2 4.24Å; V272-W344 HydrophobicContact CG1-CH2 4.26Å; F274-W344 AromaticContact CD2-CH2 3.85Å; F274-W344 HydrophobicContact CD2-CH2 3.85Å; F274-W344 AromaticContact CD2-CZ3 3.92Å; F274-W344 HydrophobicContact CD2-CZ3 3.92Å; F274-W344 AromaticContact CE2-CH2 3.6Å; F274-W344 HydrophobicContact CE2-CH2 3.6Å; F274-W344 HydrophobicContact CE2-CZ2 4.41Å; F274-W344 HydrophobicContact CE2-CZ3 4.15Å; F323-W344 HydrophobicContact CB-CZ2 3.88Å; F323-W344 HydrophobicContact CD1-CZ2 4.31Å; F323-W344 HydrophobicContact CD2-CH2 4.34Å; F323-W344 AromaticContact CD2-CZ2 3.71Å; F323-W344 HydrophobicContact CD2-CZ2 3.71Å; F323-W344 HydrophobicContact CE2-CZ2 4.28Å; F323-W344 AromaticContact CG-CZ2 3.72Å; F323-W344 HydrophobicContact CG-CZ2 3.72Å; V325-W344 HydrophobicContact CG1-CB 4.31Å; V325-W344 HydrophobicContact CG1-CD2 3.52Å; V325-W344 HydrophobicContact CG1-CE3 3.91Å; V325-W344 HydrophobicContact CG1-CG 3.64Å; Q331-W344 HydrophobicContact CB-CE3 3.87Å; Q331-W344 HydrophobicContact CB-CZ3 3.9Å; G333-W344 VanDerWaalsContact N-CE3 3.31Å; V335-W344 HydrophobicContact CG2-CH2 4.33Å; V335-W344 HydrophobicContact CG2-CZ2 3.88Å; S342-W344 VanDerWaalsContact CB-NE1 3.31Å; S342-W344 PolarHBondContact OG-NE1 3.07Å; W344-E346 PolarHBondContact O-N 2.82Å
345	L	95.4	Very high	91.3	Very high	31 Å²	31	68.5 Å²	68.5	16%	0.162	36%	0.358	C	S	.	.			trans	-70.3	120.8	176	176.1	61.8	0	0	0	110.6	I332 M347 P354 L359 W362	I332-L345 HydrophobicContact CG2-CB 3.75Å; I332-L345 HydrophobicContact CG2-CD2 3.72Å; I332-L345 HydrophobicContact CG2-CG 4.39Å; I332-L345 PolarHBondContact O-N 3.05Å; L345-M347 PolarHBondContact O-N 3.23Å; L345-P354 HydrophobicContact CD2-CB 4.31Å; L345-P354 HydrophobicContact CD2-CG 3.94Å; L345-L359 HydrophobicContact CD2-CD1 4.27Å; L345-W362 HydrophobicContact CB-CD2 4.49Å; L345-W362 HydrophobicContact CB-CZ2 4.41Å; L345-W362 HydrophobicContact CD1-CG 4.07Å
346	E	91.4	Very high	91.3	Very high	191 Å²	191	69.3 Å²	69.3	89%	0.893	36%	0.364	S	S	*	.			trans	-63.8	127.7	173.2	-64.5	-168.3	139.6	0	0	111.6	W344	W344-E346 PolarHBondContact O-N 2.82Å
347	M	90.4	Very high	91.3	Very high	41 Å²	41	72.2 Å²	72.2	20%	0.202	38%	0.383	C	S	.	.			trans	-133.8	131.9	170.5	-66.7	175.1	-75.6	0	0	107.7	P330 L345 P354	P330-M347 VanDerWaalsContact O-CE 3.23Å; P330-M347 WeakPolarHBondContact O-CE 3.41Å; L345-M347 PolarHBondContact O-N 3.23Å; M347-P354 VanDerWaalsContact SD-CD 3.6Å; M347-P354 HydrophobicContact SD-CG 4.39Å
348	E	80.8	Confident	91.4	Very high	175 Å²	175	74.9 Å²	74.9	82%	0.818	39%	0.392	S	S	*	.	S	Bend	trans	-66.6	-42.1	-172.7	-74.3	-165.7	-169	0	0	112.3	D352	E348-D352 HydrophobicContact CB-CB 4.35Å; E348-D352 PolarHBondContact N-OD2 3.16Å
349	D	80.5	Confident	91.6	Very high	72 Å²	72	69.3 Å²	69.3	39%	0.385	36%	0.358	S	S	.	.	S	Bend	trans	-159	-172	170	61.6	46.6	0	0	0	112.7	E351 D352	D349-E351 PolarHBondContact O-N 3.43Å; D349-E351 PolarHBondContact OD1-N 2.62Å; D349-D352 PolarHBondContact O-N 2.65Å; D349-D352 VanDerWaalsContact O-N 3.09Å
