H2T0R7_TAKRU Loading...

Proteasome 26S subunit, ATPase 3

AlphaFold DB , UniProt , Accession H2T0R7, Species TAKRU (Takifugu rubripes, Japanese pufferfish), Gene psmc3, Length 427 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	47	Very low	241 Å²	241	120.1 Å²	120.1	100%	1.187	66%	0.657	S	S	*	*				0	100.8	0	-78.2	178.6	-167.1	0	0	106.6	S3	M1-S3 PolarHBondContact O-N 3.32Å
2	A	36.2	Very low	47.3	Very low	86 Å²	86	124.3 Å²	124.3	71%	0.711	67%	0.669	S	S	*	*			trans	-62.1	118.6	163.3	0	0	0	0	0	106.2
3	S	40.8	Very low	47.7	Very low	74 Å²	74	121.2 Å²	121.2	52%	0.517	66%	0.656	S	S	.	*			trans	-63.5	149.7	174.2	42.9	0	0	0	0	108.6	M1 S5 D6	M1-S3 PolarHBondContact O-N 3.32Å; S3-S5 PolarHBondContact O-N 3.42Å; S3-S5 PolarHBondContact OG-OG 3.38Å; S3-D6 PolarHBondContact O-N 3.01Å
4	L	48.9	Very low	48.1	Very low	165 Å²	165	121.9 Å²	121.9	86%	0.864	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	11.8	172.4	-86.3	115.5	0	0	0	115
5	S	47.7	Very low	48.3	Very low	82 Å²	82	123.9 Å²	123.9	57%	0.573	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-1.2	178.9	62.9	0	0	0	0	114.3	S3 K7	S3-S5 PolarHBondContact O-N 3.42Å; S3-S5 PolarHBondContact OG-OG 3.38Å; S5-K7 PolarHBondContact O-N 3.05Å
6	D	44.2	Very low	48.6	Very low	80 Å²	80	119 Å²	119	43%	0.428	65%	0.652	S	S	.	*			trans	-72.6	95.8	173.5	-88.5	-20.3	0	0	0	109.8	S3 S8 V9	S3-D6 PolarHBondContact O-N 3.01Å; D6-S8 PolarHBondContact O-N 3.26Å; D6-V9 HydrophobicContact CB-CG2 4.42Å; D6-V9 PolarHBondContact O-N 3.48Å
7	K	51.6	Low	49.1	Very low	168 Å²	168	117.1 Å²	117.1	73%	0.73	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-25.9	176.6	-82.2	-178	169.9	-175.4	0	113.6	S5 V9 W10 D11	S5-K7 PolarHBondContact O-N 3.05Å; K7-V9 VanDerWaalsContact C-N 3.26Å; K7-V9 PolarHBondContact O-N 3.13Å; K7-W10 PolarHBondContact O-N 3.16Å; K7-W10 VanDerWaalsContact O-N 3.14Å; K7-D11 PolarHBondContact O-N 3.16Å
8	S	52.1	Low	49.7	Very low	74 Å²	74	112.8 Å²	112.8	52%	0.517	63%	0.627	S	S	.	*	H	α-helix	trans	-65.8	-24.9	-178.7	56	0	0	0	0	114.2	D6 W10	D6-S8 PolarHBondContact O-N 3.26Å; S8-W10 VanDerWaalsContact C-N 3.31Å
9	V	53.2	Low	50.3	Low	92 Å²	92	113.5 Å²	113.5	56%	0.558	63%	0.625	S	S	*	*	H	α-helix	trans	-75.5	-23.9	177	-179	0	0	0	0	111.6	D6 K7 V13	D6-V9 HydrophobicContact CB-CG2 4.42Å; D6-V9 PolarHBondContact O-N 3.48Å; K7-V9 VanDerWaalsContact C-N 3.26Å; K7-V9 PolarHBondContact O-N 3.13Å; V9-V13 VanDerWaalsContact O-CG2 3.29Å; V9-V13 WeakPolarHBondContact O-CG2 3.38Å
10	W	53.1	Low	50.8	Low	157 Å²	157	112.9 Å²	112.9	60%	0.595	62%	0.617	S	S	*	*	H	α-helix	trans	-85.4	-35.2	179.8	-60.2	91.3	0	0	0	111.7	K7 S8 E12 V13 E14	K7-W10 PolarHBondContact O-N 3.16Å; K7-W10 VanDerWaalsContact O-N 3.14Å; S8-W10 VanDerWaalsContact C-N 3.31Å; W10-E12 PolarHBondContact O-N 3.44Å; W10-V13 PolarHBondContact O-N 3.01Å; W10-E14 PolarHBondContact O-N 3.07Å
11	D	51.8	Low	51.3	Low	102 Å²	102	110.8 Å²	110.8	55%	0.545	61%	0.608	S	S	.	*	H	α-helix	trans	-65.4	-34.3	-179.6	-73.1	-20.4	0	0	0	112.8	K7 V13	K7-D11 PolarHBondContact O-N 3.16Å; D11-V13 VanDerWaalsContact C-N 3.33Å; D11-V13 PolarHBondContact O-N 3.06Å
12	E	50.8	Low	52.6	Low	171 Å²	171	106.5 Å²	106.5	80%	0.799	59%	0.589	S	S	*	*	H	α-helix	trans	-75.5	-19.4	177.1	-73.3	-173.9	169.5	0	0	113.8	W10	W10-E12 PolarHBondContact O-N 3.44Å
13	V	52.2	Low	54.1	Low	84 Å²	84	109.4 Å²	109.4	51%	0.509	59%	0.586	S	S	.	*	H	α-helix	trans	-91.2	-28.7	-178.2	-172.8	0	0	0	0	110.8	V9 W10 D11 D15 G16 I17	V9-V13 VanDerWaalsContact O-CG2 3.29Å; V9-V13 WeakPolarHBondContact O-CG2 3.38Å; W10-V13 PolarHBondContact O-N 3.01Å; D11-V13 VanDerWaalsContact C-N 3.33Å; D11-V13 PolarHBondContact O-N 3.06Å; V13-D15 VanDerWaalsContact C-N 3.31Å; V13-D15 PolarHBondContact O-N 3.14Å; V13-G16 PolarHBondContact O-N 3.24Å; V13-I17 HydrophobicContact CG1-CD1 4.06Å; V13-I17 HydrophobicContact CG1-CG1 4.34Å; V13-I17 WeakPolarHBondContact O-CD1 3.3Å; V13-I17 VanDerWaalsContact O-CG1 3.29Å; V13-I17 WeakPolarHBondContact O-CG1 3.26Å
14	E	54	Low	55.4	Low	130 Å²	130	108.8 Å²	108.8	61%	0.607	58%	0.575	S	S	*	*	H	α-helix	trans	-60.6	-34.5	179.7	-79.3	-172	172.8	0	0	113.8	W10 G16 I17	W10-E14 PolarHBondContact O-N 3.07Å; E14-G16 VanDerWaalsContact C-N 3.28Å; E14-G16 PolarHBondContact O-N 2.98Å; E14-I17 PolarHBondContact O-N 3.12Å
15	D	51	Low	56.7	Low	152 Å²	152	103.6 Å²	103.6	81%	0.813	55%	0.553	S	S	*	*	H	α-helix	trans	-68.7	-20.7	-178.2	-80.3	-23.7	0	0	0	114.1	V13	V13-D15 VanDerWaalsContact C-N 3.31Å; V13-D15 PolarHBondContact O-N 3.14Å
16	G	53	Low	58.1	Low	46 Å²	46	105.3 Å²	105.3	47%	0.474	56%	0.56	S	S	.	*	H	α-helix	trans	-96	-22.7	178.5	0	0	0	0	0	115	V13 E14	V13-G16 PolarHBondContact O-N 3.24Å; E14-G16 VanDerWaalsContact C-N 3.28Å; E14-G16 PolarHBondContact O-N 2.98Å
17	I	57.4	Low	59.7	Low	86 Å²	86	108.3 Å²	108.3	44%	0.441	57%	0.571	S	S	.	*	H	α-helix	trans	-70.2	-37.4	-174.6	-62.3	164.4	0	0	0	110.8	V13 E14 E19 E20 V21	V13-I17 HydrophobicContact CG1-CD1 4.06Å; V13-I17 HydrophobicContact CG1-CG1 4.34Å; V13-I17 WeakPolarHBondContact O-CD1 3.3Å; V13-I17 VanDerWaalsContact O-CG1 3.29Å; V13-I17 WeakPolarHBondContact O-CG1 3.26Å; E14-I17 PolarHBondContact O-N 3.12Å; I17-E19 PolarHBondContact O-N 2.81Å; I17-E20 PolarHBondContact O-N 2.86Å; I17-V21 HydrophobicContact CG2-CG2 3.81Å; I17-V21 VanDerWaalsContact O-CB 3.32Å; I17-V21 WeakPolarHBondContact O-CB 3.43Å; I17-V21 WeakPolarHBondContact O-CG2 3.14Å; I17-V21 PolarHBondContact O-N 2.94Å
18	G	59.6	Low	61	Low	41 Å²	41	104.9 Å²	104.9	42%	0.423	56%	0.558	S	S	.	*	H	α-helix	trans	-61	-40.3	-176.8	0	0	0	0	0	113.7	L22	G18-L22 WeakPolarHBondContact O-CD1 3.36Å; G18-L22 WeakPolarHBondContact O-CG 3.32Å; G18-L22 PolarHBondContact O-N 3.23Å; G18-L22 VanDerWaalsContact O-N 3.16Å
19	E	60.1	Low	62.3	Low	125 Å²	125	103.8 Å²	103.8	58%	0.584	55%	0.546	S	S	*	.	H	α-helix	trans	-77	-33.2	-177.5	-131.1	-153.7	140.7	0	0	113	I17 K23	I17-E19 PolarHBondContact O-N 2.81Å; E19-K23 VanDerWaalsContact CD-NZ 3.33Å; E19-K23 WeakPolarHBondContact O-CD 3.38Å; E19-K23 VanDerWaalsContact O-CG 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.39Å; E19-K23 PolarHBondContact O-N 3.45Å; E19-K23 WeakPolarHBondContact OE1-CE 3.49Å; E19-K23 IonicContact OE1-NZ 2.78Å; E19-K23 PolarHBondContact OE1-NZ 3.29Å; E19-K23 IonicContact OE2-NZ 3.8Å
20	E	60.1	Low	63.7	Low	101 Å²	101	102.7 Å²	102.7	47%	0.472	54%	0.539	S	S	.	.	H	α-helix	trans	-70.6	-40	172.3	-79.6	-150.1	168.4	0	0	111.8	I17 L22 K23 M24 R32	I17-E20 PolarHBondContact O-N 2.86Å; E20-L22 VanDerWaalsContact C-N 3.31Å; E20-L22 PolarHBondContact O-N 3.28Å; E20-K23 PolarHBondContact O-N 3.01Å; E20-K23 VanDerWaalsContact O-N 3.13Å; E20-M24 WeakPolarHBondContact O-CG 3.34Å; E20-M24 PolarHBondContact O-N 3.46Å; E20-M24 VanDerWaalsContact O-N 3.12Å; E20-R32 IonicContact OE2-CZ 2.75Å; E20-R32 IonicContact OE2-NH1 2.65Å; E20-R32 PolarHBondContact OE2-NH1 2.97Å
21	V	61.8	Low	65.1	Low	69 Å²	69	100.9 Å²	100.9	42%	0.418	54%	0.537	S	S	.	.	H	α-helix	trans	-66.6	-32.4	179.2	169.2	0	0	0	0	111.9	I17 K23 I29	I17-V21 HydrophobicContact CG2-CG2 3.81Å; I17-V21 VanDerWaalsContact O-CB 3.32Å; I17-V21 WeakPolarHBondContact O-CB 3.43Å; I17-V21 WeakPolarHBondContact O-CG2 3.14Å; I17-V21 PolarHBondContact O-N 2.94Å; V21-K23 VanDerWaalsContact C-N 3.32Å; V21-I29 HydrophobicContact CG1-CD1 3.82Å
22	L	63.9	Low	66.5	Low	151 Å²	151	101.9 Å²	101.9	79%	0.791	53%	0.534	S	S	*	.	H	α-helix	trans	-70.6	-25.2	173	-83.1	157	0	0	0	113.4	G18 E20	G18-L22 WeakPolarHBondContact O-CD1 3.36Å; G18-L22 WeakPolarHBondContact O-CG 3.32Å; G18-L22 PolarHBondContact O-N 3.23Å; G18-L22 VanDerWaalsContact O-N 3.16Å; E20-L22 VanDerWaalsContact C-N 3.31Å; E20-L22 PolarHBondContact O-N 3.28Å
23	K	68.4	Low	68.1	Low	148 Å²	148	96.9 Å²	96.9	64%	0.643	52%	0.515	S	S	*	.	H	α-helix	trans	-91	-19.1	-178.7	-70.4	169.4	-170.5	164.8	0	113.1	E19 E20 V21	E19-K23 VanDerWaalsContact CD-NZ 3.33Å; E19-K23 WeakPolarHBondContact O-CD 3.38Å; E19-K23 VanDerWaalsContact O-CG 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.39Å; E19-K23 PolarHBondContact O-N 3.45Å; E19-K23 WeakPolarHBondContact OE1-CE 3.49Å; E19-K23 IonicContact OE1-NZ 2.78Å; E19-K23 PolarHBondContact OE1-NZ 3.29Å; E19-K23 IonicContact OE2-NZ 3.8Å; E20-K23 PolarHBondContact O-N 3.01Å; E20-K23 VanDerWaalsContact O-N 3.13Å; V21-K23 VanDerWaalsContact C-N 3.32Å
24	M	68.4	Low	69.6	Low	60 Å²	60	101.3 Å²	101.3	30%	0.296	52%	0.523	S	S	.	.	S	Bend	trans	-93.6	148.7	-179.1	-71.6	-174.2	174.2	0	0	112.1	E20 E28 I29 R32	E20-M24 WeakPolarHBondContact O-CG 3.34Å; E20-M24 PolarHBondContact O-N 3.46Å; E20-M24 VanDerWaalsContact O-N 3.12Å; M24-E28 HydrophobicContact CB-CB 4.33Å; M24-I29 HydrophobicContact CB-CD1 4.37Å; M24-I29 HydrophobicContact CB-CG1 4.01Å; M24-R32 PolarHBondContact SD-NH1 2.88Å
25	S	77.1	Confident	71.2	Confident	56 Å²	56	100.4 Å²	100.4	39%	0.392	52%	0.521	S	S	.	.			trans	-68.8	151.9	172	66.2	0	0	0	0	110.8	E27 E28 I29	S25-E27 PolarHBondContact O-N 3.08Å; S25-E28 PolarHBondContact N-OE2 3.48Å; S25-E28 PolarHBondContact O-N 3.38Å; S25-E28 VanDerWaalsContact O-N 3.07Å; S25-E28 WeakPolarHBondContact OG-CG 3.35Å; S25-E28 PolarHBondContact OG-N 3.38Å; S25-E28 PolarHBondContact OG-OE2 3.28Å; S25-E28 VanDerWaalsContact OG-OE2 3.14Å; S25-I29 PolarHBondContact O-N 3.13Å; S25-I29 VanDerWaalsContact O-N 3.16Å
26	T	75.9	Confident	72.9	Confident	119 Å²	119	97.4 Å²	97.4	73%	0.73	51%	0.505	S	S	*	.	H	α-helix	trans	-55.4	-28.2	175.4	49	0	0	0	0	112.4	V30	T26-V30 VanDerWaalsContact O-CG2 3.26Å; T26-V30 WeakPolarHBondContact O-CG2 3.48Å; T26-V30 PolarHBondContact O-N 3.45Å
27	E	78.3	Confident	74.5	Confident	142 Å²	142	100.2 Å²	100.2	66%	0.664	51%	0.509	S	S	*	.	H	α-helix	trans	-76.8	-37.7	179.4	-161.2	155.8	-166.6	0	0	112.5	S25 V30 Q31	S25-E27 PolarHBondContact O-N 3.08Å; E27-V30 PolarHBondContact O-N 3.32Å; E27-Q31 PolarHBondContact O-N 2.78Å
28	E	79	Confident	76	Confident	96 Å²	96	98.7 Å²	98.7	45%	0.449	51%	0.506	S	S	.	.	H	α-helix	trans	-64.6	-40.8	172.5	-80.3	170.2	143.4	0	0	112.3	M24 S25 V30 Q31 R32	M24-E28 HydrophobicContact CB-CB 4.33Å; S25-E28 PolarHBondContact N-OE2 3.48Å; S25-E28 PolarHBondContact O-N 3.38Å; S25-E28 VanDerWaalsContact O-N 3.07Å; S25-E28 WeakPolarHBondContact OG-CG 3.35Å; S25-E28 PolarHBondContact OG-N 3.38Å; S25-E28 PolarHBondContact OG-OE2 3.28Å; S25-E28 VanDerWaalsContact OG-OE2 3.14Å; E28-V30 VanDerWaalsContact C-N 3.3Å; E28-V30 PolarHBondContact O-N 2.99Å; E28-Q31 PolarHBondContact O-N 3.33Å; E28-R32 WeakPolarHBondContact O-CB 3.39Å; E28-R32 PolarHBondContact O-N 3.44Å
29	I	80.1	Confident	77.5	Confident	51 Å²	51	101.6 Å²	101.6	26%	0.262	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-39.9	177.6	-63.6	159.8	0	0	0	110.6	V21 M24 S25 R32 T33	V21-I29 HydrophobicContact CG1-CD1 3.82Å; M24-I29 HydrophobicContact CB-CD1 4.37Å; M24-I29 HydrophobicContact CB-CG1 4.01Å; S25-I29 PolarHBondContact O-N 3.13Å; S25-I29 VanDerWaalsContact O-N 3.16Å; I29-R32 PolarHBondContact O-N 2.81Å; I29-T33 WeakPolarHBondContact O-CB 3.41Å; I29-T33 WeakPolarHBondContact O-CG2 3.49Å; I29-T33 PolarHBondContact O-N 2.91Å; I29-T33 PolarHBondContact O-OG1 3.13Å
30	V	81.9	Confident	79	Confident	69 Å²	69	100.4 Å²	100.4	42%	0.418	51%	0.505	S	S	.	.	H	α-helix	trans	-69.3	-35.7	176.9	172.5	0	0	0	0	111.7	T26 E27 E28 T33 R34	T26-V30 VanDerWaalsContact O-CG2 3.26Å; T26-V30 WeakPolarHBondContact O-CG2 3.48Å; T26-V30 PolarHBondContact O-N 3.45Å; E27-V30 PolarHBondContact O-N 3.32Å; E28-V30 VanDerWaalsContact C-N 3.3Å; E28-V30 PolarHBondContact O-N 2.99Å; V30-T33 WeakPolarHBondContact CA-OG1 3.43Å; V30-T33 PolarHBondContact O-OG1 3.48Å; V30-T33 VanDerWaalsContact O-OG1 3.05Å; V30-R34 VanDerWaalsContact O-CG 3.3Å; V30-R34 WeakPolarHBondContact O-CG 3.5Å; V30-R34 PolarHBondContact O-N 3.22Å
31	Q	82.9	Confident	80.4	Confident	119 Å²	119	103.5 Å²	103.5	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-68.3	-43.3	173.2	-76.3	-175	-6.2	0	0	112.1	E27 E28 R34 L35	E27-Q31 PolarHBondContact O-N 2.78Å; E28-Q31 PolarHBondContact O-N 3.33Å; Q31-R34 PolarHBondContact O-N 3.23Å; Q31-L35 WeakPolarHBondContact O-CG 3.41Å; Q31-L35 PolarHBondContact O-N 3.44Å
32	R	81.4	Confident	81.8	Confident	123 Å²	123	105.2 Å²	105.2	46%	0.464	52%	0.523	S	S	.	.	H	α-helix	trans	-67.1	-40.4	-178.5	-146.1	171.5	-171.1	-167.9	-0.7	112	E20 M24 E28 I29 L35 L36	E20-R32 IonicContact OE2-CZ 2.75Å; E20-R32 IonicContact OE2-NH1 2.65Å; E20-R32 PolarHBondContact OE2-NH1 2.97Å; M24-R32 PolarHBondContact SD-NH1 2.88Å; E28-R32 WeakPolarHBondContact O-CB 3.39Å; E28-R32 PolarHBondContact O-N 3.44Å; I29-R32 PolarHBondContact O-N 2.81Å; R32-L35 PolarHBondContact O-N 3.24Å; R32-L36 WeakPolarHBondContact O-CG 3.32Å; R32-L36 PolarHBondContact O-N 3.39Å
33	T	83.1	Confident	83.1	Confident	67 Å²	67	102.9 Å²	102.9	41%	0.411	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-40.4	173.3	45.6	0	0	0	0	112.1	I29 V30 L35 L36 D37	I29-T33 WeakPolarHBondContact O-CB 3.41Å; I29-T33 WeakPolarHBondContact O-CG2 3.49Å; I29-T33 PolarHBondContact O-N 2.91Å; I29-T33 PolarHBondContact O-OG1 3.13Å; V30-T33 WeakPolarHBondContact CA-OG1 3.43Å; V30-T33 PolarHBondContact O-OG1 3.48Å; V30-T33 VanDerWaalsContact O-OG1 3.05Å; T33-L35 PolarHBondContact O-N 3.36Å; T33-L36 PolarHBondContact O-N 2.64Å; T33-D37 WeakPolarHBondContact O-CB 3.48Å; T33-D37 PolarHBondContact O-N 3.41Å
34	R	85.3	Confident	84.3	Confident	177 Å²	177	102.8 Å²	102.8	67%	0.668	51%	0.509	S	S	*	.	H	α-helix	trans	-63.7	-38.5	173.9	-75.2	175.7	-178.8	176.5	3.2	113.2	V30 Q31 S38	V30-R34 VanDerWaalsContact O-CG 3.3Å; V30-R34 WeakPolarHBondContact O-CG 3.5Å; V30-R34 PolarHBondContact O-N 3.22Å; Q31-R34 PolarHBondContact O-N 3.23Å; R34-S38 WeakPolarHBondContact O-CB 3.29Å; R34-S38 PolarHBondContact O-N 3.36Å; R34-S38 VanDerWaalsContact O-N 3.08Å
35	L	87.1	Confident	85.4	Confident	110 Å²	110	103.7 Å²	103.7	58%	0.576	52%	0.52	S	S	*	.	H	α-helix	trans	-65.9	-46.8	175.6	-70.6	170.2	0	0	0	110.9	Q31 R32 T33 D37 S38 E39	Q31-L35 WeakPolarHBondContact O-CG 3.41Å; Q31-L35 PolarHBondContact O-N 3.44Å; R32-L35 PolarHBondContact O-N 3.24Å; T33-L35 PolarHBondContact O-N 3.36Å; L35-D37 PolarHBondContact O-N 3.08Å; L35-S38 WeakPolarHBondContact O-CB 3.25Å; L35-S38 PolarHBondContact O-N 2.86Å; L35-S38 VanDerWaalsContact O-N 3.13Å; L35-S38 PolarHBondContact O-OG 2.79Å; L35-E39 PolarHBondContact O-N 3.14Å
36	L	86	Confident	86.3	Confident	89 Å²	89	105.2 Å²	105.2	47%	0.466	52%	0.522	S	S	.	.	H	α-helix	trans	-62.6	-40.6	176.7	-70.8	169.6	0	0	0	112.3	R32 T33 S38 E39 I40	R32-L36 WeakPolarHBondContact O-CG 3.32Å; R32-L36 PolarHBondContact O-N 3.39Å; T33-L36 PolarHBondContact O-N 2.64Å; L36-S38 VanDerWaalsContact C-N 3.28Å; L36-S38 PolarHBondContact O-N 3.08Å; L36-E39 PolarHBondContact O-N 3.12Å; L36-I40 WeakPolarHBondContact O-CB 3.45Å; L36-I40 VanDerWaalsContact O-CG1 3.25Å; L36-I40 WeakPolarHBondContact O-CG1 3.46Å; L36-I40 PolarHBondContact O-N 3.06Å
37	D	87	Confident	87.2	Confident	105 Å²	105	104 Å²	104	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-62.7	-36.4	174.3	-86.4	-22.7	0	0	0	112.2	T33 L35 K41	T33-D37 WeakPolarHBondContact O-CB 3.48Å; T33-D37 PolarHBondContact O-N 3.41Å; L35-D37 PolarHBondContact O-N 3.08Å; D37-K41 PolarHBondContact O-N 3.35Å; D37-K41 VanDerWaalsContact O-N 3.13Å
38	S	88.9	Confident	87.9	Confident	54 Å²	54	102.6 Å²	102.6	38%	0.378	51%	0.51	S	S	.	.	H	α-helix	trans	-69	-41	175.2	77.4	0	0	0	0	111.7	R34 L35 L36 K41 I42	R34-S38 WeakPolarHBondContact O-CB 3.29Å; R34-S38 PolarHBondContact O-N 3.36Å; R34-S38 VanDerWaalsContact O-N 3.08Å; L35-S38 WeakPolarHBondContact O-CB 3.25Å; L35-S38 PolarHBondContact O-N 2.86Å; L35-S38 VanDerWaalsContact O-N 3.13Å; L35-S38 PolarHBondContact O-OG 2.79Å; L36-S38 VanDerWaalsContact C-N 3.28Å; L36-S38 PolarHBondContact O-N 3.08Å; S38-K41 PolarHBondContact O-N 3.29Å; S38-I42 WeakPolarHBondContact O-CG1 3.2Å; S38-I42 PolarHBondContact O-N 3.49Å; S38-I42 VanDerWaalsContact O-N 3.08Å
39	E	90.8	Very high	88.7	Confident	103 Å²	103	104.2 Å²	104.2	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-44	174.6	-87.5	-174.9	156.6	0	0	112.1	L35 L36 K41 I42 M43	L35-E39 PolarHBondContact O-N 3.14Å; L36-E39 PolarHBondContact O-N 3.12Å; E39-K41 VanDerWaalsContact C-N 3.27Å; E39-K41 PolarHBondContact O-N 3.31Å; E39-I42 PolarHBondContact O-N 3.32Å; E39-I42 VanDerWaalsContact O-N 3.14Å; E39-M43 HydrophobicContact CB-CE 3.89Å; E39-M43 WeakPolarHBondContact O-CB 3.42Å; E39-M43 WeakPolarHBondContact O-CG 3.42Å; E39-M43 PolarHBondContact O-N 3.02Å
40	I	90.8	Very high	89.4	Confident	99 Å²	99	105.3 Å²	105.3	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-60.8	-39.5	177.1	-71.5	167	0	0	0	110.5	L36 K44	L36-I40 WeakPolarHBondContact O-CB 3.45Å; L36-I40 VanDerWaalsContact O-CG1 3.25Å; L36-I40 WeakPolarHBondContact O-CG1 3.46Å; L36-I40 PolarHBondContact O-N 3.06Å; I40-K44 WeakPolarHBondContact O-CB 3.32Å; I40-K44 PolarHBondContact O-N 3.14Å
41	K	89.6	Confident	90	Very high	166 Å²	166	106 Å²	106	72%	0.722	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-43.8	174.5	-89.7	179.7	177.4	173.4	0	112.3	D37 S38 E39 S45	D37-K41 PolarHBondContact O-N 3.35Å; D37-K41 VanDerWaalsContact O-N 3.13Å; S38-K41 PolarHBondContact O-N 3.29Å; E39-K41 VanDerWaalsContact C-N 3.27Å; E39-K41 PolarHBondContact O-N 3.31Å; K41-S45 PolarHBondContact O-N 2.78Å
42	I	92.8	Very high	90.6	Very high	105 Å²	105	107 Å²	107	54%	0.538	53%	0.53	S	S	.	.	H	α-helix	trans	-64.3	-50.7	177.7	-66.3	164.7	0	0	0	109.7	S38 E39 K44 S45 E46	S38-I42 WeakPolarHBondContact O-CG1 3.2Å; S38-I42 PolarHBondContact O-N 3.49Å; S38-I42 VanDerWaalsContact O-N 3.08Å; E39-I42 PolarHBondContact O-N 3.32Å; E39-I42 VanDerWaalsContact O-N 3.14Å; I42-K44 VanDerWaalsContact C-N 3.33Å; I42-K44 PolarHBondContact O-N 3.18Å; I42-S45 WeakPolarHBondContact O-CB 3.34Å; I42-S45 PolarHBondContact O-N 2.69Å; I42-S45 VanDerWaalsContact O-N 3.08Å; I42-E46 HydrophobicContact CG2-CG 4.48Å; I42-E46 WeakPolarHBondContact O-CG 3.48Å; I42-E46 PolarHBondContact O-N 3.22Å
43	M	91.1	Very high	91.3	Very high	102 Å²	102	105.9 Å²	105.9	50%	0.502	53%	0.53	S	S	.	.	H	α-helix	trans	-57.7	-43.6	177.7	-76.3	-170.2	-101.6	0	0	112.1	E39 S45 E46 V47	E39-M43 HydrophobicContact CB-CE 3.89Å; E39-M43 WeakPolarHBondContact O-CB 3.42Å; E39-M43 WeakPolarHBondContact O-CG 3.42Å; E39-M43 PolarHBondContact O-N 3.02Å; M43-S45 VanDerWaalsContact C-N 3.31Å; M43-S45 PolarHBondContact O-N 2.86Å; M43-E46 PolarHBondContact O-N 2.89Å; M43-V47 WeakPolarHBondContact O-CB 3.37Å; M43-V47 VanDerWaalsContact O-CG2 3.27Å; M43-V47 WeakPolarHBondContact O-CG2 3.28Å; M43-V47 PolarHBondContact O-N 3.44Å
44	K	92.5	Very high	91.9	Very high	147 Å²	147	106.8 Å²	106.8	64%	0.639	53%	0.532	S	S	*	.	H	α-helix	trans	-63.1	-38.7	177.2	-169.6	175.6	-176.3	177.1	0	111.9	I40 I42 L48	I40-K44 WeakPolarHBondContact O-CB 3.32Å; I40-K44 PolarHBondContact O-N 3.14Å; I42-K44 VanDerWaalsContact C-N 3.33Å; I42-K44 PolarHBondContact O-N 3.18Å; K44-L48 HydrophobicContact CG-CD1 4.49Å; K44-L48 WeakPolarHBondContact O-CD1 3.27Å; K44-L48 WeakPolarHBondContact O-CG 3.29Å; K44-L48 PolarHBondContact O-N 3.34Å; K44-L48 VanDerWaalsContact O-N 3.12Å
45	S	93.1	Very high	92.4	Very high	78 Å²	78	102.9 Å²	102.9	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-40.8	174.3	-173.5	0	0	0	0	112.1	K41 I42 M43 L48 R49	K41-S45 PolarHBondContact O-N 2.78Å; I42-S45 WeakPolarHBondContact O-CB 3.34Å; I42-S45 PolarHBondContact O-N 2.69Å; I42-S45 VanDerWaalsContact O-N 3.08Å; M43-S45 VanDerWaalsContact C-N 3.31Å; M43-S45 PolarHBondContact O-N 2.86Å; S45-L48 PolarHBondContact O-N 3.16Å; S45-R49 PolarHBondContact O-N 2.88Å
46	E	94.3	Very high	92.8	Very high	89 Å²	89	99.5 Å²	99.5	42%	0.416	51%	0.509	S	S	.	.	H	α-helix	trans	-67.9	-42.5	177.6	-69.7	-148.2	123.4	0	0	112.2	I42 M43 L48 R49 V50	I42-E46 HydrophobicContact CG2-CG 4.48Å; I42-E46 WeakPolarHBondContact O-CG 3.48Å; I42-E46 PolarHBondContact O-N 3.22Å; M43-E46 PolarHBondContact O-N 2.89Å; E46-L48 VanDerWaalsContact C-N 3.28Å; E46-L48 PolarHBondContact O-N 2.99Å; E46-R49 PolarHBondContact O-N 3Å; E46-R49 VanDerWaalsContact O-N 3.16Å; E46-R49 IonicContact OE1-CZ 3.69Å; E46-R49 IonicContact OE1-NH1 3.83Å; E46-R49 IonicContact OE1-NH2 3.77Å; E46-R49 PolarHBondContact OE1-NH2 3.38Å; E46-V50 WeakPolarHBondContact O-CG2 3.48Å; E46-V50 PolarHBondContact O-N 2.62Å
47	V	94.5	Very high	93.2	Very high	92 Å²	92	101.2 Å²	101.2	56%	0.558	52%	0.516	S	S	*	.	H	α-helix	trans	-58.2	-44.2	175	169.6	0	0	0	0	110.3	M43 T51	M43-V47 WeakPolarHBondContact O-CB 3.37Å; M43-V47 VanDerWaalsContact O-CG2 3.27Å; M43-V47 WeakPolarHBondContact O-CG2 3.28Å; M43-V47 PolarHBondContact O-N 3.44Å; V47-T51 VanDerWaalsContact O-CB 3.28Å; V47-T51 WeakPolarHBondContact O-CB 3.36Å; V47-T51 PolarHBondContact O-N 2.9Å; V47-T51 PolarHBondContact O-OG1 3.24Å
48	L	93.8	Very high	93.6	Very high	113 Å²	113	102 Å²	102	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-43.4	176	-75.7	164	0	0	0	112.2	K44 S45 E46 T51 H52	K44-L48 HydrophobicContact CG-CD1 4.49Å; K44-L48 WeakPolarHBondContact O-CD1 3.27Å; K44-L48 WeakPolarHBondContact O-CG 3.29Å; K44-L48 PolarHBondContact O-N 3.34Å; K44-L48 VanDerWaalsContact O-N 3.12Å; S45-L48 PolarHBondContact O-N 3.16Å; E46-L48 VanDerWaalsContact C-N 3.28Å; E46-L48 PolarHBondContact O-N 2.99Å; L48-T51 PolarHBondContact O-N 3.47Å; L48-H52 WeakPolarHBondContact O-CB 3.48Å; L48-H52 PolarHBondContact O-N 2.83Å
49	R	95.1	Very high	93.9	Very high	130 Å²	130	103.5 Å²	103.5	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-59.3	-52.9	176.5	-176	-178.5	72.2	-143.1	-6.8	111.3	S45 E46 T51 H52 E53	S45-R49 PolarHBondContact O-N 2.88Å; E46-R49 PolarHBondContact O-N 3Å; E46-R49 VanDerWaalsContact O-N 3.16Å; E46-R49 IonicContact OE1-CZ 3.69Å; E46-R49 IonicContact OE1-NH1 3.83Å; E46-R49 IonicContact OE1-NH2 3.77Å; E46-R49 PolarHBondContact OE1-NH2 3.38Å; R49-T51 VanDerWaalsContact C-N 3.3Å; R49-T51 PolarHBondContact O-N 3.2Å; R49-H52 PolarHBondContact O-N 3.41Å; R49-E53 WeakPolarHBondContact O-CG 3.2Å; R49-E53 PolarHBondContact O-N 3.34Å
50	V	95.3	Very high	94.2	Very high	74 Å²	74	105.2 Å²	105.2	45%	0.448	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-39.5	-179.7	174.2	0	0	0	0	110.9	E46 H52 E53 L54	E46-V50 WeakPolarHBondContact O-CG2 3.48Å; E46-V50 PolarHBondContact O-N 2.62Å; V50-H52 VanDerWaalsContact C-N 3.34Å; V50-H52 PolarHBondContact O-N 3.39Å; V50-E53 PolarHBondContact O-N 2.98Å; V50-L54 WeakPolarHBondContact O-CB 3.43Å; V50-L54 PolarHBondContact O-N 3.5Å
51	T	95.5	Very high	94.3	Very high	83 Å²	83	105.5 Å²	105.5	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-63.8	-41.8	177.8	-54.4	0	0	0	0	111.2	V47 L48 R49 L54 Q55	V47-T51 VanDerWaalsContact O-CB 3.28Å; V47-T51 WeakPolarHBondContact O-CB 3.36Å; V47-T51 PolarHBondContact O-N 2.9Å; V47-T51 PolarHBondContact O-OG1 3.24Å; L48-T51 PolarHBondContact O-N 3.47Å; R49-T51 VanDerWaalsContact C-N 3.3Å; R49-T51 PolarHBondContact O-N 3.2Å; T51-L54 PolarHBondContact O-N 2.87Å; T51-Q55 WeakPolarHBondContact O-CB 3.48Å; T51-Q55 PolarHBondContact O-N 3.39Å
52	H	95.6	Very high	94.6	Very high	142 Å²	142	103.6 Å²	103.6	66%	0.657	52%	0.518	S	S	*	.	H	α-helix	trans	-67.4	-42.9	176.9	-173.6	-82.5	0	0	0	112.1	L48 R49 V50 L54 Q55 A56	L48-H52 WeakPolarHBondContact O-CB 3.48Å; L48-H52 PolarHBondContact O-N 2.83Å; R49-H52 PolarHBondContact O-N 3.41Å; V50-H52 VanDerWaalsContact C-N 3.34Å; V50-H52 PolarHBondContact O-N 3.39Å; H52-L54 VanDerWaalsContact C-N 3.35Å; H52-L54 PolarHBondContact O-N 2.88Å; H52-Q55 PolarHBondContact O-N 2.93Å; H52-A56 WeakPolarHBondContact O-CB 3.43Å; H52-A56 PolarHBondContact O-N 3.47Å
53	E	95.7	Very high	94.7	Very high	98 Å²	98	103.3 Å²	103.3	46%	0.458	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-43.7	175	-74.6	174.4	-173.8	0	0	111.9	R49 V50 Q55 A56 M57	R49-E53 WeakPolarHBondContact O-CG 3.2Å; R49-E53 PolarHBondContact O-N 3.34Å; V50-E53 PolarHBondContact O-N 2.98Å; E53-Q55 VanDerWaalsContact C-N 3.33Å; E53-Q55 PolarHBondContact O-N 2.91Å; E53-A56 PolarHBondContact O-N 3Å; E53-M57 WeakPolarHBondContact O-CG 3.39Å; E53-M57 PolarHBondContact O-N 3.5Å
54	L	95.4	Very high	94.7	Very high	87 Å²	87	102.6 Å²	102.6	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-40.7	178.1	-170.5	151.2	0	0	0	111.3	V50 T51 H52 K58	V50-L54 WeakPolarHBondContact O-CB 3.43Å; V50-L54 PolarHBondContact O-N 3.5Å; T51-L54 PolarHBondContact O-N 2.87Å; H52-L54 VanDerWaalsContact C-N 3.35Å; H52-L54 PolarHBondContact O-N 2.88Å; L54-K58 HydrophobicContact CD2-CD 3.81Å; L54-K58 VanDerWaalsContact CD2-CE 3.41Å; L54-K58 HydrophobicContact CD2-CG 4.37Å; L54-K58 WeakPolarHBondContact O-CG 3.42Å; L54-K58 PolarHBondContact O-N 3.31Å
55	Q	95.3	Very high	94.6	Very high	94 Å²	94	99.1 Å²	99.1	44%	0.439	50%	0.503	S	S	.	.	H	α-helix	trans	-65.2	-46.6	175.2	-172.5	59.2	31.4	0	0	111.4	T51 H52 E53 M57 K58 D59	T51-Q55 WeakPolarHBondContact O-CB 3.48Å; T51-Q55 PolarHBondContact O-N 3.39Å; H52-Q55 PolarHBondContact O-N 2.93Å; E53-Q55 VanDerWaalsContact C-N 3.33Å; E53-Q55 PolarHBondContact O-N 2.91Å; Q55-M57 VanDerWaalsContact C-N 3.32Å; Q55-M57 PolarHBondContact O-N 3.47Å; Q55-K58 WeakPolarHBondContact O-CB 3.44Å; Q55-K58 PolarHBondContact O-N 3.28Å; Q55-K58 VanDerWaalsContact O-N 3.14Å; Q55-D59 PolarHBondContact NE2-OD1 3.34Å; Q55-D59 PolarHBondContact NE2-OD2 3.16Å; Q55-D59 PolarHBondContact O-N 2.98Å
56	A	96	Very high	94.5	Very high	39 Å²	39	100.8 Å²	100.8	32%	0.322	50%	0.502	S	S	.	.	H	α-helix	trans	-61.4	-39	177.6	0	0	0	0	0	112.5	H52 E53 K60	H52-A56 WeakPolarHBondContact O-CB 3.43Å; H52-A56 PolarHBondContact O-N 3.47Å; E53-A56 PolarHBondContact O-N 3Å; A56-K60 WeakPolarHBondContact O-CG 3.48Å; A56-K60 PolarHBondContact O-N 3.14Å; A56-K60 VanDerWaalsContact O-N 3.16Å
57	M	95.1	Very high	94.2	Very high	126 Å²	126	101.9 Å²	101.9	62%	0.621	51%	0.506	S	S	*	.	H	α-helix	trans	-66.7	-40.8	174.1	-73.6	-164.1	-170.8	0	0	112	E53 Q55 D59 K60 I61	E53-M57 WeakPolarHBondContact O-CG 3.39Å; E53-M57 PolarHBondContact O-N 3.5Å; Q55-M57 VanDerWaalsContact C-N 3.32Å; Q55-M57 PolarHBondContact O-N 3.47Å; M57-D59 VanDerWaalsContact C-N 3.33Å; M57-D59 PolarHBondContact O-N 2.93Å; M57-K60 PolarHBondContact O-N 3.37Å; M57-I61 VanDerWaalsContact O-CG1 3.27Å; M57-I61 WeakPolarHBondContact O-CG1 3.27Å; M57-I61 PolarHBondContact O-N 3.46Å
58	K	95.6	Very high	93.8	Very high	120 Å²	120	100.9 Å²	100.9	52%	0.522	50%	0.496	S	S	.	.	H	α-helix	trans	-60.3	-43.3	175.9	-81.9	179.3	175.5	173	0	112.2	L54 Q55 I61 K62	L54-K58 HydrophobicContact CD2-CD 3.81Å; L54-K58 VanDerWaalsContact CD2-CE 3.41Å; L54-K58 HydrophobicContact CD2-CG 4.37Å; L54-K58 WeakPolarHBondContact O-CG 3.42Å; L54-K58 PolarHBondContact O-N 3.31Å; Q55-K58 WeakPolarHBondContact O-CB 3.44Å; Q55-K58 PolarHBondContact O-N 3.28Å; Q55-K58 VanDerWaalsContact O-N 3.14Å; K58-I61 PolarHBondContact O-N 2.92Å; K58-K62 WeakPolarHBondContact O-CB 3.39Å; K58-K62 PolarHBondContact O-N 3.29Å
59	D	94.9	Very high	93.5	Very high	86 Å²	86	103 Å²	103	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-41	179.9	-66.1	-28.2	0	0	0	111.1	Q55 M57 K62 E63	Q55-D59 PolarHBondContact NE2-OD1 3.34Å; Q55-D59 PolarHBondContact NE2-OD2 3.16Å; Q55-D59 PolarHBondContact O-N 2.98Å; M57-D59 VanDerWaalsContact C-N 3.33Å; M57-D59 PolarHBondContact O-N 2.93Å; D59-K62 PolarHBondContact O-N 3.22Å; D59-E63 PolarHBondContact O-N 3.27Å
60	K	95.5	Very high	93	Very high	139 Å²	139	101.4 Å²	101.4	60%	0.604	51%	0.506	S	S	*	.	H	α-helix	trans	-62.4	-42.2	172.9	-72.8	179.3	-178.7	-177.6	0	112.9	A56 M57 K62 E63 N64	A56-K60 WeakPolarHBondContact O-CG 3.48Å; A56-K60 PolarHBondContact O-N 3.14Å; A56-K60 VanDerWaalsContact O-N 3.16Å; M57-K60 PolarHBondContact O-N 3.37Å; K60-K62 VanDerWaalsContact C-N 3.32Å; K60-E63 PolarHBondContact O-N 2.98Å; K60-N64 WeakPolarHBondContact O-CB 3.41Å; K60-N64 VanDerWaalsContact O-CG 3.28Å; K60-N64 PolarHBondContact O-N 2.72Å; K60-N64 PolarHBondContact O-ND2 3.03Å
61	I	94.9	Very high	92.2	Very high	106 Å²	106	102.7 Å²	102.7	54%	0.544	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-45.7	176.2	-70.1	165.1	0	0	0	109.5	M57 K58 E63 N64 T65	M57-I61 VanDerWaalsContact O-CG1 3.27Å; M57-I61 WeakPolarHBondContact O-CG1 3.27Å; M57-I61 PolarHBondContact O-N 3.46Å; K58-I61 PolarHBondContact O-N 2.92Å; I61-E63 PolarHBondContact O-N 3.42Å; I61-N64 PolarHBondContact O-N 2.66Å; I61-T65 HydrophobicContact CG2-CG2 4.27Å; I61-T65 WeakPolarHBondContact O-CG2 3.47Å; I61-T65 PolarHBondContact O-N 2.86Å; I61-T65 PolarHBondContact O-OG1 3.08Å
62	K	95.1	Very high	91.6	Very high	126 Å²	126	102.3 Å²	102.3	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-59.6	-48.8	179	-169.4	-178.3	176.3	-171.7	0	111.5	K58 D59 K60 N64 T65 E66	K58-K62 WeakPolarHBondContact O-CB 3.39Å; K58-K62 PolarHBondContact O-N 3.29Å; D59-K62 PolarHBondContact O-N 3.22Å; K60-K62 VanDerWaalsContact C-N 3.32Å; K62-N64 VanDerWaalsContact C-N 3.34Å; K62-N64 PolarHBondContact O-N 3.41Å; K62-T65 WeakPolarHBondContact CA-OG1 3.41Å; K62-T65 PolarHBondContact O-N 3.45Å; K62-T65 PolarHBondContact O-OG1 2.95Å; K62-E66 PolarHBondContact O-N 3.49Å
