A0A077Z462_TRITR Loading...

PDZ domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z462, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 272 aa.

Structure Viewer

Loading PAE data...

(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	36.3	Very low	38.9	Very low	232 Å²	232	140.5 Å²	140.5	100%	1.143	73%	0.73	S	S	*	*				0	117.1	0	-68	-163.8	162.4	0	0	108.5	K3	M1-K3 PolarHBondContact O-N 3.25Å
2	P	35.5	Very low	39.7	Very low	132 Å²	132	129.9 Å²	129.9	86%	0.857	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-70.4	122	173.7	29	-29.7	0	0	0	108.4	T4	P2-T4 PolarHBondContact O-N 3.36Å
3	K	36.7	Very low	39.9	Very low	206 Å²	206	124.8 Å²	124.8	90%	0.896	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-66.2	116.2	174.6	-68.4	178.9	179.4	176.3	0	107.9	M1	M1-K3 PolarHBondContact O-N 3.25Å
4	T	30.1	Very low	39.6	Very low	125 Å²	125	116.6 Å²	116.6	77%	0.767	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-58.4	130.3	171.5	37.5	0	0	0	0	109.6	P2 T6	P2-T4 PolarHBondContact O-N 3.36Å; T4-T6 PolarHBondContact O-N 3.12Å; T4-T6 VanDerWaalsContact O-N 3.12Å
5	P	36.2	Very low	39.8	Very low	116 Å²	116	114.5 Å²	114.5	75%	0.753	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-64.3	117.5	177.7	25.4	-30.7	0	0	0	108.7	K7	P5-K7 PolarHBondContact O-N 3.16Å
6	T	33.1	Very low	40	Very low	128 Å²	128	112.8 Å²	112.8	79%	0.785	60%	0.604	S	S	*	*			trans	-61.6	103.1	170.7	43.2	0	0	0	0	108.2	T4 K8	T4-T6 PolarHBondContact O-N 3.12Å; T4-T6 VanDerWaalsContact O-N 3.12Å; T6-K8 PolarHBondContact O-N 3Å; T6-K8 VanDerWaalsContact O-N 3.16Å
7	K	33.6	Very low	40.1	Very low	161 Å²	161	110.2 Å²	110.2	70%	0.7	60%	0.597	S	S	*	*			trans	-63	113.9	172.8	-67	-173.1	178.2	-175.7	0	107.9	P5 C9	P5-K7 PolarHBondContact O-N 3.16Å; K7-C9 PolarHBondContact O-N 3.02Å
8	K	39.8	Very low	40	Very low	184 Å²	184	111.8 Å²	111.8	80%	0.8	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-63.2	128.2	174.7	-86.4	177.3	171.8	178.8	0	108	T6 Y10	T6-K8 PolarHBondContact O-N 3Å; T6-K8 VanDerWaalsContact O-N 3.16Å; K8-Y10 PolarHBondContact O-N 3.19Å
9	C	43.5	Very low	40.1	Very low	63 Å²	63	112.4 Å²	112.4	43%	0.426	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-61.5	136.4	170.4	-51	0	0	0	0	108.8	K7 L11 C91	K7-C9 PolarHBondContact O-N 3.02Å; C9-L11 PolarHBondContact O-N 3.09Å; C9-C91 WeakPolarHBondContact CA-SG 3.46Å; C9-C91 WeakPolarHBondContact CB-SG 3.45Å; C9-C91 PolarHBondContact N-SG 3.1Å; C9-C91 WeakPolarHBondContact SG-CB 3.36Å; C9-C91 CovalentContact SG-SG 2.07Å; C9-C91 PolarHBondContact SG-SG 3.08Å
10	Y	56.2	Low	39.7	Very low	105 Å²	105	112.3 Å²	112.3	41%	0.412	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.3	118.7	-171.6	-53.3	-87.3	0	0	0	109.3	K8 S88 V89 P103	K8-Y10 PolarHBondContact O-N 3.19Å; Y10-S88 VanDerWaalsContact O-CA 3.29Å; Y10-S88 WeakPolarHBondContact O-CA 3.43Å; Y10-S88 WeakPolarHBondContact O-CB 3.3Å; Y10-V89 PolarHBondContact O-N 3.49Å; Y10-P103 VanDerWaalsContact CB-CG 3.48Å
11	L	47	Very low	39.7	Very low	93 Å²	93	112.4 Å²	112.4	49%	0.487	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.2	142.3	173.2	-68.7	168.2	0	0	0	107.8	C9 P13 Y87 S88	C9-L11 PolarHBondContact O-N 3.09Å; L11-P13 VanDerWaalsContact O-CD 3.26Å; L11-P13 WeakPolarHBondContact O-CD 3.41Å; L11-Y87 HydrophobicContact CD2-CE1 4.25Å; L11-S88 VanDerWaalsContact CD2-CB 3.42Å
12	I	48.8	Very low	39.7	Very low	14 Å²	14	105.4 Å²	105.4	7%	0.072	60%	0.596	C	S	.	*	P	Polyproline II helix	trans	-66.4	118.2	160.2	-56.4	-179.5	0	0	0	106.1	S14 F71 Y87 P103	I12-S14 PolarHBondContact O-N 3.22Å; I12-S14 VanDerWaalsContact O-N 3.11Å; I12-F71 HydrophobicContact CD1-CE1 3.73Å; I12-F71 HydrophobicContact CD1-CZ 4.03Å; I12-Y87 HydrophobicContact CB-CD2 4.09Å; I12-Y87 HydrophobicContact CB-CE2 3.89Å; I12-Y87 HydrophobicContact CD1-CD2 4.11Å; I12-Y87 HydrophobicContact CG1-CD2 4.21Å; I12-Y87 PolarHBondContact N-O 3.21Å; I12-P103 HydrophobicContact CG1-CB 3.8Å
13	P	41.8	Very low	39.9	Very low	64 Å²	64	105.6 Å²	105.6	42%	0.416	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-60	120.4	179.7	-19.8	31.3	0	0	0	109.9	L11 R46	L11-P13 VanDerWaalsContact O-CD 3.26Å; L11-P13 WeakPolarHBondContact O-CD 3.41Å; P13-R46 PolarHBondContact O-NH1 3.46Å
14	S	36.2	Very low	40	Very low	10 Å²	10	102.2 Å²	102.2	7%	0.07	58%	0.577	C	S	.	*	P	Polyproline II helix	trans	-82.5	136.1	165.1	69.3	0	0	0	0	109	I12 T16 S17 E39	I12-S14 PolarHBondContact O-N 3.22Å; I12-S14 VanDerWaalsContact O-N 3.11Å; S14-T16 PolarHBondContact O-N 3.47Å; S14-T16 VanDerWaalsContact O-N 3.09Å; S14-S17 PolarHBondContact O-OG 3.17Å; S14-S17 WeakPolarHBondContact OG-CB 3.33Å; S14-S17 PolarHBondContact OG-OG 2.98Å; S14-E39 WeakPolarHBondContact CB-OE1 3.15Å; S14-E39 PolarHBondContact OG-OE1 3.48Å
15	P	41.9	Very low	40.4	Very low	84 Å²	84	107 Å²	107	55%	0.545	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.5	-4.7	179.7	27.7	-33.3	0	0	0	113.3	I42	P15-I42 HydrophobicContact CG-CD1 4.01Å; P15-I42 HydrophobicContact CG-CG2 3.75Å
16	T	43	Very low	40.5	Very low	88 Å²	88	109.3 Å²	109.3	54%	0.54	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.8	-0.5	-174.4	40.8	0	0	0	0	115	S14 T18	S14-T16 PolarHBondContact O-N 3.47Å; S14-T16 VanDerWaalsContact O-N 3.09Å; T16-T18 PolarHBondContact O-N 3.48Å
17	S	42.2	Very low	40.5	Very low	69 Å²	69	109.8 Å²	109.8	48%	0.483	58%	0.579	S	S	.	*			trans	-92.8	65.6	-177.4	55.6	0	0	0	0	113.7	S14 V19	S14-S17 PolarHBondContact O-OG 3.17Å; S14-S17 WeakPolarHBondContact OG-CB 3.33Å; S14-S17 PolarHBondContact OG-OG 2.98Å; S17-V19 PolarHBondContact O-N 2.07Å
18	T	38.8	Very low	40.4	Very low	138 Å²	138	106.3 Å²	106.3	85%	0.847	59%	0.588	S	S	*	*			trans	-76.8	17.2	159.1	-54.8	0	0	0	0	111.7	T16 Q20	T16-T18 PolarHBondContact O-N 3.48Å; T18-Q20 PolarHBondContact O-N 3.47Å
19	V	40.8	Very low	40.1	Very low	123 Å²	123	103.2 Å²	103.2	75%	0.745	59%	0.585	S	S	*	*	S	Bend	trans	-80.4	90.7	176.7	-175	0	0	0	0	109.2	S17 S21	S17-V19 PolarHBondContact O-N 2.07Å; V19-S21 PolarHBondContact O-N 3.18Å
20	Q	32.2	Very low	39.7	Very low	111 Å²	111	106.6 Å²	106.6	52%	0.519	59%	0.594	S	S	.	*			trans	7.6	93.9	161.3	-70.5	-173.5	-7.4	0	0	116.3	T18 S22 Q23	T18-Q20 PolarHBondContact O-N 3.47Å; Q20-S22 PolarHBondContact O-N 3.2Å; Q20-Q23 HydrophobicContact CB-CG 4.35Å; Q20-Q23 PolarHBondContact O-N 2.82Å; Q20-Q23 VanDerWaalsContact O-N 3.1Å
21	S	39.8	Very low	38.8	Very low	115 Å²	115	109.5 Å²	109.5	80%	0.804	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	-7.9	163.6	-46.5	0	0	0	0	113.8	V19	V19-S21 PolarHBondContact O-N 3.18Å
22	S	37.7	Very low	38.9	Very low	85 Å²	85	110 Å²	110	59%	0.594	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-18.4	175.8	52	0	0	0	0	115.2	Q20	Q20-S22 PolarHBondContact O-N 3.2Å
23	Q	38.3	Very low	39.5	Very low	136 Å²	136	113.3 Å²	113.3	64%	0.636	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-18.8	-176.9	-70.5	-148.6	-24.8	0	0	115.2	Q20 R25	Q20-Q23 HydrophobicContact CB-CG 4.35Å; Q20-Q23 PolarHBondContact O-N 2.82Å; Q20-Q23 VanDerWaalsContact O-N 3.1Å; Q23-R25 VanDerWaalsContact C-N 3.25Å; Q23-R25 PolarHBondContact O-N 2.66Å
24	L	38.8	Very low	40.1	Very low	135 Å²	135	115.2 Å²	115.2	71%	0.707	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-6	-178.7	-77.9	155.4	0	0	0	114.4
25	R	39.1	Very low	41.4	Very low	225 Å²	225	115.2 Å²	115.2	85%	0.849	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-8.4	-179.2	-87.4	-178.1	154.3	-153.7	-5.8	115.2	Q23	Q23-R25 VanDerWaalsContact C-N 3.25Å; Q23-R25 PolarHBondContact O-N 2.66Å
26	Q	38.9	Very low	42.4	Very low	165 Å²	165	113.8 Å²	113.8	77%	0.771	62%	0.617	S	S	*	*	S	Bend	trans	-94	-12.7	-168.3	-83.9	-177.5	-18.8	0	0	116.2
27	N	32.1	Very low	43.3	Very low	138 Å²	138	113.7 Å²	113.7	74%	0.738	63%	0.625	S	S	*	*	S	Bend	trans	-122.4	5.9	-167.7	-71.9	-19.9	0	0	0	117.2	V29	N27-V29 WeakPolarHBondContact O-CG2 3.2Å; N27-V29 PolarHBondContact O-N 2.69Å
28	G	32.1	Very low	44.3	Very low	87 Å²	87	118 Å²	118	90%	0.897	64%	0.635	S	S	*	*	S	Bend	trans	57.9	10.8	168.7	0	0	0	0	0	116.4
29	V	32.3	Very low	45.4	Very low	120 Å²	120	112 Å²	112	73%	0.727	60%	0.597	S	S	*	*			trans	-124.6	104.2	176.1	-178.3	0	0	0	0	105.1	N27 E31	N27-V29 WeakPolarHBondContact O-CG2 3.2Å; N27-V29 PolarHBondContact O-N 2.69Å; V29-E31 VanDerWaalsContact C-N 3.32Å; V29-E31 PolarHBondContact O-N 2.94Å
30	E	36.9	Very low	46.3	Very low	134 Å²	134	107.6 Å²	107.6	63%	0.626	57%	0.57	S	S	*	*			trans	-70.4	92.8	172.9	-73.9	-171.9	162.3	0	0	108.1	F32 I90	E30-F32 PolarHBondContact O-N 3.01Å; E30-I90 WeakPolarHBondContact OE2-CG2 3.44Å
31	E	35.8	Very low	47.4	Very low	166 Å²	166	107.8 Å²	107.8	78%	0.776	57%	0.57	S	S	*	*			trans	-64.5	116.8	170.7	-167	170.4	-169.9	0	0	108.4	V29 H33	V29-E31 VanDerWaalsContact C-N 3.32Å; V29-E31 PolarHBondContact O-N 2.94Å; E31-H33 PolarHBondContact O-N 2.74Å
32	F	49	Very low	48.2	Very low	103 Å²	103	104.7 Å²	104.7	45%	0.452	54%	0.544	S	S	.	.			trans	-58.1	110.2	179.3	-68	-98.2	0	0	0	109.5	E30 Y34 I90	E30-F32 PolarHBondContact O-N 3.01Å; F32-Y34 HydrophobicContact CB-CD2 4.12Å; F32-Y34 HydrophobicContact CB-CE2 3.66Å; F32-Y34 WeakPolarHBondContact O-CD2 3.28Å; F32-Y34 PolarHBondContact O-N 3.34Å; F32-I90 HydrophobicContact CD1-CD1 3.7Å; F32-I90 HydrophobicContact CE1-CD1 3.22Å; F32-I90 HydrophobicContact CZ-CD1 3.96Å
33	H	62.6	Low	49.1	Very low	84 Å²	84	100.8 Å²	100.8	39%	0.389	52%	0.517	S	S	.	.			trans	-74	96.6	173.9	-179.3	62	0	0	0	109.4	E31 E39 Y87	E31-H33 PolarHBondContact O-N 2.74Å; H33-E39 IonicContact CE1-OE2 3.73Å; H33-E39 IonicContact NE2-OE1 3.79Å; H33-E39 IonicContact NE2-OE2 3.86Å; H33-Y87 AromaticContact CD2-CE1 3.75Å
34	Y	54.6	Low	49.9	Very low	103 Å²	103	96.2 Å²	96.2	40%	0.404	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-80.4	133.8	164.2	-69.7	-87.1	0	0	0	108.7	F32 S36	F32-Y34 HydrophobicContact CB-CD2 4.12Å; F32-Y34 HydrophobicContact CB-CE2 3.66Å; F32-Y34 WeakPolarHBondContact O-CD2 3.28Å; F32-Y34 PolarHBondContact O-N 3.34Å; Y34-S36 PolarHBondContact O-N 2.62Å
35	P	62.1	Low	50.7	Low	10 Å²	10	98.4 Å²	98.4	7%	0.065	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-58.4	130.8	176.4	20.7	-28.4	0	0	0	109.5	E39 N40 I43 F71 Y87	P35-E39 HydrophobicContact CB-CB 3.86Å; P35-N40 WeakPolarHBondContact CB-OD1 3.33Å; P35-N40 WeakPolarHBondContact CG-OD1 3.27Å; P35-N40 PolarHBondContact O-ND2 3.43Å; P35-N40 VanDerWaalsContact O-ND2 3.1Å; P35-I43 HydrophobicContact CB-CD1 4.27Å; P35-F71 HydrophobicContact CG-CB 3.83Å; P35-Y87 HydrophobicContact CB-CD2 4.49Å; P35-Y87 HydrophobicContact CB-CE1 4.24Å; P35-Y87 HydrophobicContact CB-CE2 4.11Å; P35-Y87 HydrophobicContact CG-CD1 4.11Å; P35-Y87 HydrophobicContact CG-CD2 4.08Å; P35-Y87 HydrophobicContact CG-CE1 4.17Å; P35-Y87 HydrophobicContact CG-CE2 4.19Å; P35-Y87 HydrophobicContact CG-CG 4.03Å
36	S	64	Low	51.6	Low	55 Å²	55	91.8 Å²	91.8	39%	0.385	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-59.5	164.1	174	64.3	0	0	0	0	110.8	Y34 K38 E39 N40	Y34-S36 PolarHBondContact O-N 2.62Å; S36-K38 PolarHBondContact O-N 3.21Å; S36-K38 VanDerWaalsContact O-N 3.15Å; S36-E39 WeakPolarHBondContact CB-OE2 3.4Å; S36-E39 PolarHBondContact N-OE2 3.13Å; S36-E39 PolarHBondContact O-N 3.45Å; S36-E39 VanDerWaalsContact OG-CG 3.31Å; S36-E39 WeakPolarHBondContact OG-CG 3.09Å; S36-E39 PolarHBondContact OG-N 3.49Å; S36-E39 PolarHBondContact OG-OE2 3.37Å; S36-N40 WeakPolarHBondContact O-CB 3.16Å; S36-N40 PolarHBondContact O-N 3.4Å; S36-N40 PolarHBondContact O-ND2 3.44Å
37	A	61.7	Low	52.6	Low	86 Å²	86	86.5 Å²	86.5	71%	0.711	45%	0.453	S	S	*	.	H	α-helix	trans	-55.3	-34.9	175.7	0	0	0	0	0	112.7	Q41	A37-Q41 WeakPolarHBondContact O-CB 3.35Å; A37-Q41 PolarHBondContact O-N 2.81Å
38	K	62.8	Low	54.5	Low	160 Å²	160	80.8 Å²	80.8	70%	0.696	42%	0.422	S	S	*	.	H	α-helix	trans	-67.9	-44.4	175.2	-67.7	-176.4	178.4	-177.5	0	111.9	S36 Q41 I42	S36-K38 PolarHBondContact O-N 3.21Å; S36-K38 VanDerWaalsContact O-N 3.15Å; K38-Q41 WeakPolarHBondContact O-CB 3.34Å; K38-Q41 PolarHBondContact O-N 2.84Å; K38-I42 WeakPolarHBondContact O-CG1 3.44Å; K38-I42 PolarHBondContact O-N 3.46Å
39	E	61.5	Low	56.7	Low	12 Å²	12	80.1 Å²	80.1	6%	0.056	40%	0.397	C	S	.	.	H	α-helix	trans	-66.5	-42	177.2	-70.5	167.3	135	0	0	111.3	S14 H33 P35 S36 Q41 I42 I43	S14-E39 WeakPolarHBondContact CB-OE1 3.15Å; S14-E39 PolarHBondContact OG-OE1 3.48Å; H33-E39 IonicContact CE1-OE2 3.73Å; H33-E39 IonicContact NE2-OE1 3.79Å; H33-E39 IonicContact NE2-OE2 3.86Å; P35-E39 HydrophobicContact CB-CB 3.86Å; S36-E39 WeakPolarHBondContact CB-OE2 3.4Å; S36-E39 PolarHBondContact N-OE2 3.13Å; S36-E39 PolarHBondContact O-N 3.45Å; S36-E39 VanDerWaalsContact OG-CG 3.31Å; S36-E39 WeakPolarHBondContact OG-CG 3.09Å; S36-E39 PolarHBondContact OG-N 3.49Å; S36-E39 PolarHBondContact OG-OE2 3.37Å; E39-Q41 VanDerWaalsContact C-N 3.26Å; E39-Q41 PolarHBondContact O-N 3Å; E39-I42 PolarHBondContact O-N 2.82Å; E39-I43 WeakPolarHBondContact O-CB 3.41Å; E39-I43 WeakPolarHBondContact O-CD1 3.48Å; E39-I43 WeakPolarHBondContact O-CG1 3.02Å; E39-I43 PolarHBondContact O-N 3.46Å
40	N	59.3	Low	59.3	Low	30 Å²	30	75.7 Å²	75.7	16%	0.16	37%	0.367	C	S	.	.	H	α-helix	trans	-57.9	-40	171.6	-78	-32	0	0	0	111.7	P35 S36 S44 F71	P35-N40 WeakPolarHBondContact CB-OD1 3.33Å; P35-N40 WeakPolarHBondContact CG-OD1 3.27Å; P35-N40 PolarHBondContact O-ND2 3.43Å; P35-N40 VanDerWaalsContact O-ND2 3.1Å; S36-N40 WeakPolarHBondContact O-CB 3.16Å; S36-N40 PolarHBondContact O-N 3.4Å; S36-N40 PolarHBondContact O-ND2 3.44Å; N40-S44 WeakPolarHBondContact O-CA 3.29Å; N40-S44 WeakPolarHBondContact O-CB 3.42Å; N40-S44 PolarHBondContact O-N 2.76Å; N40-S44 PolarHBondContact O-OG 2.8Å; N40-F71 WeakPolarHBondContact OD1-CB 3.45Å