350	E	76	Confident	91.8	Very high	82 Å²	82	67.3 Å²	67.3	38%	0.383	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.9	-179.8	63.6	-138.4	-160.6	0	0	114.3	R329	R329-E350 HydrophobicContact CG-CB 4.29Å; R329-E350 IonicContact CZ-OE2 3.12Å; R329-E350 IonicContact NE-OE2 2.78Å; R329-E350 PolarHBondContact NE-OE2 3.08Å; R329-E350 IonicContact NH2-OE2 2.67Å; R329-E350 PolarHBondContact NH2-OE2 2.85Å
351	E	79	Confident	91.9	Very high	180 Å²	180	70.7 Å²	70.7	84%	0.841	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-6	175	-63	-170.3	-169.4	0	0	113.1	D349	D349-E351 PolarHBondContact O-N 3.43Å; D349-E351 PolarHBondContact OD1-N 2.62Å
352	D	88.1	Confident	92	Very high	84 Å²	84	68.9 Å²	68.9	45%	0.449	35%	0.348	S	S	.	.			trans	-103.2	38.8	-173	-163.4	43	0	0	0	113.7	E348 D349	E348-D352 HydrophobicContact CB-CB 4.35Å; E348-D352 PolarHBondContact N-OD2 3.16Å; D349-D352 PolarHBondContact O-N 2.65Å; D349-D352 VanDerWaalsContact O-N 3.09Å
353	L	93.7	Very high	91.9	Very high	32 Å²	32	68.1 Å²	68.1	17%	0.168	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-62.2	136.2	-179.9	-57	-179.1	0	0	0	112.1	E284 F285 I288 P330	E284-L353 HydrophobicContact CB-CD1 4.03Å; E284-L353 HydrophobicContact CG-CD1 4.17Å; F285-L353 HydrophobicContact CB-CD1 4.23Å; F285-L353 HydrophobicContact CB-CD2 4.32Å; F285-L353 HydrophobicContact CD2-CD2 4.25Å; I288-L353 HydrophobicContact CD1-CB 4.46Å; P330-L353 HydrophobicContact CB-CD2 4.12Å; P330-L353 HydrophobicContact CG-CD2 3.9Å
354	P	95.4	Very high	91.8	Very high	8 Å²	8	73.2 Å²	73.2	5%	0.052	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-69	138.4	-179.6	29.3	-36.4	0	0	0	110.9	F285 L345 M347 Q358	F285-P354 HydrophobicContact CD2-CG 4.43Å; F285-P354 HydrophobicContact CE2-CG 3.78Å; L345-P354 HydrophobicContact CD2-CB 4.31Å; L345-P354 HydrophobicContact CD2-CG 3.94Å; M347-P354 VanDerWaalsContact SD-CD 3.6Å; M347-P354 HydrophobicContact SD-CG 4.39Å; P354-Q358 HydrophobicContact CB-CB 4.05Å
355	T	96.3	Very high	91.7	Very high	78 Å²	78	74.4 Å²	74.4	48%	0.479	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-65.9	154.7	168.5	62.4	0	0	0	0	110.9	T357 Q358 L359	T355-T357 PolarHBondContact O-N 3.03Å; T355-Q358 VanDerWaalsContact N-OE1 3.11Å; T355-Q358 WeakPolarHBondContact O-CA 3.47Å; T355-Q358 WeakPolarHBondContact O-CB 3.33Å; T355-Q358 PolarHBondContact O-N 3.21Å; T355-Q358 PolarHBondContact OG1-OE1 3.16Å; T355-L359 PolarHBondContact O-N 2.97Å; T355-L359 VanDerWaalsContact O-N 3.07Å
356	A	96.9	Very high	91.6	Very high	16 Å²	16	73.3 Å²	73.3	13%	0.132	37%	0.368	C	S	.	.	H	α-helix	trans	-48.1	-40.1	-179.9	0	0	0	0	0	113.5	I288 E291 V292 L359 E360	I288-A356 HydrophobicContact CG2-CB 4.28Å; E291-A356 HydrophobicContact CB-CB 4.4Å; E291-A356 HydrophobicContact CG-CB 4.16Å; V292-A356 HydrophobicContact CG2-CB 3.74Å; V292-A356 VanDerWaalsContact CG2-O 3.28Å; V292-A356 WeakPolarHBondContact CG2-O 3.46Å; A356-L359 PolarHBondContact O-N 3.14Å; A356-E360 VanDerWaalsContact O-CB 3.29Å; A356-E360 WeakPolarHBondContact O-CB 3.2Å; A356-E360 PolarHBondContact O-N 2.93Å