63	E	94.4	Very high	91	Very high	99 Å²	99	99.9 Å²	99.9	46%	0.463	50%	0.496	S	S	.	.	H	α-helix	trans	-58.7	-44.6	177.1	-167.2	-168.1	151.5	0	0	112.1	D59 K60 I61 E66 K67	D59-E63 PolarHBondContact O-N 3.27Å; K60-E63 PolarHBondContact O-N 2.98Å; I61-E63 PolarHBondContact O-N 3.42Å; E63-E66 PolarHBondContact O-N 3.17Å; E63-K67 WeakPolarHBondContact O-CG 3.45Å; E63-K67 PolarHBondContact O-N 2.93Å; E63-K67 VanDerWaalsContact O-N 3.08Å; E63-K67 WeakPolarHBondContact OE1-CE 3.43Å; E63-K67 IonicContact OE1-NZ 3.96Å; E63-K67 PolarHBondContact OE1-NZ 2.92Å
64	N	91.1	Very high	90.4	Very high	87 Å²	87	102 Å²	102	47%	0.465	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-40.2	177.5	-73.5	-18.6	0	0	0	112.2	K60 I61 K62 E66 K67 I68	K60-N64 WeakPolarHBondContact O-CB 3.41Å; K60-N64 VanDerWaalsContact O-CG 3.28Å; K60-N64 PolarHBondContact O-N 2.72Å; K60-N64 PolarHBondContact O-ND2 3.03Å; I61-N64 PolarHBondContact O-N 2.66Å; K62-N64 VanDerWaalsContact C-N 3.34Å; K62-N64 PolarHBondContact O-N 3.41Å; N64-E66 VanDerWaalsContact C-N 3.32Å; N64-E66 PolarHBondContact O-N 3.04Å; N64-K67 PolarHBondContact O-N 3.47Å; N64-I68 VanDerWaalsContact O-CG1 3.3Å; N64-I68 WeakPolarHBondContact O-CG1 3.33Å; N64-I68 PolarHBondContact O-N 3.19Å
65	T	91.2	Very high	90	Very high	74 Å²	74	101.8 Å²	101.8	45%	0.454	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-35.7	177.2	54.6	0	0	0	0	112.5	I61 K62 I68 K69	I61-T65 HydrophobicContact CG2-CG2 4.27Å; I61-T65 WeakPolarHBondContact O-CG2 3.47Å; I61-T65 PolarHBondContact O-N 2.86Å; I61-T65 PolarHBondContact O-OG1 3.08Å; K62-T65 WeakPolarHBondContact CA-OG1 3.41Å; K62-T65 PolarHBondContact O-N 3.45Å; K62-T65 PolarHBondContact O-OG1 2.95Å; T65-I68 PolarHBondContact O-N 3.28Å; T65-K69 WeakPolarHBondContact O-CB 3.3Å; T65-K69 PolarHBondContact O-N 3.31Å
66	E	90.3	Very high	89.7	Confident	112 Å²	112	99.6 Å²	99.6	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-66	-44.2	174.1	-74.1	178.6	-176.5	0	0	111.2	K62 E63 N64 I68 K69 V70	K62-E66 PolarHBondContact O-N 3.49Å; E63-E66 PolarHBondContact O-N 3.17Å; N64-E66 VanDerWaalsContact C-N 3.32Å; N64-E66 PolarHBondContact O-N 3.04Å; E66-I68 PolarHBondContact O-N 3.46Å; E66-K69 WeakPolarHBondContact O-CB 3.32Å; E66-K69 PolarHBondContact O-N 3.46Å; E66-K69 VanDerWaalsContact O-N 3.17Å; E66-V70 WeakPolarHBondContact O-CG2 3.35Å; E66-V70 PolarHBondContact O-N 3.36Å
67	K	87.1	Confident	89.4	Confident	113 Å²	113	99.3 Å²	99.3	49%	0.491	50%	0.495	S	S	.	.	H	α-helix	trans	-59	-44.9	174.1	-73.4	170.2	172	167.8	0	112.3	E63 N64 K69 V70 N71	E63-K67 WeakPolarHBondContact O-CG 3.45Å; E63-K67 PolarHBondContact O-N 2.93Å; E63-K67 VanDerWaalsContact O-N 3.08Å; E63-K67 WeakPolarHBondContact OE1-CE 3.43Å; E63-K67 IonicContact OE1-NZ 3.96Å; E63-K67 PolarHBondContact OE1-NZ 2.92Å; N64-K67 PolarHBondContact O-N 3.47Å; K67-K69 VanDerWaalsContact C-N 3.32Å; K67-K69 PolarHBondContact O-N 3.44Å; K67-V70 PolarHBondContact O-N 3.43Å; K67-N71 PolarHBondContact O-N 3.32Å
68	I	86.9	Confident	89.3	Confident	70 Å²	70	95.9 Å²	95.9	36%	0.359	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-41.1	176	-68.2	166.4	0	0	0	110.5	N64 T65 E66 V70 N71 K72 L127	N64-I68 VanDerWaalsContact O-CG1 3.3Å; N64-I68 WeakPolarHBondContact O-CG1 3.33Å; N64-I68 PolarHBondContact O-N 3.19Å; T65-I68 PolarHBondContact O-N 3.28Å; E66-I68 PolarHBondContact O-N 3.46Å; I68-V70 VanDerWaalsContact C-N 3.34Å; I68-V70 PolarHBondContact O-N 3.46Å; I68-N71 CarbonylContact O-C 3.57Å; I68-N71 PolarHBondContact O-N 2.79Å; I68-K72 WeakPolarHBondContact O-CB 3.46Å; I68-K72 PolarHBondContact O-N 3.18Å; I68-L127 HydrophobicContact CD1-CD2 4.18Å; I68-L127 HydrophobicContact CG1-CD2 4.34Å; I68-L127 HydrophobicContact CG2-CD1 4.15Å; I68-L127 HydrophobicContact CG2-CD2 3.93Å
69	K	87.3	Confident	89.2	Confident	157 Å²	157	90.2 Å²	90.2	68%	0.683	46%	0.457	S	S	*	.	H	α-helix	trans	-63.8	-38.1	-179.9	-171.1	178.6	180	-178	0	112.6	T65 E66 K67 N71 K72 T73	T65-K69 WeakPolarHBondContact O-CB 3.3Å; T65-K69 PolarHBondContact O-N 3.31Å; E66-K69 WeakPolarHBondContact O-CB 3.32Å; E66-K69 PolarHBondContact O-N 3.46Å; E66-K69 VanDerWaalsContact O-N 3.17Å; K67-K69 VanDerWaalsContact C-N 3.32Å; K67-K69 PolarHBondContact O-N 3.44Å; K69-N71 VanDerWaalsContact C-N 3.33Å; K69-K72 CarbonylContact O-C 3.34Å; K69-K72 PolarHBondContact O-N 2.98Å; K69-T73 PolarHBondContact O-N 3.22Å
70	V	84.3	Confident	89	Confident	98 Å²	98	89.6 Å²	89.6	59%	0.594	45%	0.453	S	S	*	.	H	α-helix	trans	-64.1	-40.1	174.3	174.5	0	0	0	0	110.8	E66 K67 I68 K72 T73	E66-V70 WeakPolarHBondContact O-CG2 3.35Å; E66-V70 PolarHBondContact O-N 3.36Å; K67-V70 PolarHBondContact O-N 3.43Å; I68-V70 VanDerWaalsContact C-N 3.34Å; I68-V70 PolarHBondContact O-N 3.46Å; V70-K72 VanDerWaalsContact C-N 3.34Å; V70-T73 WeakPolarHBondContact O-CG2 3.04Å; V70-T73 PolarHBondContact O-N 3.39Å; V70-T73 PolarHBondContact O-OG1 2.94Å
71	N	79.6	Confident	88.9	Confident	101 Å²	101	83 Å²	83	54%	0.54	43%	0.425	S	S	.	.	H	α-helix	trans	-74.2	-26.2	175.4	-71.6	-18.9	0	0	0	113	K67 I68 K69 T73	K67-N71 PolarHBondContact O-N 3.32Å; I68-N71 CarbonylContact O-C 3.57Å; I68-N71 PolarHBondContact O-N 2.79Å; K69-N71 VanDerWaalsContact C-N 3.33Å; N71-T73 PolarHBondContact O-N 2.9Å
72	K	82.3	Confident	88.7	Confident	75 Å²	75	81.5 Å²	81.5	33%	0.326	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	29	172.9	-164.1	169.9	178.5	-178.2	0	110.9	I68 K69 V70 Y76 E150	I68-K72 WeakPolarHBondContact O-CB 3.46Å; I68-K72 PolarHBondContact O-N 3.18Å; K69-K72 CarbonylContact O-C 3.34Å; K69-K72 PolarHBondContact O-N 2.98Å; V70-K72 VanDerWaalsContact C-N 3.34Å; K72-Y76 HydrophobicContact CG-CE1 4.44Å; K72-Y76 WeakPolarHBondContact CG-OH 3.26Å; K72-Y76 PolarHBondContact O-OH 2.52Å; K72-E150 WeakPolarHBondContact CE-OE2 3.32Å; K72-E150 IonicContact NZ-OE1 2.99Å; K72-E150 PolarHBondContact NZ-OE1 3.39Å; K72-E150 IonicContact NZ-OE2 3.66Å; K72-E150 PolarHBondContact NZ-OE2 3.27Å
73	T	82.2	Confident	88.5	Confident	90 Å²	90	80.3 Å²	80.3	55%	0.552	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-82	136.7	169.1	52.8	0	0	0	0	111	K69 V70 N71 Y76	K69-T73 PolarHBondContact O-N 3.22Å; V70-T73 WeakPolarHBondContact O-CG2 3.04Å; V70-T73 PolarHBondContact O-N 3.39Å; V70-T73 PolarHBondContact O-OG1 2.94Å; N71-T73 PolarHBondContact O-N 2.9Å; T73-Y76 VanDerWaalsContact O-CE1 3.26Å; T73-Y76 WeakPolarHBondContact O-CE1 3.04Å
74	L	83.8	Confident	88.2	Confident	142 Å²	142	77.7 Å²	77.7	74%	0.743	40%	0.402	S	S	*	.	S	Bend	trans	-58.8	144.9	167	-69.5	167	0	0	0	109.5	Y76	L74-Y76 HydrophobicContact CD2-CD2 3.77Å; L74-Y76 HydrophobicContact CD2-CE2 3.59Å; L74-Y76 HydrophobicContact CD2-CG 4.46Å; L74-Y76 HydrophobicContact CG-CE2 4.37Å
75	P	87.5	Confident	87.9	Confident	84 Å²	84	76.4 Å²	76.4	55%	0.545	40%	0.395	S	S	.	.	P	Polyproline II helix	cis	-98.5	138.6	12.6	34.1	-33.8	0	0	0	115.5	K143	P75-K143 HydrophobicContact CG-CD 4.46Å; P75-K143 VanDerWaalsContact CG-NZ 3.26Å; P75-K143 WeakPolarHBondContact O-CE 3.28Å
76	Y	88.4	Confident	87.5	Confident	47 Å²	47	78.2 Å²	78.2	18%	0.184	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-93.6	159.2	169	-41.6	-52.5	0	0	0	112.1	K72 T73 L74 L149	K72-Y76 HydrophobicContact CG-CE1 4.44Å; K72-Y76 WeakPolarHBondContact CG-OH 3.26Å; K72-Y76 PolarHBondContact O-OH 2.52Å; T73-Y76 VanDerWaalsContact O-CE1 3.26Å; T73-Y76 WeakPolarHBondContact O-CE1 3.04Å; L74-Y76 HydrophobicContact CD2-CD2 3.77Å; L74-Y76 HydrophobicContact CD2-CE2 3.59Å; L74-Y76 HydrophobicContact CD2-CG 4.46Å; L74-Y76 HydrophobicContact CG-CE2 4.37Å; Y76-L149 HydrophobicContact CD1-CD1 3.29Å; Y76-L149 HydrophobicContact CE1-CD1 3.43Å; Y76-L149 VanDerWaalsContact CE1-CD1 3.43Å; Y76-L149 HydrophobicContact CG-CD1 4.14Å
77	L	90.2	Very high	86.6	Confident	33 Å²	33	76 Å²	76	17%	0.173	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.8	167	-176.5	61.5	0	0	0	109.2	T114 V141 K143 Y146	L77-T114 HydrophobicContact CD2-CG2 3.67Å; L77-V141 PolarHBondContact N-O 2.74Å; L77-V141 WeakPolarHBondContact O-CA 3.49Å; L77-V141 WeakPolarHBondContact O-CB 3.43Å; L77-V141 PolarHBondContact O-N 2.88Å; L77-K143 HydrophobicContact CB-CG 4.2Å; L77-Y146 HydrophobicContact CD2-CE1 4.12Å
78	V	92.4	Very high	85.6	Confident	55 Å²	55	75.5 Å²	75.5	33%	0.333	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	137.1	175.5	-176.9	0	0	0	0	109.4	S115 L138 L152	V78-S115 PolarHBondContact O-N 2.77Å; V78-S115 PolarHBondContact O-OG 3.06Å; V78-L138 HydrophobicContact CG1-CD2 3.58Å; V78-L152 HydrophobicContact CG1-CD1 4.04Å; V78-L152 HydrophobicContact CG2-CD1 3.95Å
79	S	92.7	Very high	84.4	Confident	1 Å²	1	74.5 Å²	74.5	1%	0.007	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	157.8	177.4	-56.2	0	0	0	0	110.8	K113 T114 V139 V141	S79-K113 CarbonylContact C-O 3.59Å; S79-K113 VanDerWaalsContact CA-O 3.28Å; S79-K113 WeakPolarHBondContact CA-O 3.29Å; S79-K113 WeakPolarHBondContact CB-O 3.21Å; S79-T114 WeakPolarHBondContact OG-CA 3.45Å; S79-V139 PolarHBondContact N-O 3.25Å; S79-V139 WeakPolarHBondContact O-CG2 3.39Å; S79-V139 PolarHBondContact O-N 3.12Å; S79-V141 WeakPolarHBondContact OG-CG2 3.34Å
80	N	92.7	Very high	83	Confident	73 Å²	73	74.1 Å²	74.1	39%	0.39	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.6	171.8	-68.3	-8.4	0	0	0	109.8	I82 I112 K113 D137 L138	N80-I82 PolarHBondContact O-N 2.71Å; N80-I112 CarbonylContact O-C 3.54Å; N80-I112 WeakPolarHBondContact O-CA 3.39Å; N80-K113 PolarHBondContact N-O 3.09Å; N80-K113 PolarHBondContact O-N 3.36Å; N80-D137 WeakPolarHBondContact CA-O 3.21Å; N80-L138 WeakPolarHBondContact OD1-CD2 3.44Å; N80-L138 WeakPolarHBondContact OD1-CG 3.19Å
81	V	92.2	Very high	81.6	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.006	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	121	169.1	-176.9	0	0	0	0	108.1	L84 I112 L133 G136 D137 V139	V81-L84 HydrophobicContact CG1-CG 4.42Å; V81-I112 HydrophobicContact CG2-CG2 4.41Å; V81-L133 HydrophobicContact CG2-CD2 4.36Å; V81-G136 WeakPolarHBondContact O-CA 2.82Å; V81-G136 PolarHBondContact O-N 2.62Å; V81-D137 PolarHBondContact N-O 3.26Å; V81-V139 HydrophobicContact CG2-CG1 3.85Å; V81-V139 HydrophobicContact CG2-CG2 3.89Å
82	I	91.5	Very high	80.2	Confident	73 Å²	73	79.9 Å²	79.9	37%	0.374	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-53.1	176.9	-60.1	166.8	0	0	0	109.3	N80 V111 K113 T119 P135	N80-I82 PolarHBondContact O-N 2.71Å; I82-V111 HydrophobicContact CB-CB 4.48Å; I82-V111 HydrophobicContact CB-CG1 4.36Å; I82-V111 HydrophobicContact CD1-CG1 3.91Å; I82-V111 PolarHBondContact N-O 2.88Å; I82-K113 HydrophobicContact CD1-CB 3.63Å; I82-K113 HydrophobicContact CD1-CD 4.41Å; I82-K113 HydrophobicContact CD1-CG 4.47Å; I82-K113 HydrophobicContact CG1-CB 3.87Å; I82-T119 HydrophobicContact CD1-CG2 3.85Å; I82-P135 WeakPolarHBondContact O-CB 3.22Å
83	E	90.3	Very high	78.7	Confident	102 Å²	102	85.1 Å²	85.1	48%	0.477	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	149.9	-170.8	-166.9	170.2	-170.5	0	0	110.2	L85 V111	E83-L85 HydrophobicContact CG-CD2 4.19Å; E83-L85 HydrophobicContact CG-CG 4.45Å; E83-V111 PolarHBondContact O-N 2.97Å
84	L	88.1	Confident	77.4	Confident	43 Å²	43	89.8 Å²	89.8	23%	0.225	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.8	170.9	-68.6	162.3	0	0	0	106.9	V81 C109 A110 I125 L133	V81-L84 HydrophobicContact CG1-CG 4.42Å; L84-C109 CarbonylContact C-O 3.5Å; L84-C109 WeakPolarHBondContact CA-O 3.45Å; L84-A110 HydrophobicContact CD2-CB 3.98Å; L84-I125 HydrophobicContact CD2-CD1 4.38Å; L84-L133 HydrophobicContact CD1-CB 4.08Å; L84-L133 WeakPolarHBondContact CD1-O 3.37Å; L84-L133 HydrophobicContact CD2-CB 4.38Å
85	L	85.3	Confident	75.6	Confident	60 Å²	60	90.4 Å²	90.4	31%	0.314	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.5	-176.8	-65.8	168.1	0	0	0	108.4	E83 V87 C109 V111 F121	E83-L85 HydrophobicContact CG-CD2 4.19Å; E83-L85 HydrophobicContact CG-CG 4.45Å; L85-V87 HydrophobicContact CB-CG2 4.49Å; L85-C109 HydrophobicContact CB-CB 4.33Å; L85-C109 PolarHBondContact N-O 3.27Å; L85-C109 WeakPolarHBondContact O-CB 3.45Å; L85-C109 PolarHBondContact O-N 2.79Å; L85-V111 HydrophobicContact CD1-CG2 3.68Å; L85-V111 HydrophobicContact CG-CG2 4.46Å; L85-F121 HydrophobicContact CD1-CE2 4.17Å
86	D	81.8	Confident	73.9	Confident	113 Å²	113	90.5 Å²	90.5	60%	0.604	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	108	168.5	-64.8	-28.3	0	0	0	106.7	K108	D86-K108 VanDerWaalsContact OD1-CG 3.23Å; D86-K108 WeakPolarHBondContact OD1-CG 3.27Å
87	V	70.9	Confident	72.4	Confident	65 Å²	65	92.1 Å²	92.1	39%	0.394	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.1	178.7	-178.2	0	0	0	0	108.3	L85 C109 F121	L85-V87 HydrophobicContact CB-CG2 4.49Å; V87-C109 HydrophobicContact CG2-CB 4.21Å; V87-F121 HydrophobicContact CG2-CZ 4.43Å
88	D	67.3	Low	71	Confident	102 Å²	102	98.8 Å²	98.8	55%	0.545	55%	0.545	S	S	.	.			trans	-85.5	131.9	169.9	-83.3	-44.6	0	0	0	109.8	N90	D88-N90 PolarHBondContact O-N 3.45Å
89	P	62.2	Low	69.2	Low	49 Å²	49	100.4 Å²	100.4	32%	0.318	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-62.6	-2.2	-177.3	-23.5	31.4	0	0	0	116.1	K106	P89-K106 HydrophobicContact CG-CG 3.78Å
90	N	57.1	Low	67.5	Low	150 Å²	150	106.4 Å²	106.4	80%	0.802	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-86.3	-6.3	-171.8	-99.1	20.2	0	0	0	114.4	D88	D88-N90 PolarHBondContact O-N 3.45Å
91	D	55.3	Low	65.8	Low	151 Å²	151	109.5 Å²	109.5	81%	0.807	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-93	1.7	-176.5	-74.8	-16.5	0	0	0	114.2
92	Q	50.8	Low	63.9	Low	169 Å²	169	112.9 Å²	112.9	79%	0.79	62%	0.62	S	S	*	*			trans	-118.2	90.1	173.9	-66.8	-174	1.9	0	0	109.9
93	E	50.3	Low	62	Low	185 Å²	185	112.3 Å²	112.3	86%	0.864	62%	0.623	S	S	*	*			trans	-59	137.8	166	-71.3	-175.9	155.7	0	0	110.8
94	E	54.5	Low	60.2	Low	187 Å²	187	113.7 Å²	113.7	87%	0.874	63%	0.629	S	S	*	*			trans	24.4	97.4	154.6	-63	-171.9	157.7	0	0	117.8
95	D	45.5	Very low	58.7	Low	155 Å²	155	118.9 Å²	118.9	83%	0.829	65%	0.646	S	S	*	*			trans	-139.8	122.7	144.6	-106.4	-28.4	0	0	0	112.3	A97	D95-A97 PolarHBondContact O-N 2.86Å; D95-A97 VanDerWaalsContact O-N 3.13Å
96	G	51.9	Low	57.5	Low	86 Å²	86	123.9 Å²	123.9	89%	0.887	67%	0.665	S	S	*	*			trans	-76.6	92.5	-173.6	0	0	0	0	0	112.8
97	A	58	Low	56.8	Low	81 Å²	81	119.9 Å²	119.9	67%	0.669	65%	0.651	S	S	*	*	S	Bend	trans	-167.9	127.1	148.1	0	0	0	0	0	106.8	D95 V99	D95-A97 PolarHBondContact O-N 2.86Å; D95-A97 VanDerWaalsContact O-N 3.13Å; A97-V99 PolarHBondContact O-N 3.38Å
98	N	60.1	Low	57.2	Low	173 Å²	173	121.3 Å²	121.3	93%	0.925	65%	0.651	S	S	*	*			trans	-17.5	91.1	180	-77.3	-20.7	0	0	0	114.2
99	V	54.9	Low	58	Low	89 Å²	89	116.9 Å²	116.9	54%	0.539	63%	0.628	S	S	.	*			trans	-76.2	127	176.6	-146.9	0	0	0	0	106.8	A97 S103	A97-V99 PolarHBondContact O-N 3.38Å; V99-S103 VanDerWaalsContact CG1-OG 3.27Å; V99-S103 WeakPolarHBondContact CG1-OG 3.49Å
100	D	57.4	Low	59.3	Low	128 Å²	128	114.5 Å²	114.5	68%	0.684	61%	0.613	S	S	*	*			trans	-49.7	145.4	-177.5	-79.6	-45.2	0	0	0	111.7	D102 S103	D100-D102 PolarHBondContact O-N 3.13Å; D100-S103 WeakPolarHBondContact O-CB 3.18Å; D100-S103 PolarHBondContact O-N 3.43Å; D100-S103 PolarHBondContact O-OG 3.47Å
101	L	56.3	Low	60.9	Low	137 Å²	137	108.8 Å²	108.8	72%	0.717	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-53.3	-21.5	178.4	-80.6	149.2	0	0	0	113.7	S103 Q104	L101-S103 VanDerWaalsContact C-N 3.33Å; L101-Q104 PolarHBondContact O-N 3.01Å
102	D	52.6	Low	62.8	Low	72 Å²	72	101.6 Å²	101.6	39%	0.385	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-71.9	-24.5	175.9	-87.5	5.5	0	0	0	113.3	D100 Q104 R105	D100-D102 PolarHBondContact O-N 3.13Å; D102-Q104 VanDerWaalsContact C-N 3.27Å; D102-Q104 PolarHBondContact O-N 3.44Å; D102-R105 PolarHBondContact O-N 2.95Å; D102-R105 IonicContact OD1-CZ 2.83Å; D102-R105 IonicContact OD1-NE 2.9Å; D102-R105 PolarHBondContact OD1-NE 3.41Å; D102-R105 IonicContact OD1-NH1 2.66Å; D102-R105 IonicContact OD1-NH2 3.65Å; D102-R105 PolarHBondContact OD1-NH2 3.04Å
103	S	52	Low	64.8	Low	61 Å²	61	98.3 Å²	98.3	43%	0.427	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-74.5	-17.1	175.3	-19.3	0	0	0	0	112.8	V99 D100 L101	V99-S103 VanDerWaalsContact CG1-OG 3.27Å; V99-S103 WeakPolarHBondContact CG1-OG 3.49Å; D100-S103 WeakPolarHBondContact O-CB 3.18Å; D100-S103 PolarHBondContact O-N 3.43Å; D100-S103 PolarHBondContact O-OG 3.47Å; L101-S103 VanDerWaalsContact C-N 3.33Å
104	Q	51.1	Low	66.9	Low	132 Å²	132	89.7 Å²	89.7	62%	0.617	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-94.3	-3.4	178.8	-65.7	-175.8	-2.4	0	0	113.1	L101 D102 K106	L101-Q104 PolarHBondContact O-N 3.01Å; D102-Q104 VanDerWaalsContact C-N 3.27Å; D102-Q104 PolarHBondContact O-N 3.44Å; Q104-K106 PolarHBondContact O-N 3.45Å
105	R	57.6	Low	68.5	Low	151 Å²	151	84.6 Å²	84.6	57%	0.57	47%	0.473	S	S	*	.			trans	-78.5	113.8	-177.3	-69.5	-172.4	-166.4	-171.5	15.5	110.4	D102 G107	D102-R105 PolarHBondContact O-N 2.95Å; D102-R105 IonicContact OD1-CZ 2.83Å; D102-R105 IonicContact OD1-NE 2.9Å; D102-R105 PolarHBondContact OD1-NE 3.41Å; D102-R105 IonicContact OD1-NH1 2.66Å; D102-R105 IonicContact OD1-NH2 3.65Å; D102-R105 PolarHBondContact OD1-NH2 3.04Å; R105-G107 PolarHBondContact O-N 2.81Å
106	K	59.3	Low	70.7	Confident	165 Å²	165	81.1 Å²	81.1	72%	0.717	46%	0.458	S	S	*	.			trans	-59.6	105.5	151.6	-69.9	-176	177	-167.8	0	107.1	P89 Q104	P89-K106 HydrophobicContact CG-CG 3.78Å; Q104-K106 PolarHBondContact O-N 3.45Å
107	G	67.3	Low	72.5	Confident	29 Å²	29	87.3 Å²	87.3	30%	0.299	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	152	-172.4	0	0	0	0	0	112	R105 C109	R105-G107 PolarHBondContact O-N 2.81Å; G107-C109 PolarHBondContact O-N 2.81Å
108	K	79.1	Confident	74.2	Confident	95 Å²	95	87.9 Å²	87.9	41%	0.413	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.3	170.7	-54.3	-151.4	167.4	171.6	0	108.3	D86 I125 A130	D86-K108 VanDerWaalsContact OD1-CG 3.23Å; D86-K108 WeakPolarHBondContact OD1-CG 3.27Å; K108-I125 HydrophobicContact CB-CD1 3.92Å; K108-I125 WeakPolarHBondContact O-CD1 3.43Å; K108-I125 WeakPolarHBondContact O-CG1 3.39Å; K108-A130 HydrophobicContact CB-CB 3.85Å; K108-A130 HydrophobicContact CD-CB 3.77Å; K108-A130 HydrophobicContact CG-CB 4.1Å
109	C	85.4	Confident	75.7	Confident	9 Å²	9	84 Å²	84	6%	0.061	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	155.7	172	-61.9	0	0	0	0	109.4	L84 L85 V87 G107 F121 L122	L84-C109 CarbonylContact C-O 3.5Å; L84-C109 WeakPolarHBondContact CA-O 3.45Å; L85-C109 HydrophobicContact CB-CB 4.33Å; L85-C109 PolarHBondContact N-O 3.27Å; L85-C109 WeakPolarHBondContact O-CB 3.45Å; L85-C109 PolarHBondContact O-N 2.79Å; V87-C109 HydrophobicContact CG2-CB 4.21Å; G107-C109 PolarHBondContact O-N 2.81Å; C109-F121 HydrophobicContact CB-CE2 3.68Å; C109-F121 HydrophobicContact CB-CZ 3.77Å; C109-L122 WeakPolarHBondContact CA-O 3.44Å
110	A	88.8	Confident	77.5	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.6	176.9	0	0	0	0	0	111.1	L84 L122 I125 I148	L84-A110 HydrophobicContact CD2-CB 3.98Å; A110-L122 PolarHBondContact N-O 2.91Å; A110-L122 WeakPolarHBondContact O-CB 3.41Å; A110-L122 PolarHBondContact O-N 3.01Å; A110-I125 HydrophobicContact CB-CG1 4.07Å; A110-I148 HydrophobicContact CB-CD1 4.35Å
111	V	91.9	Very high	79	Confident	30 Å²	30	82.2 Å²	82.2	18%	0.182	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.7	167.4	-176.8	0	0	0	0	107.8	I82 E83 L85 F121	I82-V111 HydrophobicContact CB-CB 4.48Å; I82-V111 HydrophobicContact CB-CG1 4.36Å; I82-V111 HydrophobicContact CD1-CG1 3.91Å; I82-V111 PolarHBondContact N-O 2.88Å; E83-V111 PolarHBondContact O-N 2.97Å; L85-V111 HydrophobicContact CD1-CG2 3.68Å; L85-V111 HydrophobicContact CG-CG2 4.46Å; V111-F121 HydrophobicContact CG2-CD2 4.11Å
112	I	93.4	Very high	80.5	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.1	178.4	61.2	161.4	0	0	0	111.2	N80 V81 T119 Y120 L122 V141 I148	N80-I112 CarbonylContact O-C 3.54Å; N80-I112 WeakPolarHBondContact O-CA 3.39Å; V81-I112 HydrophobicContact CG2-CG2 4.41Å; I112-T119 CarbonylContact O-C 3.59Å; I112-T119 VanDerWaalsContact O-CA 3.29Å; I112-T119 WeakPolarHBondContact O-CA 3.34Å; I112-Y120 PolarHBondContact N-O 2.7Å; I112-Y120 PolarHBondContact O-N 2.82Å; I112-L122 HydrophobicContact CB-CD1 4.42Å; I112-L122 HydrophobicContact CD1-CD1 3.6Å; I112-L122 HydrophobicContact CD1-CG 4.48Å; I112-L122 HydrophobicContact CG1-CD1 3.68Å; I112-L122 HydrophobicContact CG1-CG 4.39Å; I112-L122 HydrophobicContact CG2-CD1 3.89Å; I112-V141 HydrophobicContact CD1-CG1 3.91Å; I112-V141 HydrophobicContact CD1-CG2 3.89Å; I112-I148 HydrophobicContact CG2-CD1 4.03Å; I112-I148 HydrophobicContact CG2-CG1 4.39Å
113	K	94.4	Very high	81.9	Confident	99 Å²	99	76.2 Å²	76.2	43%	0.43	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.4	169.3	-167.1	172.8	-175.9	173.3	0	109.6	S79 N80 I82 Q118 T119	S79-K113 CarbonylContact C-O 3.59Å; S79-K113 VanDerWaalsContact CA-O 3.28Å; S79-K113 WeakPolarHBondContact CA-O 3.29Å; S79-K113 WeakPolarHBondContact CB-O 3.21Å; N80-K113 PolarHBondContact N-O 3.09Å; N80-K113 PolarHBondContact O-N 3.36Å; I82-K113 HydrophobicContact CD1-CB 3.63Å; I82-K113 HydrophobicContact CD1-CD 4.41Å; I82-K113 HydrophobicContact CD1-CG 4.47Å; I82-K113 HydrophobicContact CG1-CB 3.87Å; K113-Q118 WeakPolarHBondContact CA-O 3.37Å; K113-T119 HydrophobicContact CB-CG2 4.32Å; K113-T119 HydrophobicContact CD-CG2 4.42Å; K113-T119 HydrophobicContact CG-CG2 4.09Å
114	T	92.7	Very high	83.2	Confident	5 Å²	5	75.7 Å²	75.7	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	157.8	177	55.1	0	0	0	0	111.7	L77 S79 T116 R117 Q118 Y120 Y146	L77-T114 HydrophobicContact CD2-CG2 3.67Å; S79-T114 WeakPolarHBondContact OG-CA 3.45Å; T114-T116 PolarHBondContact O-N 3.19Å; T114-T116 VanDerWaalsContact O-N 3.15Å; T114-T116 PolarHBondContact OG1-OG1 3.13Å; T114-R117 WeakPolarHBondContact O-CA 3.23Å; T114-R117 PolarHBondContact O-N 3.39Å; T114-Q118 PolarHBondContact N-O 3.44Å; T114-Q118 WeakPolarHBondContact OG1-CB 3.42Å; T114-Q118 PolarHBondContact OG1-N 3.48Å; T114-Q118 VanDerWaalsContact OG1-N 3.13Å; T114-Q118 PolarHBondContact OG1-O 3.49Å; T114-Y120 HydrophobicContact CG2-CD2 3.73Å; T114-Y120 HydrophobicContact CG2-CE2 3.78Å; T114-Y146 HydrophobicContact CG2-CD1 4.12Å; T114-Y146 HydrophobicContact CG2-CE1 4.14Å
115	S	88.9	Confident	84.6	Confident	80 Å²	80	70.1 Å²	70.1	56%	0.559	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.9	170.9	-56.9	0	0	0	0	113.4	V78 R117	V78-S115 PolarHBondContact O-N 2.77Å; V78-S115 PolarHBondContact O-OG 3.06Å; S115-R117 PolarHBondContact O-N 3.16Å
116	T	90.9	Very high	85.8	Confident	81 Å²	81	64.8 Å²	64.8	50%	0.497	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	7.5	173	57.2	0	0	0	0	113.4	T114 Q118	T114-T116 PolarHBondContact O-N 3.19Å; T114-T116 VanDerWaalsContact O-N 3.15Å; T114-T116 PolarHBondContact OG1-OG1 3.13Å; T116-Q118 PolarHBondContact O-N 3.05Å; T116-Q118 PolarHBondContact OG1-OE1 2.88Å
117	R	90.8	Very high	87.1	Confident	216 Å²	216	61 Å²	61	82%	0.815	32%	0.324	S	S	*	.	S	Bend	trans	67.2	16.8	179.2	-51.4	176.9	-179.7	177.1	-0.2	114.4	T114 S115	T114-R117 WeakPolarHBondContact O-CA 3.23Å; T114-R117 PolarHBondContact O-N 3.39Å; S115-R117 PolarHBondContact O-N 3.16Å
118	Q	92.3	Very high	88	Confident	93 Å²	93	60.6 Å²	60.6	44%	0.435	32%	0.316	S	S	.	.			trans	-92.5	139	173.8	-66.4	167.1	-35.3	0	0	110.2	K113 T114 T116 Y120	K113-Q118 WeakPolarHBondContact CA-O 3.37Å; T114-Q118 PolarHBondContact N-O 3.44Å; T114-Q118 WeakPolarHBondContact OG1-CB 3.42Å; T114-Q118 PolarHBondContact OG1-N 3.48Å; T114-Q118 VanDerWaalsContact OG1-N 3.13Å; T114-Q118 PolarHBondContact OG1-O 3.49Å; T116-Q118 PolarHBondContact O-N 3.05Å; T116-Q118 PolarHBondContact OG1-OE1 2.88Å; Q118-Y120 HydrophobicContact CB-CD2 4.34Å; Q118-Y120 HydrophobicContact CB-CE2 3.62Å; Q118-Y120 PolarHBondContact OE1-OH 2.82Å
119	T	93.3	Very high	88.4	Confident	93 Å²	93	60.3 Å²	60.3	57%	0.571	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	127.3	176.8	48.3	0	0	0	0	109.9	I82 I112 K113	I82-T119 HydrophobicContact CD1-CG2 3.85Å; I112-T119 CarbonylContact O-C 3.59Å; I112-T119 VanDerWaalsContact O-CA 3.29Å; I112-T119 WeakPolarHBondContact O-CA 3.34Å; K113-T119 HydrophobicContact CB-CG2 4.32Å; K113-T119 HydrophobicContact CD-CG2 4.42Å; K113-T119 HydrophobicContact CG-CG2 4.09Å
120	Y	91.8	Very high	88.4	Confident	65 Å²	65	61 Å²	61	26%	0.255	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.3	176.8	-68.1	-87.8	0	0	0	109.8	I112 T114 Q118 Y146	I112-Y120 PolarHBondContact N-O 2.7Å; I112-Y120 PolarHBondContact O-N 2.82Å; T114-Y120 HydrophobicContact CG2-CD2 3.73Å; T114-Y120 HydrophobicContact CG2-CE2 3.78Å; Q118-Y120 HydrophobicContact CB-CD2 4.34Å; Q118-Y120 HydrophobicContact CB-CE2 3.62Å; Q118-Y120 PolarHBondContact OE1-OH 2.82Å; Y120-Y146 HydrophobicContact CD1-CD2 4.14Å; Y120-Y146 HydrophobicContact CD1-CE2 4.45Å; Y120-Y146 HydrophobicContact CD1-CG 4.17Å; Y120-Y146 AromaticContact CD2-CD1 3.83Å; Y120-Y146 HydrophobicContact CD2-CD1 3.83Å; Y120-Y146 HydrophobicContact CD2-CE1 4.05Å; Y120-Y146 HydrophobicContact CD2-CG 4.25Å; Y120-Y146 HydrophobicContact CE1-CD1 4.43Å; Y120-Y146 AromaticContact CE1-CD2 3.92Å; Y120-Y146 HydrophobicContact CE1-CD2 3.92Å; Y120-Y146 HydrophobicContact CE1-CE1 4.29Å; Y120-Y146 AromaticContact CE1-CE2 3.78Å; Y120-Y146 HydrophobicContact CE1-CE2 3.78Å; Y120-Y146 HydrophobicContact CE1-CG 4.25Å; Y120-Y146 AromaticContact CE1-CZ 3.98Å; Y120-Y146 AromaticContact CE2-CD1 3.74Å; Y120-Y146 HydrophobicContact CE2-CD1 3.74Å; Y120-Y146 AromaticContact CE2-CE1 3.46Å; Y120-Y146 HydrophobicContact CE2-CE1 3.46Å; Y120-Y146 VanDerWaalsContact CE2-CE1 3.46Å; Y120-Y146 HydrophobicContact CE2-CE2 4.42Å; Y120-Y146 HydrophobicContact CE2-CG 4.33Å; Y120-Y146 AromaticContact CE2-CZ 3.85Å; Y120-Y146 HydrophobicContact CG-CD1 4.22Å; Y120-Y146 HydrophobicContact CG-CG 4.17Å; Y120-Y146 AromaticContact CZ-CE1 3.6Å; Y120-Y146 AromaticContact CZ-CE2 3.77Å; Y120-Y146 AromaticContact CZ-CZ 3.45Å; Y120-Y146 VanDerWaalsContact CZ-CZ 3.45Å; Y120-Y146 PolarHBondContact OH-OH 2.84Å
121	F	90	Very high	88.3	Confident	114 Å²	114	69.2 Å²	69.2	50%	0.5	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.7	169.6	174.4	-101	0	0	0	108.7	L85 V87 C109 V111 P123	L85-F121 HydrophobicContact CD1-CE2 4.17Å; V87-F121 HydrophobicContact CG2-CZ 4.43Å; C109-F121 HydrophobicContact CB-CE2 3.68Å; C109-F121 HydrophobicContact CB-CZ 3.77Å; V111-F121 HydrophobicContact CG2-CD2 4.11Å; F121-P123 HydrophobicContact CE1-CB 4.19Å
122	L	86.7	Confident	88	Confident	11 Å²	11	74.6 Å²	74.6	6%	0.058	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	109.4	179.6	-68.6	160.9	0	0	0	108.9	C109 A110 I112 V124 Y146 I148	C109-L122 WeakPolarHBondContact CA-O 3.44Å; A110-L122 PolarHBondContact N-O 2.91Å; A110-L122 WeakPolarHBondContact O-CB 3.41Å; A110-L122 PolarHBondContact O-N 3.01Å; I112-L122 HydrophobicContact CB-CD1 4.42Å; I112-L122 HydrophobicContact CD1-CD1 3.6Å; I112-L122 HydrophobicContact CD1-CG 4.48Å; I112-L122 HydrophobicContact CG1-CD1 3.68Å; I112-L122 HydrophobicContact CG1-CG 4.39Å; I112-L122 HydrophobicContact CG2-CD1 3.89Å; L122-V124 PolarHBondContact O-N 3.05Å; L122-Y146 WeakPolarHBondContact CD1-O 3.47Å; L122-Y146 WeakPolarHBondContact CD2-O 3.29Å; L122-I148 HydrophobicContact CD1-CD1 4.24Å; L122-I148 HydrophobicContact CD1-CG1 4.11Å
123	P	81.3	Confident	87.8	Confident	71 Å²	71	75 Å²	75	46%	0.461	39%	0.386	S	S	.	.	S	Bend	trans	-69.4	-23	172	28	-33	0	0	0	111.7	F121	F121-P123 HydrophobicContact CE1-CB 4.19Å
124	V	80.8	Confident	87.5	Confident	51 Å²	51	76.4 Å²	76.4	31%	0.309	39%	0.392	S	S	.	.	S	Bend	trans	-123.4	118.5	175.5	-177.5	0	0	0	0	109	L122 G126	L122-V124 PolarHBondContact O-N 3.05Å; V124-G126 PolarHBondContact O-N 2.85Å
125	I	79.6	Confident	87.3	Confident	14 Å²	14	80.3 Å²	80.3	7%	0.072	42%	0.418	C	S	.	.			trans	-60.9	-44.3	-176	-66.5	170.2	0	0	0	111	L84 K108 A110 V128 A130 L133 I148	L84-I125 HydrophobicContact CD2-CD1 4.38Å; K108-I125 HydrophobicContact CB-CD1 3.92Å; K108-I125 WeakPolarHBondContact O-CD1 3.43Å; K108-I125 WeakPolarHBondContact O-CG1 3.39Å; A110-I125 HydrophobicContact CB-CG1 4.07Å; I125-V128 WeakPolarHBondContact CG2-O 3.44Å; I125-A130 HydrophobicContact CD1-CB 3.28Å; I125-L133 HydrophobicContact CG2-CD1 3.52Å; I125-I148 HydrophobicContact CG2-CD1 3.96Å; I125-I148 WeakPolarHBondContact O-CB 3.49Å; I125-I148 PolarHBondContact O-N 2.88Å; I125-I148 VanDerWaalsContact O-N 3.13Å