41	Q	56.3	Low	61.6	Low	115 Å²	115	70.1 Å²	70.1	54%	0.537	34%	0.343	S	S	.	.	H	α-helix	trans	-64.4	-43.7	176.3	-171.5	176.6	32.9	0	0	111.7	A37 K38 E39 S44 R45	A37-Q41 WeakPolarHBondContact O-CB 3.35Å; A37-Q41 PolarHBondContact O-N 2.81Å; K38-Q41 WeakPolarHBondContact O-CB 3.34Å; K38-Q41 PolarHBondContact O-N 2.84Å; E39-Q41 VanDerWaalsContact C-N 3.26Å; E39-Q41 PolarHBondContact O-N 3Å; Q41-S44 PolarHBondContact O-N 3.29Å; Q41-R45 WeakPolarHBondContact O-CG 3.49Å; Q41-R45 PolarHBondContact O-N 2.93Å
42	I	57.1	Low	63.8	Low	49 Å²	49	67.5 Å²	67.5	25%	0.251	34%	0.34	S	S	.	.	H	α-helix	trans	-65.7	-44.6	178.2	-66.8	162.2	0	0	0	111.1	P15 K38 E39 S44 R45 R46	P15-I42 HydrophobicContact CG-CD1 4.01Å; P15-I42 HydrophobicContact CG-CG2 3.75Å; K38-I42 WeakPolarHBondContact O-CG1 3.44Å; K38-I42 PolarHBondContact O-N 3.46Å; E39-I42 PolarHBondContact O-N 2.82Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-R45 WeakPolarHBondContact O-CB 3.24Å; I42-R45 PolarHBondContact O-N 3.25Å; I42-R46 PolarHBondContact O-N 3.4Å
43	I	56.9	Low	65.7	Low	3 Å²	3	69.6 Å²	69.6	2%	0.015	35%	0.346	C	S	.	.	H	α-helix	trans	-68.4	-37.7	178.3	-58.9	159.4	0	0	0	110	P35 E39 R45 R46 F71 Y87	P35-I43 HydrophobicContact CB-CD1 4.27Å; E39-I43 WeakPolarHBondContact O-CB 3.41Å; E39-I43 WeakPolarHBondContact O-CD1 3.48Å; E39-I43 WeakPolarHBondContact O-CG1 3.02Å; E39-I43 PolarHBondContact O-N 3.46Å; I43-R45 PolarHBondContact O-N 3.21Å; I43-R46 WeakPolarHBondContact O-CB 3.29Å; I43-R46 PolarHBondContact O-N 3.07Å; I43-F71 HydrophobicContact CB-CE2 4.16Å; I43-F71 HydrophobicContact CG2-CD2 4.18Å; I43-F71 HydrophobicContact CG2-CE1 4.41Å; I43-F71 HydrophobicContact CG2-CE2 3.28Å; I43-F71 HydrophobicContact CG2-CZ 3.42Å; I43-F71 VanDerWaalsContact CG2-CZ 3.42Å; I43-Y87 HydrophobicContact CD1-CD2 4.05Å; I43-Y87 HydrophobicContact CD1-CE2 3.52Å
44	S	54.5	Low	67.1	Low	40 Å²	40	69 Å²	69	28%	0.28	35%	0.348	S	S	.	.	H	α-helix	trans	-65.2	-26.6	175	-65.3	0	0	0	0	113	N40 Q41 I42 R46	N40-S44 WeakPolarHBondContact O-CA 3.29Å; N40-S44 WeakPolarHBondContact O-CB 3.42Å; N40-S44 PolarHBondContact O-N 2.76Å; N40-S44 PolarHBondContact O-OG 2.8Å; Q41-S44 PolarHBondContact O-N 3.29Å; I42-S44 VanDerWaalsContact C-N 3.34Å; S44-R46 VanDerWaalsContact C-N 3.25Å
45	R	55.9	Low	69	Low	181 Å²	181	68.2 Å²	68.2	68%	0.683	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18	171.4	-75.8	-178.6	-178.6	-160.3	-0.7	112.7	Q41 I42 I43	Q41-R45 WeakPolarHBondContact O-CG 3.49Å; Q41-R45 PolarHBondContact O-N 2.93Å; I42-R45 WeakPolarHBondContact O-CB 3.24Å; I42-R45 PolarHBondContact O-N 3.25Å; I43-R45 PolarHBondContact O-N 3.21Å
46	R	57.1	Low	70.6	Confident	87 Å²	87	74.6 Å²	74.6	33%	0.328	38%	0.375	S	S	.	.	S	Bend	trans	-81.2	130.7	176.6	-69.8	-174.7	178.8	139.1	-1.3	110.4	P13 I42 I43 S44 I48	P13-R46 PolarHBondContact O-NH1 3.46Å; I42-R46 PolarHBondContact O-N 3.4Å; I43-R46 WeakPolarHBondContact O-CB 3.29Å; I43-R46 PolarHBondContact O-N 3.07Å; S44-R46 VanDerWaalsContact C-N 3.25Å; R46-I48 PolarHBondContact O-N 3.39Å; R46-I48 VanDerWaalsContact O-N 3.12Å
47	T	60.7	Low	72.1	Confident	54 Å²	54	72 Å²	72	33%	0.331	36%	0.357	S	S	.	.			trans	-78.9	95.7	-180	-55.9	0	0	0	0	113.7	I49 F76 V226	T47-I49 HydrophobicContact CG2-CG1 4.2Å; T47-F76 VanDerWaalsContact CB-CE1 3.48Å; T47-F76 VanDerWaalsContact CB-CZ 3.42Å; T47-F76 HydrophobicContact CG2-CD1 3.3Å; T47-F76 HydrophobicContact CG2-CD2 3.5Å; T47-F76 VanDerWaalsContact CG2-CD2 3.5Å; T47-F76 HydrophobicContact CG2-CE1 3.38Å; T47-F76 HydrophobicContact CG2-CE2 3.6Å; T47-F76 HydrophobicContact CG2-CG 3.4Å; T47-F76 VanDerWaalsContact CG2-CG 3.4Å; T47-F76 HydrophobicContact CG2-CZ 3.57Å; T47-F76 WeakPolarHBondContact OG1-CE1 3.49Å; T47-F76 WeakPolarHBondContact OG1-CZ 3.38Å; T47-V226 HydrophobicContact CG2-CG1 4.37Å
48	I	71.9	Confident	73.8	Confident	18 Å²	18	73 Å²	73	9%	0.092	35%	0.349	C	S	.	.			trans	-95.7	115.8	172.1	-47.8	175.7	0	0	0	108.9	R46 W50 F76 P142	R46-I48 PolarHBondContact O-N 3.39Å; R46-I48 VanDerWaalsContact O-N 3.12Å; I48-W50 HydrophobicContact CB-CH2 3.69Å; I48-W50 HydrophobicContact CB-CZ2 3.6Å; I48-W50 HydrophobicContact CB-CZ3 4.29Å; I48-W50 HydrophobicContact CD1-CZ2 4.09Å; I48-W50 HydrophobicContact CG1-CZ2 4.44Å; I48-W50 HydrophobicContact CG2-CD2 4Å; I48-W50 HydrophobicContact CG2-CE3 4.5Å; I48-W50 HydrophobicContact CG2-CH2 3.95Å; I48-W50 HydrophobicContact CG2-CZ2 3.38Å; I48-W50 HydrophobicContact CG2-CZ3 4.48Å; I48-W50 WeakPolarHBondContact O-CZ3 3.04Å; I48-F76 VanDerWaalsContact N-CE2 3.34Å; I48-F76 WeakPolarHBondContact O-CD2 3.45Å; I48-P142 HydrophobicContact CG2-CB 3.71Å
49	I	78	Confident	75.4	Confident	73 Å²	73	65.4 Å²	65.4	37%	0.374	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-96.7	133.5	168	-52.6	177.6	0	0	0	106.5	T47 P142 L143	T47-I49 HydrophobicContact CG2-CG1 4.2Å; I49-P142 CarbonylContact O-C 3.59Å; I49-P142 WeakPolarHBondContact O-CA 3.37Å; I49-L143 HydrophobicContact CB-CB 4.38Å; I49-L143 HydrophobicContact CG2-CB 4.47Å; I49-L143 HydrophobicContact CG2-CD1 3.86Å; I49-L143 PolarHBondContact O-N 3.35Å
50	W	85.9	Confident	77.1	Confident	27 Å²	27	69.2 Å²	69.2	10%	0.102	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-103.9	151.9	176.1	-67.4	-86	0	0	0	111.8	I48 C73 A83 V85 G104 R106 K141	I48-W50 HydrophobicContact CB-CH2 3.69Å; I48-W50 HydrophobicContact CB-CZ2 3.6Å; I48-W50 HydrophobicContact CB-CZ3 4.29Å; I48-W50 HydrophobicContact CD1-CZ2 4.09Å; I48-W50 HydrophobicContact CG1-CZ2 4.44Å; I48-W50 HydrophobicContact CG2-CD2 4Å; I48-W50 HydrophobicContact CG2-CE3 4.5Å; I48-W50 HydrophobicContact CG2-CH2 3.95Å; I48-W50 HydrophobicContact CG2-CZ2 3.38Å; I48-W50 HydrophobicContact CG2-CZ3 4.48Å; I48-W50 WeakPolarHBondContact O-CZ3 3.04Å; W50-C73 WeakPolarHBondContact CH2-SG 3.31Å; W50-A83 HydrophobicContact CH2-CB 4.13Å; W50-A83 HydrophobicContact CZ3-CB 4.17Å; W50-V85 HydrophobicContact CH2-CG2 3.99Å; W50-V85 HydrophobicContact CZ2-CG1 4.37Å; W50-V85 HydrophobicContact CZ2-CG2 3.42Å; W50-V85 VanDerWaalsContact CZ2-CG2 3.42Å; W50-G104 PolarHBondContact NE1-O 2.82Å; W50-R106 VanDerWaalsContact CD1-CB 3.46Å; W50-R106 HydrophobicContact CD2-CB 3.78Å; W50-R106 HydrophobicContact CD2-CG 4.43Å; W50-R106 HydrophobicContact CG-CB 3.77Å; W50-R106 HydrophobicContact CZ2-CB 4.21Å; W50-R106 VanDerWaalsContact NE1-CB 3.31Å; W50-K141 CarbonylContact C-O 3.58Å; W50-K141 WeakPolarHBondContact CA-O 3.48Å
51	S	85.3	Confident	78.8	Confident	16 Å²	16	69 Å²	69	11%	0.112	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-64	145.8	175.4	97.2	0	0	0	0	109.2	Y53 K141	S51-Y53 PolarHBondContact O-N 3.49Å; S51-Y53 PolarHBondContact OG-N 2.9Å; S51-Y53 PolarHBondContact OG-O 3.3Å; S51-K141 PolarHBondContact N-O 3.48Å
52	P	83.4	Confident	80.5	Confident	111 Å²	111	65.1 Å²	65.1	72%	0.721	33%	0.329	S	S	*	.	S	Bend	trans	-70.7	-11.4	173.3	32	-36.3	0	0	0	112.1
53	Y	88.5	Confident	82.1	Confident	148 Å²	148	71.6 Å²	71.6	58%	0.58	36%	0.355	S	S	*	.			trans	-82.1	136.7	178.9	-57.9	-69.7	0	0	0	110.5	S51	S51-Y53 PolarHBondContact O-N 3.49Å; S51-Y53 PolarHBondContact OG-N 2.9Å; S51-Y53 PolarHBondContact OG-O 3.3Å
54	V	92.1	Very high	83.7	Confident	71 Å²	71	80 Å²	80	43%	0.43	39%	0.394	S	S	.	.			trans	-109.8	127.5	178.6	178.7	0	0	0	0	108.7	M108 E138 I139	V54-M108 HydrophobicContact CG2-CG 4.33Å; V54-E138 HydrophobicContact CG1-CB 3.56Å; V54-E138 HydrophobicContact CG1-CG 4.01Å; V54-I139 CarbonylContact C-O 3.55Å; V54-I139 VanDerWaalsContact CA-O 3.31Å; V54-I139 WeakPolarHBondContact CA-O 3.47Å
55	E	93.9	Very high	85.5	Confident	86 Å²	86	79 Å²	79	40%	0.402	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	140.9	177.1	-66.1	177.6	-167.6	0	0	110.1	E138 I139 K141	E55-E138 CarbonylContact O-C 3.54Å; E55-E138 WeakPolarHBondContact O-CA 3.35Å; E55-I139 HydrophobicContact CB-CG1 4.08Å; E55-I139 PolarHBondContact N-O 2.96Å; E55-I139 PolarHBondContact O-N 3.37Å; E55-K141 WeakPolarHBondContact OE2-CE 3.2Å
56	K	96.1	Very high	87.4	Confident	144 Å²	144	71 Å²	71	63%	0.626	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.2	175.2	-74.8	-177.2	177.4	-173.9	0	110.3	V136 L137 E138	K56-V136 HydrophobicContact CD-CG1 4.5Å; K56-V136 HydrophobicContact CG-CG1 4.48Å; K56-L137 CarbonylContact C-O 3.56Å; K56-L137 WeakPolarHBondContact CA-O 3.48Å; K56-E138 WeakPolarHBondContact CE-OE1 3.41Å; K56-E138 HydrophobicContact CG-CG 3.92Å; K56-E138 IonicContact NZ-OE1 3.72Å
57	V	96.3	Very high	89.1	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.6	175.8	-177.7	0	0	0	0	109.2	L59 Q100 L137 I139	V57-L59 HydrophobicContact CG1-CD2 3.78Å; V57-L59 HydrophobicContact CG1-CG 4.16Å; V57-Q100 HydrophobicContact CG1-CB 3.95Å; V57-Q100 HydrophobicContact CG2-CB 3.83Å; V57-L137 HydrophobicContact CB-CB 4.35Å; V57-L137 PolarHBondContact N-O 2.8Å; V57-L137 PolarHBondContact O-N 3.11Å; V57-I139 HydrophobicContact CG2-CD1 3.62Å; V57-I139 HydrophobicContact CG2-CG1 3.95Å
58	L	96.8	Very high	90.7	Very high	107 Å²	107	65.7 Å²	65.7	56%	0.56	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	118.5	174.6	-177.1	69.6	0	0	0	109.7	P134 V136	L58-P134 HydrophobicContact CD1-CB 4.25Å; L58-V136 HydrophobicContact CD1-CG2 3.91Å
59	L	96.8	Very high	91.7	Very high	2 Å²	2	64.9 Å²	64.9	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	157.5	172.1	-56.7	-173.3	0	0	0	109.9	V57 L66 F68 A95 V135 L137	V57-L59 HydrophobicContact CG1-CD2 3.78Å; V57-L59 HydrophobicContact CG1-CG 4.16Å; L59-L66 HydrophobicContact CB-CD2 3.85Å; L59-L66 HydrophobicContact CD1-CB 4.37Å; L59-L66 HydrophobicContact CD1-CD2 4.01Å; L59-F68 HydrophobicContact CD1-CD1 4.46Å; L59-F68 HydrophobicContact CD1-CE1 4.09Å; L59-A95 HydrophobicContact CD1-CB 4.23Å; L59-V135 PolarHBondContact N-O 3.44Å; L59-V135 PolarHBondContact O-N 3.12Å; L59-L137 HydrophobicContact CD1-CD1 3.57Å; L59-L137 HydrophobicContact CD1-CG 4.34Å; L59-L137 HydrophobicContact CG-CD1 4.23Å
60	V	96.2	Very high	92.4	Very high	92 Å²	92	61.7 Å²	61.7	56%	0.558	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	108	169.1	-178.4	0	0	0	0	107.7	G62 A94 G133	V60-G62 PolarHBondContact O-N 3.17Å; V60-A94 WeakPolarHBondContact O-CB 3.37Å; V60-G133 CarbonylContact C-O 3.57Å; V60-G133 WeakPolarHBondContact CA-O 3.49Å
61	K	95.1	Very high	92.6	Very high	26 Å²	26	60.4 Å²	60.4	11%	0.113	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	115.9	177.4	-171.7	172.4	178.2	-179.3	0	108.8	L66 L127 K128 V130 E132 G133 V135	K61-L66 HydrophobicContact CB-CD2 3.75Å; K61-L66 HydrophobicContact CB-CG 4.36Å; K61-L66 HydrophobicContact CD-CG 4.33Å; K61-L66 HydrophobicContact CG-CD2 4.16Å; K61-L66 HydrophobicContact CG-CG 4.22Å; K61-L127 PolarHBondContact NZ-O 2.72Å; K61-K128 PolarHBondContact NZ-O 3.39Å; K61-V130 HydrophobicContact CD-CB 4.31Å; K61-V130 HydrophobicContact CD-CG1 4.32Å; K61-V130 WeakPolarHBondContact CD-O 3.38Å; K61-V130 WeakPolarHBondContact CE-O 3.49Å; K61-V130 PolarHBondContact NZ-O 3.27Å; K61-E132 WeakPolarHBondContact O-CA 3.34Å; K61-G133 PolarHBondContact N-O 3.19Å; K61-G133 PolarHBondContact O-N 3.45Å; K61-V135 HydrophobicContact CB-CG2 3.76Å
62	G	92.1	Very high	92.8	Very high	32 Å²	32	61.6 Å²	61.6	33%	0.33	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-96.6	-171	169.9	0	0	0	0	0	111.5	V60 E64 G65	V60-G62 PolarHBondContact O-N 3.17Å; G62-E64 PolarHBondContact O-N 2.85Å; G62-G65 PolarHBondContact N-O 2.83Å; G62-G65 WeakPolarHBondContact O-CA 3.28Å; G62-G65 PolarHBondContact O-N 3.01Å
63	K	91	Very high	92.7	Very high	186 Å²	186	56.6 Å²	56.6	81%	0.809	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-34	174.9	-63.7	-177.7	178.9	-177	0	113.3	G65	K63-G65 PolarHBondContact O-N 3.19Å
64	E	89.8	Confident	92.1	Very high	178 Å²	178	56 Å²	56	83%	0.832	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-5.4	175.4	-56.6	-61.3	154.8	0	0	113.3	G62	G62-E64 PolarHBondContact O-N 2.85Å
65	G	93.1	Very high	90.8	Very high	20 Å²	20	52.8 Å²	52.8	21%	0.206	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	86.6	-152.7	-175.3	0	0	0	0	0	113.7	G62 K63	G62-G65 PolarHBondContact N-O 2.83Å; G62-G65 WeakPolarHBondContact O-CA 3.28Å; G62-G65 PolarHBondContact O-N 3.01Å; K63-G65 PolarHBondContact O-N 3.19Å
66	L	94.5	Very high	89.3	Confident	12 Å²	12	52.8 Å²	52.8	6%	0.063	27%	0.265	C	S	.	.	S	Bend	trans	-92.6	-26.1	-176.7	-65.4	168.3	0	0	0	112.9	L59 K61 F68 A95 I110 L127 V135	L59-L66 HydrophobicContact CB-CD2 3.85Å; L59-L66 HydrophobicContact CD1-CB 4.37Å; L59-L66 HydrophobicContact CD1-CD2 4.01Å; K61-L66 HydrophobicContact CB-CD2 3.75Å; K61-L66 HydrophobicContact CB-CG 4.36Å; K61-L66 HydrophobicContact CD-CG 4.33Å; K61-L66 HydrophobicContact CG-CD2 4.16Å; K61-L66 HydrophobicContact CG-CG 4.22Å; L66-F68 HydrophobicContact CB-CD1 3.77Å; L66-F68 HydrophobicContact CB-CE1 3.46Å; L66-F68 VanDerWaalsContact CB-CE1 3.46Å; L66-F68 HydrophobicContact CB-CZ 4.45Å; L66-F68 HydrophobicContact CD1-CE1 3.72Å; L66-F68 HydrophobicContact CD1-CZ 4.05Å; L66-F68 HydrophobicContact CG-CE1 4.18Å; L66-A95 WeakPolarHBondContact O-CB 3.48Å; L66-A95 PolarHBondContact O-N 3.1Å; L66-I110 HydrophobicContact CD1-CD1 4.35Å; L66-L127 HydrophobicContact CD1-CD2 3.95Å; L66-V135 HydrophobicContact CD1-CG1 4.45Å; L66-V135 HydrophobicContact CD2-CB 4.08Å; L66-V135 HydrophobicContact CD2-CG1 4.35Å; L66-V135 HydrophobicContact CD2-CG2 4.05Å