357	T	96.4	Very high	91.5	Very high	86 Å²	86	67.9 Å²	67.9	53%	0.528	35%	0.345	S	S	.	.	H	α-helix	trans	-67.2	-34.6	175.7	-50.4	0	0	0	0	113.9	T355 D361	T355-T357 PolarHBondContact O-N 3.03Å; T357-D361 WeakPolarHBondContact O-CB 3.3Å; T357-D361 PolarHBondContact O-N 3.41Å
358	Q	96.3	Very high	91.6	Very high	108 Å²	108	69.2 Å²	69.2	51%	0.505	36%	0.358	S	S	.	.	H	α-helix	trans	-69.7	-36.9	174.8	-70.6	163	-100.6	0	0	111.5	P354 T355 W362	P354-Q358 HydrophobicContact CB-CB 4.05Å; T355-Q358 VanDerWaalsContact N-OE1 3.11Å; T355-Q358 WeakPolarHBondContact O-CA 3.47Å; T355-Q358 WeakPolarHBondContact O-CB 3.33Å; T355-Q358 PolarHBondContact O-N 3.21Å; T355-Q358 PolarHBondContact OG1-OE1 3.16Å; Q358-W362 PolarHBondContact O-N 2.97Å
359	L	97.1	Very high	92	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-71	-39	176.9	-174.5	59.6	0	0	0	111.5	I288 L289 V292 I332 L345 T355 A356 W362 I363	I288-L359 HydrophobicContact CG2-CD2 3.91Å; L289-L359 HydrophobicContact CD2-CD2 3.99Å; V292-L359 HydrophobicContact CG2-CB 4.17Å; V292-L359 HydrophobicContact CG2-CD2 4.09Å; V292-L359 HydrophobicContact CG2-CG 4.28Å; I332-L359 HydrophobicContact CD1-CD1 3.82Å; I332-L359 HydrophobicContact CG2-CD1 3.87Å; L345-L359 HydrophobicContact CD2-CD1 4.27Å; T355-L359 PolarHBondContact O-N 2.97Å; T355-L359 VanDerWaalsContact O-N 3.07Å; A356-L359 PolarHBondContact O-N 3.14Å; L359-W362 HydrophobicContact CD1-CE3 4.46Å; L359-W362 PolarHBondContact O-N 2.82Å; L359-I363 HydrophobicContact CD1-CD1 4.46Å; L359-I363 HydrophobicContact CG-CD1 4.21Å; L359-I363 WeakPolarHBondContact O-CB 3.37Å; L359-I363 VanDerWaalsContact O-CG1 3.3Å; L359-I363 WeakPolarHBondContact O-CG1 3.43Å; L359-I363 PolarHBondContact O-N 3.46Å
360	E	95.8	Very high	92.3	Very high	59 Å²	59	65.2 Å²	65.2	28%	0.276	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-47.8	170.5	-178.8	174.6	-122.9	0	0	112.1	V292 N296 A356 W362 I363 E364	V292-E360 HydrophobicContact CG1-CB 4.38Å; N296-E360 PolarHBondContact ND2-OE1 3.22Å; A356-E360 VanDerWaalsContact O-CB 3.29Å; A356-E360 WeakPolarHBondContact O-CB 3.2Å; A356-E360 PolarHBondContact O-N 2.93Å; E360-W362 VanDerWaalsContact C-N 3.29Å; E360-W362 PolarHBondContact O-N 2.83Å; E360-I363 PolarHBondContact O-N 2.89Å; E360-E364 PolarHBondContact O-N 3Å
361	D	96.2	Very high	92.7	Very high	98 Å²	98	62.8 Å²	62.8	52%	0.524	34%	0.338	S	S	.	.	H	α-helix	trans	-56.7	-41.1	174.4	-81.9	-28.8	0	0	0	111.2	T357 D365	T357-D361 WeakPolarHBondContact O-CB 3.3Å; T357-D361 PolarHBondContact O-N 3.41Å; D361-D365 PolarHBondContact O-N 3.41Å; D361-D365 VanDerWaalsContact O-N 3.15Å