126	G	83.3	Confident	87.2	Confident	39 Å²	39	79 Å²	79	40%	0.402	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	122.4	-130.4	176.7	0	0	0	0	0	112.5	V124	V124-G126 PolarHBondContact O-N 2.85Å
127	L	85.5	Confident	87.2	Confident	86 Å²	86	76.2 Å²	76.2	45%	0.45	40%	0.399	S	S	.	.	S	Bend	trans	-86.9	-8.1	-174.7	-77.4	156.8	0	0	0	114.1	I68 I148 L149	I68-L127 HydrophobicContact CD1-CD2 4.18Å; I68-L127 HydrophobicContact CG1-CD2 4.34Å; I68-L127 HydrophobicContact CG2-CD1 4.15Å; I68-L127 HydrophobicContact CG2-CD2 3.93Å; L127-I148 PolarHBondContact N-O 2.93Å; L127-L149 HydrophobicContact CD1-CD2 3.74Å
128	V	87.4	Confident	87.2	Confident	21 Å²	21	67.3 Å²	67.3	13%	0.127	37%	0.368	C	S	.	.	S	Bend	trans	-105.2	141	-176.5	-179.2	0	0	0	0	110.3	I125 L133 I148 T151	I125-V128 WeakPolarHBondContact CG2-O 3.44Å; V128-L133 HydrophobicContact CG1-CD1 4.45Å; V128-L133 HydrophobicContact CG1-CD2 4.06Å; V128-L133 HydrophobicContact CG1-CG 4.1Å; V128-I148 HydrophobicContact CB-CG2 4.25Å; V128-I148 HydrophobicContact CG2-CG2 3.87Å; V128-T151 HydrophobicContact CG1-CG2 3.79Å; V128-T151 HydrophobicContact CG2-CG2 4.47Å
129	D	86.9	Confident	87.2	Confident	89 Å²	89	62.9 Å²	62.9	48%	0.476	35%	0.347	S	S	.	.			trans	-65.7	132.3	175.7	-54.5	-46	0	0	0	111.6	E131 K132	D129-E131 PolarHBondContact O-N 2.85Å; D129-K132 HydrophobicContact CB-CD 4.2Å; D129-K132 HydrophobicContact CB-CG 4.33Å; D129-K132 PolarHBondContact O-N 3.17Å; D129-K132 VanDerWaalsContact O-N 3.16Å; D129-K132 WeakPolarHBondContact OD2-CE 3.18Å; D129-K132 IonicContact OD2-NZ 2.94Å; D129-K132 PolarHBondContact OD2-NZ 3.45Å
130	A	84.9	Confident	87.1	Confident	23 Å²	23	58.5 Å²	58.5	19%	0.19	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.4	178.8	0	0	0	0	0	113.6	K108 I125 K132 L133	K108-A130 HydrophobicContact CB-CB 3.85Å; K108-A130 HydrophobicContact CD-CB 3.77Å; K108-A130 HydrophobicContact CG-CB 4.1Å; I125-A130 HydrophobicContact CD1-CB 3.28Å; A130-K132 VanDerWaalsContact C-N 3.31Å; A130-K132 PolarHBondContact O-N 3.18Å; A130-L133 PolarHBondContact O-N 3.46Å
131	E	86.6	Confident	87.1	Confident	173 Å²	173	55.4 Å²	55.4	81%	0.808	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.3	-178.3	-61.2	-179.7	173.5	0	0	113.2	D129	D129-E131 PolarHBondContact O-N 2.85Å
132	K	87.5	Confident	87.1	Confident	142 Å²	142	51.7 Å²	51.7	62%	0.617	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-19	179.6	-69.2	174.3	-178.2	154.6	0	112.5	D129 A130	D129-K132 HydrophobicContact CB-CD 4.2Å; D129-K132 HydrophobicContact CB-CG 4.33Å; D129-K132 PolarHBondContact O-N 3.17Å; D129-K132 VanDerWaalsContact O-N 3.16Å; D129-K132 WeakPolarHBondContact OD2-CE 3.18Å; D129-K132 IonicContact OD2-NZ 2.94Å; D129-K132 PolarHBondContact OD2-NZ 3.45Å; A130-K132 VanDerWaalsContact C-N 3.31Å; A130-K132 PolarHBondContact O-N 3.18Å
133	L	87.8	Confident	87	Confident	9 Å²	9	55.9 Å²	55.9	5%	0.047	31%	0.311	C	S	.	.			trans	-83	135.3	179.7	-65.4	175.4	0	0	0	109.7	V81 L84 I125 V128 A130 V139 I148 T151	V81-L133 HydrophobicContact CG2-CD2 4.36Å; L84-L133 HydrophobicContact CD1-CB 4.08Å; L84-L133 WeakPolarHBondContact CD1-O 3.37Å; L84-L133 HydrophobicContact CD2-CB 4.38Å; I125-L133 HydrophobicContact CG2-CD1 3.52Å; V128-L133 HydrophobicContact CG1-CD1 4.45Å; V128-L133 HydrophobicContact CG1-CD2 4.06Å; V128-L133 HydrophobicContact CG1-CG 4.1Å; A130-L133 PolarHBondContact O-N 3.46Å; L133-V139 HydrophobicContact CD2-CG1 3.75Å; L133-I148 HydrophobicContact CD1-CD1 4.08Å; L133-T151 HydrophobicContact CD2-CG2 3.59Å
134	K	89	Confident	87.3	Confident	128 Å²	128	59.3 Å²	59.3	56%	0.557	33%	0.326	S	S	*	.			trans	-124.1	153.4	167.7	52.1	178.3	178	-167.7	0	110.2	G136 D137	K134-G136 PolarHBondContact O-N 2.59Å; K134-D137 WeakPolarHBondContact CE-OD1 3.5Å; K134-D137 WeakPolarHBondContact CG-OD1 3.21Å; K134-D137 WeakPolarHBondContact CG-OD2 3.47Å; K134-D137 PolarHBondContact N-OD2 2.92Å; K134-D137 IonicContact NZ-OD1 3.95Å; K134-D137 WeakPolarHBondContact O-CB 3.09Å; K134-D137 PolarHBondContact O-N 3.12Å; K134-D137 VanDerWaalsContact O-N 3.12Å
135	P	88.8	Confident	87.5	Confident	88 Å²	88	59.5 Å²	59.5	57%	0.571	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	126.8	168.7	-30	38.1	0	0	0	111.4	I82	I82-P135 WeakPolarHBondContact O-CB 3.22Å
136	G	85.9	Confident	87.9	Confident	53 Å²	53	61.5 Å²	61.5	55%	0.546	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	-3.6	-178.8	0	0	0	0	0	115.7	V81 K134	V81-G136 WeakPolarHBondContact O-CA 2.82Å; V81-G136 PolarHBondContact O-N 2.62Å; K134-G136 PolarHBondContact O-N 2.59Å
137	D	90.2	Very high	88.2	Confident	21 Å²	21	62.8 Å²	62.8	11%	0.112	33%	0.334	C	S	.	.			trans	-69.5	142.6	177	-78.3	-16.6	0	0	0	112.8	N80 V81 K134	N80-D137 WeakPolarHBondContact CA-O 3.21Å; V81-D137 PolarHBondContact N-O 3.26Å; K134-D137 WeakPolarHBondContact CE-OD1 3.5Å; K134-D137 WeakPolarHBondContact CG-OD1 3.21Å; K134-D137 WeakPolarHBondContact CG-OD2 3.47Å; K134-D137 PolarHBondContact N-OD2 2.92Å; K134-D137 IonicContact NZ-OD1 3.95Å; K134-D137 WeakPolarHBondContact O-CB 3.09Å; K134-D137 PolarHBondContact O-N 3.12Å; K134-D137 VanDerWaalsContact O-N 3.12Å
138	L	91.1	Very high	88.5	Confident	30 Å²	30	58.7 Å²	58.7	16%	0.157	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	126.1	171.1	-81.5	145.3	0	0	0	109.5	V78 N80 L152 E155	V78-L138 HydrophobicContact CG1-CD2 3.58Å; N80-L138 WeakPolarHBondContact OD1-CD2 3.44Å; N80-L138 WeakPolarHBondContact OD1-CG 3.19Å; L138-L152 HydrophobicContact CB-CB 4.19Å; L138-L152 PolarHBondContact O-N 2.83Å; L138-E155 HydrophobicContact CD1-CB 3.96Å
139	V	92.5	Very high	88.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.4	-178.6	-68	0	0	0	0	111.4	S79 V81 L133 V141 I148 E150 T151	S79-V139 PolarHBondContact N-O 3.25Å; S79-V139 WeakPolarHBondContact O-CG2 3.39Å; S79-V139 PolarHBondContact O-N 3.12Å; V81-V139 HydrophobicContact CG2-CG1 3.85Å; V81-V139 HydrophobicContact CG2-CG2 3.89Å; L133-V139 HydrophobicContact CD2-CG1 3.75Å; V139-V141 HydrophobicContact CG2-CG2 3.94Å; V139-I148 HydrophobicContact CB-CG2 3.89Å; V139-I148 HydrophobicContact CG1-CG2 4.04Å; V139-I148 HydrophobicContact CG2-CG1 4.29Å; V139-I148 HydrophobicContact CG2-CG2 4.41Å; V139-E150 CarbonylContact C-O 3.6Å; V139-E150 WeakPolarHBondContact CA-O 3.47Å; V139-T151 HydrophobicContact CG1-CG2 4.16Å
140	G	92.3	Very high	88.7	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	123	170.7	0	0	0	0	0	110	L149 E150	G140-L149 PolarHBondContact O-N 3.24Å; G140-E150 PolarHBondContact N-O 2.92Å; G140-E150 PolarHBondContact O-N 3.15Å
141	V	91.6	Very high	89	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.6	-173.5	176.3	0	0	0	0	110	L77 S79 I112 V139 Y146 L147 I148	L77-V141 PolarHBondContact N-O 2.74Å; L77-V141 WeakPolarHBondContact O-CA 3.49Å; L77-V141 WeakPolarHBondContact O-CB 3.43Å; L77-V141 PolarHBondContact O-N 2.88Å; S79-V141 WeakPolarHBondContact OG-CG2 3.34Å; I112-V141 HydrophobicContact CD1-CG1 3.91Å; I112-V141 HydrophobicContact CD1-CG2 3.89Å; V139-V141 HydrophobicContact CG2-CG2 3.94Å; V141-Y146 HydrophobicContact CG1-CD1 4.32Å; V141-Y146 WeakPolarHBondContact CG1-O 3.47Å; V141-L147 WeakPolarHBondContact CA-O 3.11Å; V141-I148 HydrophobicContact CG2-CG1 4.28Å
142	N	89.2	Confident	89.1	Confident	36 Å²	36	54.2 Å²	54.2	19%	0.193	29%	0.29	C	S	.	.			trans	-67.2	140.2	173.8	-165.5	-11.7	0	0	0	110.8	D144 S145 Y146 L147 L149	N142-D144 VanDerWaalsContact C-N 3.34Å; N142-D144 PolarHBondContact O-N 2.83Å; N142-S145 WeakPolarHBondContact CB-OG 3.42Å; N142-S145 PolarHBondContact ND2-OG 2.89Å; N142-Y146 VanDerWaalsContact O-CA 3.29Å; N142-Y146 WeakPolarHBondContact O-CA 3.42Å; N142-Y146 PolarHBondContact O-N 2.91Å; N142-Y146 VanDerWaalsContact O-N 3.09Å; N142-L147 PolarHBondContact N-O 2.92Å; N142-L149 HydrophobicContact CB-CD1 4.06Å; N142-L149 HydrophobicContact CB-CG 4.39Å
143	K	86.1	Confident	89.1	Confident	98 Å²	98	52.8 Å²	52.8	43%	0.426	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-34.5	-177.5	-67.3	-176.8	176.8	-171.7	0	113.5	P75 L77	P75-K143 HydrophobicContact CG-CD 4.46Å; P75-K143 VanDerWaalsContact CG-NZ 3.26Å; P75-K143 WeakPolarHBondContact O-CE 3.28Å; L77-K143 HydrophobicContact CB-CG 4.2Å
144	D	86.3	Confident	88.8	Confident	143 Å²	143	55.7 Å²	55.7	77%	0.765	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-47.1	-173.2	-57.6	-40.1	0	0	0	111.9	N142	N142-D144 VanDerWaalsContact C-N 3.34Å; N142-D144 PolarHBondContact O-N 2.83Å
145	S	85.8	Confident	88.5	Confident	56 Å²	56	56.4 Å²	56.4	39%	0.392	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-8.1	-175.2	64.4	0	0	0	0	114.7	N142 L147	N142-S145 WeakPolarHBondContact CB-OG 3.42Å; N142-S145 PolarHBondContact ND2-OG 2.89Å; S145-L147 PolarHBondContact O-N 2.82Å
146	Y	88.6	Confident	88.3	Confident	56 Å²	56	53.7 Å²	53.7	22%	0.22	30%	0.297	C	S	.	.			trans	54.6	15.9	-177	-58.7	-81	0	0	0	115.8	L77 T114 Y120 L122 V141 N142	L77-Y146 HydrophobicContact CD2-CE1 4.12Å; T114-Y146 HydrophobicContact CG2-CD1 4.12Å; T114-Y146 HydrophobicContact CG2-CE1 4.14Å; Y120-Y146 HydrophobicContact CD1-CD2 4.14Å; Y120-Y146 HydrophobicContact CD1-CE2 4.45Å; Y120-Y146 HydrophobicContact CD1-CG 4.17Å; Y120-Y146 AromaticContact CD2-CD1 3.83Å; Y120-Y146 HydrophobicContact CD2-CD1 3.83Å; Y120-Y146 HydrophobicContact CD2-CE1 4.05Å; Y120-Y146 HydrophobicContact CD2-CG 4.25Å; Y120-Y146 HydrophobicContact CE1-CD1 4.43Å; Y120-Y146 AromaticContact CE1-CD2 3.92Å; Y120-Y146 HydrophobicContact CE1-CD2 3.92Å; Y120-Y146 HydrophobicContact CE1-CE1 4.29Å; Y120-Y146 AromaticContact CE1-CE2 3.78Å; Y120-Y146 HydrophobicContact CE1-CE2 3.78Å; Y120-Y146 HydrophobicContact CE1-CG 4.25Å; Y120-Y146 AromaticContact CE1-CZ 3.98Å; Y120-Y146 AromaticContact CE2-CD1 3.74Å; Y120-Y146 HydrophobicContact CE2-CD1 3.74Å; Y120-Y146 AromaticContact CE2-CE1 3.46Å; Y120-Y146 HydrophobicContact CE2-CE1 3.46Å; Y120-Y146 VanDerWaalsContact CE2-CE1 3.46Å; Y120-Y146 HydrophobicContact CE2-CE2 4.42Å; Y120-Y146 HydrophobicContact CE2-CG 4.33Å; Y120-Y146 AromaticContact CE2-CZ 3.85Å; Y120-Y146 HydrophobicContact CG-CD1 4.22Å; Y120-Y146 HydrophobicContact CG-CG 4.17Å; Y120-Y146 AromaticContact CZ-CE1 3.6Å; Y120-Y146 AromaticContact CZ-CE2 3.77Å; Y120-Y146 AromaticContact CZ-CZ 3.45Å; Y120-Y146 VanDerWaalsContact CZ-CZ 3.45Å; Y120-Y146 PolarHBondContact OH-OH 2.84Å; L122-Y146 WeakPolarHBondContact CD1-O 3.47Å; L122-Y146 WeakPolarHBondContact CD2-O 3.29Å; V141-Y146 HydrophobicContact CG1-CD1 4.32Å; V141-Y146 WeakPolarHBondContact CG1-O 3.47Å; N142-Y146 VanDerWaalsContact O-CA 3.29Å; N142-Y146 WeakPolarHBondContact O-CA 3.42Å; N142-Y146 PolarHBondContact O-N 2.91Å; N142-Y146 VanDerWaalsContact O-N 3.09Å
147	L	88.9	Confident	88.3	Confident	65 Å²	65	52.5 Å²	52.5	34%	0.34	28%	0.278	S	S	.	.			trans	-72.5	141.5	175.8	-70.6	170.6	0	0	0	111.6	V141 N142 S145 L149	V141-L147 WeakPolarHBondContact CA-O 3.11Å; N142-L147 PolarHBondContact N-O 2.92Å; S145-L147 PolarHBondContact O-N 2.82Å; L147-L149 PolarHBondContact O-N 2.91Å
148	I	90.8	Very high	88.1	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	120.5	175.3	-57.9	165	0	0	0	108.8	A110 I112 L122 I125 L127 V128 L133 V139 V141	A110-I148 HydrophobicContact CB-CD1 4.35Å; I112-I148 HydrophobicContact CG2-CD1 4.03Å; I112-I148 HydrophobicContact CG2-CG1 4.39Å; L122-I148 HydrophobicContact CD1-CD1 4.24Å; L122-I148 HydrophobicContact CD1-CG1 4.11Å; I125-I148 HydrophobicContact CG2-CD1 3.96Å; I125-I148 WeakPolarHBondContact O-CB 3.49Å; I125-I148 PolarHBondContact O-N 2.88Å; I125-I148 VanDerWaalsContact O-N 3.13Å; L127-I148 PolarHBondContact N-O 2.93Å; V128-I148 HydrophobicContact CB-CG2 4.25Å; V128-I148 HydrophobicContact CG2-CG2 3.87Å; L133-I148 HydrophobicContact CD1-CD1 4.08Å; V139-I148 HydrophobicContact CB-CG2 3.89Å; V139-I148 HydrophobicContact CG1-CG2 4.04Å; V139-I148 HydrophobicContact CG2-CG1 4.29Å; V139-I148 HydrophobicContact CG2-CG2 4.41Å; V141-I148 HydrophobicContact CG2-CG1 4.28Å
149	L	89.3	Confident	87.9	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.068	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-42.6	-178.3	-60	176.7	0	0	0	111.8	Y76 L127 G140 N142 L147	Y76-L149 HydrophobicContact CD1-CD1 3.29Å; Y76-L149 HydrophobicContact CE1-CD1 3.43Å; Y76-L149 VanDerWaalsContact CE1-CD1 3.43Å; Y76-L149 HydrophobicContact CG-CD1 4.14Å; L127-L149 HydrophobicContact CD1-CD2 3.74Å; G140-L149 PolarHBondContact O-N 3.24Å; N142-L149 HydrophobicContact CB-CD1 4.06Å; N142-L149 HydrophobicContact CB-CG 4.39Å; L147-L149 PolarHBondContact O-N 2.91Å
150	E	89.4	Confident	87.6	Confident	76 Å²	76	58.3 Å²	58.3	36%	0.355	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	149.1	-172.6	-177.7	156.6	-131.9	0	0	111.3	K72 V139 G140	K72-E150 WeakPolarHBondContact CE-OE2 3.32Å; K72-E150 IonicContact NZ-OE1 2.99Å; K72-E150 PolarHBondContact NZ-OE1 3.39Å; K72-E150 IonicContact NZ-OE2 3.66Å; K72-E150 PolarHBondContact NZ-OE2 3.27Å; V139-E150 CarbonylContact C-O 3.6Å; V139-E150 WeakPolarHBondContact CA-O 3.47Å; G140-E150 PolarHBondContact N-O 2.92Å; G140-E150 PolarHBondContact O-N 3.15Å
151	T	90.7	Very high	87.3	Confident	65 Å²	65	63.5 Å²	63.5	40%	0.399	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.6	169.1	43	0	0	0	0	109.7	V128 L133 V139	V128-T151 HydrophobicContact CG1-CG2 3.79Å; V128-T151 HydrophobicContact CG2-CG2 4.47Å; L133-T151 HydrophobicContact CD2-CG2 3.59Å; V139-T151 HydrophobicContact CG1-CG2 4.16Å
152	L	90	Very high	87	Confident	59 Å²	59	67.5 Å²	67.5	31%	0.309	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-91.3	147.1	177.1	-63.5	172.8	0	0	0	109.4	V78 L138	V78-L152 HydrophobicContact CG1-CD1 4.04Å; V78-L152 HydrophobicContact CG2-CD1 3.95Å; L138-L152 HydrophobicContact CB-CB 4.19Å; L138-L152 PolarHBondContact O-N 2.83Å
153	P	86.8	Confident	86.7	Confident	112 Å²	112	66.4 Å²	66.4	73%	0.727	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-60.2	148.2	171.4	25.3	-32.1	0	0	0	110	E155	P153-E155 PolarHBondContact O-N 3.13Å
154	T	82.6	Confident	86.4	Confident	69 Å²	69	63.8 Å²	63.8	42%	0.423	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-59.5	125.7	178.6	44.1	0	0	0	0	110.3
155	E	82.3	Confident	85.7	Confident	143 Å²	143	59.4 Å²	59.4	67%	0.668	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-87.5	119.8	178.5	-171.9	175.3	-159.5	0	0	110.2	L138 P153	L138-E155 HydrophobicContact CD1-CB 3.96Å; P153-E155 PolarHBondContact O-N 3.13Å
156	Y	84.3	Confident	84.6	Confident	32 Å²	32	63.5 Å²	63.5	13%	0.125	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-88.8	151.1	166.6	-56.4	-70.1	0	0	0	110.6	S158 D258 A261 L262 E265	Y156-S158 PolarHBondContact O-N 3.37Å; Y156-D258 HydrophobicContact CD1-CB 4.21Å; Y156-A261 HydrophobicContact CE1-CB 3.75Å; Y156-L262 HydrophobicContact CD2-CD1 3.91Å; Y156-L262 HydrophobicContact CE2-CD1 3.87Å; Y156-E265 VanDerWaalsContact CE2-OE2 3.22Å; Y156-E265 WeakPolarHBondContact CE2-OE2 3.21Å; Y156-E265 PolarHBondContact OH-OE2 3.19Å; Y156-E265 VanDerWaalsContact OH-OE2 3.12Å
157	D	85.9	Confident	83.3	Confident	28 Å²	28	68.9 Å²	68.9	15%	0.15	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-52.8	135.6	173.2	-164.5	-64	0	0	0	111	R159 V160 K161	D157-R159 PolarHBondContact O-N 3.4Å; D157-R159 VanDerWaalsContact O-N 3.08Å; D157-R159 VanDerWaalsContact OD1-CB 3.27Å; D157-R159 WeakPolarHBondContact OD1-CB 3.44Å; D157-R159 VanDerWaalsContact OD1-CG 3.31Å; D157-R159 WeakPolarHBondContact OD1-CG 3.43Å; D157-R159 IonicContact OD1-CZ 2.71Å; D157-R159 PolarHBondContact OD1-N 3.14Å; D157-R159 IonicContact OD1-NE 2.73Å; D157-R159 PolarHBondContact OD1-NE 3.39Å; D157-R159 IonicContact OD1-NH2 2.62Å; D157-R159 IonicContact OD2-CZ 3.06Å; D157-R159 IonicContact OD2-NE 3.82Å; D157-R159 PolarHBondContact OD2-NE 3.45Å; D157-R159 IonicContact OD2-NH2 2.59Å; D157-R159 PolarHBondContact OD2-NH2 3.14Å; D157-V160 HydrophobicContact CB-CG2 4.19Å; D157-V160 WeakPolarHBondContact O-CB 2.97Å; D157-V160 PolarHBondContact O-N 2.88Å; D157-K161 PolarHBondContact O-N 3.5Å
158	S	86.7	Confident	82.2	Confident	93 Å²	93	75.6 Å²	75.6	65%	0.65	39%	0.393	S	S	*	.	H	α-helix	trans	-51.5	-32.5	177	59.4	0	0	0	0	113.1	Y156 V160 K161 A162	Y156-S158 PolarHBondContact O-N 3.37Å; S158-V160 VanDerWaalsContact C-N 3.32Å; S158-V160 PolarHBondContact O-N 3.22Å; S158-K161 PolarHBondContact O-N 3.01Å; S158-A162 PolarHBondContact O-N 2.93Å; S158-A162 VanDerWaalsContact O-N 3.08Å
159	R	87	Confident	81.1	Confident	80 Å²	80	77 Å²	77	30%	0.302	40%	0.402	S	S	.	.	H	α-helix	trans	-64.1	-36.5	176	-65.3	173	-75.1	-173	-3	112.1	D157 A162 M163 Q246 D251 L255	D157-R159 PolarHBondContact O-N 3.4Å; D157-R159 VanDerWaalsContact O-N 3.08Å; D157-R159 VanDerWaalsContact OD1-CB 3.27Å; D157-R159 WeakPolarHBondContact OD1-CB 3.44Å; D157-R159 VanDerWaalsContact OD1-CG 3.31Å; D157-R159 WeakPolarHBondContact OD1-CG 3.43Å; D157-R159 IonicContact OD1-CZ 2.71Å; D157-R159 PolarHBondContact OD1-N 3.14Å; D157-R159 IonicContact OD1-NE 2.73Å; D157-R159 PolarHBondContact OD1-NE 3.39Å; D157-R159 IonicContact OD1-NH2 2.62Å; D157-R159 IonicContact OD2-CZ 3.06Å; D157-R159 IonicContact OD2-NE 3.82Å; D157-R159 PolarHBondContact OD2-NE 3.45Å; D157-R159 IonicContact OD2-NH2 2.59Å; D157-R159 PolarHBondContact OD2-NH2 3.14Å; R159-A162 PolarHBondContact O-N 3.37Å; R159-M163 WeakPolarHBondContact O-CG 3.36Å; R159-M163 PolarHBondContact O-N 3.27Å; R159-Q246 VanDerWaalsContact NH1-OE1 3.13Å; R159-D251 IonicContact NH1-OD2 3.45Å; R159-D251 IonicContact NH2-OD2 4Å; R159-L255 HydrophobicContact CB-CD1 4.01Å
160	V	86.4	Confident	80.6	Confident	0 Å²	0	82.4 Å²	82.4	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-73.3	-38.2	178.4	178.1	0	0	0	0	110.7	D157 S158 A162 M163 E164 L255 D258 A259 L262	D157-V160 HydrophobicContact CB-CG2 4.19Å; D157-V160 WeakPolarHBondContact O-CB 2.97Å; D157-V160 PolarHBondContact O-N 2.88Å; S158-V160 VanDerWaalsContact C-N 3.32Å; S158-V160 PolarHBondContact O-N 3.22Å; V160-A162 PolarHBondContact O-N 3.3Å; V160-M163 WeakPolarHBondContact O-CB 3.47Å; V160-M163 PolarHBondContact O-N 2.99Å; V160-E164 PolarHBondContact O-N 2.8Å; V160-L255 HydrophobicContact CG2-CD2 4.2Å; V160-L255 HydrophobicContact CG2-CG 3.86Å; V160-D258 HydrophobicContact CG2-CB 3.86Å; V160-A259 HydrophobicContact CG1-CB 4.17Å; V160-L262 HydrophobicContact CG1-CB 4.27Å; V160-L262 HydrophobicContact CG1-CD2 3.75Å
161	K	84.8	Confident	80.2	Confident	109 Å²	109	81.1 Å²	81.1	47%	0.474	43%	0.43	S	S	.	.	H	α-helix	trans	-61	-35.4	171.9	-65.6	-178	-179.2	174.5	0	111.7	D157 S158 M163 E164	D157-K161 PolarHBondContact O-N 3.5Å; S158-K161 PolarHBondContact O-N 3.01Å; K161-M163 VanDerWaalsContact C-N 3.27Å; K161-M163 PolarHBondContact O-N 2.99Å; K161-E164 WeakPolarHBondContact O-CB 3.22Å; K161-E164 PolarHBondContact O-N 3.24Å
162	A	85.2	Confident	80	Confident	85 Å²	85	84.2 Å²	84.2	70%	0.702	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.2	174.3	0	0	0	0	0	114.3	S158 R159 V160 E164	S158-A162 PolarHBondContact O-N 2.93Å; S158-A162 VanDerWaalsContact O-N 3.08Å; R159-A162 PolarHBondContact O-N 3.37Å; V160-A162 PolarHBondContact O-N 3.3Å; A162-E164 VanDerWaalsContact C-N 3.33Å
163	M	82.1	Confident	79.9	Confident	13 Å²	13	83.3 Å²	83.3	6%	0.064	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-16.7	173.4	-69	176.5	-176.8	0	0	112.7	R159 V160 K161 V165 K238 L239 Q243 L255	R159-M163 WeakPolarHBondContact O-CG 3.36Å; R159-M163 PolarHBondContact O-N 3.27Å; V160-M163 WeakPolarHBondContact O-CB 3.47Å; V160-M163 PolarHBondContact O-N 2.99Å; K161-M163 VanDerWaalsContact C-N 3.27Å; K161-M163 PolarHBondContact O-N 2.99Å; M163-V165 PolarHBondContact O-N 3.39Å; M163-K238 WeakPolarHBondContact CB-O 3.5Å; M163-K238 PolarHBondContact O-N 3.24Å; M163-L239 HydrophobicContact SD-CB 4.47Å; M163-L239 HydrophobicContact SD-CD1 4.27Å; M163-L239 HydrophobicContact SD-CG 4.24Å; M163-Q243 HydrophobicContact CE-CB 4.09Å; M163-L255 HydrophobicContact CE-CD1 4.16Å; M163-L255 HydrophobicContact CE-CD2 3.38Å; M163-L255 HydrophobicContact CE-CG 4.32Å; M163-L255 HydrophobicContact SD-CD2 3.82Å
164	E	80.4	Confident	79.9	Confident	42 Å²	42	80.9 Å²	80.9	20%	0.196	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-67.8	125.2	170	-173.5	171.8	-173.4	0	0	109.2	V160 K161 A162 D166 K266	V160-E164 PolarHBondContact O-N 2.8Å; K161-E164 WeakPolarHBondContact O-CB 3.22Å; K161-E164 PolarHBondContact O-N 3.24Å; A162-E164 VanDerWaalsContact C-N 3.33Å; E164-D166 PolarHBondContact O-N 2.99Å; E164-K266 WeakPolarHBondContact OE1-CD 3.49Å; E164-K266 IonicContact OE1-NZ 3.05Å; E164-K266 PolarHBondContact OE1-NZ 3.09Å; E164-K266 IonicContact OE2-NZ 2.77Å; E164-K266 PolarHBondContact OE2-NZ 2.66Å
165	V	72.5	Confident	80	Confident	52 Å²	52	81.1 Å²	81.1	32%	0.315	42%	0.417	S	S	.	.			trans	-87.8	97	178.2	-178.2	0	0	0	0	108.2	M163 E167 F236 K238	M163-V165 PolarHBondContact O-N 3.39Å; V165-E167 VanDerWaalsContact C-N 3.27Å; V165-E167 WeakPolarHBondContact CG1-O 3.12Å; V165-E167 PolarHBondContact O-N 3.05Å; V165-F236 HydrophobicContact CB-CD1 4.06Å; V165-F236 WeakPolarHBondContact CB-O 3.38Å; V165-F236 HydrophobicContact CG2-CD1 3.69Å; V165-F236 HydrophobicContact CG2-CE1 4.23Å; V165-F236 PolarHBondContact N-O 2.95Å; V165-K238 HydrophobicContact CG2-CB 3.74Å
166	D	61.8	Low	80.4	Confident	141 Å²	141	75.4 Å²	75.4	75%	0.754	39%	0.39	S	S	*	.			trans	-65.2	-30.9	176.3	-71.9	-31.9	0	0	0	112.1	E164	E164-D166 PolarHBondContact O-N 2.99Å
167	E	62.2	Low	80.5	Confident	169 Å²	169	74.2 Å²	74.2	79%	0.79	39%	0.388	S	S	*	.	S	Bend	trans	-94.1	109.2	178.5	-72.3	-170.3	164.7	0	0	112	V165 P169	V165-E167 VanDerWaalsContact C-N 3.27Å; V165-E167 WeakPolarHBondContact CG1-O 3.12Å; V165-E167 PolarHBondContact O-N 3.05Å; E167-P169 WeakPolarHBondContact O-CD 3.48Å; E167-P169 VanDerWaalsContact O-N 3.16Å
168	R	65.8	Low	80.6	Confident	206 Å²	206	74.6 Å²	74.6	78%	0.777	40%	0.398	S	S	*	.			trans	-57.2	120.9	175.3	-65.3	179	-178.4	171	0.9	109.9	T170	R168-T170 PolarHBondContact O-N 3.03Å
169	P	67.7	Low	80.8	Confident	30 Å²	30	71 Å²	71	20%	0.195	37%	0.372	C	S	.	.			trans	-59.1	136.2	170.9	22.2	-29.8	0	0	0	109	E167 R226 A229 A230	E167-P169 WeakPolarHBondContact O-CD 3.48Å; E167-P169 VanDerWaalsContact O-N 3.16Å; P169-R226 HydrophobicContact CB-CB 4Å; P169-R226 HydrophobicContact CB-CG 4.48Å; P169-R226 HydrophobicContact CG-CB 4.26Å; P169-R226 WeakPolarHBondContact CG-O 3.36Å; P169-A229 HydrophobicContact CG-CB 4.15Å; P169-A230 HydrophobicContact CG-CB 4.38Å; P169-A230 WeakPolarHBondContact O-CB 3.19Å
170	T	77.4	Confident	80.9	Confident	126 Å²	126	72.8 Å²	72.8	77%	0.773	39%	0.387	S	S	*	.			trans	-96.7	5.3	-178.7	58.5	0	0	0	0	112.9	R168	R168-T170 PolarHBondContact O-N 3.03Å
171	E	81.4	Confident	81.2	Confident	50 Å²	50	80.3 Å²	80.3	23%	0.234	42%	0.42	C	S	.	.			trans	-67.8	131.7	-175.5	-65.4	174.1	-171.4	0	0	110.5	L223 R226 A227 A230	E171-L223 VanDerWaalsContact OE2-CD2 3.3Å; E171-L223 WeakPolarHBondContact OE2-CD2 3.44Å; E171-R226 WeakPolarHBondContact OE2-CB 3.35Å; E171-A227 HydrophobicContact CB-CB 4.35Å; E171-A227 WeakPolarHBondContact O-CA 3.27Å; E171-A230 WeakPolarHBondContact O-CB 3.41Å
172	Q	86.1	Confident	81.6	Confident	129 Å²	129	76.3 Å²	76.3	60%	0.603	40%	0.403	S	S	*	.			trans	-106.1	158.7	176.8	-63.2	-172.4	19.6	0	0	110.8	S174 D175	Q172-S174 WeakPolarHBondContact CB-OG 3.35Å; Q172-S174 PolarHBondContact O-N 3.23Å; Q172-S174 VanDerWaalsContact O-N 3.15Å; Q172-D175 PolarHBondContact N-OD2 3.39Å; Q172-D175 WeakPolarHBondContact O-CB 3.42Å; Q172-D175 PolarHBondContact O-N 3.27Å
173	Y	87.8	Confident	82	Confident	41 Å²	41	73.2 Å²	73.2	16%	0.161	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-61.7	-22.1	174.1	-62.6	-55.4	0	0	0	113.3	D175 I176 I183 V187 L224 A227 C228 Q231	Y173-D175 PolarHBondContact O-N 3.27Å; Y173-I176 HydrophobicContact CD1-CD1 4.37Å; Y173-I176 PolarHBondContact O-N 2.9Å; Y173-I176 VanDerWaalsContact O-N 3.13Å; Y173-I183 HydrophobicContact CD1-CG1 4.39Å; Y173-I183 HydrophobicContact CD1-CG2 3.92Å; Y173-I183 HydrophobicContact CD2-CG2 4.46Å; Y173-I183 HydrophobicContact CE1-CG2 4.18Å; Y173-I183 HydrophobicContact CG-CG2 4.09Å; Y173-V187 HydrophobicContact CE2-CG2 4.01Å; Y173-L224 HydrophobicContact CD1-CD1 4.17Å; Y173-L224 HydrophobicContact CE1-CD1 3.99Å; Y173-A227 HydrophobicContact CD1-CB 3.96Å; Y173-A227 HydrophobicContact CE1-CB 3.96Å; Y173-C228 WeakPolarHBondContact OH-CA 3.31Å; Y173-Q231 HydrophobicContact CE2-CB 4.4Å; Y173-Q231 VanDerWaalsContact CE2-CD 3.48Å; Y173-Q231 HydrophobicContact CE2-CG 4.44Å
174	S	87.1	Confident	82.5	Confident	60 Å²	60	78.1 Å²	78.1	42%	0.42	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-65.6	-16.4	173.3	56.9	0	0	0	0	114.3	Q172 R359	Q172-S174 WeakPolarHBondContact CB-OG 3.35Å; Q172-S174 PolarHBondContact O-N 3.23Å; Q172-S174 VanDerWaalsContact O-N 3.15Å; S174-R359 PolarHBondContact O-NH1 3.06Å
175	D	86.3	Confident	83.1	Confident	75 Å²	75	79.5 Å²	79.5	40%	0.401	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-93	-0.3	177.9	-56.3	-32.6	0	0	0	111.9	Q172 Y173 I356	Q172-D175 PolarHBondContact N-OD2 3.39Å; Q172-D175 WeakPolarHBondContact O-CB 3.42Å; Q172-D175 PolarHBondContact O-N 3.27Å; Y173-D175 PolarHBondContact O-N 3.27Å; D175-I356 HydrophobicContact CB-CG2 4.44Å
176	I	88.6	Confident	84	Confident	22 Å²	22	77 Å²	77	11%	0.113	39%	0.389	C	S	.	.	S	Bend	trans	-109.7	119.1	176.9	-56.3	177.7	0	0	0	108.2	Y173 L179 I183 L224 A227	Y173-I176 HydrophobicContact CD1-CD1 4.37Å; Y173-I176 PolarHBondContact O-N 2.9Å; Y173-I176 VanDerWaalsContact O-N 3.13Å; I176-L179 HydrophobicContact CG2-CB 4.2Å; I176-L179 HydrophobicContact CG2-CD1 3.93Å; I176-I183 HydrophobicContact CB-CD1 4.35Å; I176-I183 HydrophobicContact CG2-CD1 4.21Å; I176-L224 HydrophobicContact CD1-CB 4.25Å; I176-L224 HydrophobicContact CD1-CD1 3.68Å; I176-A227 HydrophobicContact CD1-CB 3.86Å
177	G	87.8	Confident	85.4	Confident	8 Å²	8	72.2 Å²	72.2	8%	0.082	36%	0.364	C	S	.	.			trans	-100.8	135.7	-178.3	0	0	0	0	0	113	L179	G177-L179 PolarHBondContact O-N 3.46Å
178	G	86.8	Confident	86.7	Confident	35 Å²	35	67.9 Å²	67.9	36%	0.361	34%	0.344	S	S	.	.	S	Bend	trans	76.4	14.4	165	0	0	0	0	0	116.6
179	L	90.9	Very high	87.8	Confident	17 Å²	17	58.2 Å²	58.2	9%	0.089	31%	0.308	C	S	.	.			trans	-119.8	32.7	-178.8	-66.6	173.3	0	0	0	112.3	I176 G177 K181 Q182 I183 T219 F342	I176-L179 HydrophobicContact CG2-CB 4.2Å; I176-L179 HydrophobicContact CG2-CD1 3.93Å; G177-L179 PolarHBondContact O-N 3.46Å; L179-K181 VanDerWaalsContact C-N 3.3Å; L179-K181 PolarHBondContact O-N 3.28Å; L179-Q182 HydrophobicContact CB-CB 4.4Å; L179-Q182 HydrophobicContact CD2-CG 4.43Å; L179-Q182 PolarHBondContact O-N 3.44Å; L179-Q182 VanDerWaalsContact O-N 3.14Å; L179-Q182 PolarHBondContact O-OE1 3.41Å; L179-I183 VanDerWaalsContact O-CG1 3.28Å; L179-I183 WeakPolarHBondContact O-CG1 3.47Å; L179-I183 PolarHBondContact O-N 3.36Å; L179-T219 WeakPolarHBondContact CD1-O 3.49Å; L179-F342 HydrophobicContact CD1-CD1 3.97Å; L179-F342 HydrophobicContact CD1-CE1 3.9Å; L179-F342 HydrophobicContact CD2-CD1 4.23Å
180	D	90.7	Very high	88.7	Confident	118 Å²	118	56.9 Å²	56.9	63%	0.631	30%	0.3	S	S	*	.	H	α-helix	trans	-59.9	-38.9	-171.3	-58.6	-50.7	0	0	0	112.8	I183 Q184	D180-I183 PolarHBondContact O-N 3.08Å; D180-Q184 PolarHBondContact O-N 3.02Å
181	K	92.4	Very high	89.2	Confident	159 Å²	159	51.4 Å²	51.4	69%	0.691	27%	0.266	S	S	*	.	H	α-helix	trans	-63.4	-46.6	176.3	-66.8	-176.9	-179.7	178.6	0	111.5	L179 Q184 E185	L179-K181 VanDerWaalsContact C-N 3.3Å; L179-K181 PolarHBondContact O-N 3.28Å; K181-Q184 PolarHBondContact O-N 3.37Å; K181-E185 WeakPolarHBondContact O-CG 3.48Å; K181-E185 PolarHBondContact O-N 3.35Å
182	Q	93.4	Very high	89.5	Confident	24 Å²	24	52 Å²	52	11%	0.112	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-38.2	179.7	-67.2	77.6	7.3	0	0	111.6	L179 E185 L186 I340 E341 F342 P343	L179-Q182 HydrophobicContact CB-CB 4.4Å; L179-Q182 HydrophobicContact CD2-CG 4.43Å; L179-Q182 PolarHBondContact O-N 3.44Å; L179-Q182 VanDerWaalsContact O-N 3.14Å; L179-Q182 PolarHBondContact O-OE1 3.41Å; Q182-E185 PolarHBondContact O-N 3.22Å; Q182-L186 WeakPolarHBondContact O-CB 3.5Å; Q182-L186 PolarHBondContact O-N 2.9Å; Q182-I340 HydrophobicContact CB-CG2 3.76Å; Q182-I340 HydrophobicContact CG-CG2 3.54Å; Q182-E341 WeakPolarHBondContact CG-O 3.08Å; Q182-E341 PolarHBondContact NE2-O 3.26Å; Q182-F342 HydrophobicContact CB-CZ 4.47Å; Q182-P343 VanDerWaalsContact NE2-CD 3.33Å