67	G	94.2	Very high	87.6	Confident	10 Å²	10	51.5 Å²	51.5	10%	0.103	28%	0.275	C	S	.	.			trans	81.3	37.2	174	0	0	0	0	0	116.5	I90 S93	G67-I90 WeakPolarHBondContact O-CB 3.39Å; G67-I90 PolarHBondContact O-N 3.41Å; G67-S93 PolarHBondContact O-OG 3.26Å; G67-S93 VanDerWaalsContact O-OG 3.13Å
68	F	94.5	Very high	85.8	Confident	20 Å²	20	55.3 Å²	55.3	9%	0.088	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	159.5	167.4	63.1	-90	0	0	0	109.6	L59 L66 I70 V86 S88 V89 A95 L101 L127 L137	L59-F68 HydrophobicContact CD1-CD1 4.46Å; L59-F68 HydrophobicContact CD1-CE1 4.09Å; L66-F68 HydrophobicContact CB-CD1 3.77Å; L66-F68 HydrophobicContact CB-CE1 3.46Å; L66-F68 VanDerWaalsContact CB-CE1 3.46Å; L66-F68 HydrophobicContact CB-CZ 4.45Å; L66-F68 HydrophobicContact CD1-CE1 3.72Å; L66-F68 HydrophobicContact CD1-CZ 4.05Å; L66-F68 HydrophobicContact CG-CE1 4.18Å; F68-I70 HydrophobicContact CD2-CG2 3.77Å; F68-I70 HydrophobicContact CE2-CG2 3.57Å; F68-V86 HydrophobicContact CB-CG1 4.26Å; F68-V86 HydrophobicContact CD2-CG2 4.3Å; F68-S88 CarbonylContact C-O 3.48Å; F68-S88 WeakPolarHBondContact CA-O 3.45Å; F68-S88 WeakPolarHBondContact CB-O 3.41Å; F68-V89 HydrophobicContact CB-CG2 4.25Å; F68-A95 HydrophobicContact CB-CB 4.29Å; F68-A95 HydrophobicContact CD1-CB 4Å; F68-L101 HydrophobicContact CB-CD2 3.97Å; F68-L101 HydrophobicContact CD1-CD2 3.52Å; F68-L101 HydrophobicContact CD2-CD2 4.24Å; F68-L101 HydrophobicContact CE1-CD2 3.95Å; F68-L101 HydrophobicContact CG-CD2 3.66Å; F68-L127 HydrophobicContact CE2-CD1 4.38Å; F68-L127 HydrophobicContact CE2-CD2 4.32Å; F68-L127 HydrophobicContact CZ-CD2 3.79Å; F68-L137 HydrophobicContact CE1-CD1 3.93Å; F68-L137 HydrophobicContact CZ-CD1 4.03Å
69	S	92.5	Very high	83.9	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.014	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	157.6	171.4	67.8	0	0	0	0	110.4	V86 Y87 S88	S69-V86 WeakPolarHBondContact O-CA 3.14Å; S69-Y87 PolarHBondContact O-N 2.74Å; S69-Y87 WeakPolarHBondContact OG-CB 3.49Å; S69-S88 PolarHBondContact N-O 2.82Å; S69-S88 WeakPolarHBondContact OG-CB 3.35Å; S69-S88 PolarHBondContact OG-N 2.78Å; S69-S88 VanDerWaalsContact OG-N 3.16Å; S69-S88 PolarHBondContact OG-OG 2.7Å
70	I	92.6	Very high	82.2	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157.7	-178.8	57.2	161.5	0	0	0	111.3	F68 I84 V85 L120 A123 I124 L127	F68-I70 HydrophobicContact CD2-CG2 3.77Å; F68-I70 HydrophobicContact CE2-CG2 3.57Å; I70-I84 HydrophobicContact CB-CG2 3.91Å; I70-I84 HydrophobicContact CD1-CG2 3.66Å; I70-I84 HydrophobicContact CG1-CG2 4.39Å; I70-I84 HydrophobicContact CG2-CG2 4.05Å; I70-V85 CarbonylContact C-O 3.57Å; I70-V85 WeakPolarHBondContact CA-O 3.33Å; I70-L120 HydrophobicContact CD1-CD1 3.85Å; I70-L120 HydrophobicContact CG1-CD1 3.89Å; I70-A123 HydrophobicContact CD1-CB 3.75Å; I70-I124 HydrophobicContact CD1-CG1 4.06Å; I70-I124 HydrophobicContact CG1-CG1 4.39Å; I70-L127 HydrophobicContact CD1-CD1 3.54Å; I70-L127 HydrophobicContact CG1-CD1 4.18Å; I70-L127 HydrophobicContact CG2-CD1 4.26Å
71	F	89.6	Confident	81.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	163.8	169.6	73.7	-75.9	0	0	0	111.1	I12 P35 N40 I43 C73 I84 V85 Y87	I12-F71 HydrophobicContact CD1-CE1 3.73Å; I12-F71 HydrophobicContact CD1-CZ 4.03Å; P35-F71 HydrophobicContact CG-CB 3.83Å; N40-F71 WeakPolarHBondContact OD1-CB 3.45Å; I43-F71 HydrophobicContact CB-CE2 4.16Å; I43-F71 HydrophobicContact CG2-CD2 4.18Å; I43-F71 HydrophobicContact CG2-CE1 4.41Å; I43-F71 HydrophobicContact CG2-CE2 3.28Å; I43-F71 HydrophobicContact CG2-CZ 3.42Å; I43-F71 VanDerWaalsContact CG2-CZ 3.42Å; F71-C73 HydrophobicContact CD2-CB 4.37Å; F71-C73 HydrophobicContact CE2-CB 3.86Å; F71-I84 WeakPolarHBondContact O-CA 3.4Å; F71-V85 HydrophobicContact CD1-CB 3.87Å; F71-V85 HydrophobicContact CD1-CG1 4.26Å; F71-V85 VanDerWaalsContact CD1-O 3.29Å; F71-V85 WeakPolarHBondContact CD1-O 3.41Å; F71-V85 HydrophobicContact CE1-CB 3.39Å; F71-V85 HydrophobicContact CE1-CG1 3.37Å; F71-V85 HydrophobicContact CE1-CG2 4.48Å; F71-V85 HydrophobicContact CE2-CB 4.31Å; F71-V85 HydrophobicContact CZ-CB 3.63Å; F71-V85 HydrophobicContact CZ-CG1 3.64Å; F71-V85 HydrophobicContact CZ-CG2 4.27Å; F71-V85 PolarHBondContact N-O 3.32Å; F71-V85 PolarHBondContact O-N 3.38Å; F71-Y87 HydrophobicContact CD1-CD2 4.13Å; F71-Y87 HydrophobicContact CD1-CG 4.35Å; F71-Y87 HydrophobicContact CE1-CD2 4.36Å
72	E	89.9	Confident	80.8	Confident	40 Å²	40	58.1 Å²	58.1	19%	0.187	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.8	175.8	160	168.9	158.5	0	0	109.3	I82 I84 R119 L120	E72-I82 HydrophobicContact CB-CG2 4.48Å; E72-I82 HydrophobicContact CG-CG2 3.64Å; E72-I84 HydrophobicContact CB-CD1 4.31Å; E72-R119 IonicContact OE1-CZ 3.55Å; E72-R119 IonicContact OE1-NH1 2.73Å; E72-R119 PolarHBondContact OE1-NH1 3.25Å; E72-R119 WeakPolarHBondContact OE2-CA 3.46Å; E72-L120 HydrophobicContact CB-CB 3.88Å; E72-L120 PolarHBondContact OE2-N 3.2Å
73	C	81.2	Confident	80.6	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.7	170	66.6	0	0	0	0	110.4	W50 F71 A83 V85	W50-C73 WeakPolarHBondContact CH2-SG 3.31Å; F71-C73 HydrophobicContact CD2-CB 4.37Å; F71-C73 HydrophobicContact CE2-CB 3.86Å; C73-A83 PolarHBondContact N-O 2.92Å; C73-A83 PolarHBondContact O-N 2.71Å; C73-A83 PolarHBondContact SG-O 3.32Å; C73-V85 WeakPolarHBondContact SG-CG2 3.22Å
74	K	75.1	Confident	80.7	Confident	135 Å²	135	47.8 Å²	47.8	59%	0.587	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.4	173	-64.7	-174.5	178.1	-173.1	0	109.2
75	A	65.6	Low	80.8	Confident	5 Å²	5	39.3 Å²	39.3	4%	0.041	21%	0.212	C	C	.	.			trans	-73.8	150.2	175.5	0	0	0	0	0	111	D78 A81	A75-D78 CarbonylContact O-C 3.5Å; A75-D78 VanDerWaalsContact O-O 3.08Å; A75-A81 HydrophobicContact CB-CB 4.05Å; A75-A81 PolarHBondContact N-O 3.45Å
76	F	63.1	Low	80.7	Confident	86 Å²	86	38.3 Å²	38.3	38%	0.377	20%	0.202	S	C	.	.	S	Bend	trans	-71.7	-35.7	177.6	-74.5	-80.4	0	0	0	113.4	T47 I48 D78	T47-F76 VanDerWaalsContact CB-CE1 3.48Å; T47-F76 VanDerWaalsContact CB-CZ 3.42Å; T47-F76 HydrophobicContact CG2-CD1 3.3Å; T47-F76 HydrophobicContact CG2-CD2 3.5Å; T47-F76 VanDerWaalsContact CG2-CD2 3.5Å; T47-F76 HydrophobicContact CG2-CE1 3.38Å; T47-F76 HydrophobicContact CG2-CE2 3.6Å; T47-F76 HydrophobicContact CG2-CG 3.4Å; T47-F76 VanDerWaalsContact CG2-CG 3.4Å; T47-F76 HydrophobicContact CG2-CZ 3.57Å; T47-F76 WeakPolarHBondContact OG1-CE1 3.49Å; T47-F76 WeakPolarHBondContact OG1-CZ 3.38Å; I48-F76 VanDerWaalsContact N-CE2 3.34Å; I48-F76 WeakPolarHBondContact O-CD2 3.45Å; F76-D78 PolarHBondContact O-N 3.32Å
77	S	59	Low	80.5	Confident	117 Å²	117	37.9 Å²	37.9	82%	0.818	20%	0.2	S	C	*	.	S	Bend	trans	-71.5	-20.7	-174.5	56	0	0	0	0	113.6
78	D	58.5	Low	80.2	Confident	80 Å²	80	38.1 Å²	38.1	43%	0.428	20%	0.2	S	C	.	.			trans	-155.8	110	-178.7	177.6	-2.9	0	0	0	107.3	A75 F76 N80 A81	A75-D78 CarbonylContact O-C 3.5Å; A75-D78 VanDerWaalsContact O-O 3.08Å; F76-D78 PolarHBondContact O-N 3.32Å; D78-N80 PolarHBondContact O-N 3.35Å; D78-N80 WeakPolarHBondContact OD1-CB 3.26Å; D78-N80 PolarHBondContact OD1-N 3.24Å; D78-A81 HydrophobicContact CB-CB 3.72Å; D78-A81 WeakPolarHBondContact O-CB 3.07Å; D78-A81 PolarHBondContact O-N 3.49Å
79	H	57.4	Low	80	Confident	119 Å²	119	37.3 Å²	37.3	55%	0.551	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.9	-178.9	-59.6	-63.1	0	0	0	113.6
80	N	60.6	Low	79.9	Confident	138 Å²	138	38.9 Å²	38.9	74%	0.738	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-12.7	176.6	-158.2	40.1	0	0	0	113.1	D78	D78-N80 PolarHBondContact O-N 3.35Å; D78-N80 WeakPolarHBondContact OD1-CB 3.26Å; D78-N80 PolarHBondContact OD1-N 3.24Å
81	A	77.6	Confident	79.8	Confident	10 Å²	10	40 Å²	40	8%	0.083	21%	0.212	C	C	.	.			trans	-79.9	131	178.4	0	0	0	0	0	111	A75 D78 N117	A75-A81 HydrophobicContact CB-CB 4.05Å; A75-A81 PolarHBondContact N-O 3.45Å; D78-A81 HydrophobicContact CB-CB 3.72Å; D78-A81 WeakPolarHBondContact O-CB 3.07Å; D78-A81 PolarHBondContact O-N 3.49Å; A81-N117 VanDerWaalsContact CA-OD1 3.24Å; A81-N117 WeakPolarHBondContact CA-OD1 3.13Å
82	I	85.2	Confident	79.8	Confident	19 Å²	19	46.3 Å²	46.3	10%	0.097	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.4	-179	-65.9	165.3	0	0	0	108.7	E72 N117 V118 R119	E72-I82 HydrophobicContact CB-CG2 4.48Å; E72-I82 HydrophobicContact CG-CG2 3.64Å; I82-N117 PolarHBondContact N-OD1 2.82Å; I82-N117 PolarHBondContact O-N 2.87Å; I82-V118 WeakPolarHBondContact CG2-O 3.43Å; I82-R119 HydrophobicContact CD1-CG 4.45Å
83	A	88.8	Confident	80	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.4	174.1	0	0	0	0	0	110.1	W50 C73 V85 R106	W50-A83 HydrophobicContact CH2-CB 4.13Å; W50-A83 HydrophobicContact CZ3-CB 4.17Å; C73-A83 PolarHBondContact N-O 2.92Å; C73-A83 PolarHBondContact O-N 2.71Å; C73-A83 PolarHBondContact SG-O 3.32Å; A83-V85 HydrophobicContact CB-CG2 4.35Å; A83-R106 HydrophobicContact CB-CG 4.19Å
84	I	92.3	Very high	80.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	124	169.6	-61	-58.5	0	0	0	108	I70 F71 E72 R106 L107 M115 V118 A123	I70-I84 HydrophobicContact CB-CG2 3.91Å; I70-I84 HydrophobicContact CD1-CG2 3.66Å; I70-I84 HydrophobicContact CG1-CG2 4.39Å; I70-I84 HydrophobicContact CG2-CG2 4.05Å; F71-I84 WeakPolarHBondContact O-CA 3.4Å; E72-I84 HydrophobicContact CB-CD1 4.31Å; I84-R106 CarbonylContact O-C 3.52Å; I84-R106 WeakPolarHBondContact O-CA 3.39Å; I84-L107 HydrophobicContact CG2-CB 4.28Å; I84-L107 HydrophobicContact CG2-CD2 4.42Å; I84-L107 PolarHBondContact O-N 3.29Å; I84-M115 HydrophobicContact CG1-CE 4.31Å; I84-M115 HydrophobicContact CG2-CE 4.37Å; I84-V118 WeakPolarHBondContact CD1-O 3.43Å; I84-A123 HydrophobicContact CD1-CB 3.82Å; I84-A123 HydrophobicContact CG1-CB 3.88Å; I84-A123 HydrophobicContact CG2-CB 4.34Å
85	V	91.7	Very high	81.5	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.6	-171.8	-176.3	0	0	0	0	109.6	W50 I70 F71 C73 A83 Y87 D105 R106	W50-V85 HydrophobicContact CH2-CG2 3.99Å; W50-V85 HydrophobicContact CZ2-CG1 4.37Å; W50-V85 HydrophobicContact CZ2-CG2 3.42Å; W50-V85 VanDerWaalsContact CZ2-CG2 3.42Å; I70-V85 CarbonylContact C-O 3.57Å; I70-V85 WeakPolarHBondContact CA-O 3.33Å; F71-V85 HydrophobicContact CD1-CB 3.87Å; F71-V85 HydrophobicContact CD1-CG1 4.26Å; F71-V85 VanDerWaalsContact CD1-O 3.29Å; F71-V85 WeakPolarHBondContact CD1-O 3.41Å; F71-V85 HydrophobicContact CE1-CB 3.39Å; F71-V85 HydrophobicContact CE1-CG1 3.37Å; F71-V85 HydrophobicContact CE1-CG2 4.48Å; F71-V85 HydrophobicContact CE2-CB 4.31Å; F71-V85 HydrophobicContact CZ-CB 3.63Å; F71-V85 HydrophobicContact CZ-CG1 3.64Å; F71-V85 HydrophobicContact CZ-CG2 4.27Å; F71-V85 PolarHBondContact N-O 3.32Å; F71-V85 PolarHBondContact O-N 3.38Å; C73-V85 WeakPolarHBondContact SG-CG2 3.22Å; A83-V85 HydrophobicContact CB-CG2 4.35Å; V85-Y87 PolarHBondContact O-N 2.96Å; V85-D105 CarbonylContact C-O 3.57Å; V85-D105 WeakPolarHBondContact CA-O 3.41Å; V85-D105 WeakPolarHBondContact CG1-O 3.39Å; V85-R106 HydrophobicContact CG2-CB 4.43Å
86	V	91.5	Very high	82.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	120.4	173	179.6	0	0	0	0	108.7	F68 S69 V89 L101 P103 G104 D105	F68-V86 HydrophobicContact CB-CG1 4.26Å; F68-V86 HydrophobicContact CD2-CG2 4.3Å; S69-V86 WeakPolarHBondContact O-CA 3.14Å; V86-V89 HydrophobicContact CG1-CG2 3.98Å; V86-L101 HydrophobicContact CG1-CD2 4.49Å; V86-L101 HydrophobicContact CG1-CG 4.4Å; V86-L101 HydrophobicContact CG2-CD1 3.85Å; V86-L101 HydrophobicContact CG2-CD2 4.17Å; V86-L101 HydrophobicContact CG2-CG 4.02Å; V86-P103 CarbonylContact O-C 3.51Å; V86-P103 WeakPolarHBondContact O-CA 3.41Å; V86-G104 PolarHBondContact O-N 2.94Å; V86-D105 HydrophobicContact CB-CB 4.42Å; V86-D105 HydrophobicContact CG2-CB 4.18Å; V86-D105 PolarHBondContact N-O 3.24Å
87	Y	89.8	Confident	84.3	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-41.8	177.6	-179.9	-115.9	0	0	0	112.1	L11 I12 H33 P35 I43 S69 F71 V85 P103	L11-Y87 HydrophobicContact CD2-CE1 4.25Å; I12-Y87 HydrophobicContact CB-CD2 4.09Å; I12-Y87 HydrophobicContact CB-CE2 3.89Å; I12-Y87 HydrophobicContact CD1-CD2 4.11Å; I12-Y87 HydrophobicContact CG1-CD2 4.21Å; I12-Y87 PolarHBondContact N-O 3.21Å; H33-Y87 AromaticContact CD2-CE1 3.75Å; P35-Y87 HydrophobicContact CB-CD2 4.49Å; P35-Y87 HydrophobicContact CB-CE1 4.24Å; P35-Y87 HydrophobicContact CB-CE2 4.11Å; P35-Y87 HydrophobicContact CG-CD1 4.11Å; P35-Y87 HydrophobicContact CG-CD2 4.08Å; P35-Y87 HydrophobicContact CG-CE1 4.17Å; P35-Y87 HydrophobicContact CG-CE2 4.19Å; P35-Y87 HydrophobicContact CG-CG 4.03Å; I43-Y87 HydrophobicContact CD1-CD2 4.05Å; I43-Y87 HydrophobicContact CD1-CE2 3.52Å; S69-Y87 PolarHBondContact O-N 2.74Å; S69-Y87 WeakPolarHBondContact OG-CB 3.49Å; F71-Y87 HydrophobicContact CD1-CD2 4.13Å; F71-Y87 HydrophobicContact CD1-CG 4.35Å; F71-Y87 HydrophobicContact CE1-CD2 4.36Å; V85-Y87 PolarHBondContact O-N 2.96Å; Y87-P103 WeakPolarHBondContact O-CB 3.18Å
88	S	88.5	Confident	85.9	Confident	14 Å²	14	40.3 Å²	40.3	10%	0.098	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	155.4	-177.3	81.1	0	0	0	0	112	Y10 L11 F68 S69	Y10-S88 VanDerWaalsContact O-CA 3.29Å; Y10-S88 WeakPolarHBondContact O-CA 3.43Å; Y10-S88 WeakPolarHBondContact O-CB 3.3Å; L11-S88 VanDerWaalsContact CD2-CB 3.42Å; F68-S88 CarbonylContact C-O 3.48Å; F68-S88 WeakPolarHBondContact CA-O 3.45Å; F68-S88 WeakPolarHBondContact CB-O 3.41Å; S69-S88 PolarHBondContact N-O 2.82Å; S69-S88 WeakPolarHBondContact OG-CB 3.35Å; S69-S88 PolarHBondContact OG-N 2.78Å; S69-S88 VanDerWaalsContact OG-N 3.16Å; S69-S88 PolarHBondContact OG-OG 2.7Å