362	W	96.6	Very high	93.1	Very high	29 Å²	29	56.1 Å²	56.1	11%	0.11	31%	0.308	C	S	.	.	H	α-helix	trans	-69.8	-40.1	177.2	-177.1	83.2	0	0	0	112.6	I271 I332 V334 L345 Q358 L359 E360 D365 V366 V371	I271-W362 HydrophobicContact CG2-CZ3 4.27Å; I332-W362 HydrophobicContact CD1-CZ3 3.93Å; I332-W362 HydrophobicContact CG1-CH2 4.36Å; I332-W362 HydrophobicContact CG1-CZ3 3.93Å; I332-W362 HydrophobicContact CG2-CZ3 4.23Å; V334-W362 HydrophobicContact CG2-CH2 3.96Å; V334-W362 HydrophobicContact CG2-CZ2 4.34Å; L345-W362 HydrophobicContact CB-CD2 4.49Å; L345-W362 HydrophobicContact CB-CZ2 4.41Å; L345-W362 HydrophobicContact CD1-CG 4.07Å; Q358-W362 PolarHBondContact O-N 2.97Å; L359-W362 HydrophobicContact CD1-CE3 4.46Å; L359-W362 PolarHBondContact O-N 2.82Å; E360-W362 VanDerWaalsContact C-N 3.29Å; E360-W362 PolarHBondContact O-N 2.83Å; W362-D365 WeakPolarHBondContact O-CB 3.23Å; W362-D365 PolarHBondContact O-N 3.07Å; W362-D365 VanDerWaalsContact O-N 3.13Å; W362-V366 HydrophobicContact CD2-CG2 4.12Å; W362-V366 HydrophobicContact CE3-CG2 4.12Å; W362-V366 HydrophobicContact CH2-CG2 3.83Å; W362-V366 HydrophobicContact CZ2-CG2 3.85Å; W362-V366 HydrophobicContact CZ3-CG2 3.97Å; W362-V366 WeakPolarHBondContact O-CG2 3.42Å; W362-V366 PolarHBondContact O-N 3.04Å; W362-V371 HydrophobicContact CZ2-CG1 4.2Å
363	I	95.1	Very high	93	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-36.9	175	-70.5	167.5	0	0	0	111.3	I271 V292 L302 I304 L359 E360 D365 V366 L367	I271-I363 HydrophobicContact CD1-CG2 4.38Å; V292-I363 HydrophobicContact CG1-CD1 3.97Å; L302-I363 HydrophobicContact CD1-CG2 3.76Å; L302-I363 HydrophobicContact CD2-CG2 4.41Å; I304-I363 HydrophobicContact CD1-CD1 3.86Å; L359-I363 HydrophobicContact CD1-CD1 4.46Å; L359-I363 HydrophobicContact CG-CD1 4.21Å; L359-I363 WeakPolarHBondContact O-CB 3.37Å; L359-I363 VanDerWaalsContact O-CG1 3.3Å; L359-I363 WeakPolarHBondContact O-CG1 3.43Å; L359-I363 PolarHBondContact O-N 3.46Å; E360-I363 PolarHBondContact O-N 2.89Å; I363-D365 VanDerWaalsContact C-N 3.28Å; I363-D365 PolarHBondContact O-N 3.34Å; I363-V366 PolarHBondContact O-N 3.43Å; I363-L367 HydrophobicContact CG2-CD1 3.79Å; I363-L367 HydrophobicContact CG2-CG 4.14Å; I363-L367 WeakPolarHBondContact O-CB 3.47Å; I363-L367 WeakPolarHBondContact O-CG 3.46Å; I363-L367 PolarHBondContact O-N 2.7Å
364	E	93.8	Very high	92.3	Very high	125 Å²	125	58.9 Å²	58.9	58%	0.584	32%	0.318	S	S	*	.	H	α-helix	trans	-60.8	-37.7	169.8	-83.4	-152.9	177.4	0	0	111.7	E360 S368	E360-E364 PolarHBondContact O-N 3Å; E364-S368 VanDerWaalsContact O-CB 3.31Å; E364-S368 WeakPolarHBondContact O-CB 3.26Å; E364-S368 PolarHBondContact O-N 3.01Å; E364-S368 VanDerWaalsContact O-N 3.09Å; E364-S368 PolarHBondContact O-OG 3.41Å
365	D	94.3	Very high	91.2	Very high	63 Å²	63	63.6 Å²	63.6	34%	0.337	34%	0.343	S	S	.	.	H	α-helix	trans	-69.5	-38.4	177	-85.7	16.4	0	0	0	112.3	D361 W362 I363 S368 G369 K370 V371	D361-D365 PolarHBondContact O-N 3.41Å; D361-D365 VanDerWaalsContact O-N 3.15Å; W362-D365 WeakPolarHBondContact O-CB 3.23Å; W362-D365 PolarHBondContact O-N 3.07Å; W362-D365 VanDerWaalsContact O-N 3.13Å; I363-D365 VanDerWaalsContact C-N 3.28Å; I363-D365 PolarHBondContact O-N 3.34Å; D365-S368 PolarHBondContact O-OG 3.08Å; D365-G369 PolarHBondContact O-N 3.11Å; D365-K370 HydrophobicContact CB-CB 4.19Å; D365-K370 WeakPolarHBondContact O-CA 3.41Å; D365-K370 WeakPolarHBondContact O-CB 3.33Å; D365-K370 PolarHBondContact O-N 3.21Å; D365-K370 IonicContact OD1-NZ 3.45Å; D365-K370 PolarHBondContact OD1-NZ 3.09Å; D365-V371 HydrophobicContact CB-CG2 4.14Å; D365-V371 PolarHBondContact O-N 3.41Å