183	I	92.2	Very high	89.6	Confident	20 Å²	20	46.1 Å²	46.1	10%	0.103	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-48.8	173.9	-68.1	162.1	0	0	0	109.6	Y173 I176 L179 D180 L186 V187 L224	Y173-I183 HydrophobicContact CD1-CG1 4.39Å; Y173-I183 HydrophobicContact CD1-CG2 3.92Å; Y173-I183 HydrophobicContact CD2-CG2 4.46Å; Y173-I183 HydrophobicContact CE1-CG2 4.18Å; Y173-I183 HydrophobicContact CG-CG2 4.09Å; I176-I183 HydrophobicContact CB-CD1 4.35Å; I176-I183 HydrophobicContact CG2-CD1 4.21Å; L179-I183 VanDerWaalsContact O-CG1 3.28Å; L179-I183 WeakPolarHBondContact O-CG1 3.47Å; L179-I183 PolarHBondContact O-N 3.36Å; D180-I183 PolarHBondContact O-N 3.08Å; I183-L186 PolarHBondContact O-N 3.08Å; I183-V187 HydrophobicContact CG2-CG2 4.2Å; I183-V187 WeakPolarHBondContact O-CB 3.43Å; I183-V187 WeakPolarHBondContact O-CG2 3.17Å; I183-V187 PolarHBondContact O-N 2.87Å; I183-L224 HydrophobicContact CB-CD1 4.44Å; I183-L224 HydrophobicContact CG1-CD1 3.53Å
184	Q	92.9	Very high	89.4	Confident	117 Å²	117	45.5 Å²	45.5	55%	0.547	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-49.1	179	-176.3	178.4	-6	0	0	112	D180 K181 L186 V187 E188	D180-Q184 PolarHBondContact O-N 3.02Å; K181-Q184 PolarHBondContact O-N 3.37Å; Q184-L186 VanDerWaalsContact C-N 3.29Å; Q184-L186 PolarHBondContact O-N 3.46Å; Q184-V187 PolarHBondContact O-N 2.78Å; Q184-E188 HydrophobicContact CG-CG 4.41Å; Q184-E188 VanDerWaalsContact CG-OE1 3.32Å; Q184-E188 WeakPolarHBondContact CG-OE1 3.45Å; Q184-E188 PolarHBondContact NE2-OE1 3.14Å; Q184-E188 WeakPolarHBondContact O-CB 3.44Å; Q184-E188 WeakPolarHBondContact O-CG 3.39Å; Q184-E188 PolarHBondContact O-N 3.17Å
185	E	92.6	Very high	89.3	Confident	71 Å²	71	47.4 Å²	47.4	33%	0.332	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-38.6	179.8	-74.1	-178.3	-175.7	0	0	112.8	K181 Q182 A189 I340	K181-E185 WeakPolarHBondContact O-CG 3.48Å; K181-E185 PolarHBondContact O-N 3.35Å; Q182-E185 PolarHBondContact O-N 3.22Å; E185-A189 VanDerWaalsContact O-CB 3.3Å; E185-A189 WeakPolarHBondContact O-CB 3.5Å; E185-A189 PolarHBondContact O-N 3.26Å; E185-A189 VanDerWaalsContact O-N 3.09Å; E185-I340 HydrophobicContact CB-CD1 3.9Å; E185-I340 HydrophobicContact CB-CG1 4.33Å
186	L	91.6	Very high	89.2	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-43.3	177.3	-169.6	102.2	0	0	0	111.7	Q182 I183 Q184 A189 I190 V211 M213 L224 C228 I340	Q182-L186 WeakPolarHBondContact O-CB 3.5Å; Q182-L186 PolarHBondContact O-N 2.9Å; I183-L186 PolarHBondContact O-N 3.08Å; Q184-L186 VanDerWaalsContact C-N 3.29Å; Q184-L186 PolarHBondContact O-N 3.46Å; L186-A189 PolarHBondContact O-N 3.4Å; L186-I190 HydrophobicContact CD1-CD1 3.96Å; L186-I190 HydrophobicContact CG-CD1 3.95Å; L186-I190 WeakPolarHBondContact O-CB 3.31Å; L186-I190 PolarHBondContact O-N 2.88Å; L186-V211 HydrophobicContact CD1-CG1 4.25Å; L186-M213 HydrophobicContact CD1-SD 3.99Å; L186-L224 HydrophobicContact CB-CD2 4.26Å; L186-L224 HydrophobicContact CD1-CD2 4.23Å; L186-L224 HydrophobicContact CD2-CD1 4.41Å; L186-L224 HydrophobicContact CD2-CD2 3.99Å; L186-L224 HydrophobicContact CD2-CG 3.86Å; L186-L224 HydrophobicContact CG-CD2 4.39Å; L186-C228 HydrophobicContact CD2-CB 3.57Å; L186-I340 HydrophobicContact CB-CD1 4.04Å; L186-I340 HydrophobicContact CD1-CD1 4.17Å
187	V	91.1	Very high	89	Confident	39 Å²	39	50.6 Å²	50.6	24%	0.236	26%	0.258	C	S	.	.	I	π-helix	trans	-62.2	-44.3	177.8	169.4	0	0	0	0	110.4	Y173 I183 Q184 A189 V191 L192	Y173-V187 HydrophobicContact CE2-CG2 4.01Å; I183-V187 HydrophobicContact CG2-CG2 4.2Å; I183-V187 WeakPolarHBondContact O-CB 3.43Å; I183-V187 WeakPolarHBondContact O-CG2 3.17Å; I183-V187 PolarHBondContact O-N 2.87Å; Q184-V187 PolarHBondContact O-N 2.78Å; V187-A189 VanDerWaalsContact C-N 3.33Å; V187-A189 PolarHBondContact O-N 3.42Å; V187-V191 HydrophobicContact CB-CG2 4.29Å; V187-V191 HydrophobicContact CG1-CB 3.96Å; V187-V191 HydrophobicContact CG1-CG1 4.47Å; V187-V191 HydrophobicContact CG1-CG2 4.17Å; V187-V191 HydrophobicContact CG2-CG2 4.21Å; V187-V191 WeakPolarHBondContact O-CA 3.46Å; V187-V191 VanDerWaalsContact O-CB 3.31Å; V187-V191 WeakPolarHBondContact O-CB 3.34Å; V187-V191 PolarHBondContact O-N 3.41Å; V187-L192 PolarHBondContact O-N 2.88Å
188	E	89.6	Confident	89	Confident	79 Å²	79	57 Å²	57	37%	0.369	29%	0.287	S	S	.	.	I	π-helix	trans	-63.2	-37.4	175.9	-73.1	174.8	-172.9	0	0	112.5	Q184 L192 P193	Q184-E188 HydrophobicContact CG-CG 4.41Å; Q184-E188 VanDerWaalsContact CG-OE1 3.32Å; Q184-E188 WeakPolarHBondContact CG-OE1 3.45Å; Q184-E188 PolarHBondContact NE2-OE1 3.14Å; Q184-E188 WeakPolarHBondContact O-CB 3.44Å; Q184-E188 WeakPolarHBondContact O-CG 3.39Å; Q184-E188 PolarHBondContact O-N 3.17Å; E188-L192 WeakPolarHBondContact O-CB 3.41Å; E188-P193 WeakPolarHBondContact O-CD 3.44Å
189	A	88.6	Confident	89.1	Confident	3 Å²	3	61.2 Å²	61.2	3%	0.025	30%	0.295	C	S	.	.	I	π-helix	trans	-77.9	-31.9	-178.3	0	0	0	0	0	113.8	E185 L186 V187 P193 P208 V211 R338	E185-A189 VanDerWaalsContact O-CB 3.3Å; E185-A189 WeakPolarHBondContact O-CB 3.5Å; E185-A189 PolarHBondContact O-N 3.26Å; E185-A189 VanDerWaalsContact O-N 3.09Å; L186-A189 PolarHBondContact O-N 3.4Å; V187-A189 VanDerWaalsContact C-N 3.33Å; V187-A189 PolarHBondContact O-N 3.42Å; A189-P193 WeakPolarHBondContact O-CG 3.39Å; A189-P208 HydrophobicContact CB-CG 3.99Å; A189-V211 HydrophobicContact CB-CG2 3.62Å; A189-R338 HydrophobicContact CB-CG 4.19Å
190	I	88.3	Confident	88.9	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.01	30%	0.296	C	S	.	.	I	π-helix	trans	-116.9	-53	-169.4	-54	-178	0	0	0	112.1	L186 P193 M194 V211 I270 K315 I317	L186-I190 HydrophobicContact CD1-CD1 3.96Å; L186-I190 HydrophobicContact CG-CD1 3.95Å; L186-I190 WeakPolarHBondContact O-CB 3.31Å; L186-I190 PolarHBondContact O-N 2.88Å; I190-P193 WeakPolarHBondContact O-CD 3.42Å; I190-M194 WeakPolarHBondContact O-CG 3.39Å; I190-M194 PolarHBondContact O-N 3.15Å; I190-V211 HydrophobicContact CD1-CG2 4.03Å; I190-V211 HydrophobicContact CG1-CG2 3.94Å; I190-I270 HydrophobicContact CG2-CD1 3.85Å; I190-I270 HydrophobicContact CG2-CG1 4.31Å; I190-K315 HydrophobicContact CG2-CB 4.29Å; I190-K315 HydrophobicContact CG2-CG 4.42Å; I190-I317 HydrophobicContact CD1-CD1 3.32Å; I190-I317 HydrophobicContact CD1-CG1 3.35Å
191	V	87.8	Confident	88.8	Confident	11 Å²	11	62.7 Å²	62.7	7%	0.067	30%	0.297	C	S	.	.	I	π-helix	trans	-72.3	-41.9	-174.2	-175.9	0	0	0	0	110.6	V187 M194 N195 T232	V187-V191 HydrophobicContact CB-CG2 4.29Å; V187-V191 HydrophobicContact CG1-CB 3.96Å; V187-V191 HydrophobicContact CG1-CG1 4.47Å; V187-V191 HydrophobicContact CG1-CG2 4.17Å; V187-V191 HydrophobicContact CG2-CG2 4.21Å; V187-V191 WeakPolarHBondContact O-CA 3.46Å; V187-V191 VanDerWaalsContact O-CB 3.31Å; V187-V191 WeakPolarHBondContact O-CB 3.34Å; V187-V191 PolarHBondContact O-N 3.41Å; V191-M194 PolarHBondContact O-N 3.43Å; V191-N195 WeakPolarHBondContact CG1-ND2 3.49Å; V191-N195 PolarHBondContact O-N 3.33Å; V191-T232 HydrophobicContact CB-CG2 4.31Å; V191-T232 HydrophobicContact CG1-CG2 4.32Å; V191-T232 HydrophobicContact CG2-CG2 3.69Å
192	L	88	Confident	88.7	Confident	61 Å²	61	61.9 Å²	61.9	32%	0.319	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-47.2	-177.3	-162.3	79.4	0	0	0	112.3	V187 E188 M194 N195 H196 F200	V187-L192 PolarHBondContact O-N 2.88Å; E188-L192 WeakPolarHBondContact O-CB 3.41Å; L192-M194 VanDerWaalsContact C-N 3.29Å; L192-M194 PolarHBondContact O-N 3.48Å; L192-N195 PolarHBondContact O-N 3.39Å; L192-H196 WeakPolarHBondContact O-CA 3.3Å; L192-H196 PolarHBondContact O-N 3.04Å; L192-F200 HydrophobicContact CB-CE2 4.41Å; L192-F200 HydrophobicContact CD2-CE2 4.03Å; L192-F200 HydrophobicContact CD2-CZ 3.93Å; L192-F200 HydrophobicContact CG-CE2 4.08Å; L192-F200 HydrophobicContact CG-CZ 4.38Å
193	P	86.8	Confident	88.6	Confident	7 Å²	7	66.6 Å²	66.6	5%	0.045	33%	0.325	C	S	.	.	H	α-helix	trans	-67.4	-25.5	175.5	-21.5	34.2	0	0	0	114.3	E188 A189 I190 K197 F200 P207	E188-P193 WeakPolarHBondContact O-CD 3.44Å; A189-P193 WeakPolarHBondContact O-CG 3.39Å; I190-P193 WeakPolarHBondContact O-CD 3.42Å; P193-K197 WeakPolarHBondContact O-CG 3.43Å; P193-F200 HydrophobicContact CB-CE2 4.05Å; P193-F200 HydrophobicContact CB-CZ 4.35Å; P193-F200 HydrophobicContact CG-CE1 4.41Å; P193-F200 HydrophobicContact CG-CE2 3.81Å; P193-F200 HydrophobicContact CG-CZ 3.67Å; P193-P207 HydrophobicContact CB-CB 3.67Å; P193-P207 HydrophobicContact CB-CG 4.34Å; P193-P207 HydrophobicContact CG-CB 3.69Å
194	M	83.6	Confident	88.4	Confident	27 Å²	27	68.9 Å²	68.9	13%	0.133	35%	0.354	C	S	.	.	H	α-helix	trans	-73.5	-45	177.5	-71.7	-68.3	-160	0	0	111.3	I190 V191 L192 P268 I270 Q313 K315	I190-M194 WeakPolarHBondContact O-CG 3.39Å; I190-M194 PolarHBondContact O-N 3.15Å; V191-M194 PolarHBondContact O-N 3.43Å; L192-M194 VanDerWaalsContact C-N 3.29Å; L192-M194 PolarHBondContact O-N 3.48Å; M194-P268 HydrophobicContact CE-CB 4.38Å; M194-P268 HydrophobicContact SD-CB 3.97Å; M194-I270 HydrophobicContact CE-CG1 4.19Å; M194-Q313 WeakPolarHBondContact CE-O 3.47Å; M194-K315 HydrophobicContact CE-CB 4.17Å; M194-K315 HydrophobicContact CE-CG 3.62Å
195	N	84.8	Confident	88.2	Confident	101 Å²	101	67.3 Å²	67.3	54%	0.54	35%	0.349	S	S	.	.	H	α-helix	trans	-88.3	-32.2	-174.2	-69.2	-18.5	0	0	0	113.8	V191 L192	V191-N195 WeakPolarHBondContact CG1-ND2 3.49Å; V191-N195 PolarHBondContact O-N 3.33Å; L192-N195 PolarHBondContact O-N 3.39Å
196	H	85.8	Confident	87.7	Confident	87 Å²	87	70.8 Å²	70.8	40%	0.403	37%	0.365	S	S	.	.			trans	-129.6	59.7	-170.2	-59.6	93.6	0	0	0	112.4	L192 E198 K199	L192-H196 WeakPolarHBondContact O-CA 3.3Å; L192-H196 PolarHBondContact O-N 3.04Å; H196-E198 VanDerWaalsContact C-N 3.26Å; H196-E198 PolarHBondContact O-N 3.23Å; H196-K199 HydrophobicContact CB-CD 4.01Å; H196-K199 HydrophobicContact CB-CG 4.21Å; H196-K199 PolarHBondContact O-N 2.99Å
197	K	83.3	Confident	87.5	Confident	76 Å²	76	72.1 Å²	72.1	33%	0.33	37%	0.373	S	S	.	.	H	α-helix	trans	-58.8	-37.7	178.4	-66.9	178	-170.5	162.5	0	113	P193 K199 F200 E201	P193-K197 WeakPolarHBondContact O-CG 3.43Å; K197-K199 PolarHBondContact O-N 3.04Å; K197-K199 VanDerWaalsContact O-N 3.14Å; K197-F200 WeakPolarHBondContact O-CB 3.38Å; K197-F200 PolarHBondContact O-N 3.23Å; K197-E201 PolarHBondContact O-N 2.97Å; K197-E201 VanDerWaalsContact O-N 3.07Å
198	E	87.9	Confident	87.2	Confident	144 Å²	144	71.5 Å²	71.5	67%	0.673	37%	0.37	S	S	*	.	H	α-helix	trans	-55.3	-34.6	179.6	-61.4	176.6	-174.2	0	0	112.8	H196 F200 E201 N202	H196-E198 VanDerWaalsContact C-N 3.26Å; H196-E198 PolarHBondContact O-N 3.23Å; E198-F200 VanDerWaalsContact C-N 3.31Å; E198-F200 PolarHBondContact O-N 3.43Å; E198-E201 PolarHBondContact O-N 3.37Å; E198-N202 VanDerWaalsContact O-CB 3.26Å; E198-N202 WeakPolarHBondContact O-CB 3.39Å; E198-N202 PolarHBondContact O-N 3.34Å; E198-N202 PolarHBondContact O-ND2 3.39Å; E198-N202 VanDerWaalsContact O-ND2 3.17Å
199	K	88.9	Confident	86.9	Confident	122 Å²	122	70 Å²	70	53%	0.53	36%	0.363	S	S	.	.	H	α-helix	trans	-65.5	-35.8	177.8	-69.8	-175.9	179.4	175.4	0	112.1	H196 K197 L203	H196-K199 HydrophobicContact CB-CD 4.01Å; H196-K199 HydrophobicContact CB-CG 4.21Å; H196-K199 PolarHBondContact O-N 2.99Å; K197-K199 PolarHBondContact O-N 3.04Å; K197-K199 VanDerWaalsContact O-N 3.14Å; K199-L203 WeakPolarHBondContact O-CB 3.35Å; K199-L203 PolarHBondContact O-N 3.07Å
200	F	87.1	Confident	86.9	Confident	26 Å²	26	70 Å²	70	11%	0.114	36%	0.363	C	S	.	.	H	α-helix	trans	-75.4	-40.3	177.5	-70.2	-90.4	0	0	0	111.2	L192 P193 K197 E198 L203 G204 I205 P207	L192-F200 HydrophobicContact CB-CE2 4.41Å; L192-F200 HydrophobicContact CD2-CE2 4.03Å; L192-F200 HydrophobicContact CD2-CZ 3.93Å; L192-F200 HydrophobicContact CG-CE2 4.08Å; L192-F200 HydrophobicContact CG-CZ 4.38Å; P193-F200 HydrophobicContact CB-CE2 4.05Å; P193-F200 HydrophobicContact CB-CZ 4.35Å; P193-F200 HydrophobicContact CG-CE1 4.41Å; P193-F200 HydrophobicContact CG-CE2 3.81Å; P193-F200 HydrophobicContact CG-CZ 3.67Å; K197-F200 WeakPolarHBondContact O-CB 3.38Å; K197-F200 PolarHBondContact O-N 3.23Å; E198-F200 VanDerWaalsContact C-N 3.31Å; E198-F200 PolarHBondContact O-N 3.43Å; F200-L203 PolarHBondContact O-N 3.11Å; F200-G204 PolarHBondContact O-N 2.85Å; F200-I205 HydrophobicContact CD1-CD1 3.89Å; F200-I205 HydrophobicContact CD1-CG1 3.93Å; F200-I205 HydrophobicContact CE1-CD1 4.15Å; F200-I205 PolarHBondContact O-N 3.42Å; F200-I205 VanDerWaalsContact O-N 3.16Å; F200-P207 HydrophobicContact CD1-CB 4.04Å; F200-P207 HydrophobicContact CE1-CB 4.07Å; F200-P207 HydrophobicContact CG-CB 4.48Å
201	E	87.3	Confident	87.2	Confident	141 Å²	141	70 Å²	70	66%	0.659	36%	0.363	S	S	*	.	H	α-helix	trans	-65.2	-45.3	177.4	-69.2	176.8	-178.4	0	0	111.9	K197 E198 L203 G204	K197-E201 PolarHBondContact O-N 2.97Å; K197-E201 VanDerWaalsContact O-N 3.07Å; E198-E201 PolarHBondContact O-N 3.37Å; E201-L203 VanDerWaalsContact C-N 3.3Å; E201-L203 PolarHBondContact O-N 3.06Å; E201-G204 PolarHBondContact O-N 3.43Å; E201-G204 VanDerWaalsContact O-N 3.13Å
202	N	91.1	Very high	87.5	Confident	141 Å²	141	69.6 Å²	69.6	75%	0.754	36%	0.36	S	S	*	.	H	α-helix	trans	-64.1	-34.3	177.6	-72	-24.1	0	0	0	112.9	E198	E198-N202 VanDerWaalsContact O-CB 3.26Å; E198-N202 WeakPolarHBondContact O-CB 3.39Å; E198-N202 PolarHBondContact O-N 3.34Å; E198-N202 PolarHBondContact O-ND2 3.39Å; E198-N202 VanDerWaalsContact O-ND2 3.17Å
203	L	92.1	Very high	87.8	Confident	123 Å²	123	66.7 Å²	66.7	64%	0.644	35%	0.345	S	S	*	.	H	α-helix	trans	-82.8	-16.1	177.1	-172.5	59.6	0	0	0	112.4	K199 F200 E201 I205	K199-L203 WeakPolarHBondContact O-CB 3.35Å; K199-L203 PolarHBondContact O-N 3.07Å; F200-L203 PolarHBondContact O-N 3.11Å; E201-L203 VanDerWaalsContact C-N 3.3Å; E201-L203 PolarHBondContact O-N 3.06Å; L203-I205 VanDerWaalsContact C-N 3.34Å; L203-I205 HydrophobicContact CB-CG1 4.13Å; L203-I205 HydrophobicContact CD2-CD1 3.61Å; L203-I205 HydrophobicContact CD2-CG1 3.81Å; L203-I205 HydrophobicContact CD2-CG2 4.41Å; L203-I205 HydrophobicContact CG-CD1 4.34Å; L203-I205 HydrophobicContact CG-CG1 4Å; L203-I205 HydrophobicContact CG-CG2 4.15Å
204	G	87.1	Confident	88.2	Confident	68 Å²	68	68.8 Å²	68.8	70%	0.701	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	23.4	-179	0	0	0	0	0	114.4	F200 E201	F200-G204 PolarHBondContact O-N 2.85Å; E201-G204 PolarHBondContact O-N 3.43Å; E201-G204 VanDerWaalsContact O-N 3.13Å
205	I	88.1	Confident	88.6	Confident	85 Å²	85	68 Å²	68	44%	0.436	35%	0.352	S	S	.	.			trans	-107.7	145.1	179.6	58.7	160	0	0	0	111.5	F200 L203	F200-I205 HydrophobicContact CD1-CD1 3.89Å; F200-I205 HydrophobicContact CD1-CG1 3.93Å; F200-I205 HydrophobicContact CE1-CD1 4.15Å; F200-I205 PolarHBondContact O-N 3.42Å; F200-I205 VanDerWaalsContact O-N 3.16Å; L203-I205 VanDerWaalsContact C-N 3.34Å; L203-I205 HydrophobicContact CB-CG1 4.13Å; L203-I205 HydrophobicContact CD2-CD1 3.61Å; L203-I205 HydrophobicContact CD2-CG1 3.81Å; L203-I205 HydrophobicContact CD2-CG2 4.41Å; L203-I205 HydrophobicContact CG-CD1 4.34Å; L203-I205 HydrophobicContact CG-CG1 4Å; L203-I205 HydrophobicContact CG-CG2 4.15Å
206	Q	83.4	Confident	88.8	Confident	143 Å²	143	65.2 Å²	65.2	67%	0.668	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-83.5	134.2	175.1	-65.8	-179.2	5.5	0	0	110.1	P310	Q206-P310 HydrophobicContact CG-CB 4.23Å
207	P	86.1	Confident	89	Confident	28 Å²	28	65 Å²	65	18%	0.182	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-68.5	151.4	175.4	30	-35	0	0	0	110.5	P193 F200 K209	P193-P207 HydrophobicContact CB-CB 3.67Å; P193-P207 HydrophobicContact CB-CG 4.34Å; P193-P207 HydrophobicContact CG-CB 3.69Å; F200-P207 HydrophobicContact CD1-CB 4.04Å; F200-P207 HydrophobicContact CE1-CB 4.07Å; F200-P207 HydrophobicContact CG-CB 4.48Å; P207-K209 PolarHBondContact O-N 3.42Å
208	P	86.2	Confident	89.1	Confident	27 Å²	27	62.9 Å²	62.9	18%	0.175	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-60.3	140.1	176.5	26.2	-33.5	0	0	0	110.5	A189 K315 D337 R338	A189-P208 HydrophobicContact CB-CG 3.99Å; P208-K315 PolarHBondContact O-NZ 3.24Å; P208-D337 WeakPolarHBondContact CA-OD2 3.48Å; P208-D337 HydrophobicContact CB-CB 3.98Å; P208-R338 HydrophobicContact CB-CG 4.07Å; P208-R338 HydrophobicContact CG-CG 4.34Å
209	K	83.6	Confident	89.1	Confident	47 Å²	47	56.6 Å²	56.6	20%	0.204	32%	0.317	C	S	.	.	S	Bend	trans	-80.1	-40.2	-177.3	-70.9	-172.6	-176.6	-173.5	0	112.2	P207 F308 V316 G334 D337	P207-K209 PolarHBondContact O-N 3.42Å; K209-F308 HydrophobicContact CD-CB 4.5Å; K209-F308 PolarHBondContact NZ-O 3.43Å; K209-V316 PolarHBondContact O-N 2.95Å; K209-G334 WeakPolarHBondContact CD-O 3.29Å; K209-D337 PolarHBondContact N-OD2 2.98Å
210	G	88.6	Confident	89	Confident	3 Å²	3	51.8 Å²	51.8	3%	0.031	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	156.6	-176.6	0	0	0	0	0	114.1	V316 R335 D337 R338	G210-V316 CarbonylContact C-O 3.53Å; G210-V316 WeakPolarHBondContact CA-O 3.48Å; G210-R335 WeakPolarHBondContact CA-O 3.34Å; G210-R335 PolarHBondContact N-O 3.06Å; G210-D337 PolarHBondContact O-N 3.28Å; G210-R338 PolarHBondContact O-N 2.95Å
211	V	92.8	Very high	89.2	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.7	178	-174.2	0	0	0	0	109	L186 A189 I190 V316 I317 A318 R338 I340	L186-V211 HydrophobicContact CD1-CG1 4.25Å; A189-V211 HydrophobicContact CB-CG2 3.62Å; I190-V211 HydrophobicContact CD1-CG2 4.03Å; I190-V211 HydrophobicContact CG1-CG2 3.94Å; V211-V316 PolarHBondContact N-O 3.44Å; V211-I317 WeakPolarHBondContact O-CA 3.36Å; V211-A318 PolarHBondContact O-N 2.78Å; V211-R338 CarbonylContact C-O 3.49Å; V211-R338 WeakPolarHBondContact CA-O 3.41Å; V211-R338 HydrophobicContact CG1-CB 4.25Å; V211-R338 HydrophobicContact CG2-CB 4.24Å; V211-I340 HydrophobicContact CG1-CD1 3.49Å; V211-I340 VanDerWaalsContact CG1-CD1 3.49Å; V211-I340 HydrophobicContact CG1-CG1 3.78Å
212	L	94.2	Very high	89.3	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.6	171.9	179.4	64.3	0	0	0	109.7	L276 A318 T320 L326 L331 L336 R338 K339 I340	L212-L276 HydrophobicContact CD1-CD2 4.23Å; L212-A318 CarbonylContact C-O 3.45Å; L212-A318 WeakPolarHBondContact CA-O 3.23Å; L212-A318 HydrophobicContact CD1-CB 3.9Å; L212-T320 HydrophobicContact CD1-CG2 4Å; L212-L326 HydrophobicContact CD1-CD1 4.46Å; L212-L326 HydrophobicContact CD2-CD1 4.17Å; L212-L331 HydrophobicContact CD2-CD2 3.35Å; L212-L336 HydrophobicContact CB-CB 4.2Å; L212-L336 HydrophobicContact CB-CD1 4.2Å; L212-L336 HydrophobicContact CD1-CD1 4.23Å; L212-L336 HydrophobicContact CD2-CD1 4.38Å; L212-R338 PolarHBondContact N-O 3.33Å; L212-K339 CarbonylContact O-C 3.56Å; L212-K339 WeakPolarHBondContact O-CA 3.46Å; L212-I340 PolarHBondContact O-N 3.5Å
213	M	95.1	Very high	89.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.3	172.3	-61.5	-175.1	-62.9	0	0	109.5	L186 K221 L224 A225 F272 I317 A318 A319 T320 I340 F342	L186-M213 HydrophobicContact CD1-SD 3.99Å; M213-K221 HydrophobicContact CB-CB 4.48Å; M213-K221 HydrophobicContact CB-CD 4.38Å; M213-K221 HydrophobicContact CB-CG 4.36Å; M213-K221 HydrophobicContact CE-CB 4.31Å; M213-K221 WeakPolarHBondContact CE-O 3.38Å; M213-L224 HydrophobicContact SD-CD2 4.22Å; M213-A225 HydrophobicContact CE-CB 4.2Å; M213-F272 HydrophobicContact CE-CE2 3.75Å; M213-I317 HydrophobicContact CE-CG2 3.34Å; M213-I317 HydrophobicContact SD-CG2 4.27Å; M213-A318 PolarHBondContact N-O 2.84Å; M213-A319 HydrophobicContact CE-CB 4.26Å; M213-A319 WeakPolarHBondContact O-CA 3.36Å; M213-T320 PolarHBondContact O-N 2.9Å; M213-I340 WeakPolarHBondContact CA-O 3.43Å; M213-F342 HydrophobicContact CB-CD2 4.19Å; M213-F342 HydrophobicContact CB-CE2 3.63Å; M213-F342 HydrophobicContact CB-CZ 4.39Å; M213-F342 HydrophobicContact CG-CE2 3.68Å; M213-F342 HydrophobicContact CG-CZ 4.21Å; M213-F342 HydrophobicContact SD-CE2 3.85Å; M213-F342 HydrophobicContact SD-CZ 3.73Å
214	Y	94.5	Very high	89.1	Confident	51 Å²	51	37.3 Å²	37.3	20%	0.2	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	157.9	179	70.9	-86.8	0	0	0	112.4	T320 V323 K339 I340 E341 F342	Y214-T320 WeakPolarHBondContact CA-O 3.4Å; Y214-V323 HydrophobicContact CD2-CB 4.27Å; Y214-V323 HydrophobicContact CD2-CG1 4.1Å; Y214-V323 HydrophobicContact CG-CB 4.27Å; Y214-K339 HydrophobicContact CE1-CB 4.01Å; Y214-I340 PolarHBondContact N-O 2.93Å; Y214-E341 HydrophobicContact CD2-CG 4.28Å; Y214-E341 HydrophobicContact CE1-CB 4.17Å; Y214-E341 HydrophobicContact CE2-CB 3.88Å; Y214-E341 HydrophobicContact CE2-CG 3.57Å; Y214-E341 WeakPolarHBondContact OH-CB 3.31Å; Y214-E341 PolarHBondContact OH-OE2 2.87Å; Y214-F342 PolarHBondContact O-N 3.19Å
215	G	92.2	Very high	89.1	Confident	12 Å²	12	34 Å²	34	12%	0.124	20%	0.198	C	C	.	.	S	Bend	trans	149	-173.2	-178.2	0	0	0	0	0	113.2	K221 N321	G215-K221 PolarHBondContact O-NZ 3.07Å; G215-N321 WeakPolarHBondContact O-CA 3.3Å
216	P	90.4	Very high	89	Confident	42 Å²	42	34.2 Å²	34.2	27%	0.273	19%	0.193	S	C	.	.	S	Bend	trans	-62.7	153.8	175.7	-21.9	34.3	0	0	0	112.6	T219 F342 M344	P216-T219 HydrophobicContact CB-CG2 4.2Å; P216-T219 HydrophobicContact CG-CG2 4.49Å; P216-T219 WeakPolarHBondContact O-CG2 3.06Å; P216-T219 PolarHBondContact O-OG1 2.9Å; P216-F342 WeakPolarHBondContact CD-O 3.18Å; P216-M344 HydrophobicContact CB-CE 3.53Å; P216-M344 HydrophobicContact CB-SD 4.01Å; P216-M344 HydrophobicContact CG-CE 3.74Å; P216-M344 HydrophobicContact CG-CG 4.24Å; P216-M344 HydrophobicContact CG-SD 4.01Å
217	P	89	Confident	89.2	Confident	82 Å²	82	27.5 Å²	27.5	53%	0.532	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	147.8	172.2	29.5	-34.8	0	0	0	110.9	N380	P217-N380 PolarHBondContact O-ND2 3.3Å; P217-N380 VanDerWaalsContact O-ND2 3.07Å
218	G	86.1	Confident	89.2	Confident	32 Å²	32	26.1 Å²	26.1	33%	0.33	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	12.4	178.4	0	0	0	0	0	115.4	G381 A382	G218-G381 WeakPolarHBondContact O-CA 3.41Å; G218-G381 PolarHBondContact O-N 3.07Å; G218-G381 VanDerWaalsContact O-N 3.1Å; G218-A382 PolarHBondContact O-N 2.71Å
219	T	88.1	Confident	89.1	Confident	12 Å²	12	25.2 Å²	25.2	7%	0.074	15%	0.148	C	C	.	.	S	Bend	trans	-88.8	0.5	173.7	50.9	0	0	0	0	113.9	L179 P216 M344	L179-T219 WeakPolarHBondContact CD1-O 3.49Å; P216-T219 HydrophobicContact CB-CG2 4.2Å; P216-T219 HydrophobicContact CG-CG2 4.49Å; P216-T219 WeakPolarHBondContact O-CG2 3.06Å; P216-T219 PolarHBondContact O-OG1 2.9Å; T219-M344 HydrophobicContact CG2-SD 4.41Å
220	G	86.7	Confident	89	Confident	20 Å²	20	24.5 Å²	24.5	21%	0.206	15%	0.15	C	C	.	.	S	Bend	trans	90.5	19.4	172.1	0	0	0	0	0	116.4	T222 L223 L224	G220-T222 PolarHBondContact O-N 3.43Å; G220-L223 WeakPolarHBondContact O-CB 3.4Å; G220-L223 PolarHBondContact O-N 2.77Å; G220-L223 VanDerWaalsContact O-N 3.11Å; G220-L224 PolarHBondContact O-N 3.03Å
221	K	91.4	Very high	88.7	Confident	8 Å²	8	29.3 Å²	29.3	4%	0.035	17%	0.172	C	C	.	.	H	α-helix	trans	-53.9	-47.6	176.1	-57.1	175.7	-157.5	161.9	0	113.2	M213 G215 L223 L224 A225 A319 T320 N321 F342	M213-K221 HydrophobicContact CB-CB 4.48Å; M213-K221 HydrophobicContact CB-CD 4.38Å; M213-K221 HydrophobicContact CB-CG 4.36Å; M213-K221 HydrophobicContact CE-CB 4.31Å; M213-K221 WeakPolarHBondContact CE-O 3.38Å; G215-K221 PolarHBondContact O-NZ 3.07Å; K221-L223 VanDerWaalsContact C-N 3.33Å; K221-L223 PolarHBondContact O-N 2.99Å; K221-L224 PolarHBondContact O-N 3.49Å; K221-A225 PolarHBondContact O-N 3.37Å; K221-A225 VanDerWaalsContact O-N 3.13Å; K221-A319 HydrophobicContact CB-CB 4.37Å; K221-A319 HydrophobicContact CD-CB 4.46Å; K221-T320 PolarHBondContact NZ-O 2.93Å; K221-N321 PolarHBondContact NZ-OD1 2.93Å; K221-F342 HydrophobicContact CG-CB 4.49Å; K221-F342 HydrophobicContact CG-CD1 3.99Å; K221-F342 HydrophobicContact CG-CD2 4.01Å; K221-F342 HydrophobicContact CG-CE1 4.16Å; K221-F342 HydrophobicContact CG-CE2 4.23Å; K221-F342 HydrophobicContact CG-CG 3.89Å; K221-F342 HydrophobicContact CG-CZ 4.27Å
222	T	88.8	Confident	88.1	Confident	42 Å²	42	30 Å²	30	26%	0.258	18%	0.177	S	C	.	.	H	α-helix	trans	-67.3	-33.2	178.2	-44.7	0	0	0	0	112	G220 R226 F272 D274	G220-T222 PolarHBondContact O-N 3.43Å; T222-R226 WeakPolarHBondContact O-CG 3.42Å; T222-R226 PolarHBondContact O-N 2.89Å; T222-F272 HydrophobicContact CG2-CE1 4.05Å; T222-F272 HydrophobicContact CG2-CZ 4.3Å; T222-D274 PolarHBondContact OG1-OD2 3.19Å; T222-D274 VanDerWaalsContact OG1-OD2 3.06Å
223	L	88.6	Confident	87.5	Confident	77 Å²	77	38.1 Å²	38.1	40%	0.403	21%	0.212	S	C	.	.	H	α-helix	trans	-67	-44.5	175	-72.6	169.4	0	0	0	110.8	E171 G220 K221 A225 R226 A227	E171-L223 VanDerWaalsContact OE2-CD2 3.3Å; E171-L223 WeakPolarHBondContact OE2-CD2 3.44Å; G220-L223 WeakPolarHBondContact O-CB 3.4Å; G220-L223 PolarHBondContact O-N 2.77Å; G220-L223 VanDerWaalsContact O-N 3.11Å; K221-L223 VanDerWaalsContact C-N 3.33Å; K221-L223 PolarHBondContact O-N 2.99Å; L223-A225 VanDerWaalsContact C-N 3.33Å; L223-A225 PolarHBondContact O-N 2.84Å; L223-R226 PolarHBondContact O-N 3.01Å; L223-A227 WeakPolarHBondContact O-CB 3.39Å; L223-A227 PolarHBondContact O-N 2.98Å
224	L	90.3	Very high	86.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-40.7	178.8	-170.9	69.2	0	0	0	112	Y173 I176 I183 L186 M213 G220 K221 R226 A227 C228 F342	Y173-L224 HydrophobicContact CD1-CD1 4.17Å; Y173-L224 HydrophobicContact CE1-CD1 3.99Å; I176-L224 HydrophobicContact CD1-CB 4.25Å; I176-L224 HydrophobicContact CD1-CD1 3.68Å; I183-L224 HydrophobicContact CB-CD1 4.44Å; I183-L224 HydrophobicContact CG1-CD1 3.53Å; L186-L224 HydrophobicContact CB-CD2 4.26Å; L186-L224 HydrophobicContact CD1-CD2 4.23Å; L186-L224 HydrophobicContact CD2-CD1 4.41Å; L186-L224 HydrophobicContact CD2-CD2 3.99Å; L186-L224 HydrophobicContact CD2-CG 3.86Å; L186-L224 HydrophobicContact CG-CD2 4.39Å; M213-L224 HydrophobicContact SD-CD2 4.22Å; G220-L224 PolarHBondContact O-N 3.03Å; K221-L224 PolarHBondContact O-N 3.49Å; L224-R226 PolarHBondContact O-N 3.3Å; L224-A227 PolarHBondContact O-N 3.01Å; L224-C228 WeakPolarHBondContact O-CB 3.26Å; L224-C228 PolarHBondContact O-N 3.3Å; L224-F342 HydrophobicContact CB-CZ 4.42Å; L224-F342 HydrophobicContact CD2-CE1 4.18Å; L224-F342 HydrophobicContact CD2-CZ 3.59Å
225	A	87.9	Confident	86.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-43.9	175.1	0	0	0	0	0	112.4	M213 K221 L223 C228 A229 F272	M213-A225 HydrophobicContact CE-CB 4.2Å; K221-A225 PolarHBondContact O-N 3.37Å; K221-A225 VanDerWaalsContact O-N 3.13Å; L223-A225 VanDerWaalsContact C-N 3.33Å; L223-A225 PolarHBondContact O-N 2.84Å; A225-C228 PolarHBondContact O-N 3.49Å; A225-A229 PolarHBondContact O-N 2.94Å; A225-F272 HydrophobicContact CB-CD1 4.43Å; A225-F272 HydrophobicContact CB-CD2 3.39Å; A225-F272 HydrophobicContact CB-CE1 4.4Å; A225-F272 HydrophobicContact CB-CE2 3.38Å; A225-F272 HydrophobicContact CB-CG 3.96Å; A225-F272 HydrophobicContact CB-CZ 3.91Å
226	R	85.7	Confident	86.3	Confident	88 Å²	88	38.4 Å²	38.4	33%	0.332	22%	0.217	S	C	.	.	H	α-helix	trans	-66.5	-43.6	178.1	-73.4	178.6	-169.4	-165.4	4.1	112.2	P169 E171 T222 L223 L224 C228 A229 A230	P169-R226 HydrophobicContact CB-CB 4Å; P169-R226 HydrophobicContact CB-CG 4.48Å; P169-R226 HydrophobicContact CG-CB 4.26Å; P169-R226 WeakPolarHBondContact CG-O 3.36Å; E171-R226 WeakPolarHBondContact OE2-CB 3.35Å; T222-R226 WeakPolarHBondContact O-CG 3.42Å; T222-R226 PolarHBondContact O-N 2.89Å; L223-R226 PolarHBondContact O-N 3.01Å; L224-R226 PolarHBondContact O-N 3.3Å; R226-C228 VanDerWaalsContact C-N 3.3Å; R226-C228 PolarHBondContact O-N 3.02Å; R226-A229 WeakPolarHBondContact O-CB 3.45Å; R226-A229 PolarHBondContact O-N 3.25Å; R226-A230 PolarHBondContact O-N 3.37Å
227	A	87.1	Confident	86.3	Confident	2 Å²	2	36.5 Å²	36.5	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-38	176.1	0	0	0	0	0	112.1	E171 Y173 I176 L223 L224 A230 Q231	E171-A227 HydrophobicContact CB-CB 4.35Å; E171-A227 WeakPolarHBondContact O-CA 3.27Å; Y173-A227 HydrophobicContact CD1-CB 3.96Å; Y173-A227 HydrophobicContact CE1-CB 3.96Å; I176-A227 HydrophobicContact CD1-CB 3.86Å; L223-A227 WeakPolarHBondContact O-CB 3.39Å; L223-A227 PolarHBondContact O-N 2.98Å; L224-A227 PolarHBondContact O-N 3.01Å; A227-A230 WeakPolarHBondContact O-CB 3.47Å; A227-A230 PolarHBondContact O-N 3.33Å; A227-Q231 PolarHBondContact O-N 2.73Å; A227-Q231 VanDerWaalsContact O-N 3.14Å
228	C	86.4	Confident	86.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-41.1	174.4	-170.4	0	0	0	0	112.5	Y173 L186 L224 A225 R226 Q231 T232	Y173-C228 WeakPolarHBondContact OH-CA 3.31Å; L186-C228 HydrophobicContact CD2-CB 3.57Å; L224-C228 WeakPolarHBondContact O-CB 3.26Å; L224-C228 PolarHBondContact O-N 3.3Å; A225-C228 PolarHBondContact O-N 3.49Å; R226-C228 VanDerWaalsContact C-N 3.3Å; R226-C228 PolarHBondContact O-N 3.02Å; C228-Q231 PolarHBondContact O-N 3.34Å; C228-T232 WeakPolarHBondContact O-CG2 3.34Å; C228-T232 PolarHBondContact O-N 3.32Å; C228-T232 VanDerWaalsContact O-N 3.14Å; C228-T232 PolarHBondContact O-OG1 3.5Å
229	A	83.3	Confident	86.6	Confident	7 Å²	7	35.2 Å²	35.2	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-43.2	175.1	0	0	0	0	0	112	P169 A225 R226 Q231 T232 K233 F236	P169-A229 HydrophobicContact CG-CB 4.15Å; A225-A229 PolarHBondContact O-N 2.94Å; R226-A229 WeakPolarHBondContact O-CB 3.45Å; R226-A229 PolarHBondContact O-N 3.25Å; A229-Q231 VanDerWaalsContact C-N 3.32Å; A229-Q231 PolarHBondContact O-N 2.92Å; A229-T232 PolarHBondContact O-OG1 3.45Å; A229-K233 PolarHBondContact O-N 2.9Å; A229-F236 HydrophobicContact CB-CB 3.89Å; A229-F236 HydrophobicContact CB-CD1 4.37Å; A229-F236 HydrophobicContact CB-CD2 3.3Å; A229-F236 HydrophobicContact CB-CE2 3.81Å; A229-F236 HydrophobicContact CB-CG 3.6Å