89	V	90.7	Very high	87.5	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.024	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.4	172.6	179	0	0	0	0	108.7	Y10 F68 V86 A95 D96	Y10-V89 PolarHBondContact O-N 3.49Å; F68-V89 HydrophobicContact CB-CG2 4.25Å; V86-V89 HydrophobicContact CG1-CG2 3.98Å; V89-A95 HydrophobicContact CG1-CB 3.83Å; V89-D96 HydrophobicContact CG1-CB 3.89Å
90	I	90.1	Very high	89.2	Confident	35 Å²	35	37.4 Å²	37.4	18%	0.179	20%	0.204	C	C	.	.			trans	-79.4	131.6	-177.5	-63.3	177.1	0	0	0	109.4	E30 F32 G67 S93 D96	E30-I90 WeakPolarHBondContact OE2-CG2 3.44Å; F32-I90 HydrophobicContact CD1-CD1 3.7Å; F32-I90 HydrophobicContact CE1-CD1 3.22Å; F32-I90 HydrophobicContact CZ-CD1 3.96Å; G67-I90 WeakPolarHBondContact O-CB 3.39Å; G67-I90 PolarHBondContact O-N 3.41Å; I90-S93 WeakPolarHBondContact O-CB 3.46Å; I90-S93 PolarHBondContact O-N 3.49Å; I90-S93 PolarHBondContact O-OG 3.08Å; I90-D96 VanDerWaalsContact O-CB 3.27Å; I90-D96 WeakPolarHBondContact O-CB 3.4Å
91	C	89.2	Confident	90.7	Very high	29 Å²	29	31 Å²	31	20%	0.196	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	137.1	177.7	-69.7	0	0	0	0	111.6	C9 S93	C9-C91 WeakPolarHBondContact CA-SG 3.46Å; C9-C91 WeakPolarHBondContact CB-SG 3.45Å; C9-C91 PolarHBondContact N-SG 3.1Å; C9-C91 WeakPolarHBondContact SG-CB 3.36Å; C9-C91 CovalentContact SG-SG 2.07Å; C9-C91 PolarHBondContact SG-SG 3.08Å; C91-S93 PolarHBondContact O-N 2.88Å
92	N	90.8	Very high	91.4	Very high	133 Å²	133	34.6 Å²	34.6	71%	0.711	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	14.9	-177.2	-54.4	-57.5	0	0	0	115.4	D96 R97	N92-D96 PolarHBondContact N-OD2 2.71Å; N92-R97 PolarHBondContact O-NH1 2.97Å
93	S	93.1	Very high	91.6	Very high	15 Å²	15	35.1 Å²	35.1	11%	0.105	19%	0.189	C	C	.	.	S	Bend	trans	-82.2	177.1	176.2	71.6	0	0	0	0	113.7	G67 I90 C91 A95 D96 R97	G67-S93 PolarHBondContact O-OG 3.26Å; G67-S93 VanDerWaalsContact O-OG 3.13Å; I90-S93 WeakPolarHBondContact O-CB 3.46Å; I90-S93 PolarHBondContact O-N 3.49Å; I90-S93 PolarHBondContact O-OG 3.08Å; C91-S93 PolarHBondContact O-N 2.88Å; S93-A95 VanDerWaalsContact C-N 3.31Å; S93-A95 PolarHBondContact O-N 3.28Å; S93-A95 PolarHBondContact OG-N 3.21Å; S93-D96 PolarHBondContact O-N 3.45Å; S93-D96 PolarHBondContact OG-N 3Å; S93-R97 WeakPolarHBondContact O-CB 3.49Å; S93-R97 VanDerWaalsContact O-CG 3.3Å; S93-R97 WeakPolarHBondContact O-CG 3.29Å; S93-R97 PolarHBondContact O-N 2.89Å
94	A	93.7	Very high	91.7	Very high	13 Å²	13	35.2 Å²	35.2	11%	0.107	19%	0.19	C	C	.	.	H	α-helix	trans	-60.9	-41.4	173.6	0	0	0	0	0	111.8	V60 S98	V60-A94 WeakPolarHBondContact O-CB 3.37Å; A94-S98 PolarHBondContact O-N 3.45Å
95	A	94.3	Very high	91.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-47.4	175.4	0	0	0	0	0	112.5	L59 L66 F68 V89 S93 S98 L101	L59-A95 HydrophobicContact CD1-CB 4.23Å; L66-A95 WeakPolarHBondContact O-CB 3.48Å; L66-A95 PolarHBondContact O-N 3.1Å; F68-A95 HydrophobicContact CB-CB 4.29Å; F68-A95 HydrophobicContact CD1-CB 4Å; V89-A95 HydrophobicContact CG1-CB 3.83Å; S93-A95 VanDerWaalsContact C-N 3.31Å; S93-A95 PolarHBondContact O-N 3.28Å; S93-A95 PolarHBondContact OG-N 3.21Å; A95-S98 WeakPolarHBondContact O-CB 3.15Å; A95-S98 PolarHBondContact O-N 2.85Å; A95-S98 PolarHBondContact O-OG 3.35Å; A95-L101 HydrophobicContact CB-CD2 3.86Å
96	D	93.4	Very high	91.7	Very high	36 Å²	36	37.2 Å²	37.2	19%	0.193	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-45.1	178.5	-177.5	44.4	0	0	0	111.9	V89 I90 N92 S93 S98 G99	V89-D96 HydrophobicContact CG1-CB 3.89Å; I90-D96 VanDerWaalsContact O-CB 3.27Å; I90-D96 WeakPolarHBondContact O-CB 3.4Å; N92-D96 PolarHBondContact N-OD2 2.71Å; S93-D96 PolarHBondContact O-N 3.45Å; S93-D96 PolarHBondContact OG-N 3Å; D96-S98 PolarHBondContact O-N 2.97Å; D96-G99 PolarHBondContact O-N 3.05Å
97	R	93.3	Very high	91.9	Very high	174 Å²	174	37.3 Å²	37.3	66%	0.657	20%	0.198	S	C	*	.	H	α-helix	trans	-62.5	-25	177.3	-72.7	-170	-56.5	-95.3	2.5	113.6	N92 S93 G99	N92-R97 PolarHBondContact O-NH1 2.97Å; S93-R97 WeakPolarHBondContact O-CB 3.49Å; S93-R97 VanDerWaalsContact O-CG 3.3Å; S93-R97 WeakPolarHBondContact O-CG 3.29Å; S93-R97 PolarHBondContact O-N 2.89Å; R97-G99 VanDerWaalsContact C-N 3.26Å; R97-G99 PolarHBondContact O-N 2.84Å
98	S	92.7	Very high	92.1	Very high	25 Å²	25	39.2 Å²	39.2	18%	0.175	21%	0.207	C	C	.	.	H	α-helix	trans	-69.3	-26.5	176	81.2	0	0	0	0	112.7	A94 A95 D96 Q100	A94-S98 PolarHBondContact O-N 3.45Å; A95-S98 WeakPolarHBondContact O-CB 3.15Å; A95-S98 PolarHBondContact O-N 2.85Å; A95-S98 PolarHBondContact O-OG 3.35Å; D96-S98 PolarHBondContact O-N 2.97Å; S98-Q100 WeakPolarHBondContact O-CG 3.22Å; S98-Q100 PolarHBondContact O-N 2.91Å; S98-Q100 VanDerWaalsContact O-N 3.09Å; S98-Q100 PolarHBondContact O-NE2 3.16Å; S98-Q100 PolarHBondContact OG-N 2.66Å
99	G	92.3	Very high	92.4	Very high	49 Å²	49	39.2 Å²	39.2	51%	0.505	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	8.4	-177.1	0	0	0	0	0	115.2	D96 R97 F102	D96-G99 PolarHBondContact O-N 3.05Å; R97-G99 VanDerWaalsContact C-N 3.26Å; R97-G99 PolarHBondContact O-N 2.84Å; G99-F102 WeakPolarHBondContact O-CE2 3.34Å; G99-F102 VanDerWaalsContact O-CZ 3.28Å; G99-F102 WeakPolarHBondContact O-CZ 3.21Å
100	Q	93.1	Very high	92.7	Very high	88 Å²	88	39 Å²	39	41%	0.411	21%	0.206	S	C	.	.			trans	-115.3	-13.7	-170.8	-73.4	168.2	91.9	0	0	113.3	V57 S98 K141	V57-Q100 HydrophobicContact CG1-CB 3.95Å; V57-Q100 HydrophobicContact CG2-CB 3.83Å; S98-Q100 WeakPolarHBondContact O-CG 3.22Å; S98-Q100 PolarHBondContact O-N 2.91Å; S98-Q100 VanDerWaalsContact O-N 3.09Å; S98-Q100 PolarHBondContact O-NE2 3.16Å; S98-Q100 PolarHBondContact OG-N 2.66Å; Q100-K141 PolarHBondContact O-NZ 3.2Å
101	L	93.6	Very high	92.8	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.214	C	C	.	.			trans	-106.9	127.1	-179.2	-162.9	71.6	0	0	0	110.1	F68 V86 A95 D105 L137 I139	F68-L101 HydrophobicContact CB-CD2 3.97Å; F68-L101 HydrophobicContact CD1-CD2 3.52Å; F68-L101 HydrophobicContact CD2-CD2 4.24Å; F68-L101 HydrophobicContact CE1-CD2 3.95Å; F68-L101 HydrophobicContact CG-CD2 3.66Å; V86-L101 HydrophobicContact CG1-CD2 4.49Å; V86-L101 HydrophobicContact CG1-CG 4.4Å; V86-L101 HydrophobicContact CG2-CD1 3.85Å; V86-L101 HydrophobicContact CG2-CD2 4.17Å; V86-L101 HydrophobicContact CG2-CG 4.02Å; A95-L101 HydrophobicContact CB-CD2 3.86Å; L101-D105 HydrophobicContact CD1-CB 4.48Å; L101-L137 HydrophobicContact CD2-CD1 4.4Å; L101-I139 HydrophobicContact CD1-CD1 4.05Å; L101-I139 HydrophobicContact CD1-CG2 3.85Å
102	F	91.7	Very high	92.9	Very high	84 Å²	84	44.4 Å²	44.4	37%	0.368	24%	0.242	S	C	.	.			trans	-133.8	154.1	-178.2	-62.4	-85.2	0	0	0	111.4	G99 G104 D105	G99-F102 WeakPolarHBondContact O-CE2 3.34Å; G99-F102 VanDerWaalsContact O-CZ 3.28Å; G99-F102 WeakPolarHBondContact O-CZ 3.21Å; F102-G104 PolarHBondContact O-N 3.18Å; F102-D105 PolarHBondContact N-OD2 2.77Å; F102-D105 VanDerWaalsContact O-CB 3.29Å; F102-D105 WeakPolarHBondContact O-CB 3.26Å; F102-D105 PolarHBondContact O-N 2.77Å; F102-D105 VanDerWaalsContact O-N 3.17Å
103	P	90	Very high	93.1	Very high	30 Å²	30	44.2 Å²	44.2	20%	0.195	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	137.5	169.1	-27.6	38.1	0	0	0	112.2	Y10 I12 V86 Y87	Y10-P103 VanDerWaalsContact CB-CG 3.48Å; I12-P103 HydrophobicContact CG1-CB 3.8Å; V86-P103 CarbonylContact O-C 3.51Å; V86-P103 WeakPolarHBondContact O-CA 3.41Å; Y87-P103 WeakPolarHBondContact O-CB 3.18Å
104	G	89.2	Confident	93.1	Very high	2 Å²	2	46.8 Å²	46.8	2%	0.021	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.3	-14.7	-174.6	0	0	0	0	0	114.5	W50 V86 F102 R106	W50-G104 PolarHBondContact NE1-O 2.82Å; V86-G104 PolarHBondContact O-N 2.94Å; F102-G104 PolarHBondContact O-N 3.18Å; G104-R106 PolarHBondContact O-N 3.39Å
105	D	92.4	Very high	93.1	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-65.6	130.6	173.8	-69.9	-17.2	0	0	0	110.7	V85 V86 L101 F102 I139 K141	V85-D105 CarbonylContact C-O 3.57Å; V85-D105 WeakPolarHBondContact CA-O 3.41Å; V85-D105 WeakPolarHBondContact CG1-O 3.39Å; V86-D105 HydrophobicContact CB-CB 4.42Å; V86-D105 HydrophobicContact CG2-CB 4.18Å; V86-D105 PolarHBondContact N-O 3.24Å; L101-D105 HydrophobicContact CD1-CB 4.48Å; F102-D105 PolarHBondContact N-OD2 2.77Å; F102-D105 VanDerWaalsContact O-CB 3.29Å; F102-D105 WeakPolarHBondContact O-CB 3.26Å; F102-D105 PolarHBondContact O-N 2.77Å; F102-D105 VanDerWaalsContact O-N 3.17Å; D105-I139 HydrophobicContact CB-CD1 4.32Å; D105-I139 WeakPolarHBondContact OD2-CD1 3.31Å; D105-K141 VanDerWaalsContact CG-NZ 3.31Å; D105-K141 WeakPolarHBondContact OD1-CD 3.41Å; D105-K141 IonicContact OD1-NZ 3.25Å; D105-K141 PolarHBondContact OD1-NZ 2.98Å; D105-K141 IonicContact OD2-NZ 2.71Å; D105-K141 PolarHBondContact OD2-NZ 3Å
106	R	92.5	Very high	92.9	Very high	39 Å²	39	49.2 Å²	49.2	15%	0.147	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.1	174.2	167.9	-177.5	-173.5	-173.3	6.7	110.1	W50 A83 I84 V85 G104 M108 I139 S140	W50-R106 VanDerWaalsContact CD1-CB 3.46Å; W50-R106 HydrophobicContact CD2-CB 3.78Å; W50-R106 HydrophobicContact CD2-CG 4.43Å; W50-R106 HydrophobicContact CG-CB 3.77Å; W50-R106 HydrophobicContact CZ2-CB 4.21Å; W50-R106 VanDerWaalsContact NE1-CB 3.31Å; A83-R106 HydrophobicContact CB-CG 4.19Å; I84-R106 CarbonylContact O-C 3.52Å; I84-R106 WeakPolarHBondContact O-CA 3.39Å; V85-R106 HydrophobicContact CG2-CB 4.43Å; G104-R106 PolarHBondContact O-N 3.39Å; R106-M108 HydrophobicContact CG-SD 3.9Å; R106-I139 CarbonylContact O-C 3.5Å; R106-I139 WeakPolarHBondContact O-CA 3.47Å; R106-S140 WeakPolarHBondContact CB-OG 3.32Å; R106-S140 PolarHBondContact N-O 3.37Å; R106-S140 PolarHBondContact O-N 2.9Å
107	L	94.9	Very high	92.6	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.8	174.6	-170.2	64.7	0	0	0	109.8	I84 M115 L127 L137 I139	I84-L107 HydrophobicContact CG2-CB 4.28Å; I84-L107 HydrophobicContact CG2-CD2 4.42Å; I84-L107 PolarHBondContact O-N 3.29Å; L107-M115 HydrophobicContact CD2-CE 4Å; L107-M115 HydrophobicContact CD2-CG 3.97Å; L107-M115 HydrophobicContact CG-CB 4.42Å; L107-M115 HydrophobicContact CG-CG 3.95Å; L107-M115 WeakPolarHBondContact O-CB 3.15Å; L107-L127 HydrophobicContact CD2-CD2 4.43Å; L107-L137 HydrophobicContact CD1-CB 4.03Å; L107-L137 HydrophobicContact CD1-CD1 4.36Å; L107-L137 HydrophobicContact CD1-CD2 4.15Å; L107-L137 HydrophobicContact CD1-CG 4.41Å; L107-I139 HydrophobicContact CD1-CG2 4.04Å
108	M	94.3	Very high	92.5	Very high	43 Å²	43	43.9 Å²	43.9	21%	0.212	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-41.8	-178.4	-60.1	-64	-67.7	0	0	111.5	V54 R106 M115 E138	V54-M108 HydrophobicContact CG2-CG 4.33Å; R106-M108 HydrophobicContact CG-SD 3.9Å; M108-M115 PolarHBondContact O-N 3.49Å; M108-E138 WeakPolarHBondContact CA-O 3.42Å; M108-E138 HydrophobicContact CB-CB 4.23Å; M108-E138 WeakPolarHBondContact CB-O 3.1Å; M108-E138 PolarHBondContact N-O 2.92Å
109	S	95.6	Very high	92.5	Very high	14 Å²	14	49.5 Å²	49.5	10%	0.098	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	162.3	176.6	82.8	0	0	0	0	113	F113 L137 E138	S109-F113 CarbonylContact C-O 3.6Å; S109-F113 WeakPolarHBondContact CA-O 3.29Å; S109-F113 VanDerWaalsContact CB-O 3.29Å; S109-F113 WeakPolarHBondContact CB-O 3.47Å; S109-L137 WeakPolarHBondContact O-CA 3.49Å; S109-E138 PolarHBondContact N-O 2.81Å; S109-E138 PolarHBondContact O-N 3.19Å; S109-E138 VanDerWaalsContact OG-CB 3.28Å; S109-E138 WeakPolarHBondContact OG-CB 3.38Å; S109-E138 VanDerWaalsContact OG-CD 3.27Å; S109-E138 WeakPolarHBondContact OG-CG 2.85Å; S109-E138 PolarHBondContact OG-OE2 3.45Å
110	I	96.4	Very high	92.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	120.2	172.8	179.1	163.6	0	0	0	111	L66 S112 F113 M115 I126 L127 V130 V135 V136 L137	L66-I110 HydrophobicContact CD1-CD1 4.35Å; I110-S112 PolarHBondContact O-N 2.85Å; I110-F113 HydrophobicContact CG2-CB 4.19Å; I110-F113 PolarHBondContact N-O 3.47Å; I110-F113 PolarHBondContact O-N 3.25Å; I110-M115 HydrophobicContact CG2-CG 4.34Å; I110-M115 HydrophobicContact CG2-SD 3.87Å; I110-I126 HydrophobicContact CG2-CG2 3.51Å; I110-L127 HydrophobicContact CD1-CD2 3.5Å; I110-L127 VanDerWaalsContact CD1-CD2 3.5Å; I110-L127 HydrophobicContact CD1-CG 4.48Å; I110-V130 HydrophobicContact CD1-CG2 3.52Å; I110-V130 HydrophobicContact CG1-CG2 3.99Å; I110-V135 HydrophobicContact CD1-CG1 3.71Å; I110-V135 HydrophobicContact CG1-CG1 3.68Å; I110-V136 CarbonylContact C-O 3.54Å; I110-V136 WeakPolarHBondContact CA-O 3.34Å; I110-L137 HydrophobicContact CB-CD2 3.97Å; I110-L137 HydrophobicContact CD1-CD2 3.7Å; I110-L137 HydrophobicContact CG1-CD2 3.7Å
111	N	93.2	Very high	92.5	Very high	63 Å²	63	53.7 Å²	53.7	34%	0.337	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-27.1	-176.1	-77.9	-6.9	0	0	0	117.5	V135 V136	N111-V135 VanDerWaalsContact OD1-CA 3.24Å; N111-V135 WeakPolarHBondContact OD1-CA 3.46Å; N111-V136 PolarHBondContact N-O 3.1Å; N111-V136 PolarHBondContact OD1-N 3.25Å
112	S	90.1	Very high	92.5	Very high	114 Å²	114	58.9 Å²	58.9	80%	0.797	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.5	-11.8	173.9	-75.5	0	0	0	0	110.3	I110 S114	I110-S112 PolarHBondContact O-N 2.85Å; S112-S114 PolarHBondContact O-N 2.77Å