366	V	92.8	Very high	89.6	Confident	8 Å²	8	64.7 Å²	64.7	5%	0.048	35%	0.346	C	S	.	.	H	α-helix	trans	-62.3	-56.4	169.7	171.2	0	0	0	0	111.6	I271 V334 W362 I363 S368 G369 V371	I271-V366 HydrophobicContact CD1-CG1 4Å; I271-V366 HydrophobicContact CG1-CG1 4.2Å; V334-V366 HydrophobicContact CG2-CB 4.28Å; V334-V366 HydrophobicContact CG2-CG1 3.58Å; V334-V366 HydrophobicContact CG2-CG2 3.61Å; W362-V366 HydrophobicContact CD2-CG2 4.12Å; W362-V366 HydrophobicContact CE3-CG2 4.12Å; W362-V366 HydrophobicContact CH2-CG2 3.83Å; W362-V366 HydrophobicContact CZ2-CG2 3.85Å; W362-V366 HydrophobicContact CZ3-CG2 3.97Å; W362-V366 WeakPolarHBondContact O-CG2 3.42Å; W362-V366 PolarHBondContact O-N 3.04Å; I363-V366 PolarHBondContact O-N 3.43Å; V366-S368 PolarHBondContact O-N 2.89Å; V366-S368 VanDerWaalsContact O-N 3.07Å; V366-G369 PolarHBondContact O-N 2.85Å; V366-V371 HydrophobicContact CG2-CB 3.79Å; V366-V371 HydrophobicContact CG2-CG1 3.77Å
367	L	91.1	Very high	87.8	Confident	77 Å²	77	70.9 Å²	70.9	40%	0.403	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-13.9	-176.5	-67.1	176.7	0	0	0	113.7	L299 L302 I363	L299-L367 HydrophobicContact CD1-CD1 4.45Å; L302-L367 HydrophobicContact CB-CD1 4.27Å; L302-L367 HydrophobicContact CD1-CD1 4.38Å; I363-L367 HydrophobicContact CG2-CD1 3.79Å; I363-L367 HydrophobicContact CG2-CG 4.14Å; I363-L367 WeakPolarHBondContact O-CB 3.47Å; I363-L367 WeakPolarHBondContact O-CG 3.46Å; I363-L367 PolarHBondContact O-N 2.7Å
368	S	91.9	Very high	85.8	Confident	68 Å²	68	74 Å²	74	48%	0.476	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	6	171.6	58.7	0	0	0	0	114.2	E364 D365 V366 K370	E364-S368 VanDerWaalsContact O-CB 3.31Å; E364-S368 WeakPolarHBondContact O-CB 3.26Å; E364-S368 PolarHBondContact O-N 3.01Å; E364-S368 VanDerWaalsContact O-N 3.09Å; E364-S368 PolarHBondContact O-OG 3.41Å; D365-S368 PolarHBondContact O-OG 3.08Å; V366-S368 PolarHBondContact O-N 2.89Å; V366-S368 VanDerWaalsContact O-N 3.07Å; S368-K370 VanDerWaalsContact C-N 3.31Å; S368-K370 PolarHBondContact O-N 3.27Å; S368-K370 PolarHBondContact OG-NZ 3.36Å
369	G	88.6	Confident	83.7	Confident	43 Å²	43	76.2 Å²	76.2	44%	0.443	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	16.6	176.6	0	0	0	0	0	114.8	D365 V366 N372	D365-G369 PolarHBondContact O-N 3.11Å; V366-G369 PolarHBondContact O-N 2.85Å; G369-N372 PolarHBondContact O-ND2 3.14Å; G369-N372 VanDerWaalsContact O-ND2 3.1Å
370	K	86.8	Confident	81.6	Confident	120 Å²	120	83.3 Å²	83.3	52%	0.522	44%	0.443	S	S	.	.	S	Bend	trans	-80.3	-26.3	174.1	-50.1	-170.8	-152	83.3	0	112.3	D365 S368	D365-K370 HydrophobicContact CB-CB 4.19Å; D365-K370 WeakPolarHBondContact O-CA 3.41Å; D365-K370 WeakPolarHBondContact O-CB 3.33Å; D365-K370 PolarHBondContact O-N 3.21Å; D365-K370 IonicContact OD1-NZ 3.45Å; D365-K370 PolarHBondContact OD1-NZ 3.09Å; S368-K370 VanDerWaalsContact C-N 3.31Å; S368-K370 PolarHBondContact O-N 3.27Å; S368-K370 PolarHBondContact OG-NZ 3.36Å