230	A	82.6	Confident	86.7	Confident	32 Å²	32	35.7 Å²	35.7	26%	0.264	19%	0.187	S	C	.	.	H	α-helix	trans	-56.9	-44.5	177	0	0	0	0	0	112.3	P169 E171 R226 A227	P169-A230 HydrophobicContact CG-CB 4.38Å; P169-A230 WeakPolarHBondContact O-CB 3.19Å; E171-A230 WeakPolarHBondContact O-CB 3.41Å; R226-A230 PolarHBondContact O-N 3.37Å; A227-A230 WeakPolarHBondContact O-CB 3.47Å; A227-A230 PolarHBondContact O-N 3.33Å
231	Q	81.9	Confident	86.8	Confident	104 Å²	104	34.8 Å²	34.8	49%	0.486	18%	0.177	S	C	.	.	H	α-helix	trans	-76.8	-37.1	-175	-158.8	-164.5	37.8	0	0	113.1	Y173 A227 C228 A229 K233	Y173-Q231 HydrophobicContact CE2-CB 4.4Å; Y173-Q231 VanDerWaalsContact CE2-CD 3.48Å; Y173-Q231 HydrophobicContact CE2-CG 4.44Å; A227-Q231 PolarHBondContact O-N 2.73Å; A227-Q231 VanDerWaalsContact O-N 3.14Å; C228-Q231 PolarHBondContact O-N 3.34Å; A229-Q231 VanDerWaalsContact C-N 3.32Å; A229-Q231 PolarHBondContact O-N 2.92Å; Q231-K233 VanDerWaalsContact C-N 3.29Å; Q231-K233 PolarHBondContact O-N 3.42Å
232	T	80.1	Confident	86.7	Confident	18 Å²	18	37.3 Å²	37.3	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-75.2	-15.3	-174.7	48.8	0	0	0	0	114.2	V191 C228 A229 A234 I270	V191-T232 HydrophobicContact CB-CG2 4.31Å; V191-T232 HydrophobicContact CG1-CG2 4.32Å; V191-T232 HydrophobicContact CG2-CG2 3.69Å; C228-T232 WeakPolarHBondContact O-CG2 3.34Å; C228-T232 PolarHBondContact O-N 3.32Å; C228-T232 VanDerWaalsContact O-N 3.14Å; C228-T232 PolarHBondContact O-OG1 3.5Å; A229-T232 PolarHBondContact O-OG1 3.45Å; T232-A234 PolarHBondContact O-N 3.39Å; T232-I270 HydrophobicContact CG2-CD1 4.25Å; T232-I270 WeakPolarHBondContact OG1-CD1 3.42Å
233	K	80.7	Confident	86.7	Confident	172 Å²	172	39.7 Å²	39.7	75%	0.748	20%	0.203	S	C	*	.			trans	52.1	20.8	-172.6	-56.8	-179.6	-178.6	175.8	0	113.4	A229 Q231	A229-K233 PolarHBondContact O-N 2.9Å; Q231-K233 VanDerWaalsContact C-N 3.29Å; Q231-K233 PolarHBondContact O-N 3.42Å
234	A	82.4	Confident	86.6	Confident	15 Å²	15	36 Å²	36	12%	0.124	18%	0.184	C	C	.	.			trans	-85.2	157.5	176.9	0	0	0	0	0	110.2	T232 F236 P268 I270	T232-A234 PolarHBondContact O-N 3.39Å; A234-F236 PolarHBondContact O-N 2.94Å; A234-P268 HydrophobicContact CB-CB 4.46Å; A234-P268 WeakPolarHBondContact CB-O 3.48Å; A234-I270 HydrophobicContact CB-CD1 4.26Å; A234-I270 HydrophobicContact CB-CG1 4.22Å
235	T	86.2	Confident	86.5	Confident	39 Å²	39	39.2 Å²	39.2	24%	0.239	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	122.7	174.1	-47.9	0	0	0	0	109.1	L237 K266 P268 S269 I270	T235-L237 HydrophobicContact CG2-CD1 3.76Å; T235-K266 HydrophobicContact CG2-CB 3.94Å; T235-K266 HydrophobicContact CG2-CD 3.99Å; T235-K266 PolarHBondContact OG1-O 3.16Å; T235-P268 PolarHBondContact N-O 2.74Å; T235-S269 CarbonylContact O-C 3.56Å; T235-S269 VanDerWaalsContact O-CA 3.22Å; T235-S269 WeakPolarHBondContact O-CA 3.42Å; T235-I270 PolarHBondContact O-N 3.07Å
236	F	88.8	Confident	86.4	Confident	14 Å²	14	41.8 Å²	41.8	6%	0.061	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	114.2	-179	-174.8	-107.2	0	0	0	110.4	V165 A229 A234 K238 I270 F272	V165-F236 HydrophobicContact CB-CD1 4.06Å; V165-F236 WeakPolarHBondContact CB-O 3.38Å; V165-F236 HydrophobicContact CG2-CD1 3.69Å; V165-F236 HydrophobicContact CG2-CE1 4.23Å; V165-F236 PolarHBondContact N-O 2.95Å; A229-F236 HydrophobicContact CB-CB 3.89Å; A229-F236 HydrophobicContact CB-CD1 4.37Å; A229-F236 HydrophobicContact CB-CD2 3.3Å; A229-F236 HydrophobicContact CB-CE2 3.81Å; A229-F236 HydrophobicContact CB-CG 3.6Å; A234-F236 PolarHBondContact O-N 2.94Å; F236-K238 HydrophobicContact CD1-CB 4.47Å; F236-K238 HydrophobicContact CE1-CB 3.97Å; F236-I270 HydrophobicContact CD2-CB 4.32Å; F236-I270 HydrophobicContact CD2-CG2 4.27Å; F236-I270 HydrophobicContact CE2-CG2 4.44Å; F236-F272 HydrophobicContact CE1-CB 4.4Å; F236-F272 HydrophobicContact CE2-CB 3.46Å; F236-F272 VanDerWaalsContact CE2-CB 3.46Å; F236-F272 HydrophobicContact CE2-CG 4.22Å; F236-F272 HydrophobicContact CZ-CB 3.39Å; F236-F272 AromaticContact CZ-CD1 3.99Å; F236-F272 HydrophobicContact CZ-CD1 3.99Å; F236-F272 AromaticContact CZ-CG 3.84Å; F236-F272 HydrophobicContact CZ-CG 3.84Å
237	L	90	Very high	86.4	Confident	3 Å²	3	46 Å²	46	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	117	173.9	-83.8	75.4	0	0	0	108.5	T235 L262 A263 I270 I271 F272	T235-L237 HydrophobicContact CG2-CD1 3.76Å; L237-L262 HydrophobicContact CD2-CB 4.49Å; L237-L262 HydrophobicContact CD2-CD2 4.22Å; L237-L262 HydrophobicContact CD2-CG 4.43Å; L237-A263 HydrophobicContact CD2-CB 4.19Å; L237-I270 PolarHBondContact N-O 3.29Å; L237-I271 HydrophobicContact CB-CG1 4.42Å; L237-F272 PolarHBondContact O-N 3.13Å
238	K	90.4	Very high	86.4	Confident	80 Å²	80	52.3 Å²	52.3	35%	0.348	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.5	176.9	-176.4	-174.1	176.8	-164.5	0	109.5	M163 V165 F236 F272	M163-K238 WeakPolarHBondContact CB-O 3.5Å; M163-K238 PolarHBondContact O-N 3.24Å; V165-K238 HydrophobicContact CG2-CB 3.74Å; F236-K238 HydrophobicContact CD1-CB 4.47Å; F236-K238 HydrophobicContact CE1-CB 3.97Å; K238-F272 HydrophobicContact CG-CD1 4.33Å
239	L	90.8	Very high	86.4	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.037	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127	176.7	-172.6	153.3	0	0	0	108.7	M163 L244 A259 F272 I273 D274	M163-L239 HydrophobicContact SD-CB 4.47Å; M163-L239 HydrophobicContact SD-CD1 4.27Å; M163-L239 HydrophobicContact SD-CG 4.24Å; L239-L244 HydrophobicContact CD1-CD1 4.27Å; L239-L244 HydrophobicContact CD1-CD2 4.13Å; L239-L244 HydrophobicContact CD1-CG 4.4Å; L239-L244 HydrophobicContact CD2-CD1 3.47Å; L239-L244 VanDerWaalsContact CD2-CD1 3.47Å; L239-L244 HydrophobicContact CD2-CD2 4.41Å; L239-L244 HydrophobicContact CD2-CG 3.79Å; L239-L244 HydrophobicContact CG-CD1 4.38Å; L239-L244 HydrophobicContact CG-CG 4.39Å; L239-A259 HydrophobicContact CD1-CB 4.39Å; L239-F272 PolarHBondContact N-O 3.09Å; L239-F272 VanDerWaalsContact O-O 3.07Å; L239-I273 HydrophobicContact CB-CG1 4.49Å; L239-I273 HydrophobicContact CD2-CB 4.45Å; L239-I273 HydrophobicContact CD2-CG1 4.19Å; L239-I273 HydrophobicContact CD2-CG2 3.92Å; L239-I273 CarbonylContact O-C 3.59Å; L239-I273 VanDerWaalsContact O-CA 3.29Å; L239-I273 WeakPolarHBondContact O-CA 3.44Å; L239-D274 PolarHBondContact O-N 2.79Å
240	A	90.7	Very high	86.5	Confident	22 Å²	22	59 Å²	59	18%	0.182	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134	170.3	0	0	0	0	0	109.8	P242 Q243	A240-P242 VanDerWaalsContact C-N 3.33Å; A240-Q243 HydrophobicContact CB-CG 4Å; A240-Q243 VanDerWaalsContact O-CB 3.31Å; A240-Q243 WeakPolarHBondContact O-CB 3.16Å; A240-Q243 PolarHBondContact O-N 2.92Å
241	G	87.8	Confident	86.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-49	-46.9	178.8	0	0	0	0	0	113.5	Q243 L244 D274 I279	G241-Q243 PolarHBondContact O-N 2.98Å; G241-L244 WeakPolarHBondContact O-CB 3.36Å; G241-L244 PolarHBondContact O-N 2.94Å; G241-L244 VanDerWaalsContact O-N 3.11Å; G241-D274 PolarHBondContact N-O 2.8Å; G241-I279 WeakPolarHBondContact O-CG2 3.4Å
242	P	89.3	Confident	87.2	Confident	62 Å²	62	54.7 Å²	54.7	40%	0.403	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-61.2	-26.5	176.9	-26.4	35	0	0	0	114.9	A240 L244 V245 E275 A278	A240-P242 VanDerWaalsContact C-N 3.33Å; P242-L244 PolarHBondContact O-N 2.91Å; P242-V245 PolarHBondContact O-N 3.25Å; P242-E275 WeakPolarHBondContact CD-OE2 3.38Å; P242-E275 VanDerWaalsContact CG-OE2 3.28Å; P242-E275 WeakPolarHBondContact CG-OE2 3.45Å; P242-A278 HydrophobicContact CG-CB 3.98Å
243	Q	88.7	Confident	87.6	Confident	91 Å²	91	54 Å²	54	43%	0.425	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-68	-20.3	178.3	-68.4	172.9	-26.5	0	0	112.5	M163 A240 G241 V245 Q246	M163-Q243 HydrophobicContact CE-CB 4.09Å; A240-Q243 HydrophobicContact CB-CG 4Å; A240-Q243 VanDerWaalsContact O-CB 3.31Å; A240-Q243 WeakPolarHBondContact O-CB 3.16Å; A240-Q243 PolarHBondContact O-N 2.92Å; G241-Q243 PolarHBondContact O-N 2.98Å; Q243-V245 VanDerWaalsContact C-N 3.32Å; Q243-Q246 PolarHBondContact O-NE2 2.93Å
244	L	87.3	Confident	88.1	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-80	-15.6	176.8	-69	177.8	0	0	0	113.3	L239 G241 P242 Q246 G252 L255 V256 I279 T297	L239-L244 HydrophobicContact CD1-CD1 4.27Å; L239-L244 HydrophobicContact CD1-CD2 4.13Å; L239-L244 HydrophobicContact CD1-CG 4.4Å; L239-L244 HydrophobicContact CD2-CD1 3.47Å; L239-L244 VanDerWaalsContact CD2-CD1 3.47Å; L239-L244 HydrophobicContact CD2-CD2 4.41Å; L239-L244 HydrophobicContact CD2-CG 3.79Å; L239-L244 HydrophobicContact CG-CD1 4.38Å; L239-L244 HydrophobicContact CG-CG 4.39Å; G241-L244 WeakPolarHBondContact O-CB 3.36Å; G241-L244 PolarHBondContact O-N 2.94Å; G241-L244 VanDerWaalsContact O-N 3.11Å; P242-L244 PolarHBondContact O-N 2.91Å; L244-Q246 PolarHBondContact O-N 3.45Å; L244-G252 WeakPolarHBondContact O-CA 3.49Å; L244-L255 HydrophobicContact CD2-CB 4.45Å; L244-L255 HydrophobicContact CD2-CD2 3.55Å; L244-V256 HydrophobicContact CD1-CG2 4Å; L244-V256 HydrophobicContact CD2-CG2 3.55Å; L244-V256 HydrophobicContact CG-CG2 4.38Å; L244-I279 HydrophobicContact CB-CG2 3.95Å; L244-I279 HydrophobicContact CD1-CD1 3.67Å; L244-I279 HydrophobicContact CD1-CG2 4.45Å; L244-T297 HydrophobicContact CB-CG2 4Å
245	V	87.3	Confident	88.5	Confident	66 Å²	66	49.5 Å²	49.5	40%	0.4	25%	0.254	S	S	.	.			trans	-85.7	109.8	177.7	-173.7	0	0	0	0	108.6	P242 Q243 I279 V294	P242-V245 PolarHBondContact O-N 3.25Å; Q243-V245 VanDerWaalsContact C-N 3.32Å; V245-I279 HydrophobicContact CG2-CG2 4.11Å; V245-V294 HydrophobicContact CG1-CG2 3.97Å; V245-V294 HydrophobicContact CG2-CG2 4.05Å
246	Q	87.1	Confident	88.7	Confident	55 Å²	55	47.7 Å²	47.7	26%	0.257	24%	0.243	S	C	.	.			trans	-118.7	153.8	-176.2	-64.3	-64	-44.5	0	0	111.2	R159 Q243 L244 F248 D251	R159-Q246 VanDerWaalsContact NH1-OE1 3.13Å; Q243-Q246 PolarHBondContact O-NE2 2.93Å; L244-Q246 PolarHBondContact O-N 3.45Å; Q246-F248 VanDerWaalsContact C-N 3.35Å; Q246-D251 HydrophobicContact CB-CB 3.9Å; Q246-D251 HydrophobicContact CG-CB 4.14Å
247	M	85.6	Confident	88.7	Confident	175 Å²	175	52.8 Å²	52.8	86%	0.862	26%	0.262	S	S	*	.	S	Bend	trans	-70.8	-31.6	177.3	-178.6	178.9	173.4	0	0	112.3
248	F	86.4	Confident	88.7	Confident	135 Å²	135	54 Å²	54	59%	0.592	27%	0.268	S	S	*	.	S	Bend	trans	-89.9	134.9	-179.2	-62.1	-73.4	0	0	0	111.3	Q246 G250 D251	Q246-F248 VanDerWaalsContact C-N 3.35Å; F248-G250 PolarHBondContact O-N 2.8Å; F248-D251 HydrophobicContact CB-CB 4.27Å; F248-D251 PolarHBondContact O-N 2.99Å
249	I	86.3	Confident	88.7	Confident	134 Å²	134	50.3 Å²	50.3	69%	0.687	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	125.4	-177.8	-61.5	169.3	0	0	0	110	D251	I249-D251 VanDerWaalsContact C-N 3.31Å
250	G	86.3	Confident	88.6	Confident	14 Å²	14	50.1 Å²	50.1	14%	0.144	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	-7.5	177.2	0	0	0	0	0	114.9	F248 A253 K254 E293	F248-G250 PolarHBondContact O-N 2.8Å; G250-A253 PolarHBondContact O-N 3.08Å; G250-K254 PolarHBondContact O-N 3.25Å; G250-E293 WeakPolarHBondContact CA-OE1 3.35Å; G250-E293 PolarHBondContact N-OE1 2.9Å; G250-E293 PolarHBondContact N-OE2 3.43Å
251	D	88.9	Confident	88.5	Confident	45 Å²	45	50.8 Å²	50.8	24%	0.241	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-40.1	176	-91.6	13	0	0	0	111.3	R159 Q246 F248 I249 K254 L255	R159-D251 IonicContact NH1-OD2 3.45Å; R159-D251 IonicContact NH2-OD2 4Å; Q246-D251 HydrophobicContact CB-CB 3.9Å; Q246-D251 HydrophobicContact CG-CB 4.14Å; F248-D251 HydrophobicContact CB-CB 4.27Å; F248-D251 PolarHBondContact O-N 2.99Å; I249-D251 VanDerWaalsContact C-N 3.31Å; D251-K254 PolarHBondContact O-N 3.39Å; D251-L255 WeakPolarHBondContact O-CB 3.26Å; D251-L255 PolarHBondContact O-N 3.45Å
252	G	89.2	Confident	88.6	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-47.6	175.4	0	0	0	0	0	111.6	L244 K254 L255 V256	L244-G252 WeakPolarHBondContact O-CA 3.49Å; G252-K254 PolarHBondContact O-N 3.25Å; G252-L255 PolarHBondContact O-N 2.97Å; G252-V256 WeakPolarHBondContact O-CG2 3.39Å; G252-V256 PolarHBondContact O-N 3.27Å
253	A	89.5	Confident	88.5	Confident	5 Å²	5	48.1 Å²	48.1	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-36.6	176.6	0	0	0	0	0	113.1	G250 R257 T297 E300	G250-A253 PolarHBondContact O-N 3.08Å; A253-R257 WeakPolarHBondContact O-CG 3.3Å; A253-R257 PolarHBondContact O-N 3.13Å; A253-R257 PolarHBondContact O-NE 3.31Å; A253-T297 PolarHBondContact N-OG1 3.28Å; A253-E300 HydrophobicContact CB-CB 3.94Å; A253-E300 HydrophobicContact CB-CG 4.04Å
254	K	90.1	Very high	88.5	Confident	89 Å²	89	47.2 Å²	47.2	39%	0.387	23%	0.234	S	C	.	.	H	α-helix	trans	-63.8	-45.7	172.2	-174.8	-172.5	170.9	-166.2	0	110.7	G250 D251 G252 V256 R257 D258	G250-K254 PolarHBondContact O-N 3.25Å; D251-K254 PolarHBondContact O-N 3.39Å; G252-K254 PolarHBondContact O-N 3.25Å; K254-V256 VanDerWaalsContact C-N 3.33Å; K254-V256 PolarHBondContact O-N 3.19Å; K254-R257 PolarHBondContact O-N 3.24Å; K254-R257 VanDerWaalsContact O-N 3.13Å; K254-D258 WeakPolarHBondContact CE-OD2 3.48Å; K254-D258 PolarHBondContact O-N 3.06Å
255	L	90.9	Very high	88.4	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-40.9	-178.5	-162.8	149.7	0	0	0	112	R159 V160 M163 L244 D251 G252 D258 A259	R159-L255 HydrophobicContact CB-CD1 4.01Å; V160-L255 HydrophobicContact CG2-CD2 4.2Å; V160-L255 HydrophobicContact CG2-CG 3.86Å; M163-L255 HydrophobicContact CE-CD1 4.16Å; M163-L255 HydrophobicContact CE-CD2 3.38Å; M163-L255 HydrophobicContact CE-CG 4.32Å; M163-L255 HydrophobicContact SD-CD2 3.82Å; L244-L255 HydrophobicContact CD2-CB 4.45Å; L244-L255 HydrophobicContact CD2-CD2 3.55Å; D251-L255 WeakPolarHBondContact O-CB 3.26Å; D251-L255 PolarHBondContact O-N 3.45Å; G252-L255 PolarHBondContact O-N 2.97Å; L255-D258 PolarHBondContact O-N 3.28Å; L255-A259 WeakPolarHBondContact O-CB 3.22Å; L255-A259 PolarHBondContact O-N 3.31Å
256	V	91.2	Very high	88.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-57.8	-52.6	172.4	174.2	0	0	0	0	110.3	L244 G252 K254 D258 A259 F260 T297 E300 L301 Q304	L244-V256 HydrophobicContact CD1-CG2 4Å; L244-V256 HydrophobicContact CD2-CG2 3.55Å; L244-V256 HydrophobicContact CG-CG2 4.38Å; G252-V256 WeakPolarHBondContact O-CG2 3.39Å; G252-V256 PolarHBondContact O-N 3.27Å; K254-V256 VanDerWaalsContact C-N 3.33Å; K254-V256 PolarHBondContact O-N 3.19Å; V256-D258 VanDerWaalsContact C-N 3.33Å; V256-D258 PolarHBondContact O-N 2.97Å; V256-A259 PolarHBondContact O-N 2.79Å; V256-F260 HydrophobicContact CG1-CD2 3.7Å; V256-F260 HydrophobicContact CG1-CE2 3.76Å; V256-F260 WeakPolarHBondContact O-CD2 3.38Å; V256-F260 PolarHBondContact O-N 2.9Å; V256-T297 HydrophobicContact CG2-CG2 3.73Å; V256-E300 HydrophobicContact CB-CG 4.47Å; V256-E300 HydrophobicContact CG1-CG 4.4Å; V256-L301 HydrophobicContact CG1-CB 4.19Å; V256-L301 HydrophobicContact CG1-CD1 4.2Å; V256-Q304 HydrophobicContact CG1-CG 4.2Å
257	R	89.2	Confident	88.3	Confident	122 Å²	122	52.8 Å²	52.8	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-57.9	-44.9	-179.9	-73.8	-175.4	-68.8	158.4	0.9	112.6	A253 K254 F260 A261 E300	A253-R257 WeakPolarHBondContact O-CG 3.3Å; A253-R257 PolarHBondContact O-N 3.13Å; A253-R257 PolarHBondContact O-NE 3.31Å; K254-R257 PolarHBondContact O-N 3.24Å; K254-R257 VanDerWaalsContact O-N 3.13Å; R257-F260 PolarHBondContact O-N 2.8Å; R257-A261 WeakPolarHBondContact O-CB 3.43Å; R257-A261 PolarHBondContact O-N 3.38Å; R257-E300 VanDerWaalsContact CD-OE1 3.22Å; R257-E300 WeakPolarHBondContact CD-OE1 3.49Å; R257-E300 HydrophobicContact CG-CG 3.9Å; R257-E300 WeakPolarHBondContact CG-OE1 3.15Å
258	D	90.1	Very high	88.4	Confident	27 Å²	27	47 Å²	47	14%	0.144	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-41.5	-179.7	-70.2	-4.1	0	0	0	111.1	Y156 V160 K254 L255 V256 F260 A261 L262	Y156-D258 HydrophobicContact CD1-CB 4.21Å; V160-D258 HydrophobicContact CG2-CB 3.86Å; K254-D258 WeakPolarHBondContact CE-OD2 3.48Å; K254-D258 PolarHBondContact O-N 3.06Å; L255-D258 PolarHBondContact O-N 3.28Å; V256-D258 VanDerWaalsContact C-N 3.33Å; V256-D258 PolarHBondContact O-N 2.97Å; D258-F260 PolarHBondContact O-N 2.69Å; D258-A261 PolarHBondContact O-N 2.93Å; D258-L262 WeakPolarHBondContact O-CB 3.44Å; D258-L262 PolarHBondContact O-N 3.1Å
259	A	89.9	Confident	88.5	Confident	3 Å²	3	40.6 Å²	40.6	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-42.3	176	0	0	0	0	0	112.4	V160 L239 L255 V256 A263	V160-A259 HydrophobicContact CG1-CB 4.17Å; L239-A259 HydrophobicContact CD1-CB 4.39Å; L255-A259 WeakPolarHBondContact O-CB 3.22Å; L255-A259 PolarHBondContact O-N 3.31Å; V256-A259 PolarHBondContact O-N 2.79Å; A259-A263 WeakPolarHBondContact O-CB 3.24Å; A259-A263 PolarHBondContact O-N 3.32Å
260	F	89.5	Confident	88.7	Confident	3 Å²	3	34.3 Å²	34.3	1%	0.013	18%	0.178	C	C	.	.	H	α-helix	trans	-69.1	-35.4	175.7	-83.8	-75.6	0	0	0	112.8	V256 R257 D258 K264 I271 L301 Q304 L305 F308 V316	V256-F260 HydrophobicContact CG1-CD2 3.7Å; V256-F260 HydrophobicContact CG1-CE2 3.76Å; V256-F260 WeakPolarHBondContact O-CD2 3.38Å; V256-F260 PolarHBondContact O-N 2.9Å; R257-F260 PolarHBondContact O-N 2.8Å; D258-F260 PolarHBondContact O-N 2.69Å; F260-K264 VanDerWaalsContact O-CG 3.29Å; F260-K264 WeakPolarHBondContact O-CG 3.44Å; F260-K264 PolarHBondContact O-N 3.37Å; F260-I271 HydrophobicContact CD1-CD1 3.46Å; F260-I271 VanDerWaalsContact CD1-CD1 3.46Å; F260-I271 HydrophobicContact CE1-CD1 3.37Å; F260-I271 HydrophobicContact CG-CD1 4.2Å; F260-I271 HydrophobicContact CZ-CD1 4.02Å; F260-L301 HydrophobicContact CE2-CD1 3.47Å; F260-L301 VanDerWaalsContact CE2-CD1 3.47Å; F260-L301 HydrophobicContact CZ-CD1 3.72Å; F260-Q304 HydrophobicContact CB-CG 4.48Å; F260-Q304 HydrophobicContact CD1-CB 4.37Å; F260-Q304 HydrophobicContact CD2-CB 3.71Å; F260-Q304 HydrophobicContact CD2-CG 3.94Å; F260-Q304 HydrophobicContact CE2-CB 3.97Å; F260-Q304 HydrophobicContact CG-CB 3.95Å; F260-Q304 HydrophobicContact CG-CG 4.27Å; F260-Q304 HydrophobicContact CZ-CB 4.37Å; F260-L305 HydrophobicContact CE1-CD2 4.46Å; F260-L305 HydrophobicContact CZ-CD2 4.17Å; F260-F308 HydrophobicContact CD1-CE1 4.47Å; F260-F308 AromaticContact CD1-CE2 3.71Å; F260-F308 HydrophobicContact CD1-CE2 3.71Å; F260-F308 AromaticContact CD1-CZ 3.35Å; F260-F308 HydrophobicContact CD1-CZ 3.35Å; F260-F308 AromaticContact CE1-CE2 3.41Å; F260-F308 HydrophobicContact CE1-CE2 3.41Å; F260-F308 VanDerWaalsContact CE1-CE2 3.41Å; F260-F308 AromaticContact CE1-CZ 3.43Å; F260-F308 HydrophobicContact CE1-CZ 3.43Å; F260-F308 VanDerWaalsContact CE1-CZ 3.43Å; F260-F308 HydrophobicContact CZ-CE2 4.44Å; F260-V316 HydrophobicContact CE1-CG2 4.07Å; F260-V316 HydrophobicContact CZ-CG2 4.42Å
261	A	88.3	Confident	89	Confident	36 Å²	36	33.7 Å²	33.7	30%	0.298	17%	0.171	S	C	.	.	H	α-helix	trans	-66.8	-44.2	175	0	0	0	0	0	111.6	Y156 R257 D258 A263 K264 E265	Y156-A261 HydrophobicContact CE1-CB 3.75Å; R257-A261 WeakPolarHBondContact O-CB 3.43Å; R257-A261 PolarHBondContact O-N 3.38Å; D258-A261 PolarHBondContact O-N 2.93Å; A261-A263 VanDerWaalsContact C-N 3.33Å; A261-A263 PolarHBondContact O-N 3.37Å; A261-K264 WeakPolarHBondContact O-CB 2.98Å; A261-K264 PolarHBondContact O-N 3.21Å; A261-E265 PolarHBondContact O-N 3.11Å
262	L	88.7	Confident	89.2	Confident	6 Å²	6	31.7 Å²	31.7	3%	0.031	16%	0.16	C	C	.	.	H	α-helix	trans	-61.2	-42.1	174.8	-178	64.8	0	0	0	111.6	Y156 V160 L237 D258 K264 E265 K266	Y156-L262 HydrophobicContact CD2-CD1 3.91Å; Y156-L262 HydrophobicContact CE2-CD1 3.87Å; V160-L262 HydrophobicContact CG1-CB 4.27Å; V160-L262 HydrophobicContact CG1-CD2 3.75Å; L237-L262 HydrophobicContact CD2-CB 4.49Å; L237-L262 HydrophobicContact CD2-CD2 4.22Å; L237-L262 HydrophobicContact CD2-CG 4.43Å; D258-L262 WeakPolarHBondContact O-CB 3.44Å; D258-L262 PolarHBondContact O-N 3.1Å; L262-K264 VanDerWaalsContact C-N 3.32Å; L262-K264 PolarHBondContact O-N 3.41Å; L262-E265 PolarHBondContact O-N 3.48Å; L262-K266 HydrophobicContact CD1-CD 4.13Å; L262-K266 HydrophobicContact CD1-CG 4.39Å; L262-K266 PolarHBondContact O-N 3.13Å
263	A	88.6	Confident	89.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-39.2	175.4	0	0	0	0	0	112.5	L237 A259 A261 K266 A267 S269 I271 V314	L237-A263 HydrophobicContact CD2-CB 4.19Å; A259-A263 WeakPolarHBondContact O-CB 3.24Å; A259-A263 PolarHBondContact O-N 3.32Å; A261-A263 VanDerWaalsContact C-N 3.33Å; A261-A263 PolarHBondContact O-N 3.37Å; A263-K266 CarbonylContact O-C 3.54Å; A263-K266 PolarHBondContact O-N 2.82Å; A263-A267 PolarHBondContact O-N 2.84Å; A263-S269 WeakPolarHBondContact CB-OG 3.33Å; A263-S269 PolarHBondContact O-OG 2.92Å; A263-S269 VanDerWaalsContact O-OG 3.05Å; A263-I271 HydrophobicContact CB-CD1 3.67Å; A263-I271 HydrophobicContact CB-CG1 3.91Å; A263-V314 HydrophobicContact CB-CG1 4.12Å
264	K	87.3	Confident	89.5	Confident	73 Å²	73	33 Å²	33	32%	0.317	17%	0.167	S	C	.	.	H	α-helix	trans	-66.2	-39.3	176.1	-73.7	168.9	-178.5	176.7	0	112.1	F260 A261 L262 K266 M312 V314	F260-K264 VanDerWaalsContact O-CG 3.29Å; F260-K264 WeakPolarHBondContact O-CG 3.44Å; F260-K264 PolarHBondContact O-N 3.37Å; A261-K264 WeakPolarHBondContact O-CB 2.98Å; A261-K264 PolarHBondContact O-N 3.21Å; L262-K264 VanDerWaalsContact C-N 3.32Å; L262-K264 PolarHBondContact O-N 3.41Å; K264-K266 VanDerWaalsContact C-N 3.35Å; K264-M312 HydrophobicContact CD-CE 3.72Å; K264-M312 HydrophobicContact CD-SD 4.18Å; K264-M312 HydrophobicContact CG-CE 3.76Å; K264-M312 HydrophobicContact CG-SD 4.06Å; K264-V314 HydrophobicContact CG-CG2 4.37Å
265	E	86.6	Confident	89.5	Confident	124 Å²	124	33.1 Å²	33.1	58%	0.579	17%	0.169	S	C	*	.	H	α-helix	trans	-65.7	-39.2	175.8	-168.6	-173.4	172.3	0	0	111.5	Y156 A261 L262 A267	Y156-E265 VanDerWaalsContact CE2-OE2 3.22Å; Y156-E265 WeakPolarHBondContact CE2-OE2 3.21Å; Y156-E265 PolarHBondContact OH-OE2 3.19Å; Y156-E265 VanDerWaalsContact OH-OE2 3.12Å; A261-E265 PolarHBondContact O-N 3.11Å; L262-E265 PolarHBondContact O-N 3.48Å; E265-A267 PolarHBondContact O-N 3.48Å
266	K	86.8	Confident	89.5	Confident	69 Å²	69	33 Å²	33	30%	0.3	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	26.9	-177.4	-62.6	-167.6	169.9	-173.5	0	114.5	E164 T235 L262 A263 K264 P268	E164-K266 WeakPolarHBondContact OE1-CD 3.49Å; E164-K266 IonicContact OE1-NZ 3.05Å; E164-K266 PolarHBondContact OE1-NZ 3.09Å; E164-K266 IonicContact OE2-NZ 2.77Å; E164-K266 PolarHBondContact OE2-NZ 2.66Å; T235-K266 HydrophobicContact CG2-CB 3.94Å; T235-K266 HydrophobicContact CG2-CD 3.99Å; T235-K266 PolarHBondContact OG1-O 3.16Å; L262-K266 HydrophobicContact CD1-CD 4.13Å; L262-K266 HydrophobicContact CD1-CG 4.39Å; L262-K266 PolarHBondContact O-N 3.13Å; A263-K266 CarbonylContact O-C 3.54Å; A263-K266 PolarHBondContact O-N 2.82Å; K264-K266 VanDerWaalsContact C-N 3.35Å; K266-P268 CarbonylContact O-C 3.53Å
267	A	85.1	Confident	89.4	Confident	45 Å²	45	34.7 Å²	34.7	37%	0.372	18%	0.177	S	C	.	.			trans	-61.3	133.8	177.5	0	0	0	0	0	111.2	A263 E265 Q313	A263-A267 PolarHBondContact O-N 2.84Å; E265-A267 PolarHBondContact O-N 3.48Å; A267-Q313 HydrophobicContact CB-CB 4.26Å
268	P	87.8	Confident	89.4	Confident	55 Å²	55	30.6 Å²	30.6	36%	0.357	17%	0.17	S	C	.	.	S	Bend	cis	-78.4	134.9	5.4	31.4	-35	0	0	0	113.5	M194 A234 T235 K266 Q313	M194-P268 HydrophobicContact CE-CB 4.38Å; M194-P268 HydrophobicContact SD-CB 3.97Å; A234-P268 HydrophobicContact CB-CB 4.46Å; A234-P268 WeakPolarHBondContact CB-O 3.48Å; T235-P268 PolarHBondContact N-O 2.74Å; K266-P268 CarbonylContact O-C 3.53Å; P268-Q313 HydrophobicContact CB-CB 4.26Å
269	S	88.6	Confident	89.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	149.7	-175.9	69.8	0	0	0	0	113.6	T235 A263 Q313 V314 K315	T235-S269 CarbonylContact O-C 3.56Å; T235-S269 VanDerWaalsContact O-CA 3.22Å; T235-S269 WeakPolarHBondContact O-CA 3.42Å; A263-S269 WeakPolarHBondContact CB-OG 3.33Å; A263-S269 PolarHBondContact O-OG 2.92Å; A263-S269 VanDerWaalsContact O-OG 3.05Å; S269-Q313 PolarHBondContact N-O 3.23Å; S269-Q313 VanDerWaalsContact N-O 3.11Å; S269-V314 WeakPolarHBondContact O-CA 3.47Å; S269-K315 PolarHBondContact O-N 3.15Å
270	I	90.1	Very high	88.9	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	122.3	173.7	-60	172.6	0	0	0	108.4	I190 M194 T232 A234 T235 F236 L237 K315 I317	I190-I270 HydrophobicContact CG2-CD1 3.85Å; I190-I270 HydrophobicContact CG2-CG1 4.31Å; M194-I270 HydrophobicContact CE-CG1 4.19Å; T232-I270 HydrophobicContact CG2-CD1 4.25Å; T232-I270 WeakPolarHBondContact OG1-CD1 3.42Å; A234-I270 HydrophobicContact CB-CD1 4.26Å; A234-I270 HydrophobicContact CB-CG1 4.22Å; T235-I270 PolarHBondContact O-N 3.07Å; F236-I270 HydrophobicContact CD2-CB 4.32Å; F236-I270 HydrophobicContact CD2-CG2 4.27Å; F236-I270 HydrophobicContact CE2-CG2 4.44Å; L237-I270 PolarHBondContact N-O 3.29Å; I270-K315 WeakPolarHBondContact CA-O 3.22Å; I270-I317 HydrophobicContact CG2-CD1 3.6Å; I270-I317 HydrophobicContact CG2-CG1 3.91Å
271	I	92.1	Very high	88.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117.4	173.1	-57.3	172.5	0	0	0	107.7	L237 F260 A263 I273 V314 K315 V316 I317	L237-I271 HydrophobicContact CB-CG1 4.42Å; F260-I271 HydrophobicContact CD1-CD1 3.46Å; F260-I271 VanDerWaalsContact CD1-CD1 3.46Å; F260-I271 HydrophobicContact CE1-CD1 3.37Å; F260-I271 HydrophobicContact CG-CD1 4.2Å; F260-I271 HydrophobicContact CZ-CD1 4.02Å; A263-I271 HydrophobicContact CB-CD1 3.67Å; A263-I271 HydrophobicContact CB-CG1 3.91Å; I271-I273 HydrophobicContact CG2-CG1 4.11Å; I271-V314 HydrophobicContact CD1-CG1 3.88Å; I271-V314 HydrophobicContact CG1-CG1 4.24Å; I271-K315 PolarHBondContact N-O 3.14Å; I271-V316 HydrophobicContact CB-CG2 4.45Å; I271-V316 WeakPolarHBondContact O-CA 3.5Å; I271-I317 PolarHBondContact O-N 3.37Å
272	F	93.3	Very high	88.2	Confident	2 Å²	2	34 Å²	34	1%	0.009	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	116.6	174.1	177	-110.5	0	0	0	110.3	M213 T222 A225 F236 L237 K238 L239 D274 I317 A319	M213-F272 HydrophobicContact CE-CE2 3.75Å; T222-F272 HydrophobicContact CG2-CE1 4.05Å; T222-F272 HydrophobicContact CG2-CZ 4.3Å; A225-F272 HydrophobicContact CB-CD1 4.43Å; A225-F272 HydrophobicContact CB-CD2 3.39Å; A225-F272 HydrophobicContact CB-CE1 4.4Å; A225-F272 HydrophobicContact CB-CE2 3.38Å; A225-F272 HydrophobicContact CB-CG 3.96Å; A225-F272 HydrophobicContact CB-CZ 3.91Å; F236-F272 HydrophobicContact CE1-CB 4.4Å; F236-F272 HydrophobicContact CE2-CB 3.46Å; F236-F272 VanDerWaalsContact CE2-CB 3.46Å; F236-F272 HydrophobicContact CE2-CG 4.22Å; F236-F272 HydrophobicContact CZ-CB 3.39Å; F236-F272 AromaticContact CZ-CD1 3.99Å; F236-F272 HydrophobicContact CZ-CD1 3.99Å; F236-F272 AromaticContact CZ-CG 3.84Å; F236-F272 HydrophobicContact CZ-CG 3.84Å; L237-F272 PolarHBondContact O-N 3.13Å; K238-F272 HydrophobicContact CG-CD1 4.33Å; L239-F272 PolarHBondContact N-O 3.09Å; L239-F272 VanDerWaalsContact O-O 3.07Å; F272-D274 HydrophobicContact CD1-CB 4.44Å; F272-D274 HydrophobicContact CE1-CB 3.64Å; F272-D274 HydrophobicContact CZ-CB 4Å; F272-I317 CarbonylContact C-O 3.56Å; F272-I317 WeakPolarHBondContact CA-O 3.46Å; F272-I317 HydrophobicContact CD2-CB 3.93Å; F272-I317 HydrophobicContact CD2-CG2 3.68Å; F272-I317 HydrophobicContact CE2-CG2 4.04Å; F272-A319 HydrophobicContact CE2-CB 3.99Å; F272-A319 HydrophobicContact CZ-CB 4.05Å
273	I	93.2	Very high	87.4	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	106.9	176.1	-55.2	176.8	0	0	0	108	L239 I271 L276 L301 V316 I317 A318 A319	L239-I273 HydrophobicContact CB-CG1 4.49Å; L239-I273 HydrophobicContact CD2-CB 4.45Å; L239-I273 HydrophobicContact CD2-CG1 4.19Å; L239-I273 HydrophobicContact CD2-CG2 3.92Å; L239-I273 CarbonylContact O-C 3.59Å; L239-I273 VanDerWaalsContact O-CA 3.29Å; L239-I273 WeakPolarHBondContact O-CA 3.44Å; I271-I273 HydrophobicContact CG2-CG1 4.11Å; I273-L276 HydrophobicContact CG2-CD1 3.97Å; I273-L301 HydrophobicContact CD1-CD1 3.97Å; I273-L301 HydrophobicContact CD1-CD2 4.17Å; I273-V316 HydrophobicContact CD1-CG1 4.09Å; I273-I317 PolarHBondContact N-O 3.35Å; I273-A318 CarbonylContact O-C 3.58Å; I273-A318 WeakPolarHBondContact O-CA 3.29Å; I273-A319 PolarHBondContact O-N 2.92Å
274	D	92.1	Very high	86.4	Confident	30 Å²	30	47.6 Å²	47.6	16%	0.16	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	154	172.5	-144.7	-16.7	0	0	0	110.6	T222 L239 G241 F272 L276	T222-D274 PolarHBondContact OG1-OD2 3.19Å; T222-D274 VanDerWaalsContact OG1-OD2 3.06Å; L239-D274 PolarHBondContact O-N 2.79Å; G241-D274 PolarHBondContact N-O 2.8Å; F272-D274 HydrophobicContact CD1-CB 4.44Å; F272-D274 HydrophobicContact CE1-CB 3.64Å; F272-D274 HydrophobicContact CZ-CB 4Å; D274-L276 PolarHBondContact O-N 2.84Å