113	F	94.4	Very high	92.7	Very high	130 Å²	130	54.9 Å²	54.9	57%	0.57	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	119.3	178.2	-65	-81.8	0	0	0	110.2	S109 I110 I126	S109-F113 CarbonylContact C-O 3.6Å; S109-F113 WeakPolarHBondContact CA-O 3.29Å; S109-F113 VanDerWaalsContact CB-O 3.29Å; S109-F113 WeakPolarHBondContact CB-O 3.47Å; I110-F113 HydrophobicContact CG2-CB 4.19Å; I110-F113 PolarHBondContact N-O 3.47Å; I110-F113 PolarHBondContact O-N 3.25Å; F113-I126 HydrophobicContact CB-CG2 4.2Å; F113-I126 HydrophobicContact CG-CG2 4.45Å
114	S	93.9	Very high	92.9	Very high	68 Å²	68	55.3 Å²	55.3	48%	0.476	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	136.2	173.5	-178.1	0	0	0	0	110.4	S112 T116 V118	S112-S114 PolarHBondContact O-N 2.77Å; S114-T116 WeakPolarHBondContact OG-CB 3.41Å; S114-T116 PolarHBondContact OG-N 3.29Å; S114-T116 PolarHBondContact OG-OG1 2.83Å; S114-V118 WeakPolarHBondContact O-CG2 3.1Å
115	M	93.2	Very high	93.1	Very high	1 Å²	1	57 Å²	57	1%	0.005	30%	0.298	C	S	.	.			trans	-100.5	8.7	174	-58.7	-63.5	-67.4	0	0	111.5	I84 L107 M108 I110 N117 V118 A123 I126	I84-M115 HydrophobicContact CG1-CE 4.31Å; I84-M115 HydrophobicContact CG2-CE 4.37Å; L107-M115 HydrophobicContact CD2-CE 4Å; L107-M115 HydrophobicContact CD2-CG 3.97Å; L107-M115 HydrophobicContact CG-CB 4.42Å; L107-M115 HydrophobicContact CG-CG 3.95Å; L107-M115 WeakPolarHBondContact O-CB 3.15Å; M108-M115 PolarHBondContact O-N 3.49Å; I110-M115 HydrophobicContact CG2-CG 4.34Å; I110-M115 HydrophobicContact CG2-SD 3.87Å; M115-N117 PolarHBondContact O-N 3.16Å; M115-V118 HydrophobicContact CE-CG1 4.48Å; M115-V118 PolarHBondContact O-N 3.27Å; M115-A123 HydrophobicContact CE-CB 3.28Å; M115-I126 HydrophobicContact SD-CD1 4.06Å; M115-I126 HydrophobicContact SD-CG2 4.3Å
116	T	89.7	Confident	93.2	Very high	64 Å²	64	58.1 Å²	58.1	39%	0.393	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	124.7	178.6	-56.4	0	0	0	0	109.9	S114 V118	S114-T116 WeakPolarHBondContact OG-CB 3.41Å; S114-T116 PolarHBondContact OG-N 3.29Å; S114-T116 PolarHBondContact OG-OG1 2.83Å; T116-V118 PolarHBondContact O-N 2.89Å; T116-V118 VanDerWaalsContact O-N 3.15Å
117	N	87.3	Confident	93.3	Very high	86 Å²	86	57.3 Å²	57.3	46%	0.46	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	17.2	-179.5	-61.5	-22.9	0	0	0	115.2	A81 I82 M115	A81-N117 VanDerWaalsContact CA-OD1 3.24Å; A81-N117 WeakPolarHBondContact CA-OD1 3.13Å; I82-N117 PolarHBondContact N-OD1 2.82Å; I82-N117 PolarHBondContact O-N 2.87Å; M115-N117 PolarHBondContact O-N 3.16Å
118	V	92.1	Very high	93.2	Very high	11 Å²	11	64.5 Å²	64.5	7%	0.067	33%	0.333	C	S	.	.			trans	-79.5	131.8	174.2	176.8	0	0	0	0	109	I82 I84 S114 M115 T116 E122 A123 I126	I82-V118 WeakPolarHBondContact CG2-O 3.43Å; I84-V118 WeakPolarHBondContact CD1-O 3.43Å; S114-V118 WeakPolarHBondContact O-CG2 3.1Å; M115-V118 HydrophobicContact CE-CG1 4.48Å; M115-V118 PolarHBondContact O-N 3.27Å; T116-V118 PolarHBondContact O-N 2.89Å; T116-V118 VanDerWaalsContact O-N 3.15Å; V118-E122 HydrophobicContact CG1-CB 3.72Å; V118-E122 HydrophobicContact CG1-CG 3.73Å; V118-A123 HydrophobicContact CG1-CB 3.9Å; V118-I126 HydrophobicContact CG1-CD1 4.25Å
119	R	91.7	Very high	93.2	Very high	144 Å²	144	66.6 Å²	66.6	54%	0.543	35%	0.353	S	S	.	.			trans	-72.2	153.3	176.3	-60.6	-70.3	-103.4	173.1	1.9	110.6	E72 I82 K121 E122 A123	E72-R119 IonicContact OE1-CZ 3.55Å; E72-R119 IonicContact OE1-NH1 2.73Å; E72-R119 PolarHBondContact OE1-NH1 3.25Å; E72-R119 WeakPolarHBondContact OE2-CA 3.46Å; I82-R119 HydrophobicContact CD1-CG 4.45Å; R119-K121 VanDerWaalsContact C-N 3.27Å; R119-K121 PolarHBondContact O-N 2.83Å; R119-K121 VanDerWaalsContact O-N 3.11Å; R119-E122 PolarHBondContact O-N 2.94Å; R119-A123 PolarHBondContact O-N 3.25Å
120	L	91.8	Very high	93.1	Very high	40 Å²	40	66.5 Å²	66.5	21%	0.209	35%	0.351	C	S	.	.	H	α-helix	trans	-49.5	-44.6	-179	-176.3	58.6	0	0	0	113.5	I70 E72 E122 A123 I124	I70-L120 HydrophobicContact CD1-CD1 3.85Å; I70-L120 HydrophobicContact CG1-CD1 3.89Å; E72-L120 HydrophobicContact CB-CB 3.88Å; E72-L120 PolarHBondContact OE2-N 3.2Å; L120-E122 PolarHBondContact O-N 3.37Å; L120-A123 PolarHBondContact O-N 2.93Å; L120-I124 HydrophobicContact CD1-CD1 4.11Å; L120-I124 HydrophobicContact CD1-CG1 4.35Å; L120-I124 HydrophobicContact CG-CD1 3.99Å; L120-I124 VanDerWaalsContact O-CG1 3.26Å; L120-I124 WeakPolarHBondContact O-CG1 3.46Å; L120-I124 PolarHBondContact O-N 2.87Å
121	K	93.8	Very high	93	Very high	185 Å²	185	71 Å²	71	80%	0.804	38%	0.38	S	S	*	.	H	α-helix	trans	-61.6	-42.1	-179.4	-175.7	179.9	178.5	-177.4	0	112.5	R119 G125	R119-K121 VanDerWaalsContact C-N 3.27Å; R119-K121 PolarHBondContact O-N 2.83Å; R119-K121 VanDerWaalsContact O-N 3.11Å; K121-G125 PolarHBondContact O-N 3.31Å
122	E	94.7	Very high	93.1	Very high	113 Å²	113	73.9 Å²	73.9	53%	0.528	39%	0.392	S	S	.	.	H	α-helix	trans	-72.5	-42	179.4	-177.5	179.4	-172.3	0	0	110.8	V118 R119 L120 I124 G125 I126	V118-E122 HydrophobicContact CG1-CB 3.72Å; V118-E122 HydrophobicContact CG1-CG 3.73Å; R119-E122 PolarHBondContact O-N 2.94Å; L120-E122 PolarHBondContact O-N 3.37Å; E122-I124 VanDerWaalsContact C-N 3.31Å; E122-I124 PolarHBondContact O-N 2.73Å; E122-G125 CarbonylContact O-C 3.53Å; E122-G125 WeakPolarHBondContact O-CA 3.37Å; E122-G125 PolarHBondContact O-N 3.43Å; E122-I126 HydrophobicContact CG-CD1 4.27Å; E122-I126 WeakPolarHBondContact O-CG1 3.35Å; E122-I126 PolarHBondContact O-N 2.99Å
123	A	94.5	Very high	93.4	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-55.9	-44.8	174.9	0	0	0	0	0	112.3	I70 I84 M115 V118 R119 L120 G125 I126 L127	I70-A123 HydrophobicContact CD1-CB 3.75Å; I84-A123 HydrophobicContact CD1-CB 3.82Å; I84-A123 HydrophobicContact CG1-CB 3.88Å; I84-A123 HydrophobicContact CG2-CB 4.34Å; M115-A123 HydrophobicContact CE-CB 3.28Å; V118-A123 HydrophobicContact CG1-CB 3.9Å; R119-A123 PolarHBondContact O-N 3.25Å; L120-A123 PolarHBondContact O-N 2.93Å; A123-G125 VanDerWaalsContact C-N 3.31Å; A123-G125 PolarHBondContact O-N 3.06Å; A123-I126 PolarHBondContact O-N 3.31Å; A123-L127 WeakPolarHBondContact O-CB 3.26Å; A123-L127 WeakPolarHBondContact O-CG 3.49Å; A123-L127 PolarHBondContact O-N 3.47Å
124	I	94.2	Very high	93.5	Very high	40 Å²	40	67.9 Å²	67.9	21%	0.205	37%	0.367	C	S	.	.	H	α-helix	trans	-61.4	-41.2	174.1	-68.9	167.1	0	0	0	110.8	I70 L120 E122 L127 K128	I70-I124 HydrophobicContact CD1-CG1 4.06Å; I70-I124 HydrophobicContact CG1-CG1 4.39Å; L120-I124 HydrophobicContact CD1-CD1 4.11Å; L120-I124 HydrophobicContact CD1-CG1 4.35Å; L120-I124 HydrophobicContact CG-CD1 3.99Å; L120-I124 VanDerWaalsContact O-CG1 3.26Å; L120-I124 WeakPolarHBondContact O-CG1 3.46Å; L120-I124 PolarHBondContact O-N 2.87Å; E122-I124 VanDerWaalsContact C-N 3.31Å; E122-I124 PolarHBondContact O-N 2.73Å; I124-L127 PolarHBondContact O-N 3.28Å; I124-K128 HydrophobicContact CG2-CD 3.88Å; I124-K128 HydrophobicContact CG2-CG 4.39Å; I124-K128 WeakPolarHBondContact O-CB 3.37Å; I124-K128 VanDerWaalsContact O-CG 3.26Å; I124-K128 WeakPolarHBondContact O-CG 3.18Å; I124-K128 PolarHBondContact O-N 3.41Å
125	G	94.8	Very high	93.6	Very high	37 Å²	37	64.7 Å²	64.7	38%	0.381	34%	0.344	S	S	.	.	H	α-helix	trans	-57.8	-49.6	175.5	0	0	0	0	0	112.3	K121 E122 A123 K128 S129	K121-G125 PolarHBondContact O-N 3.31Å; E122-G125 CarbonylContact O-C 3.53Å; E122-G125 WeakPolarHBondContact O-CA 3.37Å; E122-G125 PolarHBondContact O-N 3.43Å; A123-G125 VanDerWaalsContact C-N 3.31Å; A123-G125 PolarHBondContact O-N 3.06Å; G125-K128 PolarHBondContact O-N 2.93Å; G125-S129 WeakPolarHBondContact O-CB 3.26Å; G125-S129 PolarHBondContact O-N 3.11Å; G125-S129 PolarHBondContact O-OG 3.22Å
126	I	94.6	Very high	93.8	Very high	27 Å²	27	67.2 Å²	67.2	14%	0.138	36%	0.36	C	S	.	.	H	α-helix	trans	-61.4	-48.8	178.4	-63.7	168.1	0	0	0	110.8	I110 F113 M115 V118 E122 A123 K128 S129 V130	I110-I126 HydrophobicContact CG2-CG2 3.51Å; F113-I126 HydrophobicContact CB-CG2 4.2Å; F113-I126 HydrophobicContact CG-CG2 4.45Å; M115-I126 HydrophobicContact SD-CD1 4.06Å; M115-I126 HydrophobicContact SD-CG2 4.3Å; V118-I126 HydrophobicContact CG1-CD1 4.25Å; E122-I126 HydrophobicContact CG-CD1 4.27Å; E122-I126 WeakPolarHBondContact O-CG1 3.35Å; E122-I126 PolarHBondContact O-N 2.99Å; A123-I126 PolarHBondContact O-N 3.31Å; I126-K128 VanDerWaalsContact C-N 3.26Å; I126-K128 PolarHBondContact O-N 3.22Å; I126-S129 PolarHBondContact O-N 3.03Å; I126-S129 PolarHBondContact O-OG 3.49Å; I126-V130 WeakPolarHBondContact O-CG2 3.47Å; I126-V130 PolarHBondContact O-N 3.38Å
127	L	94.1	Very high	94.2	Very high	23 Å²	23	64.2 Å²	64.2	12%	0.12	34%	0.341	C	S	.	.	H	α-helix	trans	-59.9	-37.7	178.9	-76.4	164.5	0	0	0	112.3	K61 L66 F68 I70 L107 I110 A123 I124	K61-L127 PolarHBondContact NZ-O 2.72Å; L66-L127 HydrophobicContact CD1-CD2 3.95Å; F68-L127 HydrophobicContact CE2-CD1 4.38Å; F68-L127 HydrophobicContact CE2-CD2 4.32Å; F68-L127 HydrophobicContact CZ-CD2 3.79Å; I70-L127 HydrophobicContact CD1-CD1 3.54Å; I70-L127 HydrophobicContact CG1-CD1 4.18Å; I70-L127 HydrophobicContact CG2-CD1 4.26Å; L107-L127 HydrophobicContact CD2-CD2 4.43Å; I110-L127 HydrophobicContact CD1-CD2 3.5Å; I110-L127 VanDerWaalsContact CD1-CD2 3.5Å; I110-L127 HydrophobicContact CD1-CG 4.48Å; A123-L127 WeakPolarHBondContact O-CB 3.26Å; A123-L127 WeakPolarHBondContact O-CG 3.49Å; A123-L127 PolarHBondContact O-N 3.47Å; I124-L127 PolarHBondContact O-N 3.28Å
128	K	93	Very high	94.6	Very high	151 Å²	151	62.8 Å²	62.8	66%	0.657	33%	0.332	S	S	*	.	H	α-helix	trans	-71.2	-39.5	176.7	-75.5	178.8	177.6	-178.9	0	112.2	K61 I124 G125 I126 V130	K61-K128 PolarHBondContact NZ-O 3.39Å; I124-K128 HydrophobicContact CG2-CD 3.88Å; I124-K128 HydrophobicContact CG2-CG 4.39Å; I124-K128 WeakPolarHBondContact O-CB 3.37Å; I124-K128 VanDerWaalsContact O-CG 3.26Å; I124-K128 WeakPolarHBondContact O-CG 3.18Å; I124-K128 PolarHBondContact O-N 3.41Å; G125-K128 PolarHBondContact O-N 2.93Å; I126-K128 VanDerWaalsContact C-N 3.26Å; I126-K128 PolarHBondContact O-N 3.22Å; K128-V130 VanDerWaalsContact C-N 3.28Å; K128-V130 PolarHBondContact O-N 3.34Å
129	S	93.4	Very high	94.8	Very high	88 Å²	88	62.3 Å²	62.3	62%	0.615	33%	0.328	S	S	*	.	H	α-helix	trans	-72.2	-17.1	-177.6	68.5	0	0	0	0	114.4	G125 I126	G125-S129 WeakPolarHBondContact O-CB 3.26Å; G125-S129 PolarHBondContact O-N 3.11Å; G125-S129 PolarHBondContact O-OG 3.22Å; I126-S129 PolarHBondContact O-N 3.03Å; I126-S129 PolarHBondContact O-OG 3.49Å
130	V	93.6	Very high	94.8	Very high	11 Å²	11	55.6 Å²	55.6	7%	0.067	30%	0.304	C	S	.	.	S	Bend	trans	-60.2	127.3	175.8	-179.6	0	0	0	0	110.1	K61 I110 I126 K128 V135	K61-V130 HydrophobicContact CD-CB 4.31Å; K61-V130 HydrophobicContact CD-CG1 4.32Å; K61-V130 WeakPolarHBondContact CD-O 3.38Å; K61-V130 WeakPolarHBondContact CE-O 3.49Å; K61-V130 PolarHBondContact NZ-O 3.27Å; I110-V130 HydrophobicContact CD1-CG2 3.52Å; I110-V130 HydrophobicContact CG1-CG2 3.99Å; I126-V130 WeakPolarHBondContact O-CG2 3.47Å; I126-V130 PolarHBondContact O-N 3.38Å; K128-V130 VanDerWaalsContact C-N 3.28Å; K128-V130 PolarHBondContact O-N 3.34Å; V130-V135 HydrophobicContact CG1-CB 4.46Å; V130-V135 HydrophobicContact CG1-CG1 4.19Å; V130-V135 HydrophobicContact CG1-CG2 3.45Å; V130-V135 VanDerWaalsContact CG1-CG2 3.45Å
131	P	94.6	Very high	94.7	Very high	94 Å²	94	55.5 Å²	55.5	61%	0.61	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-66.4	164.2	179.4	28.2	-35.4	0	0	0	112
132	E	95.3	Very high	94.3	Very high	125 Å²	125	48 Å²	48	58%	0.584	27%	0.272	S	S	*	.	S	Bend	trans	-59.2	145.6	167.6	-66.1	-178.3	-153	0	0	110.4	K61	K61-E132 WeakPolarHBondContact O-CA 3.34Å
133	G	96	Very high	93.4	Very high	18 Å²	18	46.7 Å²	46.7	19%	0.186	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.5	-161.7	-177.4	0	0	0	0	0	114	V60 K61 V135	V60-G133 CarbonylContact C-O 3.57Å; V60-G133 WeakPolarHBondContact CA-O 3.49Å; K61-G133 PolarHBondContact N-O 3.19Å; K61-G133 PolarHBondContact O-N 3.45Å; G133-V135 PolarHBondContact O-N 3Å
134	P	96.4	Very high	91.7	Very high	100 Å²	100	48.6 Å²	48.6	65%	0.649	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	131.1	-177.2	-20.6	32.9	0	0	0	112.2	L58	L58-P134 HydrophobicContact CD1-CB 4.25Å
135	V	97.2	Very high	89.1	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.1	177.1	-177.2	0	0	0	0	108.9	L59 K61 L66 I110 N111 V130 G133 L137	L59-V135 PolarHBondContact N-O 3.44Å; L59-V135 PolarHBondContact O-N 3.12Å; K61-V135 HydrophobicContact CB-CG2 3.76Å; L66-V135 HydrophobicContact CD1-CG1 4.45Å; L66-V135 HydrophobicContact CD2-CB 4.08Å; L66-V135 HydrophobicContact CD2-CG1 4.35Å; L66-V135 HydrophobicContact CD2-CG2 4.05Å; I110-V135 HydrophobicContact CD1-CG1 3.71Å; I110-V135 HydrophobicContact CG1-CG1 3.68Å; N111-V135 VanDerWaalsContact OD1-CA 3.24Å; N111-V135 WeakPolarHBondContact OD1-CA 3.46Å; V130-V135 HydrophobicContact CG1-CB 4.46Å; V130-V135 HydrophobicContact CG1-CG1 4.19Å; V130-V135 HydrophobicContact CG1-CG2 3.45Å; V130-V135 VanDerWaalsContact CG1-CG2 3.45Å; G133-V135 PolarHBondContact O-N 3Å; V135-L137 HydrophobicContact CG1-CD2 3.82Å
136	V	97.1	Very high	86.3	Confident	55 Å²	55	53.7 Å²	53.7	33%	0.333	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.5	175.2	-178.1	0	0	0	0	108.2	K56 L58 I110 N111	K56-V136 HydrophobicContact CD-CG1 4.5Å; K56-V136 HydrophobicContact CG-CG1 4.48Å; L58-V136 HydrophobicContact CD1-CG2 3.91Å; I110-V136 CarbonylContact C-O 3.54Å; I110-V136 WeakPolarHBondContact CA-O 3.34Å; N111-V136 PolarHBondContact N-O 3.1Å; N111-V136 PolarHBondContact OD1-N 3.25Å