371	V	85.5	Confident	79.7	Confident	32 Å²	32	87.7 Å²	87.7	19%	0.194	47%	0.468	C	S	.	.	S	Bend	trans	-113	120.1	165.6	173.9	0	0	0	0	105.9	V343 W362 D365 V366	V343-V371 HydrophobicContact CG1-CG1 3.66Å; V343-V371 HydrophobicContact CG2-CG1 4.14Å; W362-V371 HydrophobicContact CZ2-CG1 4.2Å; D365-V371 HydrophobicContact CB-CG2 4.14Å; D365-V371 PolarHBondContact O-N 3.41Å; V366-V371 HydrophobicContact CG2-CB 3.79Å; V366-V371 HydrophobicContact CG2-CG1 3.77Å
372	N	86.7	Confident	77.6	Confident	39 Å²	39	90.2 Å²	90.2	21%	0.209	48%	0.482	C	S	.	.			trans	-153.5	167.9	179.8	66.3	76.6	0	0	0	107.4	G369 E374 D375	G369-N372 PolarHBondContact O-ND2 3.14Å; G369-N372 VanDerWaalsContact O-ND2 3.1Å; N372-E374 PolarHBondContact OD1-N 3.36Å; N372-D375 PolarHBondContact ND2-OD2 3.36Å; N372-D375 PolarHBondContact OD1-N 2.67Å
373	T	85.3	Confident	75.5	Confident	9 Å²	9	96.7 Å²	96.7	6%	0.055	52%	0.519	C	S	.	.	S	Bend	trans	-86.6	-19.6	-178.1	85.5	0	0	0	0	113.2	N336 D341 V343 D375	N336-T373 HydrophobicContact CB-CG2 4.43Å; D341-T373 WeakPolarHBondContact OD2-CB 3.34Å; D341-T373 PolarHBondContact OD2-OG1 2.94Å; V343-T373 HydrophobicContact CG1-CG2 4.3Å; T373-D375 PolarHBondContact O-N 2.78Å
374	E	80.2	Confident	73.5	Confident	166 Å²	166	102.9 Å²	102.9	78%	0.776	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-69.6	-29.3	-178.9	-61	-169.1	157.2	0	0	113.4	N372	N372-E374 PolarHBondContact OD1-N 3.36Å
375	D	72	Confident	71.6	Confident	107 Å²	107	104.5 Å²	104.5	57%	0.572	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-80.3	-17.8	-177.6	-78.6	-36.5	0	0	0	113.9	N372 T373 D377	N372-D375 PolarHBondContact ND2-OD2 3.36Å; N372-D375 PolarHBondContact OD1-N 2.67Å; T373-D375 PolarHBondContact O-N 2.78Å; D375-D377 VanDerWaalsContact C-N 3.32Å; D375-D377 PolarHBondContact O-N 2.84Å
376	D	62.6	Low	69.9	Low	101 Å²	101	108.7 Å²	108.7	54%	0.54	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-76.1	-16.6	-179	-84.8	-8.3	0	0	0	113.3	V343	V343-D376 WeakPolarHBondContact CB-OD2 3.47Å; V343-D376 VanDerWaalsContact CG2-OD2 3.26Å; V343-D376 WeakPolarHBondContact CG2-OD2 3.49Å
377	D	58.4	Low	68	Low	146 Å²	146	116.4 Å²	116.4	78%	0.781	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-81.6	-16.5	-175.5	-135.1	16.8	0	0	0	112.8	D375	D375-D377 VanDerWaalsContact C-N 3.32Å; D375-D377 PolarHBondContact O-N 2.84Å
378	D	54.7	Low	66.5	Low	150 Å²	150	119.8 Å²	119.8	80%	0.802	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-86.8	-6.5	-167.8	-127.6	21.5	0	0	0	114.1	N380	D378-N380 PolarHBondContact O-N 3.06Å
379	D	53.1	Low	64.5	Low	155 Å²	155	124.6 Å²	124.6	83%	0.829	67%	0.667	S	S	*	*	S	Bend	trans	-90.8	20.1	-170.6	-130.5	22.4	0	0	0	114.5
380	N	52.8	Low	63	Low	149 Å²	149	129.4 Å²	129.4	80%	0.797	68%	0.682	S	S	*	*	S	Bend	trans	-131.9	52.5	-176.7	-92.4	-71.4	0	0	0	115.5	D378	D378-N380 PolarHBondContact O-N 3.06Å
381	D	54.5	Low	61.3	Low	151 Å²	151	130.7 Å²	130.7	81%	0.807	70%	0.695	S	S	*	*			trans	-168.4	76.2	154.4	-119.7	-7.5	0	0	0	114.8