275	E	91.1	Very high	85.1	Confident	90 Å²	90	52.4 Å²	52.4	42%	0.421	27%	0.265	S	S	.	.			trans	51.2	51.4	178.4	-60.4	-178.4	169.8	0	0	113.4	P242 D277 A278 A319	P242-E275 WeakPolarHBondContact CD-OE2 3.38Å; P242-E275 VanDerWaalsContact CG-OE2 3.28Å; P242-E275 WeakPolarHBondContact CG-OE2 3.45Å; E275-D277 VanDerWaalsContact CA-OD1 3.25Å; E275-D277 WeakPolarHBondContact CA-OD1 3.06Å; E275-D277 PolarHBondContact O-N 3.07Å; E275-D277 VanDerWaalsContact O-N 3.08Å; E275-A278 WeakPolarHBondContact O-CB 3.22Å; E275-A278 PolarHBondContact O-N 3.41Å; E275-A319 PolarHBondContact N-O 2.89Å
276	L	90.7	Very high	83.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-58.8	-22.8	178.9	-175.5	66.9	0	0	0	112.4	L212 I273 D274 A278 I279 G280 L301 A318 A319 L326 L330 L336	L212-L276 HydrophobicContact CD1-CD2 4.23Å; I273-L276 HydrophobicContact CG2-CD1 3.97Å; D274-L276 PolarHBondContact O-N 2.84Å; L276-A278 PolarHBondContact O-N 3.15Å; L276-I279 HydrophobicContact CD1-CD1 3.88Å; L276-I279 HydrophobicContact CD1-CG1 3.96Å; L276-I279 PolarHBondContact O-N 2.96Å; L276-G280 WeakPolarHBondContact O-CA 3.36Å; L276-G280 PolarHBondContact O-N 3.42Å; L276-L301 HydrophobicContact CD1-CD2 4.17Å; L276-A318 HydrophobicContact CD2-CB 3.92Å; L276-A319 PolarHBondContact N-O 3.4Å; L276-L326 HydrophobicContact CD2-CD1 4.26Å; L276-L326 HydrophobicContact CD2-CD2 4.19Å; L276-L326 HydrophobicContact CG-CD2 4.1Å; L276-L330 HydrophobicContact CD2-CD1 4.34Å; L276-L336 HydrophobicContact CD2-CD1 4.17Å
277	D	89.2	Confident	82.6	Confident	34 Å²	34	55 Å²	55	18%	0.182	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-61	-22.4	174	46.6	-15.4	0	0	0	114.5	E275 I279 T281 I325	E275-D277 VanDerWaalsContact CA-OD1 3.25Å; E275-D277 WeakPolarHBondContact CA-OD1 3.06Å; E275-D277 PolarHBondContact O-N 3.07Å; E275-D277 VanDerWaalsContact O-N 3.08Å; D277-I279 VanDerWaalsContact C-N 3.28Å; D277-I279 PolarHBondContact O-N 3.29Å; D277-T281 WeakPolarHBondContact O-CG2 3.31Å; D277-I325 HydrophobicContact CB-CD1 3.43Å; D277-I325 VanDerWaalsContact CB-CD1 3.43Å; D277-I325 HydrophobicContact CB-CG1 4.16Å
278	A	87.8	Confident	82	Confident	37 Å²	37	60.4 Å²	60.4	31%	0.306	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-65.9	-31.3	175.6	0	0	0	0	0	112.9	P242 E275 L276	P242-A278 HydrophobicContact CG-CB 3.98Å; E275-A278 WeakPolarHBondContact O-CB 3.22Å; E275-A278 PolarHBondContact O-N 3.41Å; L276-A278 PolarHBondContact O-N 3.15Å
279	I	87.4	Confident	81.1	Confident	2 Å²	2	62 Å²	62	1%	0.01	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-21.2	-176.9	56.8	156.4	0	0	0	114	G241 L244 V245 L276 D277 T281 V294 M298 L301	G241-I279 WeakPolarHBondContact O-CG2 3.4Å; L244-I279 HydrophobicContact CB-CG2 3.95Å; L244-I279 HydrophobicContact CD1-CD1 3.67Å; L244-I279 HydrophobicContact CD1-CG2 4.45Å; V245-I279 HydrophobicContact CG2-CG2 4.11Å; L276-I279 HydrophobicContact CD1-CD1 3.88Å; L276-I279 HydrophobicContact CD1-CG1 3.96Å; L276-I279 PolarHBondContact O-N 2.96Å; D277-I279 VanDerWaalsContact C-N 3.28Å; D277-I279 PolarHBondContact O-N 3.29Å; I279-T281 PolarHBondContact O-N 2.9Å; I279-V294 HydrophobicContact CB-CG1 4.29Å; I279-V294 HydrophobicContact CG2-CG1 4.33Å; I279-M298 WeakPolarHBondContact O-CB 3.48Å; I279-L301 HydrophobicContact CD1-CD2 3.52Å
280	G	83.3	Confident	80.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.34	C	S	.	.			trans	-92.8	16.1	-170.7	0	0	0	0	0	114.5	L276 L326 D327	L276-G280 WeakPolarHBondContact O-CA 3.36Å; L276-G280 PolarHBondContact O-N 3.42Å; G280-L326 CarbonylContact O-C 3.44Å; G280-L326 VanDerWaalsContact O-CA 3.24Å; G280-L326 WeakPolarHBondContact O-CA 3.43Å; G280-D327 PolarHBondContact O-N 2.9Å
281	T	84.8	Confident	79.6	Confident	56 Å²	56	67.5 Å²	67.5	34%	0.344	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-62.9	142.6	-176	50.7	0	0	0	0	112	D277 I279 R283 I325	D277-T281 WeakPolarHBondContact O-CG2 3.31Å; I279-T281 PolarHBondContact O-N 2.9Å; T281-R283 PolarHBondContact O-N 3.07Å; T281-I325 CarbonylContact C-O 3.55Å; T281-I325 WeakPolarHBondContact CA-O 3.32Å
282	K	78.8	Confident	79.2	Confident	82 Å²	82	76.9 Å²	76.9	36%	0.357	39%	0.393	S	S	.	.			trans	-53.5	141.5	172.7	-79.2	172.6	-178.9	161.4	0	110.7	F284 D324 I325 L326	K282-F284 HydrophobicContact CB-CE2 3.96Å; K282-F284 HydrophobicContact CB-CZ 4.4Å; K282-F284 WeakPolarHBondContact O-CD2 3.34Å; K282-F284 PolarHBondContact O-N 3.03Å; K282-D324 WeakPolarHBondContact CE-O 3.25Å; K282-D324 PolarHBondContact NZ-O 3.36Å; K282-I325 PolarHBondContact N-O 3.47Å; K282-L326 WeakPolarHBondContact CE-O 3.5Å; K282-L326 WeakPolarHBondContact CG-O 3.39Å
283	R	71.5	Confident	78.7	Confident	142 Å²	142	77.8 Å²	77.8	54%	0.536	40%	0.397	S	S	.	.			trans	-63.3	104.2	175.8	-56.8	178.5	-163.3	-161.2	-1.7	109.1	T281 D327	T281-R283 PolarHBondContact O-N 3.07Å; R283-D327 IonicContact NE-OD2 3.5Å; R283-D327 PolarHBondContact NE-OD2 2.94Å
284	F	66.7	Low	78.4	Confident	149 Å²	149	78.4 Å²	78.4	65%	0.654	40%	0.401	S	S	*	.			trans	-98.2	145.5	162.2	-67.1	-77.9	0	0	0	108.1	K282 S286	K282-F284 HydrophobicContact CB-CE2 3.96Å; K282-F284 HydrophobicContact CB-CZ 4.4Å; K282-F284 WeakPolarHBondContact O-CD2 3.34Å; K282-F284 PolarHBondContact O-N 3.03Å; F284-S286 PolarHBondContact O-N 3.21Å
285	D	60.7	Low	78.1	Confident	174 Å²	174	79.3 Å²	79.3	93%	0.93	40%	0.404	S	S	*	.			trans	-74.2	59	176	-157.8	18.7	0	0	0	109.2
286	S	60.1	Low	78	Confident	46 Å²	46	81.2 Å²	81.2	32%	0.322	41%	0.407	S	S	.	.			trans	-90.7	119.8	176.8	50.8	0	0	0	0	109.2	F284 K288 D291	F284-S286 PolarHBondContact O-N 3.21Å; S286-K288 PolarHBondContact O-N 3.33Å; S286-D291 WeakPolarHBondContact CB-OD2 3.46Å; S286-D291 PolarHBondContact OG-OD2 3Å
287	E	61.6	Low	77.9	Confident	203 Å²	203	81.2 Å²	81.2	95%	0.949	41%	0.407	S	S	*	.			trans	-69.1	5.5	179.3	-69.6	-177.6	140	0	0	114.2
288	K	70.4	Confident	77.9	Confident	157 Å²	157	79.6 Å²	79.6	68%	0.683	40%	0.399	S	S	*	.			trans	-79.2	126.3	-177	-66	-174	-177.6	177.2	0	110.6	S286 G290 D291	S286-K288 PolarHBondContact O-N 3.33Å; K288-G290 PolarHBondContact O-N 3Å; K288-G290 VanDerWaalsContact O-N 3.12Å; K288-D291 PolarHBondContact O-N 3.13Å
289	A	69.4	Low	78	Confident	88 Å²	88	81.2 Å²	81.2	73%	0.727	40%	0.402	S	S	*	.	H	α-helix	trans	-55.9	-30.6	-179	0	0	0	0	0	114.3
290	G	70.7	Confident	78.1	Confident	49 Å²	49	82.9 Å²	82.9	51%	0.505	41%	0.409	S	S	.	.	H	α-helix	trans	-66.7	-42.1	179.1	0	0	0	0	0	113.5	K288 R292 E293 V294	K288-G290 PolarHBondContact O-N 3Å; K288-G290 VanDerWaalsContact O-N 3.12Å; G290-R292 VanDerWaalsContact C-N 3.25Å; G290-R292 PolarHBondContact O-N 3.39Å; G290-E293 PolarHBondContact O-N 3.23Å; G290-V294 PolarHBondContact O-N 3.29Å
291	D	77.9	Confident	78.5	Confident	69 Å²	69	83 Å²	83	37%	0.369	41%	0.41	S	S	.	.	H	α-helix	trans	-66.2	-32.8	-178.4	-64.3	-16.9	0	0	0	111	S286 K288 E293 V294 Q295	S286-D291 WeakPolarHBondContact CB-OD2 3.46Å; S286-D291 PolarHBondContact OG-OD2 3Å; K288-D291 PolarHBondContact O-N 3.13Å; D291-E293 VanDerWaalsContact C-N 3.33Å; D291-E293 PolarHBondContact O-N 2.94Å; D291-V294 PolarHBondContact O-N 2.94Å; D291-Q295 WeakPolarHBondContact O-CB 3.3Å; D291-Q295 VanDerWaalsContact O-CG 3.26Å; D291-Q295 WeakPolarHBondContact O-CG 3.41Å; D291-Q295 PolarHBondContact O-N 2.86Å
292	R	81.9	Confident	78.6	Confident	199 Å²	199	80.6 Å²	80.6	75%	0.751	40%	0.395	S	S	*	.	H	α-helix	trans	-65.1	-34.5	177.4	-168.1	173.7	178.6	173.8	0	112.7	G290 R296	G290-R292 VanDerWaalsContact C-N 3.25Å; G290-R292 PolarHBondContact O-N 3.39Å; R292-R296 WeakPolarHBondContact O-CB 3.42Å; R292-R296 PolarHBondContact O-N 2.88Å
293	E	84.4	Confident	79.1	Confident	20 Å²	20	81.1 Å²	81.1	9%	0.093	40%	0.402	C	S	.	.	H	α-helix	trans	-73.2	-40.2	177.1	-179.7	56.7	-161.2	0	0	111.8	G250 G290 D291 Q295 R296 T297	G250-E293 WeakPolarHBondContact CA-OE1 3.35Å; G250-E293 PolarHBondContact N-OE1 2.9Å; G250-E293 PolarHBondContact N-OE2 3.43Å; G290-E293 PolarHBondContact O-N 3.23Å; D291-E293 VanDerWaalsContact C-N 3.33Å; D291-E293 PolarHBondContact O-N 2.94Å; E293-Q295 VanDerWaalsContact C-N 3.33Å; E293-Q295 PolarHBondContact O-N 3.45Å; E293-R296 WeakPolarHBondContact O-CB 3.28Å; E293-R296 PolarHBondContact O-N 2.81Å; E293-T297 PolarHBondContact O-N 3.18Å; E293-T297 PolarHBondContact O-OG1 3.42Å
294	V	86.3	Confident	79.9	Confident	18 Å²	18	76.1 Å²	76.1	11%	0.109	38%	0.384	C	S	.	.	H	α-helix	trans	-60.4	-46.2	174.2	179.3	0	0	0	0	110.3	V245 I279 G290 D291 R296 T297 M298	V245-V294 HydrophobicContact CG1-CG2 3.97Å; V245-V294 HydrophobicContact CG2-CG2 4.05Å; I279-V294 HydrophobicContact CB-CG1 4.29Å; I279-V294 HydrophobicContact CG2-CG1 4.33Å; G290-V294 PolarHBondContact O-N 3.29Å; D291-V294 PolarHBondContact O-N 2.94Å; V294-R296 VanDerWaalsContact C-N 3.32Å; V294-R296 PolarHBondContact O-N 3.46Å; V294-T297 PolarHBondContact O-N 3.33Å; V294-M298 PolarHBondContact O-N 3.33Å
295	Q	86.3	Confident	80.7	Confident	48 Å²	48	69.4 Å²	69.4	22%	0.224	36%	0.355	C	S	.	.	H	α-helix	trans	-60.4	-40.1	175.3	-72.7	175.8	12.1	0	0	112.4	D291 E293 M298 L299	D291-Q295 WeakPolarHBondContact O-CB 3.3Å; D291-Q295 VanDerWaalsContact O-CG 3.26Å; D291-Q295 WeakPolarHBondContact O-CG 3.41Å; D291-Q295 PolarHBondContact O-N 2.86Å; E293-Q295 VanDerWaalsContact C-N 3.33Å; E293-Q295 PolarHBondContact O-N 3.45Å; Q295-M298 WeakPolarHBondContact O-CB 3.44Å; Q295-M298 PolarHBondContact O-N 3.34Å; Q295-L299 VanDerWaalsContact O-CG 3.3Å; Q295-L299 WeakPolarHBondContact O-CG 3.4Å; Q295-L299 PolarHBondContact O-N 3.04Å
296	R	87.4	Confident	81.5	Confident	131 Å²	131	64.4 Å²	64.4	49%	0.494	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-43.4	176.2	-175.4	-178.8	177.9	169.4	-0.2	111.6	R292 E293 V294 L299 E300	R292-R296 WeakPolarHBondContact O-CB 3.42Å; R292-R296 PolarHBondContact O-N 2.88Å; E293-R296 WeakPolarHBondContact O-CB 3.28Å; E293-R296 PolarHBondContact O-N 2.81Å; V294-R296 VanDerWaalsContact C-N 3.32Å; V294-R296 PolarHBondContact O-N 3.46Å; R296-L299 PolarHBondContact O-N 3.5Å; R296-E300 PolarHBondContact O-N 3.01Å
297	T	90.1	Very high	81.9	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.006	34%	0.34	C	S	.	.	H	α-helix	trans	-66.6	-38.4	177.6	-57.9	0	0	0	0	111.6	L244 A253 V256 E293 V294 E300 L301	L244-T297 HydrophobicContact CB-CG2 4Å; A253-T297 PolarHBondContact N-OG1 3.28Å; V256-T297 HydrophobicContact CG2-CG2 3.73Å; E293-T297 PolarHBondContact O-N 3.18Å; E293-T297 PolarHBondContact O-OG1 3.42Å; V294-T297 PolarHBondContact O-N 3.33Å; T297-E300 PolarHBondContact O-N 3Å; T297-L301 PolarHBondContact O-N 3.14Å
298	M	89.3	Confident	82.1	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-44.7	172.2	-175.8	-170	64.4	0	0	112.2	I279 V294 Q295 E300 L301 L302 D327 L330	I279-M298 WeakPolarHBondContact O-CB 3.48Å; V294-M298 PolarHBondContact O-N 3.33Å; Q295-M298 WeakPolarHBondContact O-CB 3.44Å; Q295-M298 PolarHBondContact O-N 3.34Å; M298-E300 VanDerWaalsContact C-N 3.29Å; M298-E300 PolarHBondContact O-N 3.31Å; M298-L301 WeakPolarHBondContact O-CB 3.4Å; M298-L301 PolarHBondContact O-N 3.09Å; M298-L302 WeakPolarHBondContact O-CG 3.46Å; M298-L302 PolarHBondContact O-N 3.48Å; M298-D327 HydrophobicContact CE-CB 4.36Å; M298-D327 WeakPolarHBondContact CE-OD2 3.4Å; M298-D327 HydrophobicContact SD-CB 3.95Å; M298-L330 HydrophobicContact CG-CD1 4.4Å; M298-L330 HydrophobicContact SD-CD1 4.25Å
299	L	89.3	Confident	81.7	Confident	70 Å²	70	55.1 Å²	55.1	37%	0.366	30%	0.297	S	S	.	.	H	α-helix	trans	-61.1	-40	176.7	-73.9	171	0	0	0	111.6	Q295 R296 L302 N303	Q295-L299 VanDerWaalsContact O-CG 3.3Å; Q295-L299 WeakPolarHBondContact O-CG 3.4Å; Q295-L299 PolarHBondContact O-N 3.04Å; R296-L299 PolarHBondContact O-N 3.5Å; L299-L302 HydrophobicContact CD2-CD1 4.49Å; L299-L302 WeakPolarHBondContact O-CB 3.46Å; L299-L302 PolarHBondContact O-N 3.29Å; L299-N303 VanDerWaalsContact O-CG 3.24Å; L299-N303 PolarHBondContact O-N 3.46Å; L299-N303 PolarHBondContact O-ND2 3.27Å
300	E	90.3	Very high	81.1	Confident	37 Å²	37	53.1 Å²	53.1	17%	0.173	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-42	175	-172.9	56.2	-148.4	0	0	111.7	A253 V256 R257 R296 T297 M298 L302 N303 Q304	A253-E300 HydrophobicContact CB-CB 3.94Å; A253-E300 HydrophobicContact CB-CG 4.04Å; V256-E300 HydrophobicContact CB-CG 4.47Å; V256-E300 HydrophobicContact CG1-CG 4.4Å; R257-E300 VanDerWaalsContact CD-OE1 3.22Å; R257-E300 WeakPolarHBondContact CD-OE1 3.49Å; R257-E300 HydrophobicContact CG-CG 3.9Å; R257-E300 WeakPolarHBondContact CG-OE1 3.15Å; R296-E300 PolarHBondContact O-N 3.01Å; T297-E300 PolarHBondContact O-N 3Å; M298-E300 VanDerWaalsContact C-N 3.29Å; M298-E300 PolarHBondContact O-N 3.31Å; E300-L302 VanDerWaalsContact C-N 3.3Å; E300-L302 PolarHBondContact O-N 2.97Å; E300-N303 PolarHBondContact O-N 3.37Å; E300-Q304 WeakPolarHBondContact O-CG 3.42Å; E300-Q304 PolarHBondContact O-N 3.02Å; E300-Q304 PolarHBondContact OE1-NE2 3.23Å
301	L	90	Very high	80.3	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-57.6	-44	172.8	177.5	62.5	0	0	0	111.5	V256 F260 I273 L276 I279 T297 M298 N303 Q304 L305	V256-L301 HydrophobicContact CG1-CB 4.19Å; V256-L301 HydrophobicContact CG1-CD1 4.2Å; F260-L301 HydrophobicContact CE2-CD1 3.47Å; F260-L301 VanDerWaalsContact CE2-CD1 3.47Å; F260-L301 HydrophobicContact CZ-CD1 3.72Å; I273-L301 HydrophobicContact CD1-CD1 3.97Å; I273-L301 HydrophobicContact CD1-CD2 4.17Å; L276-L301 HydrophobicContact CD1-CD2 4.17Å; I279-L301 HydrophobicContact CD1-CD2 3.52Å; T297-L301 PolarHBondContact O-N 3.14Å; M298-L301 WeakPolarHBondContact O-CB 3.4Å; M298-L301 PolarHBondContact O-N 3.09Å; L301-N303 PolarHBondContact O-N 3.35Å; L301-Q304 PolarHBondContact O-N 3.47Å; L301-L305 HydrophobicContact CD1-CD1 4.26Å; L301-L305 HydrophobicContact CD1-CG 4.28Å; L301-L305 HydrophobicContact CG-CD1 4.07Å; L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 VanDerWaalsContact O-CG 3.23Å; L301-L305 WeakPolarHBondContact O-CG 3.48Å; L301-L305 PolarHBondContact O-N 2.87Å
302	L	88.1	Confident	79.7	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-61.2	-43.8	175.7	-70.5	177.7	0	0	0	112.3	M298 L299 E300 Q304 L305 D306 A329 L330	M298-L302 WeakPolarHBondContact O-CG 3.46Å; M298-L302 PolarHBondContact O-N 3.48Å; L299-L302 HydrophobicContact CD2-CD1 4.49Å; L299-L302 WeakPolarHBondContact O-CB 3.46Å; L299-L302 PolarHBondContact O-N 3.29Å; E300-L302 VanDerWaalsContact C-N 3.3Å; E300-L302 PolarHBondContact O-N 2.97Å; L302-Q304 VanDerWaalsContact C-N 3.34Å; L302-Q304 PolarHBondContact O-N 2.96Å; L302-L305 PolarHBondContact O-N 3.41Å; L302-D306 PolarHBondContact O-N 2.92Å; L302-A329 HydrophobicContact CD1-CB 3.95Å; L302-L330 HydrophobicContact CD2-CD2 3.32Å; L302-L330 HydrophobicContact CD2-CG 3.82Å; L302-L330 HydrophobicContact CG-CD2 4.18Å
303	N	88.8	Confident	79.5	Confident	92 Å²	92	51.5 Å²	51.5	49%	0.492	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-41.4	177.5	-69.8	-20.8	0	0	0	111.6	L299 E300 L301 G307	L299-N303 VanDerWaalsContact O-CG 3.24Å; L299-N303 PolarHBondContact O-N 3.46Å; L299-N303 PolarHBondContact O-ND2 3.27Å; E300-N303 PolarHBondContact O-N 3.37Å; L301-N303 PolarHBondContact O-N 3.35Å; N303-G307 PolarHBondContact O-N 3.06Å
304	Q	87.5	Confident	79.6	Confident	37 Å²	37	51 Å²	51	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-66.7	-38.7	176	-66.3	-54.7	-42	0	0	112	V256 F260 E300 L301 L302 F308	V256-Q304 HydrophobicContact CG1-CG 4.2Å; F260-Q304 HydrophobicContact CB-CG 4.48Å; F260-Q304 HydrophobicContact CD1-CB 4.37Å; F260-Q304 HydrophobicContact CD2-CB 3.71Å; F260-Q304 HydrophobicContact CD2-CG 3.94Å; F260-Q304 HydrophobicContact CE2-CB 3.97Å; F260-Q304 HydrophobicContact CG-CB 3.95Å; F260-Q304 HydrophobicContact CG-CG 4.27Å; F260-Q304 HydrophobicContact CZ-CB 4.37Å; E300-Q304 WeakPolarHBondContact O-CG 3.42Å; E300-Q304 PolarHBondContact O-N 3.02Å; E300-Q304 PolarHBondContact OE1-NE2 3.23Å; L301-Q304 PolarHBondContact O-N 3.47Å; L302-Q304 VanDerWaalsContact C-N 3.34Å; L302-Q304 PolarHBondContact O-N 2.96Å; Q304-F308 WeakPolarHBondContact O-CD2 3.49Å; Q304-F308 VanDerWaalsContact O-CE2 3.24Å; Q304-F308 WeakPolarHBondContact O-CE2 3.45Å
305	L	83.9	Confident	79.7	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-66.3	-39.9	176.6	-70.5	173.1	0	0	0	112.9	F260 L301 L302 F308 V316 L330 R335	F260-L305 HydrophobicContact CE1-CD2 4.46Å; F260-L305 HydrophobicContact CZ-CD2 4.17Å; L301-L305 HydrophobicContact CD1-CD1 4.26Å; L301-L305 HydrophobicContact CD1-CG 4.28Å; L301-L305 HydrophobicContact CG-CD1 4.07Å; L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 VanDerWaalsContact O-CG 3.23Å; L301-L305 WeakPolarHBondContact O-CG 3.48Å; L301-L305 PolarHBondContact O-N 2.87Å; L302-L305 PolarHBondContact O-N 3.41Å; L305-F308 HydrophobicContact CD2-CE2 4.37Å; L305-F308 WeakPolarHBondContact O-CD2 3.34Å; L305-V316 HydrophobicContact CD2-CB 4.15Å; L305-V316 HydrophobicContact CD2-CG1 4.15Å; L305-V316 HydrophobicContact CD2-CG2 3.72Å; L305-L330 HydrophobicContact CD1-CD2 4.5Å; L305-R335 HydrophobicContact CB-CG 4.38Å
306	D	78.3	Confident	80	Confident	69 Å²	69	48.6 Å²	48.6	37%	0.369	25%	0.254	S	S	.	.	H	α-helix	trans	-74.2	-38	177	-74.2	-15.6	0	0	0	112	L302 F308 R335	L302-D306 PolarHBondContact O-N 2.92Å; D306-F308 PolarHBondContact O-N 3.28Å; D306-F308 VanDerWaalsContact O-N 3.09Å; D306-R335 WeakPolarHBondContact OD1-CG 3.47Å; D306-R335 IonicContact OD1-CZ 2.84Å; D306-R335 IonicContact OD1-NE 3.77Å; D306-R335 PolarHBondContact OD1-NE 3.27Å; D306-R335 IonicContact OD1-NH2 3.57Å; D306-R335 IonicContact OD2-CZ 3.61Å; D306-R335 IonicContact OD2-NE 2.74Å; D306-R335 PolarHBondContact OD2-NE 2.95Å; D306-R335 IonicContact OD2-NH2 2.84Å; D306-R335 PolarHBondContact OD2-NH2 3.31Å
307	G	68.8	Low	80.3	Confident	55 Å²	55	42.4 Å²	42.4	57%	0.567	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-3.6	-178.6	0	0	0	0	0	114.8	N303 Q309	N303-G307 PolarHBondContact O-N 3.06Å; G307-Q309 PolarHBondContact O-N 2.85Å
308	F	65.8	Low	80.5	Confident	16 Å²	16	42.4 Å²	42.4	7%	0.07	23%	0.23	C	C	.	.			trans	-68.7	119.1	171.3	-79.1	-75.1	0	0	0	111.4	K209 F260 Q304 L305 D306 M312 V314	K209-F308 HydrophobicContact CD-CB 4.5Å; K209-F308 PolarHBondContact NZ-O 3.43Å; F260-F308 HydrophobicContact CD1-CE1 4.47Å; F260-F308 AromaticContact CD1-CE2 3.71Å; F260-F308 HydrophobicContact CD1-CE2 3.71Å; F260-F308 AromaticContact CD1-CZ 3.35Å; F260-F308 HydrophobicContact CD1-CZ 3.35Å; F260-F308 AromaticContact CE1-CE2 3.41Å; F260-F308 HydrophobicContact CE1-CE2 3.41Å; F260-F308 VanDerWaalsContact CE1-CE2 3.41Å; F260-F308 AromaticContact CE1-CZ 3.43Å; F260-F308 HydrophobicContact CE1-CZ 3.43Å; F260-F308 VanDerWaalsContact CE1-CZ 3.43Å; F260-F308 HydrophobicContact CZ-CE2 4.44Å; Q304-F308 WeakPolarHBondContact O-CD2 3.49Å; Q304-F308 VanDerWaalsContact O-CE2 3.24Å; Q304-F308 WeakPolarHBondContact O-CE2 3.45Å; L305-F308 HydrophobicContact CD2-CE2 4.37Å; L305-F308 WeakPolarHBondContact O-CD2 3.34Å; D306-F308 PolarHBondContact O-N 3.28Å; D306-F308 VanDerWaalsContact O-N 3.09Å; F308-M312 HydrophobicContact CD1-CB 3.97Å; F308-M312 HydrophobicContact CD1-CG 4.32Å; F308-M312 HydrophobicContact CD1-SD 3.52Å; F308-M312 VanDerWaalsContact CD1-SD 3.52Å; F308-M312 HydrophobicContact CE1-SD 3.91Å; F308-V314 HydrophobicContact CE1-CB 3.68Å; F308-V314 HydrophobicContact CE1-CG1 3.86Å; F308-V314 HydrophobicContact CE1-CG2 4.2Å; F308-V314 HydrophobicContact CZ-CB 4.17Å; F308-V314 HydrophobicContact CZ-CG1 3.83Å
309	Q	61.3	Low	80.7	Confident	140 Å²	140	42.4 Å²	42.4	65%	0.654	23%	0.231	S	C	*	.			trans	-59.1	135.8	157.9	-67.1	-176.4	-7.9	0	0	108.6	G307 N311 M312	G307-Q309 PolarHBondContact O-N 2.85Å; Q309-N311 PolarHBondContact O-N 3.25Å; Q309-M312 PolarHBondContact O-N 3.17Å
310	P	56.4	Low	80.9	Confident	47 Å²	47	39.1 Å²	39.1	31%	0.305	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18	-175.2	23.6	-33.4	0	0	0	113.5	Q206	Q206-P310 HydrophobicContact CG-CB 4.23Å
311	N	54.4	Low	81	Confident	143 Å²	143	40.3 Å²	40.3	77%	0.765	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	0.5	-179.7	-65	4	0	0	0	114	Q309	Q309-N311 PolarHBondContact O-N 3.25Å
312	M	65.9	Low	80.9	Confident	65 Å²	65	46.2 Å²	46.2	32%	0.32	24%	0.244	S	C	.	.			trans	-73.2	136.9	-179.8	-86	-167.3	152.5	0	0	112.4	K264 F308 Q309 V314	K264-M312 HydrophobicContact CD-CE 3.72Å; K264-M312 HydrophobicContact CD-SD 4.18Å; K264-M312 HydrophobicContact CG-CE 3.76Å; K264-M312 HydrophobicContact CG-SD 4.06Å; F308-M312 HydrophobicContact CD1-CB 3.97Å; F308-M312 HydrophobicContact CD1-CG 4.32Å; F308-M312 HydrophobicContact CD1-SD 3.52Å; F308-M312 VanDerWaalsContact CD1-SD 3.52Å; F308-M312 HydrophobicContact CE1-SD 3.91Å; Q309-M312 PolarHBondContact O-N 3.17Å; M312-V314 PolarHBondContact O-N 3.37Å
313	Q	77.3	Confident	81	Confident	75 Å²	75	48.6 Å²	48.6	35%	0.35	26%	0.258	S	S	.	.	S	Bend	trans	-81.9	29.3	177.9	-43.2	-173.8	18.7	0	0	112.6	M194 A267 P268 S269	M194-Q313 WeakPolarHBondContact CE-O 3.47Å; A267-Q313 HydrophobicContact CB-CB 4.26Å; P268-Q313 HydrophobicContact CB-CB 4.26Å; S269-Q313 PolarHBondContact N-O 3.23Å; S269-Q313 VanDerWaalsContact N-O 3.11Å
314	V	86.9	Confident	81	Confident	9 Å²	9	48.2 Å²	48.2	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124	178.8	-177.4	0	0	0	0	107.3	A263 K264 S269 I271 F308 M312	A263-V314 HydrophobicContact CB-CG1 4.12Å; K264-V314 HydrophobicContact CG-CG2 4.37Å; S269-V314 WeakPolarHBondContact O-CA 3.47Å; I271-V314 HydrophobicContact CD1-CG1 3.88Å; I271-V314 HydrophobicContact CG1-CG1 4.24Å; F308-V314 HydrophobicContact CE1-CB 3.68Å; F308-V314 HydrophobicContact CE1-CG1 3.86Å; F308-V314 HydrophobicContact CE1-CG2 4.2Å; F308-V314 HydrophobicContact CZ-CB 4.17Å; F308-V314 HydrophobicContact CZ-CG1 3.83Å; M312-V314 PolarHBondContact O-N 3.37Å
315	K	88.9	Confident	81.1	Confident	11 Å²	11	48.3 Å²	48.3	5%	0.048	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	142.6	177.3	-63.8	-62.7	-177.8	-173.3	0	110.1	I190 M194 P208 S269 I270 I271	I190-K315 HydrophobicContact CG2-CB 4.29Å; I190-K315 HydrophobicContact CG2-CG 4.42Å; M194-K315 HydrophobicContact CE-CB 4.17Å; M194-K315 HydrophobicContact CE-CG 3.62Å; P208-K315 PolarHBondContact O-NZ 3.24Å; S269-K315 PolarHBondContact O-N 3.15Å; I270-K315 WeakPolarHBondContact CA-O 3.22Å; I271-K315 PolarHBondContact N-O 3.14Å
316	V	91.4	Very high	81.3	Confident	5 Å²	5	48 Å²	48	3%	0.03	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.5	-179.7	-176	0	0	0	0	109.9	K209 G210 V211 F260 I271 I273 L305	K209-V316 PolarHBondContact O-N 2.95Å; G210-V316 CarbonylContact C-O 3.53Å; G210-V316 WeakPolarHBondContact CA-O 3.48Å; V211-V316 PolarHBondContact N-O 3.44Å; F260-V316 HydrophobicContact CE1-CG2 4.07Å; F260-V316 HydrophobicContact CZ-CG2 4.42Å; I271-V316 HydrophobicContact CB-CG2 4.45Å; I271-V316 WeakPolarHBondContact O-CA 3.5Å; I273-V316 HydrophobicContact CD1-CG1 4.09Å; L305-V316 HydrophobicContact CD2-CB 4.15Å; L305-V316 HydrophobicContact CD2-CG1 4.15Å; L305-V316 HydrophobicContact CD2-CG2 3.72Å
317	I	93.4	Very high	81.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122	171.2	-55.8	177.9	0	0	0	106.7	I190 V211 M213 I270 I271 F272 I273	I190-I317 HydrophobicContact CD1-CD1 3.32Å; I190-I317 HydrophobicContact CD1-CG1 3.35Å; V211-I317 WeakPolarHBondContact O-CA 3.36Å; M213-I317 HydrophobicContact CE-CG2 3.34Å; M213-I317 HydrophobicContact SD-CG2 4.27Å; I270-I317 HydrophobicContact CG2-CD1 3.6Å; I270-I317 HydrophobicContact CG2-CG1 3.91Å; I271-I317 PolarHBondContact O-N 3.37Å; F272-I317 CarbonylContact C-O 3.56Å; F272-I317 WeakPolarHBondContact CA-O 3.46Å; F272-I317 HydrophobicContact CD2-CB 3.93Å; F272-I317 HydrophobicContact CD2-CG2 3.68Å; F272-I317 HydrophobicContact CE2-CG2 4.04Å; I273-I317 PolarHBondContact N-O 3.35Å
318	A	94.1	Very high	82.6	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.1	172.9	0	0	0	0	0	110.3	V211 L212 M213 I273 L276 L336	V211-A318 PolarHBondContact O-N 2.78Å; L212-A318 CarbonylContact C-O 3.45Å; L212-A318 WeakPolarHBondContact CA-O 3.23Å; L212-A318 HydrophobicContact CD1-CB 3.9Å; M213-A318 PolarHBondContact N-O 2.84Å; I273-A318 CarbonylContact O-C 3.58Å; I273-A318 WeakPolarHBondContact O-CA 3.29Å; L276-A318 HydrophobicContact CD2-CB 3.92Å; A318-L336 HydrophobicContact CB-CD1 4.48Å; A318-L336 HydrophobicContact CB-CD2 4.1Å
319	A	94.1	Very high	83.6	Confident	2 Å²	2	46.3 Å²	46.3	2%	0.017	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135.9	172.1	0	0	0	0	0	110.4	M213 K221 F272 I273 E275 L276	M213-A319 HydrophobicContact CE-CB 4.26Å; M213-A319 WeakPolarHBondContact O-CA 3.36Å; K221-A319 HydrophobicContact CB-CB 4.37Å; K221-A319 HydrophobicContact CD-CB 4.46Å; F272-A319 HydrophobicContact CE2-CB 3.99Å; F272-A319 HydrophobicContact CZ-CB 4.05Å; I273-A319 PolarHBondContact O-N 2.92Å; E275-A319 PolarHBondContact N-O 2.89Å; L276-A319 PolarHBondContact N-O 3.4Å
320	T	93.3	Very high	84.8	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	147	171.9	-177.7	0	0	0	0	110.2	L212 M213 Y214 K221 R322 L326	L212-T320 HydrophobicContact CD1-CG2 4Å; M213-T320 PolarHBondContact O-N 2.9Å; Y214-T320 WeakPolarHBondContact CA-O 3.4Å; K221-T320 PolarHBondContact NZ-O 2.93Å; T320-R322 PolarHBondContact OG1-N 3.15Å; T320-R322 VanDerWaalsContact OG1-N 3.08Å; T320-R322 PolarHBondContact OG1-O 2.91Å; T320-L326 HydrophobicContact CG2-CD1 3.78Å
321	N	91.6	Very high	86.2	Confident	62 Å²	62	39.3 Å²	39.3	33%	0.332	20%	0.204	S	C	.	.	S	Bend	trans	-85.9	-21.9	169.3	-63.8	-39.9	0	0	0	112.3	G215 K221	G215-N321 WeakPolarHBondContact O-CA 3.3Å; K221-N321 PolarHBondContact NZ-OD1 2.93Å
322	R	88.8	Confident	87.8	Confident	127 Å²	127	40.1 Å²	40.1	48%	0.479	20%	0.197	S	C	.	.			trans	-132.5	102.2	-171.8	-71.5	-170.3	66.8	-180	1.3	110	T320 D324 I325	T320-R322 PolarHBondContact OG1-N 3.15Å; T320-R322 VanDerWaalsContact OG1-N 3.08Å; T320-R322 PolarHBondContact OG1-O 2.91Å; R322-D324 WeakPolarHBondContact CA-OD1 3.32Å; R322-D324 VanDerWaalsContact CB-OD1 3.29Å; R322-D324 WeakPolarHBondContact CB-OD1 3.49Å; R322-D324 IonicContact CZ-OD2 3.68Å; R322-D324 IonicContact NE-OD1 3.27Å; R322-D324 IonicContact NE-OD2 3.63Å; R322-D324 IonicContact NH2-OD2 3.34Å; R322-D324 PolarHBondContact NH2-OD2 3.33Å; R322-I325 HydrophobicContact CB-CD1 3.7Å; R322-I325 HydrophobicContact CB-CG1 3.78Å; R322-I325 WeakPolarHBondContact O-CG1 3.39Å
323	V	89.5	Confident	88.5	Confident	55 Å²	55	42.1 Å²	42.1	33%	0.333	22%	0.217	S	C	.	.	S	Bend	trans	-79.9	-22.1	178	69.4	0	0	0	0	112.2	Y214 I325 L326 L331	Y214-V323 HydrophobicContact CD2-CB 4.27Å; Y214-V323 HydrophobicContact CD2-CG1 4.1Å; Y214-V323 HydrophobicContact CG-CB 4.27Å; V323-I325 VanDerWaalsContact C-N 3.33Å; V323-I325 PolarHBondContact O-N 3.23Å; V323-L326 PolarHBondContact O-N 3.33Å; V323-L331 HydrophobicContact CG2-CD1 4.46Å; V323-L331 HydrophobicContact CG2-CD2 4.43Å
324	D	89.1	Confident	88.5	Confident	85 Å²	85	39.8 Å²	39.8	46%	0.455	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-34	-178.5	57.3	-51.4	0	0	0	113.5	K282 R322	K282-D324 WeakPolarHBondContact CE-O 3.25Å; K282-D324 PolarHBondContact NZ-O 3.36Å; R322-D324 WeakPolarHBondContact CA-OD1 3.32Å; R322-D324 VanDerWaalsContact CB-OD1 3.29Å; R322-D324 WeakPolarHBondContact CB-OD1 3.49Å; R322-D324 IonicContact CZ-OD2 3.68Å; R322-D324 IonicContact NE-OD1 3.27Å; R322-D324 IonicContact NE-OD2 3.63Å; R322-D324 IonicContact NH2-OD2 3.34Å; R322-D324 PolarHBondContact NH2-OD2 3.33Å
325	I	89.2	Confident	88.5	Confident	39 Å²	39	40.6 Å²	40.6	20%	0.2	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-11	-177.7	61.8	178.2	0	0	0	113.7	D277 T281 K282 R322 V323	D277-I325 HydrophobicContact CB-CD1 3.43Å; D277-I325 VanDerWaalsContact CB-CD1 3.43Å; D277-I325 HydrophobicContact CB-CG1 4.16Å; T281-I325 CarbonylContact C-O 3.55Å; T281-I325 WeakPolarHBondContact CA-O 3.32Å; K282-I325 PolarHBondContact N-O 3.47Å; R322-I325 HydrophobicContact CB-CD1 3.7Å; R322-I325 HydrophobicContact CB-CG1 3.78Å; R322-I325 WeakPolarHBondContact O-CG1 3.39Å; V323-I325 VanDerWaalsContact C-N 3.33Å; V323-I325 PolarHBondContact O-N 3.23Å
326	L	88.5	Confident	88.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-70.7	142.4	-176.7	-70.4	-178.3	0	0	0	112.4	L212 L276 G280 K282 T320 V323 P328 L331	L212-L326 HydrophobicContact CD1-CD1 4.46Å; L212-L326 HydrophobicContact CD2-CD1 4.17Å; L276-L326 HydrophobicContact CD2-CD1 4.26Å; L276-L326 HydrophobicContact CD2-CD2 4.19Å; L276-L326 HydrophobicContact CG-CD2 4.1Å; G280-L326 CarbonylContact O-C 3.44Å; G280-L326 VanDerWaalsContact O-CA 3.24Å; G280-L326 WeakPolarHBondContact O-CA 3.43Å; K282-L326 WeakPolarHBondContact CE-O 3.5Å; K282-L326 WeakPolarHBondContact CG-O 3.39Å; T320-L326 HydrophobicContact CG2-CD1 3.78Å; V323-L326 PolarHBondContact O-N 3.33Å; L326-P328 WeakPolarHBondContact O-CD 3.28Å; L326-L331 HydrophobicContact CD1-CD2 4.37Å