137	L	97.5	Very high	83.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	142.6	169.4	-52.2	-177	0	0	0	109	K56 V57 L59 F68 L101 L107 S109 I110 V135 I139	K56-L137 CarbonylContact C-O 3.56Å; K56-L137 WeakPolarHBondContact CA-O 3.48Å; V57-L137 HydrophobicContact CB-CB 4.35Å; V57-L137 PolarHBondContact N-O 2.8Å; V57-L137 PolarHBondContact O-N 3.11Å; L59-L137 HydrophobicContact CD1-CD1 3.57Å; L59-L137 HydrophobicContact CD1-CG 4.34Å; L59-L137 HydrophobicContact CG-CD1 4.23Å; F68-L137 HydrophobicContact CE1-CD1 3.93Å; F68-L137 HydrophobicContact CZ-CD1 4.03Å; L101-L137 HydrophobicContact CD2-CD1 4.4Å; L107-L137 HydrophobicContact CD1-CB 4.03Å; L107-L137 HydrophobicContact CD1-CD1 4.36Å; L107-L137 HydrophobicContact CD1-CD2 4.15Å; L107-L137 HydrophobicContact CD1-CG 4.41Å; S109-L137 WeakPolarHBondContact O-CA 3.49Å; I110-L137 HydrophobicContact CB-CD2 3.97Å; I110-L137 HydrophobicContact CD1-CD2 3.7Å; I110-L137 HydrophobicContact CG1-CD2 3.7Å; V135-L137 HydrophobicContact CG1-CD2 3.82Å; L137-I139 HydrophobicContact CB-CG2 4.38Å
138	E	96.8	Very high	80.9	Confident	57 Å²	57	63.9 Å²	63.9	27%	0.266	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.2	163.5	-74.8	179	164.9	0	0	108.4	V54 E55 K56 M108 S109	V54-E138 HydrophobicContact CG1-CB 3.56Å; V54-E138 HydrophobicContact CG1-CG 4.01Å; E55-E138 CarbonylContact O-C 3.54Å; E55-E138 WeakPolarHBondContact O-CA 3.35Å; K56-E138 WeakPolarHBondContact CE-OE1 3.41Å; K56-E138 HydrophobicContact CG-CG 3.92Å; K56-E138 IonicContact NZ-OE1 3.72Å; M108-E138 WeakPolarHBondContact CA-O 3.42Å; M108-E138 HydrophobicContact CB-CB 4.23Å; M108-E138 WeakPolarHBondContact CB-O 3.1Å; M108-E138 PolarHBondContact N-O 2.92Å; S109-E138 PolarHBondContact N-O 2.81Å; S109-E138 PolarHBondContact O-N 3.19Å; S109-E138 VanDerWaalsContact OG-CB 3.28Å; S109-E138 WeakPolarHBondContact OG-CB 3.38Å; S109-E138 VanDerWaalsContact OG-CD 3.27Å; S109-E138 WeakPolarHBondContact OG-CG 2.85Å; S109-E138 PolarHBondContact OG-OE2 3.45Å
139	I	95.1	Very high	78.5	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.3	-176	64	168.7	0	0	0	111.4	V54 E55 V57 L101 D105 R106 L107 L137 K141	V54-I139 CarbonylContact C-O 3.55Å; V54-I139 VanDerWaalsContact CA-O 3.31Å; V54-I139 WeakPolarHBondContact CA-O 3.47Å; E55-I139 HydrophobicContact CB-CG1 4.08Å; E55-I139 PolarHBondContact N-O 2.96Å; E55-I139 PolarHBondContact O-N 3.37Å; V57-I139 HydrophobicContact CG2-CD1 3.62Å; V57-I139 HydrophobicContact CG2-CG1 3.95Å; L101-I139 HydrophobicContact CD1-CD1 4.05Å; L101-I139 HydrophobicContact CD1-CG2 3.85Å; D105-I139 HydrophobicContact CB-CD1 4.32Å; D105-I139 WeakPolarHBondContact OD2-CD1 3.31Å; R106-I139 CarbonylContact O-C 3.5Å; R106-I139 WeakPolarHBondContact O-CA 3.47Å; L107-I139 HydrophobicContact CD1-CG2 4.04Å; L137-I139 HydrophobicContact CB-CG2 4.38Å; I139-K141 HydrophobicContact CD1-CD 4.31Å
140	S	92.2	Very high	76	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.021	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.2	167.6	53.3	0	0	0	0	109.5	R106	R106-S140 WeakPolarHBondContact CB-OG 3.32Å; R106-S140 PolarHBondContact N-O 3.37Å; R106-S140 PolarHBondContact O-N 2.9Å
141	K	90.1	Very high	73.3	Confident	39 Å²	39	65.8 Å²	65.8	17%	0.17	38%	0.379	C	S	.	.			trans	-81.8	143	-178.7	-60.6	-57.5	-173.6	172.6	0	111	W50 S51 E55 Q100 D105 I139	W50-K141 CarbonylContact C-O 3.58Å; W50-K141 WeakPolarHBondContact CA-O 3.48Å; S51-K141 PolarHBondContact N-O 3.48Å; E55-K141 WeakPolarHBondContact OE2-CE 3.2Å; Q100-K141 PolarHBondContact O-NZ 3.2Å; D105-K141 VanDerWaalsContact CG-NZ 3.31Å; D105-K141 WeakPolarHBondContact OD1-CD 3.41Å; D105-K141 IonicContact OD1-NZ 3.25Å; D105-K141 PolarHBondContact OD1-NZ 2.98Å; D105-K141 IonicContact OD2-NZ 2.71Å; D105-K141 PolarHBondContact OD2-NZ 3Å; I139-K141 HydrophobicContact CD1-CD 4.31Å
142	P	85.8	Confident	70.4	Confident	28 Å²	28	66.6 Å²	66.6	18%	0.182	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-65.4	137.2	173.4	29.2	-34.5	0	0	0	110.4	I48 I49 S144	I48-P142 HydrophobicContact CG2-CB 3.71Å; I49-P142 CarbonylContact O-C 3.59Å; I49-P142 WeakPolarHBondContact O-CA 3.37Å; P142-S144 PolarHBondContact O-N 3.35Å; P142-S144 VanDerWaalsContact O-N 3.11Å
143	L	74.3	Confident	67.9	Low	84 Å²	84	64.2 Å²	64.2	44%	0.44	37%	0.371	S	S	.	.			trans	-81.7	65.7	168.8	-61.8	179.4	0	0	0	108.9	I49	I49-L143 HydrophobicContact CB-CB 4.38Å; I49-L143 HydrophobicContact CG2-CB 4.47Å; I49-L143 HydrophobicContact CG2-CD1 3.86Å; I49-L143 PolarHBondContact O-N 3.35Å
144	S	59.4	Low	65	Low	41 Å²	41	72.1 Å²	72.1	29%	0.287	40%	0.404	S	S	.	.			trans	-120.6	132	168.2	19.9	0	0	0	0	107.6	P142 S146 F150	P142-S144 PolarHBondContact O-N 3.35Å; P142-S144 VanDerWaalsContact O-N 3.11Å; S144-S146 PolarHBondContact O-N 3.47Å; S144-F150 WeakPolarHBondContact OG-CE2 3.08Å; S144-F150 WeakPolarHBondContact OG-CZ 3.48Å
145	L	39.4	Very low	62	Low	110 Å²	110	73.8 Å²	73.8	58%	0.576	41%	0.407	S	S	*	.	S	Bend	trans	-78.5	113	-163.9	-65	164.6	0	0	0	108.3	Q230	L145-Q230 HydrophobicContact CD1-CG 4.37Å
146	S	36	Very low	59.1	Low	74 Å²	74	79.3 Å²	79.3	52%	0.517	44%	0.441	S	S	.	.	S	Bend	trans	67.4	138.7	176.7	80.4	0	0	0	0	116.4	S144 E148	S144-S146 PolarHBondContact O-N 3.47Å; S146-E148 PolarHBondContact O-N 2.97Å
147	S	37	Very low	55.9	Low	114 Å²	114	84.8 Å²	84.8	80%	0.797	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	1	-177.4	-57.6	0	0	0	0	115.4
148	E	39.6	Very low	52.8	Low	150 Å²	150	89.5 Å²	89.5	70%	0.701	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-27.6	-174.7	-65.2	177.5	158.6	0	0	112.5	S146 F150 A151 N152	S146-E148 PolarHBondContact O-N 2.97Å; E148-F150 VanDerWaalsContact C-N 3.35Å; E148-F150 PolarHBondContact O-N 3.43Å; E148-A151 WeakPolarHBondContact O-CB 3.39Å; E148-A151 PolarHBondContact O-N 3.08Å; E148-A151 VanDerWaalsContact O-N 3.07Å; E148-N152 PolarHBondContact O-N 3.35Å
149	E	42.2	Very low	49.6	Very low	119 Å²	119	93.2 Å²	93.2	56%	0.556	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-27.6	-177.3	-65.5	-175	143.7	0	0	113.1	A151	E149-A151 VanDerWaalsContact C-N 3.27Å; E149-A151 PolarHBondContact O-N 3.29Å
150	F	39.9	Very low	46.4	Very low	87 Å²	87	104 Å²	104	38%	0.382	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-14.8	172.4	-68.9	-77.8	0	0	0	113.6	S144 E148	S144-F150 WeakPolarHBondContact OG-CE2 3.08Å; S144-F150 WeakPolarHBondContact OG-CZ 3.48Å; E148-F150 VanDerWaalsContact C-N 3.35Å; E148-F150 PolarHBondContact O-N 3.43Å
151	A	38.3	Very low	43.6	Very low	84 Å²	84	114.4 Å²	114.4	69%	0.694	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-15.1	-177.6	0	0	0	0	0	113.3	E148 E149	E148-A151 WeakPolarHBondContact O-CB 3.39Å; E148-A151 PolarHBondContact O-N 3.08Å; E148-A151 VanDerWaalsContact O-N 3.07Å; E149-A151 VanDerWaalsContact C-N 3.27Å; E149-A151 PolarHBondContact O-N 3.29Å
152	N	34	Very low	40.8	Very low	111 Å²	111	121 Å²	121	59%	0.594	62%	0.622	S	S	*	*			trans	-129.8	46.9	-169.8	-152	17	0	0	0	115.1	E148 Q154	E148-N152 PolarHBondContact O-N 3.35Å; N152-Q154 PolarHBondContact O-N 3.17Å
153	V	41.2	Very low	38.4	Very low	74 Å²	74	125.1 Å²	125.1	45%	0.448	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.1	46.1	176.3	-163.1	0	0	0	0	111.9
154	Q	35.8	Very low	36.6	Very low	185 Å²	185	125.8 Å²	125.8	86%	0.864	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	-3.2	170.9	-71.7	-171.8	1.9	0	0	113.4	N152	N152-Q154 PolarHBondContact O-N 3.17Å
155	D	33.9	Very low	35.4	Very low	134 Å²	134	132.8 Å²	132.8	72%	0.717	69%	0.694	S	S	*	*			trans	-125.2	19.2	-173.3	-145.5	17.4	0	0	0	114.9	Q157	D155-Q157 PolarHBondContact O-N 3.2Å
156	V	36.7	Very low	35.5	Very low	117 Å²	117	136.9 Å²	136.9	71%	0.709	71%	0.71	S	S	*	*			trans	-95.8	82.7	165.7	-170.8	0	0	0	0	108	M158	V156-M158 VanDerWaalsContact C-N 3.34Å; V156-M158 PolarHBondContact O-N 3.15Å; V156-M158 VanDerWaalsContact O-N 3.09Å
157	Q	28.2	Very low	35.8	Very low	169 Å²	169	142.5 Å²	142.5	79%	0.79	73%	0.728	S	S	*	*			trans	-65	101.4	155.5	-74.7	-172.3	-19.1	0	0	106.9	D155 D159	D155-Q157 PolarHBondContact O-N 3.2Å; Q157-D159 PolarHBondContact O-N 3.49Å
158	M	32.7	Very low	35.6	Very low	100 Å²	100	140.4 Å²	140.4	49%	0.493	73%	0.725	S	S	.	*			trans	-75.6	104.5	165.3	-123.2	-65.4	174.7	0	0	106.5	V156 Y160 Q225	V156-M158 VanDerWaalsContact C-N 3.34Å; V156-M158 PolarHBondContact O-N 3.15Å; V156-M158 VanDerWaalsContact O-N 3.09Å; M158-Y160 PolarHBondContact O-N 3.22Å; M158-Q225 HydrophobicContact CE-CG 4.41Å
159	D	29.5	Very low	35.6	Very low	135 Å²	135	139 Å²	139	72%	0.722	73%	0.731	S	S	*	*			trans	-61.3	100.5	170.4	-73.8	-30	0	0	0	108.1	Q157 Y161	Q157-D159 PolarHBondContact O-N 3.49Å; D159-Y161 PolarHBondContact O-N 2.92Å
160	Y	28.8	Very low	35.4	Very low	226 Å²	226	140.8 Å²	140.8	89%	0.886	75%	0.745	S	S	*	*			trans	-62.1	106.8	170.3	-97.1	-97.6	0	0	0	108.3	M158 E162	M158-Y160 PolarHBondContact O-N 3.22Å; Y160-E162 PolarHBondContact O-N 3.41Å
161	Y	33	Very low	35.5	Very low	222 Å²	222	143.9 Å²	143.9	87%	0.871	76%	0.761	S	S	*	*			trans	-78.6	106.3	165.4	-133.4	-87.7	0	0	0	107.8	D159 P163	D159-Y161 PolarHBondContact O-N 2.92Å; Y161-P163 WeakPolarHBondContact O-CD 3.38Å
162	E	32.1	Very low	35.4	Very low	177 Å²	177	149.6 Å²	149.6	83%	0.827	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-68.6	120.5	171.7	-139.7	171.5	-163.4	0	0	108.3	Y160 A164	Y160-E162 PolarHBondContact O-N 3.41Å; E162-A164 PolarHBondContact O-N 2.96Å
163	P	35.3	Very low	35.8	Very low	115 Å²	115	150.9 Å²	150.9	75%	0.747	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-70.1	117.2	175.8	-10	25	0	0	0	108.9	Y161 E165	Y161-P163 WeakPolarHBondContact O-CD 3.38Å; P163-E165 PolarHBondContact O-N 3.41Å
164	A	34.8	Very low	35.4	Very low	98 Å²	98	155.9 Å²	155.9	81%	0.81	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67	124.2	172.9	0	0	0	0	0	110.1	E162 E166	E162-A164 PolarHBondContact O-N 2.96Å; A164-E166 PolarHBondContact O-N 3.06Å
165	E	34.3	Very low	35.5	Very low	187 Å²	187	150 Å²	150	87%	0.874	79%	0.79	S	S	*	*			trans	-69.2	112.7	173.3	-55.5	177.5	-169.9	0	0	109.1	P163	P163-E165 PolarHBondContact O-N 3.41Å
166	E	42.8	Very low	35.5	Very low	196 Å²	196	149.1 Å²	149.1	92%	0.916	79%	0.794	S	S	*	*			trans	-94	106.7	165.4	-83.7	-170.4	167.3	0	0	109.1	A164	A164-E166 PolarHBondContact O-N 3.06Å
167	E	40.9	Very low	35.4	Very low	192 Å²	192	151.2 Å²	151.2	90%	0.897	80%	0.8	S	S	*	*			trans	-64	148.5	166.6	-76.4	-164.5	145.7	0	0	111.4
168	G	32.8	Very low	35.7	Very low	71 Å²	71	153.7 Å²	153.7	73%	0.732	80%	0.803	S	S	*	*			trans	-76.6	160.3	-165.5	0	0	0	0	0	116.2
169	S	39.8	Very low	35.7	Very low	119 Å²	119	152.2 Å²	152.2	83%	0.832	81%	0.813	S	S	*	*				179.2	122.7	120.5	38.1	0	0	0	0	110.8
170	D	38.5	Very low	35.9	Very low	157 Å²	157	153 Å²	153	84%	0.84	81%	0.81	S	S	*	*			trans	19.5	126.4	150.3	-60.5	-28.4	0	0	0	122.5
171	E	41.3	Very low	35.9	Very low	153 Å²	153	152.1 Å²	152.1	72%	0.715	81%	0.811	S	S	*	*			trans	32.2	109.8	131.3	-78.9	-161.1	158	0	0	119.6
172	R	36.2	Very low	35.5	Very low	203 Å²	203	150.7 Å²	150.7	77%	0.766	80%	0.804	S	S	*	*				171.7	147.3	94.7	-108.5	174.8	176.3	79.3	6	112.1
173	T	42.6	Very low	35.4	Very low	139 Å²	139	148.4 Å²	148.4	85%	0.853	80%	0.802	S	S	*	*			trans	99.5	98.1	167.7	70.5	0	0	0	0	116	G175	T173-G175 PolarHBondContact O-N 3.43Å
174	D	33.6	Very low	35.1	Very low	179 Å²	179	148 Å²	148	96%	0.957	80%	0.798	S	S	*	*			trans	-67.6	101	-178.7	-174.2	9.6	0	0	0	110.8
175	G	38.2	Very low	34.8	Very low	62 Å²	62	151.4 Å²	151.4	64%	0.639	80%	0.801	S	S	*	*			trans	-124.5	115.5	-172.1	0	0	0	0	0	111.4	T173 L177	T173-G175 PolarHBondContact O-N 3.43Å; G175-L177 PolarHBondContact O-N 3.15Å
176	S	32.8	Very low	34.7	Very low	115 Å²	115	148.1 Å²	148.1	80%	0.804	80%	0.799	S	S	*	*			trans	-34.9	112.6	162	-173.9	0	0	0	0	113.9
177	L	36	Very low	34.1	Very low	160 Å²	160	141.8 Å²	141.8	84%	0.838	79%	0.786	S	S	*	*			trans	-157.5	82	157.6	-133.6	128.7	0	0	0	111.8	G175 G179	G175-L177 PolarHBondContact O-N 3.15Å; L177-G179 VanDerWaalsContact C-N 3.3Å; L177-G179 PolarHBondContact O-N 3.26Å
178	W	32.9	Very low	33.6	Very low	221 Å²	221	144.5 Å²	144.5	84%	0.837	79%	0.788	S	S	*	*			trans	-65	92.4	164.1	-74.8	54.4	0	0	0	108.8	K180	W178-K180 PolarHBondContact O-N 3.32Å
179	G	33.3	Very low	33.4	Very low	69 Å²	69	149.1 Å²	149.1	71%	0.711	79%	0.792	S	S	*	*			trans	-70	69.3	168.5	0	0	0	0	0	111.5	L177 K181	L177-G179 VanDerWaalsContact C-N 3.3Å; L177-G179 PolarHBondContact O-N 3.26Å; G179-K181 PolarHBondContact O-N 2.94Å
180	K	33.4	Very low	32.9	Very low	151 Å²	151	147.6 Å²	147.6	66%	0.657	79%	0.787	S	S	*	*			trans	-58.8	99.4	166.8	-81.1	167.7	174.4	157.9	0	109.6	W178 R182	W178-K180 PolarHBondContact O-N 3.32Å; K180-R182 PolarHBondContact O-N 3.09Å
181	K	28.6	Very low	32.9	Very low	208 Å²	208	148.8 Å²	148.8	90%	0.904	79%	0.788	S	S	*	*			trans	-88.4	87.8	149.5	-116.6	176.3	-177.5	173.3	0	107.9	G179 V183	G179-K181 PolarHBondContact O-N 2.94Å; K181-V183 PolarHBondContact O-N 3.09Å
182	R	26.4	Very low	32.3	Very low	192 Å²	192	148.9 Å²	148.9	73%	0.725	79%	0.792	S	S	*	*			trans	-75.4	104.4	173.1	-179.6	-175.3	-71.3	177.4	-4.6	107.9	K180 T184	K180-R182 PolarHBondContact O-N 3.09Å; R182-T184 HydrophobicContact CG-CG2 4.07Å
183	V	28.5	Very low	32.1	Very low	129 Å²	129	150.7 Å²	150.7	78%	0.782	80%	0.799	S	S	*	*			trans	-90.2	108	162.2	179.8	0	0	0	0	107.1	K181 L185	K181-V183 PolarHBondContact O-N 3.09Å; V183-L185 PolarHBondContact O-N 3.45Å
184	T	28.8	Very low	31.6	Very low	108 Å²	108	151.1 Å²	151.1	66%	0.663	80%	0.796	S	S	*	*			trans	-76.8	108.2	174.8	39	0	0	0	0	110	R182 S186	R182-T184 HydrophobicContact CG-CG2 4.07Å; T184-S186 PolarHBondContact O-N 3.32Å