382	D	53.7	Low	59.8	Low	151 Å²	151	136 Å²	136	81%	0.807	72%	0.722	S	S	*	*			trans	-160.2	64.8	156.4	-131.9	-0.3	0	0	0	114.8
383	D	51.1	Low	58.2	Low	165 Å²	165	140.2 Å²	140.2	88%	0.882	75%	0.745	S	S	*	*			trans	-124.3	44.3	167.2	-133.6	4.1	0	0	0	111	D385	D383-D385 PolarHBondContact O-N 3.19Å
384	N	53.4	Low	56.6	Low	135 Å²	135	146.4 Å²	146.4	72%	0.722	78%	0.778	S	S	*	*			trans	-84.3	90.8	167.1	-77.9	-75	0	0	0	110.3
385	D	54.1	Low	55.3	Low	160 Å²	160	145 Å²	145	86%	0.856	78%	0.776	S	S	*	*			trans	-111.4	107.3	159.8	-116.1	-9.9	0	0	0	108.7	D383	D383-D385 PolarHBondContact O-N 3.19Å
386	D	58.1	Low	54.3	Low	150 Å²	150	146.3 Å²	146.3	80%	0.802	78%	0.782	S	S	*	*			trans	-63.7	141.7	169.1	-68.2	-55.9	0	0	0	110.2
387	D	52.7	Low	53.8	Low	170 Å²	170	148.3 Å²	148.3	91%	0.909	79%	0.793	S	S	*	*			trans	-152	118.2	146	-119.1	-14.9	0	0	0	109.2
388	D	59.4	Low	53.7	Low	149 Å²	149	149.3 Å²	149.3	80%	0.797	80%	0.799	S	S	*	*			trans	-69.5	157.1	177.1	-63.4	-65	0	0	0	111.9
389	D	51.2	Low	53.7	Low	168 Å²	168	150.8 Å²	150.8	90%	0.898	80%	0.8	S	S	*	*				-167.9	139.3	122	-107.3	-19.1	0	0	0	111.6
390	D	56.5	Low	53.8	Low	144 Å²	144	151.5 Å²	151.5	77%	0.77	81%	0.805	S	S	*	*			trans	-70.7	157.5	-179.6	-61.5	-64.6	0	0	0	113.8
391	D	51.6	Low	54	Low	148 Å²	148	152.8 Å²	152.8	79%	0.791	81%	0.806	S	S	*	*				171.1	107.6	114.3	-93.4	-12.9	0	0	0	113
392	D	53.9	Low	53.8	Low	142 Å²	142	152.1 Å²	152.1	76%	0.759	80%	0.802	S	S	*	*				55.6	153.9	127	-79.1	-5	0	0	0	126
393	D	53.1	Low	53.7	Low	129 Å²	129	150.4 Å²	150.4	69%	0.69	79%	0.793	S	S	*	*			trans	80.1	113.3	151.9	-68.9	-4.1	0	0	0	122.4
394	D	51.1	Low	53.7	Low	139 Å²	139	151 Å²	151	74%	0.743	79%	0.79	S	S	*	*				66.5	140.9	121.8	-67.5	7.3	0	0	0	121.7
395	D	52.4	Low	53.6	Low	137 Å²	137	151.8 Å²	151.8	73%	0.733	79%	0.794	S	S	*	*			cis	-167.1	-166.7	-12.6	-149.6	-11	0	0	0	108.3
396	D	52.2	Low	53.6	Low	133 Å²	133	151.2 Å²	151.2	71%	0.711	79%	0.791	S	S	*	*			trans	71.1	102.4	159.9	-68	-25.2	0	0	0	119.1
397	D	52.8	Low	53.4	Low	143 Å²	143	152.4 Å²	152.4	77%	0.765	79%	0.792	S	S	*	*				31.4	132.1	119	-61.8	-6.5	0	0	0	121.2
398	D	54.9	Low	53.3	Low	168 Å²	168	152.3 Å²	152.3	90%	0.898	79%	0.786	S	S	*	*				-153.8	130.8	108.6	-107.9	-26.2	0	0	0	110.1
399	E	55.3	Low	52.9	Low	180 Å²	180	151.3 Å²	151.3	84%	0.841	78%	0.781	S	S	*	*			trans	-83.2	146.1	169.7	-61.9	177.1	146.7	0	0	109.8
400	D	54.2	Low	53.1	Low	171 Å²	171	151.4 Å²	151.4	91%	0.914	78%	0.782	S	S	*	*			trans	-160.3	101.4	148.9	-108	-18.8	0	0	0	109
401	E	57.3	Low	53.1	Low	176 Å²	176	152.7 Å²	152.7	82%	0.822	78%	0.783	S	S	*	*			trans	-74.4	150.7	160.1	-57	-178.6	130	0	0	108.8
402	D	51.8	Low	53.3	Low	136 Å²	136	153.9 Å²	153.9	73%	0.727	79%	0.789	S	S	*	*				171.9	138.5	127.2	-108.5	10.3	0	0	0	116.7
403	N	50	Low	53.3	Low	116 Å²	116	155.6 Å²	155.6	62%	0.62	79%	0.793	S	S	*	*			trans	67.9	142.3	152.2	-51.7	-46.4	0	0	0	119.4
404	E	50.8	Low	53.2	Low	176 Å²	176	157.6 Å²	157.6	82%	0.822	80%	0.798	S	S	*	*			cis	67.6	154.3	31.9	-48.9	-177.2	174.5	0	0	112.6