327	D	88.3	Confident	88.1	Confident	14 Å²	14	42.3 Å²	42.3	8%	0.075	23%	0.225	C	C	.	.			trans	-60.7	124.9	171.4	-169.8	-32.4	0	0	0	109.3	G280 R283 M298 A329 L330	G280-D327 PolarHBondContact O-N 2.9Å; R283-D327 IonicContact NE-OD2 3.5Å; R283-D327 PolarHBondContact NE-OD2 2.94Å; M298-D327 HydrophobicContact CE-CB 4.36Å; M298-D327 WeakPolarHBondContact CE-OD2 3.4Å; M298-D327 HydrophobicContact SD-CB 3.95Å; D327-A329 PolarHBondContact O-N 3.45Å; D327-A329 WeakPolarHBondContact OD1-CB 3.46Å; D327-A329 PolarHBondContact OD1-N 2.99Å; D327-L330 PolarHBondContact O-N 3.44Å
328	P	87.3	Confident	88	Confident	79 Å²	79	47.1 Å²	47.1	51%	0.513	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-23.6	174.6	-27	34.8	0	0	0	114.2	L326 L330 L331 R332	L326-P328 WeakPolarHBondContact O-CD 3.28Å; P328-L330 VanDerWaalsContact C-N 3.32Å; P328-L330 PolarHBondContact O-N 3.04Å; P328-L331 PolarHBondContact O-N 3.37Å; P328-R332 PolarHBondContact O-N 3.06Å
329	A	86.9	Confident	87.9	Confident	12 Å²	12	51.9 Å²	51.9	10%	0.099	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-42.2	173.5	0	0	0	0	0	111.7	L302 D327 L331 R332 R335	L302-A329 HydrophobicContact CD1-CB 3.95Å; D327-A329 PolarHBondContact O-N 3.45Å; D327-A329 WeakPolarHBondContact OD1-CB 3.46Å; D327-A329 PolarHBondContact OD1-N 2.99Å; A329-L331 VanDerWaalsContact C-N 3.28Å; A329-L331 PolarHBondContact O-N 3.29Å; A329-R332 PolarHBondContact O-N 2.82Å; A329-R335 VanDerWaalsContact O-CD 3.27Å; A329-R335 WeakPolarHBondContact O-CD 3.42Å; A329-R335 PolarHBondContact O-NH1 3.35Å
330	L	85.6	Confident	87.9	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-31.9	178.3	-73.6	161.7	0	0	0	112.1	L276 M298 L302 L305 D327 P328 R332 L336	L276-L330 HydrophobicContact CD2-CD1 4.34Å; M298-L330 HydrophobicContact CG-CD1 4.4Å; M298-L330 HydrophobicContact SD-CD1 4.25Å; L302-L330 HydrophobicContact CD2-CD2 3.32Å; L302-L330 HydrophobicContact CD2-CG 3.82Å; L302-L330 HydrophobicContact CG-CD2 4.18Å; L305-L330 HydrophobicContact CD1-CD2 4.5Å; D327-L330 PolarHBondContact O-N 3.44Å; P328-L330 VanDerWaalsContact C-N 3.32Å; P328-L330 PolarHBondContact O-N 3.04Å; L330-R332 VanDerWaalsContact C-N 3.29Å; L330-R332 PolarHBondContact O-N 3.22Å; L330-L336 HydrophobicContact CB-CD1 4.3Å
331	L	86.4	Confident	87.9	Confident	38 Å²	38	56.8 Å²	56.8	20%	0.199	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-0.2	-175.3	-62.1	177.5	0	0	0	114.3	L212 V323 L326 P328 A329 K339	L212-L331 HydrophobicContact CD2-CD2 3.35Å; V323-L331 HydrophobicContact CG2-CD1 4.46Å; V323-L331 HydrophobicContact CG2-CD2 4.43Å; L326-L331 HydrophobicContact CD1-CD2 4.37Å; P328-L331 PolarHBondContact O-N 3.37Å; A329-L331 VanDerWaalsContact C-N 3.28Å; A329-L331 PolarHBondContact O-N 3.29Å; L331-K339 WeakPolarHBondContact O-CE 3.29Å; L331-K339 PolarHBondContact O-NZ 2.93Å
332	R	87.4	Confident	88	Confident	160 Å²	160	53.9 Å²	53.9	60%	0.604	27%	0.27	S	S	*	.	S	Bend	trans	-74.2	143.4	-179.9	-169.2	-179.6	-69.5	173.1	-2.5	110.5	P328 A329 L330 R335	P328-R332 PolarHBondContact O-N 3.06Å; A329-R332 PolarHBondContact O-N 2.82Å; L330-R332 VanDerWaalsContact C-N 3.29Å; L330-R332 PolarHBondContact O-N 3.22Å; R332-R335 PolarHBondContact O-N 2.92Å
333	S	80.6	Confident	88.1	Confident	107 Å²	107	50.7 Å²	50.7	75%	0.748	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	138.9	170.9	-172.1	0	0	0	0	110.8
334	G	77.7	Confident	88.2	Confident	26 Å²	26	52.1 Å²	52.1	27%	0.268	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	-1.7	-171.4	0	0	0	0	0	114.5	K209 D337	K209-G334 WeakPolarHBondContact CD-O 3.29Å; G334-D337 WeakPolarHBondContact CA-OD1 3.48Å; G334-D337 PolarHBondContact N-OD1 3.48Å
335	R	85.7	Confident	88.3	Confident	27 Å²	27	49 Å²	49	10%	0.102	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-80.3	178.7	-63	167.1	-178.3	-177.8	-3.8	109.9	G210 L305 D306 A329 R332	G210-R335 WeakPolarHBondContact CA-O 3.34Å; G210-R335 PolarHBondContact N-O 3.06Å; L305-R335 HydrophobicContact CB-CG 4.38Å; D306-R335 WeakPolarHBondContact OD1-CG 3.47Å; D306-R335 IonicContact OD1-CZ 2.84Å; D306-R335 IonicContact OD1-NE 3.77Å; D306-R335 PolarHBondContact OD1-NE 3.27Å; D306-R335 IonicContact OD1-NH2 3.57Å; D306-R335 IonicContact OD2-CZ 3.61Å; D306-R335 IonicContact OD2-NE 2.74Å; D306-R335 PolarHBondContact OD2-NE 2.95Å; D306-R335 IonicContact OD2-NH2 2.84Å; D306-R335 PolarHBondContact OD2-NH2 3.31Å; A329-R335 VanDerWaalsContact O-CD 3.27Å; A329-R335 WeakPolarHBondContact O-CD 3.42Å; A329-R335 PolarHBondContact O-NH1 3.35Å; R332-R335 PolarHBondContact O-N 2.92Å
336	L	87.5	Confident	88.4	Confident	3 Å²	3	53 Å²	53	2%	0.016	28%	0.277	C	S	.	.	S	Bend	trans	-107.5	84.1	175.6	-62.4	172.3	0	0	0	108.7	L212 L276 A318 L330	L212-L336 HydrophobicContact CB-CB 4.2Å; L212-L336 HydrophobicContact CB-CD1 4.2Å; L212-L336 HydrophobicContact CD1-CD1 4.23Å; L212-L336 HydrophobicContact CD2-CD1 4.38Å; L276-L336 HydrophobicContact CD2-CD1 4.17Å; A318-L336 HydrophobicContact CB-CD1 4.48Å; A318-L336 HydrophobicContact CB-CD2 4.1Å; L330-L336 HydrophobicContact CB-CD1 4.3Å
337	D	85.6	Confident	88.6	Confident	49 Å²	49	56.9 Å²	56.9	26%	0.262	30%	0.295	S	S	.	.			trans	-75.1	-44.9	-169.7	-60	-36.9	0	0	0	112	P208 K209 G210 G334	P208-D337 WeakPolarHBondContact CA-OD2 3.48Å; P208-D337 HydrophobicContact CB-CB 3.98Å; K209-D337 PolarHBondContact N-OD2 2.98Å; G210-D337 PolarHBondContact O-N 3.28Å; G334-D337 WeakPolarHBondContact CA-OD1 3.48Å; G334-D337 PolarHBondContact N-OD1 3.48Å
338	R	90	Very high	88.8	Confident	100 Å²	100	64.4 Å²	64.4	38%	0.377	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128	-178.6	-62.8	-71.3	-90.5	177.5	-7.8	109.6	A189 P208 G210 V211 L212	A189-R338 HydrophobicContact CB-CG 4.19Å; P208-R338 HydrophobicContact CB-CG 4.07Å; P208-R338 HydrophobicContact CG-CG 4.34Å; G210-R338 PolarHBondContact O-N 2.95Å; V211-R338 CarbonylContact C-O 3.49Å; V211-R338 WeakPolarHBondContact CA-O 3.41Å; V211-R338 HydrophobicContact CG1-CB 4.25Å; V211-R338 HydrophobicContact CG2-CB 4.24Å; L212-R338 PolarHBondContact N-O 3.33Å
339	K	92.7	Very high	89.1	Confident	101 Å²	101	61.1 Å²	61.1	44%	0.439	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	106.3	-179.5	-59.7	175.8	-173.2	176	0	107.3	L212 Y214 L331	L212-K339 CarbonylContact O-C 3.56Å; L212-K339 WeakPolarHBondContact O-CA 3.46Å; Y214-K339 HydrophobicContact CE1-CB 4.01Å; L331-K339 WeakPolarHBondContact O-CE 3.29Å; L331-K339 PolarHBondContact O-NZ 2.93Å
340	I	93.8	Very high	89.5	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.6	-176.5	-55.2	-176.8	0	0	0	108.1	Q182 E185 L186 V211 L212 M213 Y214 F342	Q182-I340 HydrophobicContact CB-CG2 3.76Å; Q182-I340 HydrophobicContact CG-CG2 3.54Å; E185-I340 HydrophobicContact CB-CD1 3.9Å; E185-I340 HydrophobicContact CB-CG1 4.33Å; L186-I340 HydrophobicContact CB-CD1 4.04Å; L186-I340 HydrophobicContact CD1-CD1 4.17Å; V211-I340 HydrophobicContact CG1-CD1 3.49Å; V211-I340 VanDerWaalsContact CG1-CD1 3.49Å; V211-I340 HydrophobicContact CG1-CG1 3.78Å; L212-I340 PolarHBondContact O-N 3.5Å; M213-I340 WeakPolarHBondContact CA-O 3.43Å; Y214-I340 PolarHBondContact N-O 2.93Å; I340-F342 HydrophobicContact CB-CE2 4.35Å; I340-F342 HydrophobicContact CG2-CD2 4.28Å; I340-F342 HydrophobicContact CG2-CE2 3.78Å
341	E	93.6	Very high	89.9	Confident	106 Å²	106	62.1 Å²	62.1	50%	0.495	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	133.2	175.4	-168.7	166.4	156.2	0	0	111.2	Q182 Y214 P343	Q182-E341 WeakPolarHBondContact CG-O 3.08Å; Q182-E341 PolarHBondContact NE2-O 3.26Å; Y214-E341 HydrophobicContact CD2-CG 4.28Å; Y214-E341 HydrophobicContact CE1-CB 4.17Å; Y214-E341 HydrophobicContact CE2-CB 3.88Å; Y214-E341 HydrophobicContact CE2-CG 3.57Å; Y214-E341 WeakPolarHBondContact OH-CB 3.31Å; Y214-E341 PolarHBondContact OH-OE2 2.87Å; E341-P343 VanDerWaalsContact O-CD 3.26Å; E341-P343 WeakPolarHBondContact O-CD 3.43Å
342	F	93.6	Very high	90.2	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.324	C	S	.	.			trans	-103.7	98.2	173.1	-76.1	-111	0	0	0	108.6	L179 Q182 M213 Y214 P216 K221 L224 I340	L179-F342 HydrophobicContact CD1-CD1 3.97Å; L179-F342 HydrophobicContact CD1-CE1 3.9Å; L179-F342 HydrophobicContact CD2-CD1 4.23Å; Q182-F342 HydrophobicContact CB-CZ 4.47Å; M213-F342 HydrophobicContact CB-CD2 4.19Å; M213-F342 HydrophobicContact CB-CE2 3.63Å; M213-F342 HydrophobicContact CB-CZ 4.39Å; M213-F342 HydrophobicContact CG-CE2 3.68Å; M213-F342 HydrophobicContact CG-CZ 4.21Å; M213-F342 HydrophobicContact SD-CE2 3.85Å; M213-F342 HydrophobicContact SD-CZ 3.73Å; Y214-F342 PolarHBondContact O-N 3.19Å; P216-F342 WeakPolarHBondContact CD-O 3.18Å; K221-F342 HydrophobicContact CG-CB 4.49Å; K221-F342 HydrophobicContact CG-CD1 3.99Å; K221-F342 HydrophobicContact CG-CD2 4.01Å; K221-F342 HydrophobicContact CG-CE1 4.16Å; K221-F342 HydrophobicContact CG-CE2 4.23Å; K221-F342 HydrophobicContact CG-CG 3.89Å; K221-F342 HydrophobicContact CG-CZ 4.27Å; L224-F342 HydrophobicContact CB-CZ 4.42Å; L224-F342 HydrophobicContact CD2-CE1 4.18Å; L224-F342 HydrophobicContact CD2-CZ 3.59Å; I340-F342 HydrophobicContact CB-CE2 4.35Å; I340-F342 HydrophobicContact CG2-CD2 4.28Å; I340-F342 HydrophobicContact CG2-CE2 3.78Å
343	P	91.8	Very high	90.5	Very high	61 Å²	61	58.9 Å²	58.9	40%	0.396	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-70.6	166.6	174.2	31.6	-35.4	0	0	0	110.7	Q182 E341	Q182-P343 VanDerWaalsContact NE2-CD 3.33Å; E341-P343 VanDerWaalsContact O-CD 3.26Å; E341-P343 WeakPolarHBondContact O-CD 3.43Å
344	M	90.4	Very high	91.2	Very high	85 Å²	85	53.8 Å²	53.8	42%	0.419	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-62.8	147.5	164.6	-71.3	-63.4	-163.7	0	0	109.9	P216 T219 N346 N380	P216-M344 HydrophobicContact CB-CE 3.53Å; P216-M344 HydrophobicContact CB-SD 4.01Å; P216-M344 HydrophobicContact CG-CE 3.74Å; P216-M344 HydrophobicContact CG-CG 4.24Å; P216-M344 HydrophobicContact CG-SD 4.01Å; T219-M344 HydrophobicContact CG2-SD 4.41Å; M344-N346 PolarHBondContact O-N 2.91Å; M344-N380 HydrophobicContact SD-CB 4.11Å
345	P	92.1	Very high	91.9	Very high	20 Å²	20	56 Å²	56	13%	0.13	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-69.4	131.3	-177.2	29	-34.8	0	0	0	111.5	A349 R350 I353 F379	P345-A349 HydrophobicContact CB-CB 3.73Å; P345-R350 HydrophobicContact CB-CG 3.96Å; P345-R350 HydrophobicContact CG-CG 3.86Å; P345-R350 PolarHBondContact O-NH1 3.29Å; P345-I353 HydrophobicContact CB-CD1 4Å; P345-I353 HydrophobicContact CG-CD1 4.44Å; P345-F379 WeakPolarHBondContact CD-O 3.38Å; P345-F379 WeakPolarHBondContact CG-O 3.49Å
346	N	91.9	Very high	92.3	Very high	123 Å²	123	55.3 Å²	55.3	66%	0.658	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-64.9	169.3	170.1	-65.3	-11.6	0	0	0	111.3	M344 E348 A349 R350	M344-N346 PolarHBondContact O-N 2.91Å; N346-E348 PolarHBondContact O-N 2.78Å; N346-A349 WeakPolarHBondContact O-CA 3.26Å; N346-A349 WeakPolarHBondContact O-CB 3.44Å; N346-A349 PolarHBondContact O-N 3.38Å; N346-R350 WeakPolarHBondContact O-CG 3.49Å; N346-R350 PolarHBondContact O-N 2.96Å
347	E	92.4	Very high	92.5	Very high	82 Å²	82	57.9 Å²	57.9	38%	0.383	28%	0.277	S	S	.	.	H	α-helix	trans	-50.4	-51.9	177.8	-172.3	-178.2	155.8	0	0	112.3	A349 R350 A351 A373 R374	E347-A349 VanDerWaalsContact C-N 3.3Å; E347-A349 PolarHBondContact O-N 3.4Å; E347-R350 PolarHBondContact O-N 2.87Å; E347-A351 PolarHBondContact O-N 3.41Å; E347-A373 HydrophobicContact CG-CB 4.03Å; E347-A373 VanDerWaalsContact O-CB 3.31Å; E347-A373 WeakPolarHBondContact O-CB 3.39Å; E347-R374 HydrophobicContact CG-CG 4.22Å; E347-R374 WeakPolarHBondContact OE1-CD 3.4Å; E347-R374 WeakPolarHBondContact OE1-CG 3.47Å; E347-R374 IonicContact OE1-CZ 3.52Å; E347-R374 IonicContact OE1-NE 2.69Å; E347-R374 PolarHBondContact OE1-NE 3.43Å; E347-R374 IonicContact OE1-NH2 2.92Å
348	E	92.9	Very high	92.8	Very high	172 Å²	172	55.6 Å²	55.6	80%	0.804	27%	0.265	S	S	*	.	H	α-helix	trans	-60.6	-38.6	177.2	-63.6	-178.4	172.7	0	0	112.8	N346 A351 R352	N346-E348 PolarHBondContact O-N 2.78Å; E348-A351 PolarHBondContact O-N 2.92Å; E348-R352 WeakPolarHBondContact O-CB 3.47Å; E348-R352 PolarHBondContact O-N 3.22Å
349	A	93.1	Very high	92.9	Very high	9 Å²	9	57 Å²	57	7%	0.074	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-41.4	178.3	0	0	0	0	0	111.2	P345 N346 E347 R352 I353	P345-A349 HydrophobicContact CB-CB 3.73Å; N346-A349 WeakPolarHBondContact O-CA 3.26Å; N346-A349 WeakPolarHBondContact O-CB 3.44Å; N346-A349 PolarHBondContact O-N 3.38Å; E347-A349 VanDerWaalsContact C-N 3.3Å; E347-A349 PolarHBondContact O-N 3.4Å; A349-R352 PolarHBondContact O-N 3.17Å; A349-I353 WeakPolarHBondContact O-CB 3.46Å; A349-I353 WeakPolarHBondContact O-CD1 3.46Å; A349-I353 WeakPolarHBondContact O-CG1 3.5Å; A349-I353 PolarHBondContact O-N 3.27Å
350	R	94.3	Very high	92.7	Very high	21 Å²	21	61.9 Å²	61.9	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-45.8	176.3	-68	-171.5	-59.9	-108.7	21.1	111.5	P345 N346 E347 R352 I353 M354 A373 T376 D377	P345-R350 HydrophobicContact CB-CG 3.96Å; P345-R350 HydrophobicContact CG-CG 3.86Å; P345-R350 PolarHBondContact O-NH1 3.29Å; N346-R350 WeakPolarHBondContact O-CG 3.49Å; N346-R350 PolarHBondContact O-N 2.96Å; E347-R350 PolarHBondContact O-N 2.87Å; R350-R352 VanDerWaalsContact C-N 3.27Å; R350-R352 PolarHBondContact O-N 3.11Å; R350-I353 PolarHBondContact O-N 3.33Å; R350-M354 WeakPolarHBondContact O-CG 3.43Å; R350-M354 PolarHBondContact O-N 3.21Å; R350-A373 HydrophobicContact CB-CB 4.13Å; R350-A373 PolarHBondContact NE-O 3.09Å; R350-A373 VanDerWaalsContact NE-O 3.11Å; R350-A373 PolarHBondContact NH2-O 3.43Å; R350-T376 WeakPolarHBondContact CD-O 3.3Å; R350-T376 PolarHBondContact NE-O 2.97Å; R350-D377 IonicContact NH2-OD1 3.83Å; R350-D377 PolarHBondContact NH2-OD1 3.05Å
351	A	94.1	Very high	92.7	Very high	14 Å²	14	64.7 Å²	64.7	12%	0.116	31%	0.305	C	S	.	.	H	α-helix	trans	-55.1	-46.6	174.6	0	0	0	0	0	110.6	E347 E348 M354 Q355 A373	E347-A351 PolarHBondContact O-N 3.41Å; E348-A351 PolarHBondContact O-N 2.92Å; A351-M354 PolarHBondContact O-N 2.69Å; A351-Q355 WeakPolarHBondContact O-CB 3.08Å; A351-Q355 PolarHBondContact O-N 3.14Å; A351-A373 HydrophobicContact CB-CB 3.84Å
352	R	93.9	Very high	92.7	Very high	113 Å²	113	64.5 Å²	64.5	43%	0.426	31%	0.308	S	S	.	.	H	α-helix	trans	-65.5	-41.7	179.4	-168.9	58.3	172.7	-172.1	-6.9	113.1	E348 A349 R350 Q355 I356	E348-R352 WeakPolarHBondContact O-CB 3.47Å; E348-R352 PolarHBondContact O-N 3.22Å; A349-R352 PolarHBondContact O-N 3.17Å; R350-R352 VanDerWaalsContact C-N 3.27Å; R350-R352 PolarHBondContact O-N 3.11Å; R352-Q355 PolarHBondContact O-N 3.45Å; R352-I356 HydrophobicContact CG-CD1 4.14Å; R352-I356 WeakPolarHBondContact O-CD1 3.49Å; R352-I356 VanDerWaalsContact O-CG1 3.26Å; R352-I356 WeakPolarHBondContact O-CG1 3.47Å; R352-I356 PolarHBondContact O-N 2.79Å
353	I	93.7	Very high	92.7	Very high	17 Å²	17	66.1 Å²	66.1	9%	0.087	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-46.8	178.2	-69.9	162.3	0	0	0	110.6	P345 A349 R350 Q355 I356 H357 C384	P345-I353 HydrophobicContact CB-CD1 4Å; P345-I353 HydrophobicContact CG-CD1 4.44Å; A349-I353 WeakPolarHBondContact O-CB 3.46Å; A349-I353 WeakPolarHBondContact O-CD1 3.46Å; A349-I353 WeakPolarHBondContact O-CG1 3.5Å; A349-I353 PolarHBondContact O-N 3.27Å; R350-I353 PolarHBondContact O-N 3.33Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 3.43Å; I353-I356 PolarHBondContact O-N 3.36Å; I353-H357 PolarHBondContact O-CD2 2.95Å; I353-H357 VanDerWaalsContact O-CD2 3.32Å; I353-H357 PolarHBondContact O-N 3.35Å; I353-H357 VanDerWaalsContact O-N 3.1Å; I353-C384 HydrophobicContact CB-CB 4.42Å; I353-C384 HydrophobicContact CG2-CB 3.69Å
354	M	93.9	Very high	92.8	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-42.3	176.8	-70.2	-177.1	-176.5	0	0	111.5	R350 A351 I356 H357 S358 Y369 L372 T376 C384	R350-M354 WeakPolarHBondContact O-CG 3.43Å; R350-M354 PolarHBondContact O-N 3.21Å; A351-M354 PolarHBondContact O-N 2.69Å; M354-I356 PolarHBondContact O-N 3Å; M354-H357 PolarHBondContact O-N 3.34Å; M354-S358 WeakPolarHBondContact O-CB 3.33Å; M354-S358 PolarHBondContact O-N 3.32Å; M354-S358 PolarHBondContact O-OG 3.16Å; M354-Y369 HydrophobicContact CB-CD1 3.96Å; M354-Y369 HydrophobicContact CB-CE1 4.31Å; M354-L372 HydrophobicContact SD-CB 3.96Å; M354-T376 HydrophobicContact CE-CG2 3.43Å; M354-T376 VanDerWaalsContact CE-CG2 3.43Å; M354-T376 WeakPolarHBondContact CE-OG1 3.48Å; M354-C384 HydrophobicContact CE-CB 4.32Å; M354-C384 HydrophobicContact CG-CB 4.07Å
355	Q	93.8	Very high	92.8	Very high	71 Å²	71	65.9 Å²	65.9	33%	0.332	32%	0.322	S	S	.	.	H	α-helix	trans	-59.7	-45.1	176.5	-170.3	-176.6	32.4	0	0	111.5	A351 R352 I353 S358 R359 Y369	A351-Q355 WeakPolarHBondContact O-CB 3.08Å; A351-Q355 PolarHBondContact O-N 3.14Å; R352-Q355 PolarHBondContact O-N 3.45Å; I353-Q355 VanDerWaalsContact C-N 3.32Å; I353-Q355 PolarHBondContact O-N 3.43Å; Q355-S358 PolarHBondContact O-N 3.44Å; Q355-R359 WeakPolarHBondContact O-CG 3.27Å; Q355-R359 PolarHBondContact O-N 3.33Å; Q355-Y369 HydrophobicContact CB-CD2 4.24Å; Q355-Y369 HydrophobicContact CB-CE2 4.26Å; Q355-Y369 HydrophobicContact CB-CG 4.38Å; Q355-Y369 HydrophobicContact CG-CD2 4.24Å; Q355-Y369 HydrophobicContact CG-CE2 4.02Å
356	I	93.3	Very high	92.8	Very high	14 Å²	14	71.3 Å²	71.3	7%	0.072	35%	0.351	C	S	.	.	H	α-helix	trans	-60.6	-48.4	178.8	-70.6	162.2	0	0	0	111	D175 R352 I353 M354 S358 R359	D175-I356 HydrophobicContact CB-CG2 4.44Å; R352-I356 HydrophobicContact CG-CD1 4.14Å; R352-I356 WeakPolarHBondContact O-CD1 3.49Å; R352-I356 VanDerWaalsContact O-CG1 3.26Å; R352-I356 WeakPolarHBondContact O-CG1 3.47Å; R352-I356 PolarHBondContact O-N 2.79Å; I353-I356 PolarHBondContact O-N 3.36Å; M354-I356 PolarHBondContact O-N 3Å; I356-S358 PolarHBondContact O-N 3.26Å; I356-R359 WeakPolarHBondContact O-CB 3.36Å; I356-R359 PolarHBondContact O-N 3.46Å
357	H	92.1	Very high	92.9	Very high	56 Å²	56	66.2 Å²	66.2	26%	0.259	32%	0.324	S	S	.	.	H	α-helix	trans	-67.3	-29	179.8	-72.5	-48.6	0	0	0	112.8	I353 M354 M361 C388	I353-H357 PolarHBondContact O-CD2 2.95Å; I353-H357 VanDerWaalsContact O-CD2 3.32Å; I353-H357 PolarHBondContact O-N 3.35Å; I353-H357 VanDerWaalsContact O-N 3.1Å; M354-H357 PolarHBondContact O-N 3.34Å; H357-M361 WeakPolarHBondContact O-CE 3.44Å; H357-C388 HydrophobicContact CB-CB 4.19Å
358	S	92.4	Very high	93	Very high	2 Å²	2	65.7 Å²	65.7	1%	0.014	32%	0.323	C	S	.	.	H	α-helix	trans	-75.1	-18.4	177.6	-60.3	0	0	0	0	113.9	M354 Q355 I356 K360 M361 Y369 Y408	M354-S358 WeakPolarHBondContact O-CB 3.33Å; M354-S358 PolarHBondContact O-N 3.32Å; M354-S358 PolarHBondContact O-OG 3.16Å; Q355-S358 PolarHBondContact O-N 3.44Å; I356-S358 PolarHBondContact O-N 3.26Å; S358-K360 PolarHBondContact O-N 3.48Å; S358-M361 PolarHBondContact O-N 3.46Å; S358-Y369 WeakPolarHBondContact CB-OH 3.3Å; S358-Y408 WeakPolarHBondContact CB-OH 3.43Å; S358-Y408 PolarHBondContact OG-OH 2.84Å
359	R	91.2	Very high	93.1	Very high	128 Å²	128	59.5 Å²	59.5	48%	0.483	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.2	-180	-70.5	-178.6	-173.5	156.2	4.9	114.6	S174 Q355 I356	S174-R359 PolarHBondContact O-NH1 3.06Å; Q355-R359 WeakPolarHBondContact O-CG 3.27Å; Q355-R359 PolarHBondContact O-N 3.33Å; I356-R359 WeakPolarHBondContact O-CB 3.36Å; I356-R359 PolarHBondContact O-N 3.46Å
360	K	89.2	Confident	93.1	Very high	204 Å²	204	65.1 Å²	65.1	89%	0.887	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-10	-179.8	-64.3	-172.7	179.8	-175.6	0	113	S358	S358-K360 PolarHBondContact O-N 3.48Å
361	M	92.7	Very high	93.1	Very high	61 Å²	61	68.7 Å²	68.7	30%	0.3	34%	0.336	S	S	.	.	S	Bend	trans	-108.9	157.1	-175.4	-66.4	-179.7	-82.8	0	0	110.3	H357 S358 V363 C388 L403	H357-M361 WeakPolarHBondContact O-CE 3.44Å; S358-M361 PolarHBondContact O-N 3.46Å; M361-V363 HydrophobicContact CB-CG2 4.26Å; M361-V363 PolarHBondContact O-N 2.91Å; M361-C388 HydrophobicContact CE-CB 3.76Å; M361-L403 HydrophobicContact CB-CD1 3.77Å; M361-L403 HydrophobicContact CG-CD1 4.4Å; M361-L403 HydrophobicContact SD-CD1 3.95Å
362	N	93.8	Very high	93.1	Very high	102 Å²	102	68 Å²	68	55%	0.545	33%	0.33	S	S	.	.			trans	-84.2	107.1	174.1	-173.1	29.3	0	0	0	109.2	T401 E402 L403	N362-T401 WeakPolarHBondContact CB-O 3.15Å; N362-T401 PolarHBondContact ND2-O 3.33Å; N362-E402 WeakPolarHBondContact O-CA 3.44Å; N362-L403 PolarHBondContact O-N 3.2Å
363	V	94.4	Very high	93.1	Very high	34 Å²	34	62.7 Å²	62.7	21%	0.206	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-116.7	135	-173.3	-172	0	0	0	0	109.7	M361 V367 L403 Y408	M361-V363 HydrophobicContact CB-CG2 4.26Å; M361-V363 PolarHBondContact O-N 2.91Å; V363-V367 HydrophobicContact CG1-CB 3.86Å; V363-V367 HydrophobicContact CG1-CG1 4.34Å; V363-V367 HydrophobicContact CG1-CG2 3.53Å; V363-L403 HydrophobicContact CG1-CB 4.34Å; V363-L403 HydrophobicContact CG2-CB 4.32Å; V363-L403 HydrophobicContact CG2-CD1 4.02Å; V363-Y408 HydrophobicContact CG1-CE2 4.23Å
364	S	93.5	Very high	93.1	Very high	12 Å²	12	69.4 Å²	69.4	8%	0.084	33%	0.334	C	S	.	.			trans	-62.3	141.2	173.5	172.3	0	0	0	0	110.5	D366 V367 L403	S364-D366 PolarHBondContact O-N 2.8Å; S364-D366 VanDerWaalsContact O-N 3.08Å; S364-D366 PolarHBondContact OG-N 3.04Å; S364-D366 PolarHBondContact OG-OD2 2.72Å; S364-V367 WeakPolarHBondContact O-CG2 3.44Å; S364-V367 PolarHBondContact O-N 3.03Å; S364-L403 VanDerWaalsContact CB-O 3.3Å; S364-L403 WeakPolarHBondContact CB-O 3.22Å; S364-L403 PolarHBondContact N-O 3.11Å
365	P	90.9	Very high	93	Very high	128 Å²	128	71.7 Å²	71.7	83%	0.831	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.7	174.5	28.2	-36.6	0	0	0	113.4	V367	P365-V367 PolarHBondContact O-N 2.81Å
366	D	91.5	Very high	92.8	Very high	135 Å²	135	68.3 Å²	68.3	72%	0.722	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-5.2	179.2	-59.8	-29.9	0	0	0	113.3	S364 N368	S364-D366 PolarHBondContact O-N 2.8Å; S364-D366 VanDerWaalsContact O-N 3.08Å; S364-D366 PolarHBondContact OG-N 3.04Å; S364-D366 PolarHBondContact OG-OD2 2.72Å; D366-N368 PolarHBondContact O-N 3.37Å
367	V	93.3	Very high	92.5	Very high	15 Å²	15	72.6 Å²	72.6	9%	0.091	36%	0.357	C	S	.	.			trans	-77.9	111.5	-178.9	178.7	0	0	0	0	111.5	V363 S364 P365 Y369 L372 Y408	V363-V367 HydrophobicContact CG1-CB 3.86Å; V363-V367 HydrophobicContact CG1-CG1 4.34Å; V363-V367 HydrophobicContact CG1-CG2 3.53Å; S364-V367 WeakPolarHBondContact O-CG2 3.44Å; S364-V367 PolarHBondContact O-N 3.03Å; P365-V367 PolarHBondContact O-N 2.81Å; V367-Y369 HydrophobicContact CG1-CD1 4.4Å; V367-Y369 HydrophobicContact CG1-CE1 4.06Å; V367-L372 HydrophobicContact CG1-CD1 3.83Å; V367-Y408 HydrophobicContact CG1-CD2 4.11Å; V367-Y408 HydrophobicContact CG1-CE2 4.01Å; V367-Y408 HydrophobicContact CG2-CD2 4.41Å; V367-Y408 HydrophobicContact CG2-CE2 4.2Å
368	N	95	Very high	92.3	Very high	71 Å²	71	75.7 Å²	75.7	38%	0.38	38%	0.375	S	S	.	.			trans	-89.8	106.7	172.2	-172.3	-4.9	0	0	0	112.5	D366 E370 E371 L372	D366-N368 PolarHBondContact O-N 3.37Å; N368-E370 VanDerWaalsContact C-N 3.33Å; N368-E370 PolarHBondContact O-N 3.13Å; N368-E370 WeakPolarHBondContact OD1-CB 3.16Å; N368-E370 PolarHBondContact OD1-N 3.14Å; N368-E371 HydrophobicContact CB-CB 4.15Å; N368-E371 PolarHBondContact O-N 3.18Å; N368-L372 WeakPolarHBondContact O-CG 3.41Å; N368-L372 PolarHBondContact O-N 2.83Å
369	Y	94.5	Very high	92.2	Very high	43 Å²	43	75.8 Å²	75.8	17%	0.169	38%	0.375	C	S	.	.	H	α-helix	trans	-70.6	-23.7	178.1	-64.9	-71.5	0	0	0	114.4	M354 Q355 S358 V367 L372 A373	M354-Y369 HydrophobicContact CB-CD1 3.96Å; M354-Y369 HydrophobicContact CB-CE1 4.31Å; Q355-Y369 HydrophobicContact CB-CD2 4.24Å; Q355-Y369 HydrophobicContact CB-CE2 4.26Å; Q355-Y369 HydrophobicContact CB-CG 4.38Å; Q355-Y369 HydrophobicContact CG-CD2 4.24Å; Q355-Y369 HydrophobicContact CG-CE2 4.02Å; S358-Y369 WeakPolarHBondContact CB-OH 3.3Å; V367-Y369 HydrophobicContact CG1-CD1 4.4Å; V367-Y369 HydrophobicContact CG1-CE1 4.06Å; Y369-L372 HydrophobicContact CD1-CD1 4.22Å; Y369-A373 VanDerWaalsContact O-CB 3.29Å; Y369-A373 WeakPolarHBondContact O-CB 3.49Å; Y369-A373 PolarHBondContact O-N 3.27Å
370	E	94.2	Very high	92.2	Very high	127 Å²	127	70.8 Å²	70.8	59%	0.593	36%	0.358	S	S	*	.	H	α-helix	trans	-69.2	-41.5	176.6	-63	-179.9	179	0	0	110.5	N368 A373 R374	N368-E370 VanDerWaalsContact C-N 3.33Å; N368-E370 PolarHBondContact O-N 3.13Å; N368-E370 WeakPolarHBondContact OD1-CB 3.16Å; N368-E370 PolarHBondContact OD1-N 3.14Å; E370-A373 PolarHBondContact O-N 2.75Å; E370-R374 WeakPolarHBondContact O-CG 3.36Å; E370-R374 PolarHBondContact O-N 3.15Å; E370-R374 VanDerWaalsContact O-N 3.16Å
371	E	94.1	Very high	92.2	Very high	96 Å²	96	61.8 Å²	61.8	45%	0.449	32%	0.323	S	S	.	.	H	α-helix	trans	-64.2	-46.4	174.8	-177.5	169.9	-165.1	0	0	111.4	N368 A373 R374 C375 H405	N368-E371 HydrophobicContact CB-CB 4.15Å; N368-E371 PolarHBondContact O-N 3.18Å; E371-A373 VanDerWaalsContact C-N 3.27Å; E371-A373 PolarHBondContact O-N 2.65Å; E371-R374 WeakPolarHBondContact O-CB 3.29Å; E371-R374 PolarHBondContact O-N 3.31Å; E371-R374 VanDerWaalsContact O-N 3.16Å; E371-C375 PolarHBondContact O-N 3.3Å; E371-C375 VanDerWaalsContact O-N 3.12Å; E371-C375 PolarHBondContact O-SG 2.82Å; E371-C375 VanDerWaalsContact O-SG 3.41Å; E371-H405 IonicContact OE2-CE1 3.65Å; E371-H405 IonicContact OE2-NE2 3.27Å
372	L	93.9	Very high	92.1	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-58.9	-40.3	175.5	-65.5	177.3	0	0	0	111.9	M354 V367 N368 Y369 R374 C375 T376 H405 Y408 M409 I412	M354-L372 HydrophobicContact SD-CB 3.96Å; V367-L372 HydrophobicContact CG1-CD1 3.83Å; N368-L372 WeakPolarHBondContact O-CG 3.41Å; N368-L372 PolarHBondContact O-N 2.83Å; Y369-L372 HydrophobicContact CD1-CD1 4.22Å; L372-R374 VanDerWaalsContact C-N 3.31Å; L372-R374 PolarHBondContact O-N 2.85Å; L372-C375 PolarHBondContact O-N 3.01Å; L372-C375 VanDerWaalsContact O-N 3.14Å; L372-T376 WeakPolarHBondContact O-CG2 3.45Å; L372-T376 PolarHBondContact O-N 2.95Å; L372-T376 VanDerWaalsContact O-N 3.13Å; L372-T376 PolarHBondContact O-OG1 3.43Å; L372-H405 VanDerWaalsContact CD2-CE1 3.5Å; L372-H405 WeakPolarHBondContact CD2-CE1 3.22Å; L372-Y408 HydrophobicContact CD1-CD1 3.94Å; L372-Y408 HydrophobicContact CD1-CD2 4.19Å; L372-Y408 HydrophobicContact CD1-CG 3.68Å; L372-M409 HydrophobicContact CD2-CG 4.36Å; L372-M409 HydrophobicContact CD2-SD 4.03Å; L372-I412 HydrophobicContact CD2-CD1 4.03Å
373	A	94.2	Very high	92	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-35.4	179.1	0	0	0	0	0	113.1	E347 R350 A351 Y369 E370 E371 T376	E347-A373 HydrophobicContact CG-CB 4.03Å; E347-A373 VanDerWaalsContact O-CB 3.31Å; E347-A373 WeakPolarHBondContact O-CB 3.39Å; R350-A373 HydrophobicContact CB-CB 4.13Å; R350-A373 PolarHBondContact NE-O 3.09Å; R350-A373 VanDerWaalsContact NE-O 3.11Å; R350-A373 PolarHBondContact NH2-O 3.43Å; A351-A373 HydrophobicContact CB-CB 3.84Å; Y369-A373 VanDerWaalsContact O-CB 3.29Å; Y369-A373 WeakPolarHBondContact O-CB 3.49Å; Y369-A373 PolarHBondContact O-N 3.27Å; E370-A373 PolarHBondContact O-N 2.75Å; E371-A373 VanDerWaalsContact C-N 3.27Å; E371-A373 PolarHBondContact O-N 2.65Å; A373-T376 PolarHBondContact O-N 3.25Å; A373-T376 PolarHBondContact O-OG1 2.79Å
374	R	93.4	Very high	92	Very high	159 Å²	159	57.2 Å²	57.2	60%	0.6	31%	0.305	S	S	*	.	H	α-helix	trans	-67.8	-33.6	172.5	-70.4	178.2	-178.8	179.9	5.3	112.7	E347 E370 E371 L372 T376	E347-R374 HydrophobicContact CG-CG 4.22Å; E347-R374 WeakPolarHBondContact OE1-CD 3.4Å; E347-R374 WeakPolarHBondContact OE1-CG 3.47Å; E347-R374 IonicContact OE1-CZ 3.52Å; E347-R374 IonicContact OE1-NE 2.69Å; E347-R374 PolarHBondContact OE1-NE 3.43Å; E347-R374 IonicContact OE1-NH2 2.92Å; E370-R374 WeakPolarHBondContact O-CG 3.36Å; E370-R374 PolarHBondContact O-N 3.15Å; E370-R374 VanDerWaalsContact O-N 3.16Å; E371-R374 WeakPolarHBondContact O-CB 3.29Å; E371-R374 PolarHBondContact O-N 3.31Å; E371-R374 VanDerWaalsContact O-N 3.16Å; L372-R374 VanDerWaalsContact C-N 3.31Å; L372-R374 PolarHBondContact O-N 2.85Å; R374-T376 VanDerWaalsContact C-N 3.29Å
375	C	91.5	Very high	91.9	Very high	47 Å²	47	62 Å²	62	32%	0.318	32%	0.324	S	S	.	.	H	α-helix	trans	-76.9	-16.1	176.7	-63.7	0	0	0	0	113.4	E371 L372 M409 I412	E371-C375 PolarHBondContact O-N 3.3Å; E371-C375 VanDerWaalsContact O-N 3.12Å; E371-C375 PolarHBondContact O-SG 2.82Å; E371-C375 VanDerWaalsContact O-SG 3.41Å; L372-C375 PolarHBondContact O-N 3.01Å; L372-C375 VanDerWaalsContact O-N 3.14Å; C375-M409 HydrophobicContact CB-SD 4.28Å; C375-I412 HydrophobicContact CB-CD1 4.12Å