185	L	29.7	Very low	31.6	Very low	169 Å²	169	147.6 Å²	147.6	89%	0.885	78%	0.776	S	S	*	*			trans	-83.1	86.3	159.2	-86.2	158.7	0	0	0	108.4	V183	V183-L185 PolarHBondContact O-N 3.45Å
186	S	31	Very low	31.4	Very low	117 Å²	117	150.9 Å²	150.9	82%	0.818	78%	0.778	S	S	*	*			trans	-82.1	111.7	162.8	68.1	0	0	0	0	108.3	T184	T184-S186 PolarHBondContact O-N 3.32Å
187	G	31.3	Very low	31.6	Very low	63 Å²	63	148.1 Å²	148.1	65%	0.649	76%	0.756	S	S	*	*	S	Bend	trans	159.8	80.3	175.5	0	0	0	0	0	113	M189	G187-M189 PolarHBondContact O-N 3.06Å
188	R	29.4	Very low	31.9	Very low	249 Å²	249	143.4 Å²	143.4	94%	0.94	74%	0.735	S	S	*	*			trans	51.3	58.4	156.9	-62.1	-175.7	163.9	-170.3	-4.7	117	A190	R188-A190 PolarHBondContact O-N 3.35Å
189	M	29	Very low	32.1	Very low	168 Å²	168	137 Å²	137	83%	0.828	72%	0.721	S	S	*	*			trans	-86	48.9	164	-85.9	-78	-151.7	0	0	112	G187	G187-M189 PolarHBondContact O-N 3.06Å
190	A	30.5	Very low	32.4	Very low	87 Å²	87	134.9 Å²	134.9	72%	0.719	69%	0.694	S	S	*	*			trans	-102.2	-1.7	-176.3	0	0	0	0	0	114.7	R188	R188-A190 PolarHBondContact O-N 3.35Å
191	E	36.7	Very low	32.4	Very low	183 Å²	183	134.5 Å²	134.5	86%	0.855	70%	0.696	S	S	*	*	S	Bend	trans	-123.4	-5.4	-168.2	-72	-105.4	139.4	0	0	115.6	R193	E191-R193 PolarHBondContact O-N 3.02Å
192	L	29.9	Very low	32.8	Very low	154 Å²	154	128.8 Å²	128.8	81%	0.806	67%	0.672	S	S	*	*			trans	-98	36.4	-179.4	-80.8	165.1	0	0	0	114
193	R	32.4	Very low	33.2	Very low	241 Å²	241	124.2 Å²	124.2	91%	0.909	66%	0.662	S	S	*	*			trans	-93.2	13.1	-177.5	-133	179.4	-170	171	2.5	114.9	E191	E191-R193 PolarHBondContact O-N 3.02Å
194	L	32.1	Very low	33.6	Very low	149 Å²	149	121.3 Å²	121.3	78%	0.78	65%	0.645	S	S	*	*	S	Bend	trans	-134.7	130.9	-179.4	-73.4	160.9	0	0	0	108.3
195	L	32.2	Very low	33.9	Very low	104 Å²	104	118.7 Å²	118.7	55%	0.545	63%	0.634	S	S	.	*			trans	110.1	10.5	169.2	-53.2	160.5	0	0	0	117.9	T197 W247	L195-T197 PolarHBondContact O-N 3.18Å; L195-W247 HydrophobicContact CB-CH2 3.78Å; L195-W247 HydrophobicContact CB-CZ2 4.36Å; L195-W247 HydrophobicContact CD1-CH2 3.23Å; L195-W247 HydrophobicContact CD1-CZ2 3.15Å; L195-W247 HydrophobicContact CD1-CZ3 4.35Å; L195-W247 HydrophobicContact CD2-CH2 3.47Å; L195-W247 VanDerWaalsContact CD2-CH2 3.47Å; L195-W247 HydrophobicContact CD2-CZ2 4.28Å; L195-W247 HydrophobicContact CD2-CZ3 3.95Å; L195-W247 HydrophobicContact CG-CH2 3.59Å; L195-W247 HydrophobicContact CG-CZ2 4.05Å
196	L	34.2	Very low	34.1	Very low	132 Å²	132	115 Å²	115	69%	0.691	62%	0.615	S	S	*	*			trans	-80.4	71.8	152.2	-76.7	160.3	0	0	0	108.7	V200	L196-V200 HydrophobicContact CD2-CB 3.76Å; L196-V200 HydrophobicContact CD2-CG1 3.58Å; L196-V200 HydrophobicContact CD2-CG2 3.85Å
197	T	38.5	Very low	34.5	Very low	56 Å²	56	112.5 Å²	112.5	34%	0.344	60%	0.595	S	S	.	*			trans	-63.1	149.7	168.1	36.7	0	0	0	0	110	L195 V199 V200 L253	L195-T197 PolarHBondContact O-N 3.18Å; T197-V199 PolarHBondContact O-N 3.43Å; T197-V200 PolarHBondContact O-N 3.09Å; T197-L253 HydrophobicContact CG2-CD2 4.32Å
198	P	40.6	Very low	34.8	Very low	61 Å²	61	118 Å²	118	40%	0.396	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53.8	-13.4	-162.7	14	-29.7	0	0	0	117.2	V200 M201 E202 F257	P198-V200 PolarHBondContact O-N 2.99Å; P198-M201 PolarHBondContact O-N 3.35Å; P198-M201 VanDerWaalsContact O-N 3.1Å; P198-E202 PolarHBondContact O-N 2.83Å; P198-F257 HydrophobicContact CB-CE2 4Å; P198-F257 HydrophobicContact CG-CD2 3.62Å; P198-F257 HydrophobicContact CG-CE2 3.43Å; P198-F257 VanDerWaalsContact CG-CE2 3.43Å
199	V	37.3	Very low	35.2	Very low	87 Å²	87	111.7 Å²	111.7	53%	0.527	59%	0.593	S	S	.	*	H	α-helix	trans	-53.9	-33.8	172.7	-177.2	0	0	0	0	112.1	T197 L203	T197-V199 PolarHBondContact O-N 3.43Å; V199-L203 HydrophobicContact CG1-CD1 4.47Å
200	V	40.2	Very low	35.3	Very low	24 Å²	24	111 Å²	111	15%	0.145	59%	0.585	C	S	.	*	H	α-helix	trans	-79.3	-28.4	-179.8	177.8	0	0	0	0	112.8	L196 T197 P198 T204 F227	L196-V200 HydrophobicContact CD2-CB 3.76Å; L196-V200 HydrophobicContact CD2-CG1 3.58Å; L196-V200 HydrophobicContact CD2-CG2 3.85Å; T197-V200 PolarHBondContact O-N 3.09Å; P198-V200 PolarHBondContact O-N 2.99Å; V200-T204 WeakPolarHBondContact O-CG2 3.47Å; V200-T204 PolarHBondContact O-N 3.48Å; V200-T204 PolarHBondContact O-OG1 3Å; V200-F227 HydrophobicContact CB-CZ 4.38Å; V200-F227 HydrophobicContact CG1-CE1 3.77Å; V200-F227 HydrophobicContact CG1-CZ 3.89Å; V200-F227 HydrophobicContact CG2-CZ 4.25Å
201	M	32.7	Very low	35.3	Very low	144 Å²	144	110 Å²	110	71%	0.709	58%	0.584	S	S	*	*	H	α-helix	trans	-78.7	-28.6	177	-72.2	-139.6	-59.4	0	0	113.3	P198 T204 A205	P198-M201 PolarHBondContact O-N 3.35Å; P198-M201 VanDerWaalsContact O-N 3.1Å; M201-T204 WeakPolarHBondContact CA-OG1 3.24Å; M201-T204 PolarHBondContact O-N 3.17Å; M201-T204 PolarHBondContact O-OG1 3.35Å; M201-A205 WeakPolarHBondContact O-CB 3.4Å; M201-A205 PolarHBondContact O-N 3.26Å; M201-A205 VanDerWaalsContact O-N 3.09Å
202	E	38.2	Very low	35	Very low	87 Å²	87	110.2 Å²	110.2	41%	0.407	59%	0.585	S	S	.	*	H	α-helix	trans	-72.2	-34.6	179.9	-153.2	166.6	-179.5	0	0	111.5	P198 H264	P198-E202 PolarHBondContact O-N 2.83Å; E202-H264 IonicContact OE1-CD2 3.37Å; E202-H264 PolarHBondContact OE1-CD2 3.01Å
203	L	33.9	Very low	35.2	Very low	97 Å²	97	106.5 Å²	106.5	51%	0.508	57%	0.57	S	S	.	*	H	α-helix	trans	-76.4	-25	175.4	-73.8	160.4	0	0	0	113.3	V199 V207 F227	V199-L203 HydrophobicContact CG1-CD1 4.47Å; L203-V207 WeakPolarHBondContact O-CG2 3.46Å; L203-F227 HydrophobicContact CB-CE2 4.06Å; L203-F227 HydrophobicContact CB-CZ 4.31Å; L203-F227 HydrophobicContact CD1-CE2 3.8Å; L203-F227 HydrophobicContact CD1-CZ 4.4Å
204	T	36.9	Very low	35.3	Very low	68 Å²	68	100.5 Å²	100.5	42%	0.417	57%	0.572	S	S	.	*	H	α-helix	trans	-82.9	-26	174.3	53.9	0	0	0	0	113	V200 M201 V207	V200-T204 WeakPolarHBondContact O-CG2 3.47Å; V200-T204 PolarHBondContact O-N 3.48Å; V200-T204 PolarHBondContact O-OG1 3Å; M201-T204 WeakPolarHBondContact CA-OG1 3.24Å; M201-T204 PolarHBondContact O-N 3.17Å; M201-T204 PolarHBondContact O-OG1 3.35Å; T204-V207 PolarHBondContact O-N 2.81Å
205	A	35.9	Very low	35.5	Very low	52 Å²	52	95.9 Å²	95.9	43%	0.43	56%	0.561	S	S	.	*	H	α-helix	trans	-75.2	-30.7	-179	0	0	0	0	0	113.5	M201 V207 T209	M201-A205 WeakPolarHBondContact O-CB 3.4Å; M201-A205 PolarHBondContact O-N 3.26Å; M201-A205 VanDerWaalsContact O-N 3.09Å; A205-V207 VanDerWaalsContact C-N 3.29Å; A205-V207 PolarHBondContact O-N 3.05Å; A205-T209 PolarHBondContact O-OG1 3.23Å
206	D	34.6	Very low	35.6	Very low	91 Å²	91	96.3 Å²	96.3	49%	0.487	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-19.5	175	-80.5	-19.2	0	0	0	112.7	F210	D206-F210 WeakPolarHBondContact O-CD2 3.44Å
207	V	39.4	Very low	35.7	Very low	66 Å²	66	99.2 Å²	99.2	40%	0.4	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-23.5	-179	177.2	0	0	0	0	112.6	L203 T204 A205	L203-V207 WeakPolarHBondContact O-CG2 3.46Å; T204-V207 PolarHBondContact O-N 2.81Å; A205-V207 VanDerWaalsContact C-N 3.29Å; A205-V207 PolarHBondContact O-N 3.05Å
208	E	37	Very low	35.8	Very low	177 Å²	177	102.2 Å²	102.2	83%	0.827	59%	0.585	S	S	*	*	S	Bend	trans	-95	-5.5	-178.3	-69	-173.1	158.4	0	0	114.3
209	T	36.5	Very low	35.5	Very low	117 Å²	117	103.5 Å²	103.5	72%	0.718	59%	0.585	S	S	*	*	S	Bend	trans	-109.6	-0.6	-175.2	-32.3	0	0	0	0	114.2	A205	A205-T209 PolarHBondContact O-OG1 3.23Å
210	F	31.7	Very low	35.3	Very low	153 Å²	153	103.7 Å²	103.7	67%	0.671	58%	0.579	S	S	*	*			trans	-92.6	104.5	171.9	-87.6	-92	0	0	0	110.2	D206 E212	D206-F210 WeakPolarHBondContact O-CD2 3.44Å; F210-E212 PolarHBondContact O-N 3.15Å
211	G	31	Very low	35	Very low	67 Å²	67	105.5 Å²	105.5	69%	0.691	59%	0.593	S	S	*	*			trans	-49.9	137.7	158.9	0	0	0	0	0	109.5	P213	G211-P213 VanDerWaalsContact O-CD 3.24Å; G211-P213 WeakPolarHBondContact O-CD 3.32Å
212	E	30.9	Very low	35.1	Very low	188 Å²	188	103.9 Å²	103.9	88%	0.879	58%	0.583	S	S	*	*			trans	-38.6	109.7	-174.1	-67.7	-169.3	138.4	0	0	112.1	F210 A214	F210-E212 PolarHBondContact O-N 3.15Å; E212-A214 PolarHBondContact O-N 2.86Å
213	P	33.5	Very low	34.9	Very low	75 Å²	75	104.5 Å²	104.5	49%	0.487	59%	0.588	S	S	.	*			trans	-71.9	124.9	162.6	28.6	-28.4	0	0	0	107.2	G211 G215 F220	G211-P213 VanDerWaalsContact O-CD 3.24Å; G211-P213 WeakPolarHBondContact O-CD 3.32Å; P213-G215 PolarHBondContact O-N 3.48Å; P213-F220 HydrophobicContact CG-CE2 4.21Å
214	A	34.7	Very low	34.8	Very low	115 Å²	115	106.6 Å²	106.6	95%	0.95	59%	0.593	S	S	*	*	S	Bend	trans	-64.1	87.4	165.3	0	0	0	0	0	108.8	E212	E212-A214 PolarHBondContact O-N 2.86Å
215	G	34.9	Very low	34.7	Very low	53 Å²	53	107.8 Å²	107.8	55%	0.546	59%	0.594	S	S	.	*	S	Bend	trans	174.5	115.7	179.8	0	0	0	0	0	112.3	P213	P213-G215 PolarHBondContact O-N 3.48Å
216	D	36.1	Very low	34.6	Very low	112 Å²	112	107.6 Å²	107.6	60%	0.599	59%	0.588	S	S	*	*			trans	47.7	88.3	168.5	-118.1	1.1	0	0	0	117.5	D218 Q219	D216-D218 PolarHBondContact O-N 2.82Å; D216-D218 VanDerWaalsContact O-N 3.14Å; D216-Q219 PolarHBondContact O-N 3.02Å
217	K	36.2	Very low	34.6	Very low	193 Å²	193	106.7 Å²	106.7	84%	0.839	58%	0.579	S	S	*	*	H	α-helix	trans	-60.8	-17.9	174.6	-70.5	-176.7	175.3	-179.1	0	113.7
218	D	40	Very low	34.3	Very low	120 Å²	120	110.8 Å²	110.8	64%	0.642	59%	0.589	S	S	*	*	H	α-helix	trans	-76.6	-22.1	-178	-74.2	-12.3	0	0	0	113.9	D216 S221	D216-D218 PolarHBondContact O-N 2.82Å; D216-D218 VanDerWaalsContact O-N 3.14Å; D218-S221 PolarHBondContact O-OG 3.47Å
219	Q	34.8	Very low	34.2	Very low	87 Å²	87	107.9 Å²	107.9	41%	0.407	58%	0.578	S	S	.	*	H	α-helix	trans	-77.4	-31.1	-179.2	-98.2	-179.6	17.4	0	0	113.7	D216 I223	D216-Q219 PolarHBondContact O-N 3.02Å; Q219-I223 WeakPolarHBondContact O-CG1 3.38Å; Q219-I223 PolarHBondContact O-N 2.77Å
220	F	32.8	Very low	34.1	Very low	92 Å²	92	106.5 Å²	106.5	40%	0.404	56%	0.563	S	S	.	*	H	α-helix	trans	-77.6	-22.6	-177.8	-85.5	-88.1	0	0	0	113.2	P213 K224	P213-F220 HydrophobicContact CG-CE2 4.21Å; F220-K224 PolarHBondContact O-N 3.09Å
221	S	33.3	Very low	34.5	Very low	61 Å²	61	104.4 Å²	104.4	43%	0.427	56%	0.555	S	S	.	*	H	α-helix	trans	-72.8	-42.7	175.2	54.9	0	0	0	0	111.4	D218 I223 K224 Q225	D218-S221 PolarHBondContact O-OG 3.47Å; S221-I223 PolarHBondContact O-N 3.1Å; S221-K224 PolarHBondContact O-N 3.35Å; S221-Q225 PolarHBondContact O-N 2.93Å; S221-Q225 VanDerWaalsContact O-N 3.09Å
222	E	34	Very low	34.5	Very low	110 Å²	110	105.6 Å²	105.6	51%	0.514	55%	0.546	S	S	.	.	H	α-helix	trans	-62	-41.4	176.8	-82.2	-175.9	154.8	0	0	112.4	K224 Q225 V226	E222-K224 PolarHBondContact O-N 2.68Å; E222-Q225 PolarHBondContact O-N 2.88Å; E222-V226 WeakPolarHBondContact O-CG2 3.42Å; E222-V226 PolarHBondContact O-N 2.85Å
223	I	34.9	Very low	34.7	Very low	100 Å²	100	102.1 Å²	102.1	51%	0.513	54%	0.539	S	S	.	.	H	α-helix	trans	-64.5	-39.3	-179.5	-66	170	0	0	0	111.6	Q219 S221 F227	Q219-I223 WeakPolarHBondContact O-CG1 3.38Å; Q219-I223 PolarHBondContact O-N 2.77Å; S221-I223 PolarHBondContact O-N 3.1Å; I223-F227 PolarHBondContact O-N 2.94Å
224	K	32.1	Very low	34.8	Very low	142 Å²	142	104.9 Å²	104.9	62%	0.617	56%	0.555	S	S	*	*	H	α-helix	trans	-69.2	-35.1	175.1	-72.2	-176.9	179.8	-179.6	0	112	F220 S221 E222 Y228	F220-K224 PolarHBondContact O-N 3.09Å; S221-K224 PolarHBondContact O-N 3.35Å; E222-K224 PolarHBondContact O-N 2.68Å; K224-Y228 WeakPolarHBondContact O-CB 3.45Å; K224-Y228 PolarHBondContact O-N 3.01Å
225	Q	33.6	Very low	34.4	Very low	93 Å²	93	107.8 Å²	107.8	44%	0.435	55%	0.546	S	S	.	.	H	α-helix	trans	-68	-44.5	180	-122.4	162.5	12.5	0	0	112.3	M158 S221 E222 F227 Y228 I229	M158-Q225 HydrophobicContact CE-CG 4.41Å; S221-Q225 PolarHBondContact O-N 2.93Å; S221-Q225 VanDerWaalsContact O-N 3.09Å; E222-Q225 PolarHBondContact O-N 2.88Å; Q225-F227 VanDerWaalsContact C-N 3.33Å; Q225-F227 PolarHBondContact O-N 3.05Å; Q225-Y228 PolarHBondContact O-N 3.29Å; Q225-I229 WeakPolarHBondContact O-CD1 3.44Å; Q225-I229 VanDerWaalsContact O-CG1 3.26Å; Q225-I229 WeakPolarHBondContact O-CG1 3.41Å; Q225-I229 PolarHBondContact O-N 3.39Å
226	V	34.9	Very low	34.3	Very low	48 Å²	48	111.1 Å²	111.1	29%	0.291	55%	0.552	S	S	.	*	H	α-helix	trans	-63.6	-40.8	178.1	176.6	0	0	0	0	111	T47 E222 Q230	T47-V226 HydrophobicContact CG2-CG1 4.37Å; E222-V226 WeakPolarHBondContact O-CG2 3.42Å; E222-V226 PolarHBondContact O-N 2.85Å; V226-Q230 PolarHBondContact O-N 3.44Å
227	F	34.4	Very low	34.2	Very low	71 Å²	71	114.1 Å²	114.1	31%	0.311	56%	0.56	S	S	.	*	H	α-helix	trans	-69.1	-35.1	178.8	-147.8	-91.4	0	0	0	112.9	V200 L203 I223 Q225	V200-F227 HydrophobicContact CB-CZ 4.38Å; V200-F227 HydrophobicContact CG1-CE1 3.77Å; V200-F227 HydrophobicContact CG1-CZ 3.89Å; V200-F227 HydrophobicContact CG2-CZ 4.25Å; L203-F227 HydrophobicContact CB-CE2 4.06Å; L203-F227 HydrophobicContact CB-CZ 4.31Å; L203-F227 HydrophobicContact CD1-CE2 3.8Å; L203-F227 HydrophobicContact CD1-CZ 4.4Å; I223-F227 PolarHBondContact O-N 2.94Å; Q225-F227 VanDerWaalsContact C-N 3.33Å; Q225-F227 PolarHBondContact O-N 3.05Å
228	Y	31.9	Very low	34.2	Very low	152 Å²	152	111.4 Å²	111.4	60%	0.596	55%	0.554	S	S	*	*	H	α-helix	trans	-72.9	-39.8	178.7	-169.4	-94.7	0	0	0	112.6	K224 Q225 Q230 N232	K224-Y228 WeakPolarHBondContact O-CB 3.45Å; K224-Y228 PolarHBondContact O-N 3.01Å; Q225-Y228 PolarHBondContact O-N 3.29Å; Y228-Q230 PolarHBondContact O-N 3.11Å; Y228-N232 PolarHBondContact O-N 3.21Å