405	D	52	Low	53.2	Low	152 Å²	152	157.9 Å²	157.9	81%	0.813	80%	0.799	S	S	*	*			cis	-64.8	-156.2	-21.2	-44.5	-93.4	0	0	0	110.9
406	D	54.9	Low	53.4	Low	148 Å²	148	160.7 Å²	160.7	79%	0.791	81%	0.808	S	S	*	*			cis	-125.3	174.8	-6.2	-54	-86.1	0	0	0	107.1
407	E	52.6	Low	53.3	Low	175 Å²	175	162.3 Å²	162.3	82%	0.818	81%	0.811	S	S	*	*			cis	69.7	122.5	28.4	-63.3	-174.2	-173	0	0	115.6
408	E	51.9	Low	53.2	Low	169 Å²	169	162.3 Å²	162.3	79%	0.79	81%	0.812	S	S	*	*			cis	-169.5	-169.4	-12.2	-139.4	174.1	-156	0	0	110.1
409	D	50.8	Low	53	Low	127 Å²	127	161.4 Å²	161.4	68%	0.679	81%	0.807	S	S	*	*			trans	-42.2	165	-179.9	-54.2	-33.7	0	0	0	120.7
410	D	54.8	Low	52.9	Low	171 Å²	171	160.1 Å²	160.1	91%	0.914	81%	0.805	S	S	*	*				-154	113	126.3	-105.5	-24	0	0	0	109.3
411	E	57.1	Low	52.9	Low	171 Å²	171	159.1 Å²	159.1	80%	0.799	80%	0.8	S	S	*	*			trans	-80.4	148.2	165.1	-61.5	177.7	144.1	0	0	109.4
412	D	55.4	Low	52.7	Low	173 Å²	173	157.1 Å²	157.1	93%	0.925	80%	0.795	S	S	*	*			trans	-151.5	118.8	154.4	-109.4	-24.2	0	0	0	108
413	E	54.8	Low	52.8	Low	177 Å²	177	156.6 Å²	156.6	83%	0.827	79%	0.792	S	S	*	*			trans	-94.1	-155.8	176.6	-61.9	-167.7	129.5	0	0	110.9
414	E	50.8	Low	53.1	Low	171 Å²	171	157.7 Å²	157.7	80%	0.799	80%	0.798	S	S	*	*			trans	71	103.5	170.7	-54.1	-172.5	-173	0	0	114.7
415	D	51.1	Low	53.3	Low	145 Å²	145	157 Å²	157	78%	0.775	80%	0.8	S	S	*	*				77.8	115.4	61.7	-67.4	-22.8	0	0	0	113.9
416	E	54.9	Low	53.7	Low	197 Å²	197	158.5 Å²	158.5	92%	0.921	80%	0.802	S	S	*	*			trans	-142.4	110.3	148.8	-76.8	-74.7	-174.2	0	0	106
417	E	50.7	Low	53.7	Low	166 Å²	166	164.5 Å²	164.5	78%	0.776	83%	0.826	S	S	*	*			trans	-86.8	159	177.9	-70.2	-173.7	131.1	0	0	112.3
418	D	50.9	Low	53.7	Low	144 Å²	144	164 Å²	164	77%	0.77	83%	0.826	S	S	*	*			trans	65.5	-178.8	142.4	-75.3	7.6	0	0	0	121.9
419	D	51.1	Low	53.8	Low	148 Å²	148	163.7 Å²	163.7	79%	0.791	83%	0.828	S	S	*	*			trans	61.8	95.7	-174.3	-65.3	-3.8	0	0	0	116.1
420	D	52.8	Low	54	Low	153 Å²	153	165.8 Å²	165.8	82%	0.818	84%	0.836	S	S	*	*				90.8	166.9	60.9	-88.6	-13.8	0	0	0	114.5
421	D	54.5	Low	53.9	Low	150 Å²	150	165.5 Å²	165.5	80%	0.802	83%	0.832	S	S	*	*			trans	68.6	143.4	175.4	-64.6	-5.4	0	0	0	118.7
422	D	53.7	Low	53.7	Low	134 Å²	134	165.1 Å²	165.1	72%	0.717	83%	0.834	S	S	*	*			cis	-164.9	172.5	-43.2	-138	-11.3	0	0	0	109.4
423	D	54	Low	53.6	Low	125 Å²	125	164.6 Å²	164.6	67%	0.668	83%	0.828	S	S	*	*			trans	48.7	131.8	151.6	-77.7	-13.4	0	0	0	123.2
424	D	55.3	Low	53.5	Low	140 Å²	140	163.7 Å²	163.7	75%	0.749	83%	0.828	S	S	*	*			trans	52.6	136.3	133	-66.1	-7.5	0	0	0	121.9
425	D	55.6	Low	53.7	Low	162 Å²	162	163.2 Å²	163.2	87%	0.866	83%	0.83	S	S	*	*				-156.9	159.1	74.5	-128.6	-25.3	0	0	0	114.4
426	E	60.7	Low	53.9	Low	182 Å²	182	164.7 Å²	164.7	85%	0.85	83%	0.834	S	S	*	*			trans	-89.6	139.9	176	-58.8	-176.4	134.1	0	0	113.1
427	E	53.1	Low	53.9	Low	275 Å²	275	161.7 Å²	161.7	100%	1.285	83%	0.827	S	S	*	*			trans	-167.8	0	134	-112.5	-171.1	-171.8	0	0	114

Retrieved 427 of 427 residues in 879.5 ms (Link to these results)

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