376	T	90.3	Very high	92	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.297	C	S	.	.			trans	-104.7	57.7	-178.1	58	0	0	0	0	114.3	R350 M354 L372 A373 R374 F379 I412	R350-T376 WeakPolarHBondContact CD-O 3.3Å; R350-T376 PolarHBondContact NE-O 2.97Å; M354-T376 HydrophobicContact CE-CG2 3.43Å; M354-T376 VanDerWaalsContact CE-CG2 3.43Å; M354-T376 WeakPolarHBondContact CE-OG1 3.48Å; L372-T376 WeakPolarHBondContact O-CG2 3.45Å; L372-T376 PolarHBondContact O-N 2.95Å; L372-T376 VanDerWaalsContact O-N 3.13Å; L372-T376 PolarHBondContact O-OG1 3.43Å; A373-T376 PolarHBondContact O-N 3.25Å; A373-T376 PolarHBondContact O-OG1 2.79Å; R374-T376 VanDerWaalsContact C-N 3.29Å; T376-F379 HydrophobicContact CG2-CD2 3.73Å; T376-F379 HydrophobicContact CG2-CE2 3.84Å; T376-F379 HydrophobicContact CG2-CG 4.3Å; T376-F379 HydrophobicContact CG2-CZ 4.48Å; T376-I412 HydrophobicContact CG2-CB 4.46Å; T376-I412 HydrophobicContact CG2-CD1 3.51Å; T376-I412 HydrophobicContact CG2-CG1 3.56Å; T376-I412 HydrophobicContact CG2-CG2 4.05Å
377	D	87.4	Confident	92.2	Very high	105 Å²	105	51 Å²	51	56%	0.561	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	141.4	175.2	-71.7	-30.3	0	0	0	112.5	R350 F379	R350-D377 IonicContact NH2-OD1 3.83Å; R350-D377 PolarHBondContact NH2-OD1 3.05Å; D377-F379 VanDerWaalsContact O-CD1 3.3Å; D377-F379 WeakPolarHBondContact O-CD1 3.4Å; D377-F379 PolarHBondContact O-N 3.13Å
378	D	87.4	Confident	92.2	Very high	120 Å²	120	50.3 Å²	50.3	64%	0.642	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	23.3	-177.3	-62.5	-31.7	0	0	0	115.8
379	F	90.2	Very high	92.2	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.018	26%	0.264	C	S	.	.			trans	-81.4	131.9	176	-84.8	31.8	0	0	0	111.1	P345 T376 D377 Q383 V387 I412 V415 Q416	P345-F379 WeakPolarHBondContact CD-O 3.38Å; P345-F379 WeakPolarHBondContact CG-O 3.49Å; T376-F379 HydrophobicContact CG2-CD2 3.73Å; T376-F379 HydrophobicContact CG2-CE2 3.84Å; T376-F379 HydrophobicContact CG2-CG 4.3Å; T376-F379 HydrophobicContact CG2-CZ 4.48Å; D377-F379 VanDerWaalsContact O-CD1 3.3Å; D377-F379 WeakPolarHBondContact O-CD1 3.4Å; D377-F379 PolarHBondContact O-N 3.13Å; F379-Q383 HydrophobicContact CB-CB 4.2Å; F379-Q383 HydrophobicContact CD2-CB 3.8Å; F379-Q383 HydrophobicContact CE2-CB 4.33Å; F379-Q383 HydrophobicContact CG-CB 4.02Å; F379-V387 HydrophobicContact CD2-CG2 4.09Å; F379-V387 HydrophobicContact CE2-CG2 3.55Å; F379-I412 HydrophobicContact CZ-CG2 4.39Å; F379-V415 HydrophobicContact CE2-CB 4.38Å; F379-V415 HydrophobicContact CE2-CG1 3.88Å; F379-V415 HydrophobicContact CZ-CB 4.43Å; F379-V415 HydrophobicContact CZ-CG1 3.96Å; F379-Q416 HydrophobicContact CE1-CG 3.86Å; F379-Q416 HydrophobicContact CZ-CG 3.64Å
380	N	91	Very high	92.2	Very high	24 Å²	24	50.5 Å²	50.5	13%	0.128	26%	0.264	C	S	.	.			trans	-81.8	170.6	167.5	68.8	12.1	0	0	0	111.2	P217 M344 A382 Q383 C384	P217-N380 PolarHBondContact O-ND2 3.3Å; P217-N380 VanDerWaalsContact O-ND2 3.07Å; M344-N380 HydrophobicContact SD-CB 4.11Å; N380-A382 PolarHBondContact O-N 2.68Å; N380-A382 PolarHBondContact OD1-N 3Å; N380-Q383 PolarHBondContact O-N 3.26Å; N380-Q383 VanDerWaalsContact O-N 3.13Å; N380-Q383 VanDerWaalsContact OD1-CB 3.3Å; N380-Q383 WeakPolarHBondContact OD1-CB 3.49Å; N380-Q383 WeakPolarHBondContact OD1-CG 3.43Å; N380-Q383 PolarHBondContact OD1-N 3.31Å; N380-Q383 PolarHBondContact OD1-OE1 3.1Å; N380-C384 PolarHBondContact O-N 3.01Å; N380-C384 PolarHBondContact O-SG 3.42Å
381	G	89.7	Confident	92.2	Very high	15 Å²	15	44.4 Å²	44.4	16%	0.155	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-35	-179.9	0	0	0	0	0	113	G218 C384 K385	G218-G381 WeakPolarHBondContact O-CA 3.41Å; G218-G381 PolarHBondContact O-N 3.07Å; G218-G381 VanDerWaalsContact O-N 3.1Å; G381-C384 PolarHBondContact O-N 2.89Å; G381-K385 WeakPolarHBondContact O-CB 3.46Å; G381-K385 PolarHBondContact O-N 3.4Å
382	A	90.6	Very high	92.2	Very high	52 Å²	52	40.9 Å²	40.9	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-64.5	-39.2	175.2	0	0	0	0	0	112.8	G218 N380 K385 A386	G218-A382 PolarHBondContact O-N 2.71Å; N380-A382 PolarHBondContact O-N 2.68Å; N380-A382 PolarHBondContact OD1-N 3Å; A382-K385 WeakPolarHBondContact O-CB 3.48Å; A382-K385 PolarHBondContact O-N 2.92Å; A382-A386 PolarHBondContact O-N 2.85Å
383	Q	91.8	Very high	92.1	Very high	49 Å²	49	45.2 Å²	45.2	23%	0.229	25%	0.246	C	C	.	.	H	α-helix	trans	-70.8	-41.4	175.9	-75.3	164.5	-28.8	0	0	111.5	F379 N380 K385 A386 V387 V415	F379-Q383 HydrophobicContact CB-CB 4.2Å; F379-Q383 HydrophobicContact CD2-CB 3.8Å; F379-Q383 HydrophobicContact CE2-CB 4.33Å; F379-Q383 HydrophobicContact CG-CB 4.02Å; N380-Q383 PolarHBondContact O-N 3.26Å; N380-Q383 VanDerWaalsContact O-N 3.13Å; N380-Q383 VanDerWaalsContact OD1-CB 3.3Å; N380-Q383 WeakPolarHBondContact OD1-CB 3.49Å; N380-Q383 WeakPolarHBondContact OD1-CG 3.43Å; N380-Q383 PolarHBondContact OD1-N 3.31Å; N380-Q383 PolarHBondContact OD1-OE1 3.1Å; Q383-K385 VanDerWaalsContact C-N 3.25Å; Q383-K385 PolarHBondContact O-N 3.19Å; Q383-A386 WeakPolarHBondContact O-CA 3.3Å; Q383-A386 WeakPolarHBondContact O-CB 3.41Å; Q383-A386 PolarHBondContact O-N 3.08Å; Q383-V387 WeakPolarHBondContact O-CG2 2.99Å; Q383-V387 PolarHBondContact O-N 3.03Å; Q383-V415 HydrophobicContact CB-CG1 4.4Å; Q383-V415 HydrophobicContact CG-CG1 4.38Å
384	C	92.8	Very high	92.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-58.4	-40.5	173.3	-63.6	0	0	0	0	111.3	I353 M354 N380 G381 C388	I353-C384 HydrophobicContact CB-CB 4.42Å; I353-C384 HydrophobicContact CG2-CB 3.69Å; M354-C384 HydrophobicContact CE-CB 4.32Å; M354-C384 HydrophobicContact CG-CB 4.07Å; N380-C384 PolarHBondContact O-N 3.01Å; N380-C384 PolarHBondContact O-SG 3.42Å; G381-C384 PolarHBondContact O-N 2.89Å; C384-C388 PolarHBondContact O-N 2.9Å; C384-C388 PolarHBondContact O-SG 2.9Å
385	K	92.4	Very high	92.1	Very high	111 Å²	111	38.6 Å²	38.6	48%	0.483	22%	0.223	S	C	.	.	H	α-helix	trans	-63	-44.3	172	-175.4	-177.9	177	-175.9	0	111.8	G381 A382 Q383 V387 C388 V389	G381-K385 WeakPolarHBondContact O-CB 3.46Å; G381-K385 PolarHBondContact O-N 3.4Å; A382-K385 WeakPolarHBondContact O-CB 3.48Å; A382-K385 PolarHBondContact O-N 2.92Å; Q383-K385 VanDerWaalsContact C-N 3.25Å; Q383-K385 PolarHBondContact O-N 3.19Å; K385-V387 VanDerWaalsContact C-N 3.34Å; K385-V387 PolarHBondContact O-N 2.81Å; K385-C388 PolarHBondContact O-N 3.35Å; K385-V389 WeakPolarHBondContact O-CG2 3.5Å; K385-V389 PolarHBondContact O-N 3Å; K385-V389 VanDerWaalsContact O-N 3.14Å
386	A	93.3	Very high	92.3	Very high	34 Å²	34	42.1 Å²	42.1	28%	0.281	24%	0.239	S	C	.	.	H	α-helix	trans	-60.3	-42.6	178.7	0	0	0	0	0	111.8	A382 Q383 C388 V389 E390 V415	A382-A386 PolarHBondContact O-N 2.85Å; Q383-A386 WeakPolarHBondContact O-CA 3.3Å; Q383-A386 WeakPolarHBondContact O-CB 3.41Å; Q383-A386 PolarHBondContact O-N 3.08Å; A386-C388 VanDerWaalsContact C-N 3.31Å; A386-C388 PolarHBondContact O-N 3.48Å; A386-V389 PolarHBondContact O-N 3.42Å; A386-V389 VanDerWaalsContact O-N 3.09Å; A386-E390 WeakPolarHBondContact O-CG 3.49Å; A386-E390 PolarHBondContact O-N 2.97Å; A386-V415 HydrophobicContact CB-CG2 4.15Å
387	V	94.4	Very high	92.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.3	-46.8	174.6	171.5	0	0	0	0	111.3	F379 Q383 K385 V389 E390 A391 Y408 I412 V415	F379-V387 HydrophobicContact CD2-CG2 4.09Å; F379-V387 HydrophobicContact CE2-CG2 3.55Å; Q383-V387 WeakPolarHBondContact O-CG2 2.99Å; Q383-V387 PolarHBondContact O-N 3.03Å; K385-V387 VanDerWaalsContact C-N 3.34Å; K385-V387 PolarHBondContact O-N 2.81Å; V387-V389 VanDerWaalsContact C-N 3.27Å; V387-V389 PolarHBondContact O-N 3.48Å; V387-E390 PolarHBondContact O-N 3.22Å; V387-A391 WeakPolarHBondContact O-CB 3.45Å; V387-A391 PolarHBondContact O-N 3.26Å; V387-Y408 HydrophobicContact CG1-CD1 4.19Å; V387-I412 HydrophobicContact CG1-CG1 3.68Å; V387-I412 HydrophobicContact CG2-CG1 4.02Å; V387-V415 HydrophobicContact CG2-CB 4.21Å; V387-V415 HydrophobicContact CG2-CG1 4.48Å; V387-V415 HydrophobicContact CG2-CG2 3.97Å
388	C	94.4	Very high	92.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-35	179.7	-59.5	0	0	0	0	112.1	H357 M361 C384 K385 A386 G392 Y408	H357-C388 HydrophobicContact CB-CB 4.19Å; M361-C388 HydrophobicContact CE-CB 3.76Å; C384-C388 PolarHBondContact O-N 2.9Å; C384-C388 PolarHBondContact O-SG 2.9Å; K385-C388 PolarHBondContact O-N 3.35Å; A386-C388 VanDerWaalsContact C-N 3.31Å; A386-C388 PolarHBondContact O-N 3.48Å; C388-G392 PolarHBondContact O-N 3.33Å; C388-Y408 HydrophobicContact CB-CE1 4.39Å
389	V	94.5	Very high	92.8	Very high	80 Å²	80	47.5 Å²	47.5	49%	0.485	26%	0.262	S	S	.	.	H	α-helix	trans	-72.2	-44.4	177.1	174.4	0	0	0	0	111.3	K385 A386 V387 G392 M393	K385-V389 WeakPolarHBondContact O-CG2 3.5Å; K385-V389 PolarHBondContact O-N 3Å; K385-V389 VanDerWaalsContact O-N 3.14Å; A386-V389 PolarHBondContact O-N 3.42Å; A386-V389 VanDerWaalsContact O-N 3.09Å; V387-V389 VanDerWaalsContact C-N 3.27Å; V387-V389 PolarHBondContact O-N 3.48Å; V389-G392 PolarHBondContact O-N 3.4Å; V389-M393 PolarHBondContact O-N 3.2Å; V389-M393 VanDerWaalsContact O-N 3.07Å
390	E	93.8	Very high	92.9	Very high	37 Å²	37	48.9 Å²	48.9	17%	0.173	28%	0.275	C	S	.	.	H	α-helix	trans	-65.6	-40.7	178.7	-65.1	-64.5	-178.3	0	0	111.6	A386 V387 G392 M393 I394 V415 K418	A386-E390 WeakPolarHBondContact O-CG 3.49Å; A386-E390 PolarHBondContact O-N 2.97Å; V387-E390 PolarHBondContact O-N 3.22Å; E390-G392 VanDerWaalsContact C-N 3.26Å; E390-G392 PolarHBondContact O-N 2.97Å; E390-M393 WeakPolarHBondContact O-CB 3.45Å; E390-M393 PolarHBondContact O-N 3.03Å; E390-I394 VanDerWaalsContact O-CG1 3.32Å; E390-I394 WeakPolarHBondContact O-CG1 3.2Å; E390-I394 PolarHBondContact O-N 3.32Å; E390-V415 HydrophobicContact CG-CG2 4.13Å; E390-K418 IonicContact OE1-NZ 2.66Å; E390-K418 PolarHBondContact OE1-NZ 3.01Å
391	A	94.3	Very high	93	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-55.7	-44.1	172.7	0	0	0	0	0	111.1	V387 M393 I394 A395 L403 D407 Y408	V387-A391 WeakPolarHBondContact O-CB 3.45Å; V387-A391 PolarHBondContact O-N 3.26Å; A391-M393 VanDerWaalsContact C-N 3.35Å; A391-M393 PolarHBondContact O-N 3.21Å; A391-I394 PolarHBondContact O-N 3.38Å; A391-A395 WeakPolarHBondContact O-CB 3.3Å; A391-A395 PolarHBondContact O-N 3.2Å; A391-L403 HydrophobicContact CB-CD2 4Å; A391-L403 WeakPolarHBondContact O-CD2 3.24Å; A391-D407 HydrophobicContact CB-CB 4.15Å; A391-Y408 HydrophobicContact CB-CD1 3.94Å; A391-Y408 HydrophobicContact CB-CD2 4.42Å; A391-Y408 HydrophobicContact CB-CE1 4.21Å; A391-Y408 HydrophobicContact CB-CG 4.07Å
392	G	93.9	Very high	93.2	Very high	22 Å²	22	57.5 Å²	57.5	23%	0.227	32%	0.319	C	S	.	.	H	α-helix	trans	-55.2	-45.1	172.1	0	0	0	0	0	113.6	C388 V389 E390 L396	C388-G392 PolarHBondContact O-N 3.33Å; V389-G392 PolarHBondContact O-N 3.4Å; E390-G392 VanDerWaalsContact C-N 3.26Å; E390-G392 PolarHBondContact O-N 2.97Å; G392-L396 WeakPolarHBondContact O-CB 3.42Å; G392-L396 PolarHBondContact O-N 2.82Å
393	M	93.5	Very high	93.3	Very high	90 Å²	90	55.3 Å²	55.3	44%	0.443	30%	0.3	S	S	.	.	H	α-helix	trans	-69.8	-34.5	179.7	-69.3	-61.6	-64.8	0	0	112.8	V389 E390 A391 L396 R397	V389-M393 PolarHBondContact O-N 3.2Å; V389-M393 VanDerWaalsContact O-N 3.07Å; E390-M393 WeakPolarHBondContact O-CB 3.45Å; E390-M393 PolarHBondContact O-N 3.03Å; A391-M393 VanDerWaalsContact C-N 3.35Å; A391-M393 PolarHBondContact O-N 3.21Å; M393-L396 PolarHBondContact O-N 3.16Å; M393-R397 WeakPolarHBondContact O-CG 3.4Å; M393-R397 PolarHBondContact O-N 3.41Å
394	I	93.6	Very high	93.4	Very high	15 Å²	15	55.4 Å²	55.4	8%	0.077	30%	0.302	C	S	.	.	H	α-helix	trans	-68.7	-47.3	176.4	-68	162.2	0	0	0	110	E390 A391 L396 R397 R398 E410	E390-I394 VanDerWaalsContact O-CG1 3.32Å; E390-I394 WeakPolarHBondContact O-CG1 3.2Å; E390-I394 PolarHBondContact O-N 3.32Å; A391-I394 PolarHBondContact O-N 3.38Å; I394-L396 PolarHBondContact O-N 3.41Å; I394-R397 WeakPolarHBondContact O-CB 3.14Å; I394-R397 PolarHBondContact O-N 3.34Å; I394-R397 VanDerWaalsContact O-N 3.07Å; I394-R398 PolarHBondContact O-N 3.12Å; I394-R398 VanDerWaalsContact O-N 3.15Å; I394-E410 HydrophobicContact CD1-CB 3.7Å; I394-E410 VanDerWaalsContact CG2-OE2 3.3Å; I394-E410 WeakPolarHBondContact CG2-OE2 3.42Å
395	A	93.9	Very high	93.5	Very high	5 Å²	5	57.2 Å²	57.2	4%	0.041	31%	0.31	C	S	.	.	H	α-helix	trans	-59	-37.7	174.8	0	0	0	0	0	112.1	A391 R398 G399 A400 L403	A391-A395 WeakPolarHBondContact O-CB 3.3Å; A391-A395 PolarHBondContact O-N 3.2Å; A395-R398 WeakPolarHBondContact O-CG 3.48Å; A395-R398 PolarHBondContact O-N 3.44Å; A395-G399 PolarHBondContact O-N 2.84Å; A395-A400 PolarHBondContact O-N 3.03Å; A395-L403 HydrophobicContact CB-CD2 3.58Å; A395-L403 HydrophobicContact CB-CG 4.34Å
396	L	94.6	Very high	93.5	Very high	122 Å²	122	58.6 Å²	58.6	64%	0.639	32%	0.318	S	S	*	.	H	α-helix	trans	-67.6	-39.5	175.1	-169.2	67.7	0	0	0	112.3	G392 M393 I394 R398 G399	G392-L396 WeakPolarHBondContact O-CB 3.42Å; G392-L396 PolarHBondContact O-N 2.82Å; M393-L396 PolarHBondContact O-N 3.16Å; I394-L396 PolarHBondContact O-N 3.41Å; L396-R398 VanDerWaalsContact C-N 3.31Å; L396-R398 PolarHBondContact O-N 3.21Å; L396-G399 PolarHBondContact O-N 2.94Å
397	R	93.2	Very high	93.6	Very high	168 Å²	168	57.2 Å²	57.2	63%	0.634	31%	0.306	S	S	*	.	H	α-helix	trans	-62	-35.7	177.2	-81.1	-177.9	-112.5	165.5	-4.4	112.6	M393 I394 G399 E414	M393-R397 WeakPolarHBondContact O-CG 3.4Å; M393-R397 PolarHBondContact O-N 3.41Å; I394-R397 WeakPolarHBondContact O-CB 3.14Å; I394-R397 PolarHBondContact O-N 3.34Å; I394-R397 VanDerWaalsContact O-N 3.07Å; R397-G399 VanDerWaalsContact C-N 3.27Å; R397-E414 IonicContact NH2-OE2 2.82Å
398	R	91.6	Very high	93.6	Very high	104 Å²	104	57.2 Å²	57.2	39%	0.392	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-4.4	173.7	68.3	174.9	-170.2	-155.9	-3.8	114	I394 A395 L396 A400 E402 D407	I394-R398 PolarHBondContact O-N 3.12Å; I394-R398 VanDerWaalsContact O-N 3.15Å; A395-R398 WeakPolarHBondContact O-CG 3.48Å; A395-R398 PolarHBondContact O-N 3.44Å; L396-R398 VanDerWaalsContact C-N 3.31Å; L396-R398 PolarHBondContact O-N 3.21Å; R398-A400 VanDerWaalsContact C-N 3.35Å; R398-A400 HydrophobicContact CG-CB 3.82Å; R398-E402 PolarHBondContact NH2-O 3.38Å; R398-D407 VanDerWaalsContact CZ-CG 3.49Å; R398-D407 IonicContact CZ-OD1 3.83Å; R398-D407 IonicContact CZ-OD2 3.84Å; R398-D407 IonicContact NE-OD1 3.16Å; R398-D407 IonicContact NH1-OD1 3.03Å; R398-D407 PolarHBondContact NH1-OD1 2.9Å; R398-D407 IonicContact NH1-OD2 2.92Å; R398-D407 PolarHBondContact NH1-OD2 3.45Å; R398-D407 IonicContact NH2-OD1 3.34Å; R398-D407 IonicContact NH2-OD2 3.98Å; R398-D407 PolarHBondContact NH2-OD2 3.05Å
399	G	92	Very high	93.6	Very high	65 Å²	65	60.6 Å²	60.6	67%	0.67	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	21	-177.8	0	0	0	0	0	114.5	A395 L396 R397	A395-G399 PolarHBondContact O-N 2.84Å; L396-G399 PolarHBondContact O-N 2.94Å; R397-G399 VanDerWaalsContact C-N 3.27Å
400	A	92.3	Very high	93.5	Very high	34 Å²	34	62 Å²	62	28%	0.281	32%	0.324	S	S	.	.			trans	-86.9	153.6	177.3	0	0	0	0	0	111.9	A395 R398	A395-A400 PolarHBondContact O-N 3.03Å; R398-A400 VanDerWaalsContact C-N 3.35Å; R398-A400 HydrophobicContact CG-CB 3.82Å
401	T	92.1	Very high	93.5	Very high	125 Å²	125	60.2 Å²	60.2	77%	0.767	32%	0.316	S	S	*	.	S	Bend	trans	-99.8	-8.1	178.1	51.4	0	0	0	0	113.6	N362	N362-T401 WeakPolarHBondContact CB-O 3.15Å; N362-T401 PolarHBondContact ND2-O 3.33Å
402	E	93.9	Very high	93.4	Very high	94 Å²	94	60.5 Å²	60.5	44%	0.439	32%	0.317	S	S	.	.	S	Bend	trans	-127.8	149.9	-179.5	65.2	-171.6	175.2	0	0	110.7	N362 R398	N362-E402 WeakPolarHBondContact O-CA 3.44Å; R398-E402 PolarHBondContact NH2-O 3.38Å
403	L	94.1	Very high	93.3	Very high	7 Å²	7	64.7 Å²	64.7	4%	0.037	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-93.4	128.2	175.7	-73.9	160.3	0	0	0	110.6	M361 N362 V363 S364 A391 A395 D407 Y408	M361-L403 HydrophobicContact CB-CD1 3.77Å; M361-L403 HydrophobicContact CG-CD1 4.4Å; M361-L403 HydrophobicContact SD-CD1 3.95Å; N362-L403 PolarHBondContact O-N 3.2Å; V363-L403 HydrophobicContact CG1-CB 4.34Å; V363-L403 HydrophobicContact CG2-CB 4.32Å; V363-L403 HydrophobicContact CG2-CD1 4.02Å; S364-L403 VanDerWaalsContact CB-O 3.3Å; S364-L403 WeakPolarHBondContact CB-O 3.22Å; S364-L403 PolarHBondContact N-O 3.11Å; A391-L403 HydrophobicContact CB-CD2 4Å; A391-L403 WeakPolarHBondContact O-CD2 3.24Å; A395-L403 HydrophobicContact CB-CD2 3.58Å; A395-L403 HydrophobicContact CB-CG 4.34Å; L403-D407 HydrophobicContact CD2-CB 4.08Å; L403-Y408 HydrophobicContact CB-CE2 4.04Å
404	N	94	Very high	93.1	Very high	50 Å²	50	63.1 Å²	63.1	27%	0.267	33%	0.325	S	S	.	.			trans	-103.9	165.4	176	-66.8	-18.1	0	0	0	110.1	E406 D407 Y408	N404-E406 PolarHBondContact O-N 3.47Å; N404-D407 PolarHBondContact N-OD2 3.48Å; N404-D407 PolarHBondContact O-N 3.39Å; N404-D407 VanDerWaalsContact O-N 3.15Å; N404-Y408 WeakPolarHBondContact O-CD2 3.16Å
405	H	94	Very high	92.8	Very high	39 Å²	39	63.1 Å²	63.1	18%	0.181	33%	0.326	C	S	.	.	H	α-helix	trans	-57.8	-36.6	178.6	-173.1	84	0	0	0	112.3	E371 L372 D407 Y408 M409	E371-H405 IonicContact OE2-CE1 3.65Å; E371-H405 IonicContact OE2-NE2 3.27Å; L372-H405 VanDerWaalsContact CD2-CE1 3.5Å; L372-H405 WeakPolarHBondContact CD2-CE1 3.22Å; H405-D407 VanDerWaalsContact C-N 3.32Å; H405-D407 PolarHBondContact O-N 3.42Å; H405-Y408 PolarHBondContact O-N 3.23Å; H405-M409 PolarHBondContact O-N 2.69Å; H405-M409 VanDerWaalsContact O-N 3.17Å
406	E	93.3	Very high	92.4	Very high	140 Å²	140	65.5 Å²	65.5	65%	0.654	34%	0.337	S	S	*	.	H	α-helix	trans	-61.3	-35.8	178.4	-62.9	-179	168.2	0	0	113.2	N404 Y408 M409 E410	N404-E406 PolarHBondContact O-N 3.47Å; E406-Y408 VanDerWaalsContact C-N 3.3Å; E406-Y408 PolarHBondContact O-N 2.81Å; E406-M409 WeakPolarHBondContact O-CB 3.25Å; E406-M409 PolarHBondContact O-N 3.19Å; E406-M409 VanDerWaalsContact O-N 3.15Å; E406-E410 PolarHBondContact O-N 3.08Å
407	D	94.4	Very high	91.6	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-37	179.1	-57.6	-62.8	0	0	0	111.6	A391 R398 L403 N404 H405 G411	A391-D407 HydrophobicContact CB-CB 4.15Å; R398-D407 VanDerWaalsContact CZ-CG 3.49Å; R398-D407 IonicContact CZ-OD1 3.83Å; R398-D407 IonicContact CZ-OD2 3.84Å; R398-D407 IonicContact NE-OD1 3.16Å; R398-D407 IonicContact NH1-OD1 3.03Å; R398-D407 PolarHBondContact NH1-OD1 2.9Å; R398-D407 IonicContact NH1-OD2 2.92Å; R398-D407 PolarHBondContact NH1-OD2 3.45Å; R398-D407 IonicContact NH2-OD1 3.34Å; R398-D407 IonicContact NH2-OD2 3.98Å; R398-D407 PolarHBondContact NH2-OD2 3.05Å; L403-D407 HydrophobicContact CD2-CB 4.08Å; N404-D407 PolarHBondContact N-OD2 3.48Å; N404-D407 PolarHBondContact O-N 3.39Å; N404-D407 VanDerWaalsContact O-N 3.15Å; H405-D407 VanDerWaalsContact C-N 3.32Å; H405-D407 PolarHBondContact O-N 3.42Å; D407-G411 PolarHBondContact O-N 3Å
408	Y	94.6	Very high	90.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-67.9	-39.9	174.5	-74.2	-86.9	0	0	0	111	S358 V363 V367 L372 V387 C388 A391 L403 N404 H405 E406 G411 I412	S358-Y408 WeakPolarHBondContact CB-OH 3.43Å; S358-Y408 PolarHBondContact OG-OH 2.84Å; V363-Y408 HydrophobicContact CG1-CE2 4.23Å; V367-Y408 HydrophobicContact CG1-CD2 4.11Å; V367-Y408 HydrophobicContact CG1-CE2 4.01Å; V367-Y408 HydrophobicContact CG2-CD2 4.41Å; V367-Y408 HydrophobicContact CG2-CE2 4.2Å; L372-Y408 HydrophobicContact CD1-CD1 3.94Å; L372-Y408 HydrophobicContact CD1-CD2 4.19Å; L372-Y408 HydrophobicContact CD1-CG 3.68Å; V387-Y408 HydrophobicContact CG1-CD1 4.19Å; C388-Y408 HydrophobicContact CB-CE1 4.39Å; A391-Y408 HydrophobicContact CB-CD1 3.94Å; A391-Y408 HydrophobicContact CB-CD2 4.42Å; A391-Y408 HydrophobicContact CB-CE1 4.21Å; A391-Y408 HydrophobicContact CB-CG 4.07Å; L403-Y408 HydrophobicContact CB-CE2 4.04Å; N404-Y408 WeakPolarHBondContact O-CD2 3.16Å; H405-Y408 PolarHBondContact O-N 3.23Å; E406-Y408 VanDerWaalsContact C-N 3.3Å; E406-Y408 PolarHBondContact O-N 2.81Å; Y408-G411 PolarHBondContact O-N 2.94Å; Y408-I412 VanDerWaalsContact O-CG1 3.22Å; Y408-I412 WeakPolarHBondContact O-CG1 3.38Å; Y408-I412 PolarHBondContact O-N 3.29Å
409	M	93.8	Very high	89.1	Confident	71 Å²	71	60.6 Å²	60.6	35%	0.35	33%	0.328	S	S	.	.	H	α-helix	trans	-62.8	-44.9	176.7	-70.3	-62.8	-74.2	0	0	112	L372 C375 H405 E406 G411 I412 L413	L372-M409 HydrophobicContact CD2-CG 4.36Å; L372-M409 HydrophobicContact CD2-SD 4.03Å; C375-M409 HydrophobicContact CB-SD 4.28Å; H405-M409 PolarHBondContact O-N 2.69Å; H405-M409 VanDerWaalsContact O-N 3.17Å; E406-M409 WeakPolarHBondContact O-CB 3.25Å; E406-M409 PolarHBondContact O-N 3.19Å; E406-M409 VanDerWaalsContact O-N 3.15Å; M409-G411 VanDerWaalsContact C-N 3.35Å; M409-I412 PolarHBondContact O-N 3Å; M409-I412 HydrophobicContact SD-CD1 4.19Å; M409-L413 WeakPolarHBondContact O-CG 3.29Å; M409-L413 PolarHBondContact O-N 2.8Å; M409-L413 VanDerWaalsContact O-N 3.09Å
410	E	92.9	Very high	87.4	Confident	109 Å²	109	63.7 Å²	63.7	51%	0.509	32%	0.323	S	S	.	.	H	α-helix	trans	-63.6	-40.3	173.2	-71.4	-169.4	-179.5	0	0	111.9	I394 E406 I412 L413 E414	I394-E410 HydrophobicContact CD1-CB 3.7Å; I394-E410 VanDerWaalsContact CG2-OE2 3.3Å; I394-E410 WeakPolarHBondContact CG2-OE2 3.42Å; E406-E410 PolarHBondContact O-N 3.08Å; E410-I412 VanDerWaalsContact C-N 3.33Å; E410-I412 PolarHBondContact O-N 3.42Å; E410-L413 WeakPolarHBondContact O-CB 3.41Å; E410-L413 PolarHBondContact O-N 3.06Å; E410-E414 PolarHBondContact O-N 3.36Å
411	G	92.8	Very high	85.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.2	-38.8	174.8	0	0	0	0	0	113	D407 Y408 M409 E414 V415	D407-G411 PolarHBondContact O-N 3Å; Y408-G411 PolarHBondContact O-N 2.94Å; M409-G411 VanDerWaalsContact C-N 3.35Å; G411-E414 PolarHBondContact O-N 3.27Å; G411-V415 VanDerWaalsContact O-CG2 3.3Å; G411-V415 WeakPolarHBondContact O-CG2 3.33Å; G411-V415 PolarHBondContact O-N 2.92Å
412	I	93.1	Very high	83.5	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-47.2	173.8	-67.8	164.4	0	0	0	109.9	L372 C375 T376 F379 V387 Y408 M409 E410 E414 V415 Q416	L372-I412 HydrophobicContact CD2-CD1 4.03Å; C375-I412 HydrophobicContact CB-CD1 4.12Å; T376-I412 HydrophobicContact CG2-CB 4.46Å; T376-I412 HydrophobicContact CG2-CD1 3.51Å; T376-I412 HydrophobicContact CG2-CG1 3.56Å; T376-I412 HydrophobicContact CG2-CG2 4.05Å; F379-I412 HydrophobicContact CZ-CG2 4.39Å; V387-I412 HydrophobicContact CG1-CG1 3.68Å; V387-I412 HydrophobicContact CG2-CG1 4.02Å; Y408-I412 VanDerWaalsContact O-CG1 3.22Å; Y408-I412 WeakPolarHBondContact O-CG1 3.38Å; Y408-I412 PolarHBondContact O-N 3.29Å; M409-I412 PolarHBondContact O-N 3Å; M409-I412 HydrophobicContact SD-CD1 4.19Å; E410-I412 VanDerWaalsContact C-N 3.33Å; E410-I412 PolarHBondContact O-N 3.42Å; I412-E414 VanDerWaalsContact C-N 3.32Å; I412-E414 PolarHBondContact O-N 3.5Å; I412-V415 PolarHBondContact O-N 2.66Å; I412-Q416 HydrophobicContact CG2-CG 4.2Å; I412-Q416 WeakPolarHBondContact O-CB 3.26Å; I412-Q416 VanDerWaalsContact O-CG 3.29Å; I412-Q416 WeakPolarHBondContact O-CG 3.49Å; I412-Q416 PolarHBondContact O-N 3.03Å
413	L	90.8	Very high	81.4	Confident	111 Å²	111	69.4 Å²	69.4	58%	0.581	36%	0.358	S	S	*	.	H	α-helix	trans	-60.1	-41.8	178.2	-68.8	173	0	0	0	111.7	M409 E410 Q416 A417	M409-L413 WeakPolarHBondContact O-CG 3.29Å; M409-L413 PolarHBondContact O-N 2.8Å; M409-L413 VanDerWaalsContact O-N 3.09Å; E410-L413 WeakPolarHBondContact O-CB 3.41Å; E410-L413 PolarHBondContact O-N 3.06Å; L413-Q416 PolarHBondContact O-N 3.5Å; L413-A417 VanDerWaalsContact O-CB 3.22Å; L413-A417 WeakPolarHBondContact O-CB 3.22Å; L413-A417 PolarHBondContact O-N 2.81Å
414	E	89.6	Confident	78.9	Confident	56 Å²	56	76.8 Å²	76.8	26%	0.262	39%	0.392	S	S	.	.	H	α-helix	trans	-65.1	-44.7	178	-170.7	173.6	159.9	0	0	111.7	R397 E410 G411 I412 Q416 A417 K418	R397-E414 IonicContact NH2-OE2 2.82Å; E410-E414 PolarHBondContact O-N 3.36Å; G411-E414 PolarHBondContact O-N 3.27Å; I412-E414 VanDerWaalsContact C-N 3.32Å; I412-E414 PolarHBondContact O-N 3.5Å; E414-Q416 PolarHBondContact O-N 3.12Å; E414-A417 PolarHBondContact O-N 2.84Å; E414-K418 WeakPolarHBondContact O-CG 3.44Å; E414-K418 PolarHBondContact O-N 2.99Å; E414-K418 WeakPolarHBondContact OE1-CE 3.48Å; E414-K418 IonicContact OE1-NZ 3.21Å; E414-K418 PolarHBondContact OE1-NZ 3.24Å
415	V	88.4	Confident	76.6	Confident	15 Å²	15	85 Å²	85	9%	0.091	42%	0.422	C	S	.	.	H	α-helix	trans	-66.2	-38.1	177.5	174.6	0	0	0	0	111.4	F379 Q383 A386 V387 E390 G411 I412 K419	F379-V415 HydrophobicContact CE2-CB 4.38Å; F379-V415 HydrophobicContact CE2-CG1 3.88Å; F379-V415 HydrophobicContact CZ-CB 4.43Å; F379-V415 HydrophobicContact CZ-CG1 3.96Å; Q383-V415 HydrophobicContact CB-CG1 4.4Å; Q383-V415 HydrophobicContact CG-CG1 4.38Å; A386-V415 HydrophobicContact CB-CG2 4.15Å; V387-V415 HydrophobicContact CG2-CB 4.21Å; V387-V415 HydrophobicContact CG2-CG1 4.48Å; V387-V415 HydrophobicContact CG2-CG2 3.97Å; E390-V415 HydrophobicContact CG-CG2 4.13Å; G411-V415 VanDerWaalsContact O-CG2 3.3Å; G411-V415 WeakPolarHBondContact O-CG2 3.33Å; G411-V415 PolarHBondContact O-N 2.92Å; I412-V415 PolarHBondContact O-N 2.66Å; V415-K419 PolarHBondContact O-N 3.19Å
416	Q	85.4	Confident	74.4	Confident	56 Å²	56	93.7 Å²	93.7	26%	0.262	45%	0.454	S	S	.	.	H	α-helix	trans	-69.1	-37.2	173.8	-71.6	-174.4	1.1	0	0	112.5	F379 I412 L413 E414 K418 K419 K420	F379-Q416 HydrophobicContact CE1-CG 3.86Å; F379-Q416 HydrophobicContact CZ-CG 3.64Å; I412-Q416 HydrophobicContact CG2-CG 4.2Å; I412-Q416 WeakPolarHBondContact O-CB 3.26Å; I412-Q416 VanDerWaalsContact O-CG 3.29Å; I412-Q416 WeakPolarHBondContact O-CG 3.49Å; I412-Q416 PolarHBondContact O-N 3.03Å; L413-Q416 PolarHBondContact O-N 3.5Å; E414-Q416 PolarHBondContact O-N 3.12Å; Q416-K418 VanDerWaalsContact C-N 3.35Å; Q416-K419 WeakPolarHBondContact O-CA 3.45Å; Q416-K419 VanDerWaalsContact O-CB 3.25Å; Q416-K419 WeakPolarHBondContact O-CB 3.17Å; Q416-K419 PolarHBondContact O-N 3.41Å; Q416-K420 PolarHBondContact O-N 3.36Å
417	A	76.9	Confident	72.3	Confident	55 Å²	55	95.5 Å²	95.5	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-65.2	-39.9	177.1	0	0	0	0	0	111.2	L413 E414 K419 K420 A421	L413-A417 VanDerWaalsContact O-CB 3.22Å; L413-A417 WeakPolarHBondContact O-CB 3.22Å; L413-A417 PolarHBondContact O-N 2.81Å; E414-A417 PolarHBondContact O-N 2.84Å; A417-K419 PolarHBondContact O-N 2.88Å; A417-K420 PolarHBondContact O-N 2.81Å; A417-A421 PolarHBondContact O-N 2.9Å
418	K	68.6	Low	71.2	Confident	113 Å²	113	100.1 Å²	100.1	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-58.4	-30	170.8	-71.8	173.2	-172.5	169.3	0	112.2	E390 E414 Q416	E390-K418 IonicContact OE1-NZ 2.66Å; E390-K418 PolarHBondContact OE1-NZ 3.01Å; E414-K418 WeakPolarHBondContact O-CG 3.44Å; E414-K418 PolarHBondContact O-N 2.99Å; E414-K418 WeakPolarHBondContact OE1-CE 3.48Å; E414-K418 IonicContact OE1-NZ 3.21Å; E414-K418 PolarHBondContact OE1-NZ 3.24Å; Q416-K418 VanDerWaalsContact C-N 3.35Å
419	K	63.3	Low	69.9	Low	123 Å²	123	105.3 Å²	105.3	54%	0.535	54%	0.544	S	S	.	.	H	α-helix	trans	-74.5	-35.3	172.3	-167.7	-179.2	178.8	-179	0	112.6	V415 Q416 A417	V415-K419 PolarHBondContact O-N 3.19Å; Q416-K419 WeakPolarHBondContact O-CA 3.45Å; Q416-K419 VanDerWaalsContact O-CB 3.25Å; Q416-K419 WeakPolarHBondContact O-CB 3.17Å; Q416-K419 PolarHBondContact O-N 3.41Å; A417-K419 PolarHBondContact O-N 2.88Å
420	K	58.1	Low	68.6	Low	129 Å²	129	107.2 Å²	107.2	56%	0.561	55%	0.554	S	S	*	*	H	α-helix	trans	-86.8	-18	-176.4	-75.5	-176.2	178.8	175.2	0	115.3	Q416 A417 N422 L423	Q416-K420 PolarHBondContact O-N 3.36Å; A417-K420 PolarHBondContact O-N 2.81Å; K420-N422 PolarHBondContact O-N 2.98Å; K420-L423 PolarHBondContact O-N 3Å
421	A	53.5	Low	67.2	Low	87 Å²	87	107.1 Å²	107.1	72%	0.719	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-9.4	-178.5	0	0	0	0	0	114.9	A417	A417-A421 PolarHBondContact O-N 2.9Å
422	N	49	Very low	65.6	Low	146 Å²	146	113.8 Å²	113.8	78%	0.781	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-4.6	174.6	-76.7	-21.1	0	0	0	115.4	K420	K420-N422 PolarHBondContact O-N 2.98Å
423	L	49.1	Very low	63.8	Low	141 Å²	141	121 Å²	121	74%	0.738	63%	0.629	S	S	*	*			trans	-160.6	85.9	-178.4	-123.4	116.3	0	0	0	113.3	K420	K420-L423 PolarHBondContact O-N 3Å
424	Q	41.1	Very low	61.8	Low	161 Å²	161	121.7 Å²	121.7	75%	0.752	63%	0.633	S	S	*	*			trans	-139.5	76.5	159.9	-74.7	-164.9	-24.6	0	0	110.4
425	Y	46.8	Very low	59.7	Low	224 Å²	224	126.8 Å²	126.8	88%	0.878	66%	0.661	S	S	*	*			trans	-119.9	33.4	163.7	-79.8	-71.6	0	0	0	111.6
426	Y	47.2	Very low	57.3	Low	220 Å²	220	136.1 Å²	136.1	86%	0.863	71%	0.709	S	S	*	*			trans	-131.4	115	167.7	-70	-73.3	0	0	0	108.5
427	A	48.5	Very low	54.7	Low	178 Å²	178	143.4 Å²	143.4	100%	1.471	75%	0.749	S	S	*	*			trans	-79.6	0	171.1	0	0	0	0	0	110.7

Retrieved 427 of 427 residues in 221.6 ms (Link to these results)

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