229	I	36	Very low	34.1	Very low	116 Å²	116	114 Å²	114	60%	0.595	56%	0.562	S	S	*	*	H	α-helix	trans	-67.7	-35.8	-179.5	-67.6	166.5	0	0	0	111.5	Q225	Q225-I229 WeakPolarHBondContact O-CD1 3.44Å; Q225-I229 VanDerWaalsContact O-CG1 3.26Å; Q225-I229 WeakPolarHBondContact O-CG1 3.41Å; Q225-I229 PolarHBondContact O-N 3.39Å
230	Q	35.2	Very low	33.8	Very low	89 Å²	89	113.8 Å²	113.8	42%	0.416	58%	0.584	S	S	.	*	H	α-helix	trans	-81.7	-16.5	-175	-146.1	154.8	-8.3	0	0	113.9	L145 V226 Y228	L145-Q230 HydrophobicContact CD1-CG 4.37Å; V226-Q230 PolarHBondContact O-N 3.44Å; Y228-Q230 PolarHBondContact O-N 3.11Å
231	H	39.5	Very low	33.6	Very low	108 Å²	108	119 Å²	119	50%	0.5	61%	0.607	S	S	.	*	H	α-helix	trans	-115.9	-2	-176.7	-86.3	-71.7	0	0	0	115.1
232	N	30.2	Very low	33.4	Very low	93 Å²	93	122.5 Å²	122.5	50%	0.497	63%	0.626	S	S	.	*			trans	-141.8	81.2	-179.8	-121.4	-28.8	0	0	0	110.5	Y228 T234	Y228-N232 PolarHBondContact O-N 3.21Å; N232-T234 PolarHBondContact O-N 3.24Å; N232-T234 VanDerWaalsContact O-N 3.08Å
233	P	36.1	Very low	33.2	Very low	114 Å²	114	121.5 Å²	121.5	74%	0.74	64%	0.636	S	S	*	*			trans	-65.1	116.1	170.2	27.3	-30	0	0	0	107.5	F235	P233-F235 PolarHBondContact O-N 3.02Å; P233-F235 VanDerWaalsContact O-N 3.1Å
234	T	34.5	Very low	33.1	Very low	133 Å²	133	123.9 Å²	123.9	82%	0.816	65%	0.65	S	S	*	*			trans	-55.2	116.6	173.3	34.7	0	0	0	0	109.1	N232 N236	N232-T234 PolarHBondContact O-N 3.24Å; N232-T234 VanDerWaalsContact O-N 3.08Å; T234-N236 PolarHBondContact O-N 3.41Å; T234-N236 VanDerWaalsContact O-N 3.08Å
235	F	27.2	Very low	33	Very low	176 Å²	176	126 Å²	126	77%	0.772	66%	0.659	S	S	*	*			trans	-63.1	105.2	175.2	-177.9	-99.6	0	0	0	109.5	P233 K237	P233-F235 PolarHBondContact O-N 3.02Å; P233-F235 VanDerWaalsContact O-N 3.1Å; F235-K237 HydrophobicContact CD1-CG 3.89Å; F235-K237 HydrophobicContact CE1-CB 4.5Å; F235-K237 HydrophobicContact CE1-CD 4.45Å; F235-K237 HydrophobicContact CE1-CG 3.43Å; F235-K237 VanDerWaalsContact CE1-CG 3.43Å; F235-K237 HydrophobicContact CZ-CG 4.46Å
236	N	32.5	Very low	33.1	Very low	124 Å²	124	127.7 Å²	127.7	66%	0.663	68%	0.679	S	S	*	*			trans	-87.2	127.5	166.9	-159	-7.1	0	0	0	108.8	T234 D238	T234-N236 PolarHBondContact O-N 3.41Å; T234-N236 VanDerWaalsContact O-N 3.08Å; N236-D238 PolarHBondContact O-N 3.46Å
237	K	34	Very low	33.1	Very low	174 Å²	174	133 Å²	133	76%	0.757	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-3.4	-167.7	-96.6	177.9	178.5	175.3	0	114.8	F235	F235-K237 HydrophobicContact CD1-CG 3.89Å; F235-K237 HydrophobicContact CE1-CB 4.5Å; F235-K237 HydrophobicContact CE1-CD 4.45Å; F235-K237 HydrophobicContact CE1-CG 3.43Å; F235-K237 VanDerWaalsContact CE1-CG 3.43Å; F235-K237 HydrophobicContact CZ-CG 4.46Å
238	D	36.1	Very low	33.1	Very low	137 Å²	137	135 Å²	135	73%	0.733	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	4.5	-162.1	-63.8	-28.1	0	0	0	115.5	N236	N236-D238 PolarHBondContact O-N 3.46Å
239	E	37.5	Very low	33.5	Very low	173 Å²	173	132.3 Å²	132.3	81%	0.808	71%	0.706	S	S	*	*			trans	-133.9	112.8	-177.5	-68.5	-93.3	153.3	0	0	111.5	F241	E239-F241 PolarHBondContact O-N 3.15Å
240	G	28.7	Very low	33.5	Very low	84 Å²	84	130.8 Å²	130.8	87%	0.866	71%	0.711	S	S	*	*			trans	-74.3	119.6	179.5	0	0	0	0	0	112.9
241	F	28.8	Very low	33.5	Very low	202 Å²	202	129 Å²	129	89%	0.886	72%	0.717	S	S	*	*			trans	-88.4	119.9	-176.9	-138	-91.5	0	0	0	112.9	E239	E239-F241 PolarHBondContact O-N 3.15Å
242	T	28.9	Very low	33.6	Very low	134 Å²	134	128.2 Å²	128.2	82%	0.822	71%	0.713	S	S	*	*			trans	-84.8	112.2	163	54.6	0	0	0	0	109.6
243	A	30.7	Very low	33.9	Very low	88 Å²	88	127.3 Å²	127.3	73%	0.727	71%	0.708	S	S	*	*			trans	-78.7	125	-180	0	0	0	0	0	112.3
244	N	32.2	Very low	33.7	Very low	150 Å²	150	126 Å²	126	80%	0.802	70%	0.702	S	S	*	*			trans	-154.5	87.2	163.1	-127.8	-22	0	0	0	111.7
245	K	29.8	Very low	33.8	Very low	187 Å²	187	127 Å²	127	81%	0.813	69%	0.694	S	S	*	*				149.4	132.9	127	-78.2	178.3	-175.4	-169.9	0	113.7
246	P	35.8	Very low	34.3	Very low	129 Å²	129	121.7 Å²	121.7	84%	0.838	68%	0.679	S	S	*	*			trans	-94.1	154.8	-170.9	38.4	-33.3	0	0	0	113
247	W	34.6	Very low	34.4	Very low	159 Å²	159	121.7 Å²	121.7	60%	0.602	67%	0.673	S	S	*	*			trans	-106.9	147.5	-166.3	42.9	-90.8	0	0	0	112.8	L195	L195-W247 HydrophobicContact CB-CH2 3.78Å; L195-W247 HydrophobicContact CB-CZ2 4.36Å; L195-W247 HydrophobicContact CD1-CH2 3.23Å; L195-W247 HydrophobicContact CD1-CZ2 3.15Å; L195-W247 HydrophobicContact CD1-CZ3 4.35Å; L195-W247 HydrophobicContact CD2-CH2 3.47Å; L195-W247 VanDerWaalsContact CD2-CH2 3.47Å; L195-W247 HydrophobicContact CD2-CZ2 4.28Å; L195-W247 HydrophobicContact CD2-CZ3 3.95Å; L195-W247 HydrophobicContact CG-CH2 3.59Å; L195-W247 HydrophobicContact CG-CZ2 4.05Å
248	L	35.4	Very low	34.4	Very low	113 Å²	113	120.2 Å²	120.2	59%	0.592	67%	0.668	S	S	*	*			trans	47.8	132.2	174.1	-73	112.3	0	0	0	119.6	Q252	L248-Q252 HydrophobicContact CD2-CB 3.74Å; L248-Q252 HydrophobicContact CD2-CG 4.36Å
249	T	39.6	Very low	34.7	Very low	96 Å²	96	119 Å²	119	59%	0.589	66%	0.661	S	S	*	*			trans	-79.7	148.3	173.2	56.5	0	0	0	0	111.5	G251 Q252	T249-G251 PolarHBondContact O-N 3.19Å; T249-Q252 PolarHBondContact O-N 3.41Å
250	A	35.1	Very low	34.6	Very low	83 Å²	83	111.8 Å²	111.8	69%	0.686	63%	0.633	S	S	*	*	H	α-helix	trans	-52.6	-28.4	-179.3	0	0	0	0	0	114.6	Q252 L253 S254	A250-Q252 VanDerWaalsContact C-N 3.3Å; A250-Q252 PolarHBondContact O-N 3.35Å; A250-L253 PolarHBondContact O-N 3.43Å; A250-S254 PolarHBondContact O-N 3.48Å
251	G	35.6	Very low	35.2	Very low	53 Å²	53	110.9 Å²	110.9	55%	0.546	61%	0.613	S	S	.	*	H	α-helix	trans	-66.8	-26.5	176.8	0	0	0	0	0	114.3	T249	T249-G251 PolarHBondContact O-N 3.19Å
252	Q	42.8	Very low	35.9	Very low	91 Å²	91	107 Å²	107	43%	0.425	60%	0.598	S	S	.	*	H	α-helix	trans	-75.8	-34	177.5	-66.6	-178.2	-69.4	0	0	111.5	L248 T249 A250 K255	L248-Q252 HydrophobicContact CD2-CB 3.74Å; L248-Q252 HydrophobicContact CD2-CG 4.36Å; T249-Q252 PolarHBondContact O-N 3.41Å; A250-Q252 VanDerWaalsContact C-N 3.3Å; A250-Q252 PolarHBondContact O-N 3.35Å; Q252-K255 PolarHBondContact O-N 3.37Å
253	L	36	Very low	36.6	Very low	74 Å²	74	103.8 Å²	103.8	39%	0.387	58%	0.578	S	S	.	*	H	α-helix	trans	-66.4	-36.6	175.8	-67.7	172.4	0	0	0	112.6	T197 A250 K255 C256 F257	T197-L253 HydrophobicContact CG2-CD2 4.32Å; A250-L253 PolarHBondContact O-N 3.43Å; L253-K255 VanDerWaalsContact C-N 3.29Å; L253-K255 PolarHBondContact O-N 3.42Å; L253-C256 PolarHBondContact O-N 3.05Å; L253-F257 PolarHBondContact O-N 3.32Å
254	S	32	Very low	37	Very low	86 Å²	86	103.7 Å²	103.7	60%	0.601	56%	0.562	S	S	*	*	H	α-helix	trans	-64.6	-30.1	-179	-172.8	0	0	0	0	113.5	A250	A250-S254 PolarHBondContact O-N 3.48Å
255	K	37	Very low	37.7	Very low	153 Å²	153	102.1 Å²	102.1	67%	0.665	55%	0.55	S	S	*	.	H	α-helix	trans	-76.4	-35.6	178.9	-83.4	-179.3	177.6	178.6	0	112.5	Q252 L253 F257 H258 I259	Q252-K255 PolarHBondContact O-N 3.37Å; L253-K255 VanDerWaalsContact C-N 3.29Å; L253-K255 PolarHBondContact O-N 3.42Å; K255-F257 VanDerWaalsContact C-N 3.27Å; K255-F257 PolarHBondContact O-N 3.21Å; K255-H258 PolarHBondContact O-N 3.49Å; K255-I259 PolarHBondContact O-N 3.38Å
256	C	36.7	Very low	38.5	Very low	66 Å²	66	98.6 Å²	98.6	45%	0.446	54%	0.536	S	S	.	.	H	α-helix	trans	-60.9	-38.2	175.8	-64.3	0	0	0	0	111.7	L253 H258 I259 G260	L253-C256 PolarHBondContact O-N 3.05Å; C256-H258 PolarHBondContact O-N 3.46Å; C256-I259 PolarHBondContact O-N 3.49Å; C256-G260 PolarHBondContact O-N 3.41Å
257	F	35	Very low	39	Very low	124 Å²	124	100.2 Å²	100.2	54%	0.544	53%	0.526	S	S	.	.	H	α-helix	trans	-67.5	-34.2	-179.8	-155.5	-100.1	0	0	0	113.4	P198 L253 K255 S261	P198-F257 HydrophobicContact CB-CE2 4Å; P198-F257 HydrophobicContact CG-CD2 3.62Å; P198-F257 HydrophobicContact CG-CE2 3.43Å; P198-F257 VanDerWaalsContact CG-CE2 3.43Å; L253-F257 PolarHBondContact O-N 3.32Å; K255-F257 VanDerWaalsContact C-N 3.27Å; K255-F257 PolarHBondContact O-N 3.21Å; F257-S261 PolarHBondContact O-N 2.98Å; F257-S261 PolarHBondContact O-OG 3.22Å
258	H	34.5	Very low	39.7	Very low	142 Å²	142	101.3 Å²	101.3	66%	0.657	53%	0.53	S	S	*	.	H	α-helix	trans	-71.7	-38	180	-134.6	58.5	0	0	0	112.1	K255 C256 Q262	K255-H258 PolarHBondContact O-N 3.49Å; C256-H258 PolarHBondContact O-N 3.46Å; H258-Q262 PolarHBondContact O-N 3.46Å
259	I	42.3	Very low	40.9	Very low	113 Å²	113	102.3 Å²	102.3	58%	0.579	53%	0.531	S	S	*	.	H	α-helix	trans	-68.7	-43.5	178.6	-62.9	169.4	0	0	0	110.8	K255 C256 S261 Q262 V263	K255-I259 PolarHBondContact O-N 3.38Å; C256-I259 PolarHBondContact O-N 3.49Å; I259-S261 PolarHBondContact O-N 2.86Å; I259-Q262 PolarHBondContact O-N 2.98Å; I259-V263 WeakPolarHBondContact O-CG2 3.45Å; I259-V263 PolarHBondContact O-N 2.85Å
260	G	34.8	Very low	42	Very low	21 Å²	21	106.5 Å²	106.5	22%	0.216	54%	0.541	C	S	.	.	H	α-helix	trans	-58.7	-44.7	176.7	0	0	0	0	0	112.7	C256 Q262 V263 H264	C256-G260 PolarHBondContact O-N 3.41Å; G260-Q262 VanDerWaalsContact C-N 3.28Å; G260-Q262 PolarHBondContact O-N 3.49Å; G260-V263 PolarHBondContact O-N 2.73Å; G260-H264 PolarHBondContact O-N 2.97Å; G260-H264 VanDerWaalsContact O-N 3.08Å
261	S	40.7	Very low	43	Very low	65 Å²	65	110.7 Å²	110.7	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-61.1	-35.6	177.4	-65.6	0	0	0	0	113.1	F257 I259 H265	F257-S261 PolarHBondContact O-N 2.98Å; F257-S261 PolarHBondContact O-OG 3.22Å; I259-S261 PolarHBondContact O-N 2.86Å; S261-H265 WeakPolarHBondContact O-CB 3.39Å; S261-H265 PolarHBondContact O-N 2.99Å; S261-H265 VanDerWaalsContact O-N 3.15Å
262	Q	44.5	Very low	43.7	Very low	121 Å²	121	120.1 Å²	120.1	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-73	-40.3	-177.9	-154.7	169.9	-25.3	0	0	111.7	H258 I259 G260 H265 E266	H258-Q262 PolarHBondContact O-N 3.46Å; I259-Q262 PolarHBondContact O-N 2.98Å; G260-Q262 VanDerWaalsContact C-N 3.28Å; G260-Q262 PolarHBondContact O-N 3.49Å; Q262-H265 PolarHBondContact O-N 3.38Å; Q262-E266 PolarHBondContact O-N 3.5Å
263	V	43.1	Very low	43.8	Very low	66 Å²	66	121.6 Å²	121.6	40%	0.4	58%	0.58	S	S	.	*	H	α-helix	trans	-66.5	-40.9	176	177.2	0	0	0	0	111.3	I259 G260 H265 E266 R267	I259-V263 WeakPolarHBondContact O-CG2 3.45Å; I259-V263 PolarHBondContact O-N 2.85Å; G260-V263 PolarHBondContact O-N 2.73Å; V263-H265 VanDerWaalsContact C-N 3.33Å; V263-H265 PolarHBondContact O-N 3Å; V263-E266 PolarHBondContact O-N 3.26Å; V263-R267 WeakPolarHBondContact O-CG 3.24Å; V263-R267 PolarHBondContact O-N 2.91Å
264	H	40.1	Very low	44.2	Very low	86 Å²	86	124.1 Å²	124.1	40%	0.398	59%	0.59	S	S	.	*	H	α-helix	trans	-68.8	-32.3	179.8	-150.7	-44.6	0	0	0	112.4	E202 G260 R268	E202-H264 IonicContact OE1-CD2 3.37Å; E202-H264 PolarHBondContact OE1-CD2 3.01Å; G260-H264 PolarHBondContact O-N 2.97Å; G260-H264 VanDerWaalsContact O-N 3.08Å; H264-R268 PolarHBondContact O-N 3.37Å
265	H	46.6	Very low	44.9	Very low	117 Å²	117	126.2 Å²	126.2	54%	0.542	59%	0.589	S	S	.	*	H	α-helix	trans	-71.4	-43.4	174.1	-172.6	-77.4	0	0	0	112	S261 Q262 V263 R267 R268 Q269	S261-H265 WeakPolarHBondContact O-CB 3.39Å; S261-H265 PolarHBondContact O-N 2.99Å; S261-H265 VanDerWaalsContact O-N 3.15Å; Q262-H265 PolarHBondContact O-N 3.38Å; V263-H265 VanDerWaalsContact C-N 3.33Å; V263-H265 PolarHBondContact O-N 3Å; H265-R267 PolarHBondContact O-N 2.9Å; H265-R268 PolarHBondContact O-N 3.36Å; H265-Q269 PolarHBondContact CE1-NE2 3.39Å; H265-Q269 WeakPolarHBondContact O-CG 3.47Å; H265-Q269 PolarHBondContact O-N 3.14Å
266	E	46.2	Very low	45.3	Very low	113 Å²	113	124.6 Å²	124.6	53%	0.528	59%	0.585	S	S	.	*	H	α-helix	trans	-65	-36.3	176.9	-77.2	-175.9	175.5	0	0	112.8	Q262 V263 Q269 K270	Q262-E266 PolarHBondContact O-N 3.5Å; V263-E266 PolarHBondContact O-N 3.26Å; E266-Q269 PolarHBondContact O-N 3.47Å; E266-K270 PolarHBondContact O-N 2.83Å
267	R	47.2	Very low	45.9	Very low	163 Å²	163	128.3 Å²	128.3	62%	0.615	59%	0.594	S	S	*	*	H	α-helix	trans	-69.6	-37.9	176.4	-74.5	-176.6	177.6	-172.9	-1.3	112.7	V263 H265 Q269 K270 Q271	V263-R267 WeakPolarHBondContact O-CG 3.24Å; V263-R267 PolarHBondContact O-N 2.91Å; H265-R267 PolarHBondContact O-N 2.9Å; R267-Q269 VanDerWaalsContact C-N 3.27Å; R267-Q269 PolarHBondContact O-N 3.36Å; R267-K270 PolarHBondContact O-N 3.2Å; R267-Q271 PolarHBondContact O-N 3.23Å
268	R	48.9	Very low	46.6	Very low	182 Å²	182	128.5 Å²	128.5	69%	0.687	60%	0.597	S	S	*	*	H	α-helix	trans	-65	-29.3	173.5	-82.9	-173.2	169.6	-174.8	-0.2	113.4	H264 H265	H264-R268 PolarHBondContact O-N 3.37Å; H265-R268 PolarHBondContact O-N 3.36Å
269	Q	60.2	Low	47.4	Very low	134 Å²	134	127.6 Å²	127.6	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-74.8	-25.6	176.4	-70.1	-109.6	-18.2	0	0	112.9	H265 E266 R267	H265-Q269 PolarHBondContact CE1-NE2 3.39Å; H265-Q269 WeakPolarHBondContact O-CG 3.47Å; H265-Q269 PolarHBondContact O-N 3.14Å; E266-Q269 PolarHBondContact O-N 3.47Å; R267-Q269 VanDerWaalsContact C-N 3.27Å; R267-Q269 PolarHBondContact O-N 3.36Å
270	K	61.8	Low	47.8	Very low	183 Å²	183	128.7 Å²	128.7	80%	0.796	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-5	179	-72	-177.1	178.2	178.1	0	114.6	E266 R267	E266-K270 PolarHBondContact O-N 2.83Å; R267-K270 PolarHBondContact O-N 3.2Å
271	Q	57.1	Low	48.9	Very low	171 Å²	171	137.7 Å²	137.7	80%	0.799	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	9.6	-178.8	-98.6	161.8	-7.6	0	0	114.1	R267	R267-Q271 PolarHBondContact O-N 3.23Å
272	K	50.8	Low	49.7	Very low	251 Å²	251	144.3 Å²	144.3	100%	1.091	64%	0.641	S	S	*	*			trans	-113.1	0	166.6	-84.7	-173.3	173	-174.2	0	109.8

Retrieved 272 of 272 residues in 163.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).