A0A087XFR1_POEFO Loading...

Sulfate transporter

AlphaFold DB , UniProt , Accession A0A087XFR1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 715 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	42.4	Very low	33.1	Very low	244 Å²	244	156.9 Å²	156.9	100%	1.202	86%	0.861	S	S	*	*				0	95.7	0	-112.5	172.9	170.1	0	0	105.9
2	E	29.3	Very low	33.3	Very low	197 Å²	197	156.1 Å²	156.1	92%	0.921	85%	0.853	S	S	*	*			trans	-166.5	122.5	148.7	-113.5	170.8	173.5	0	0	106.9
3	E	30.1	Very low	33.6	Very low	198 Å²	198	150.1 Å²	150.1	93%	0.925	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-73	143.6	-172	-73.4	170.7	131.1	0	0	111.4
4	V	30	Very low	33.7	Very low	145 Å²	145	148.5 Å²	148.5	88%	0.879	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-89	116.5	167.2	176	0	0	0	0	107.7
5	S	30.4	Very low	33.7	Very low	95 Å²	95	147.1 Å²	147.1	66%	0.664	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-78.3	147.7	168.5	49.1	0	0	0	0	111.3
6	P	36.3	Very low	33.8	Very low	120 Å²	120	144.6 Å²	144.6	78%	0.779	81%	0.813	S	S	*	*			trans	-88.9	115.5	-176.6	33.4	-28.4	0	0	0	110.9
7	D	30.3	Very low	34.2	Very low	158 Å²	158	143.2 Å²	143.2	85%	0.845	81%	0.811	S	S	*	*			trans	-75.7	134.2	167.6	-82.2	-30.8	0	0	0	110.5	E9	D7-E9 PolarHBondContact O-N 3.12Å
8	T	33.3	Very low	34.5	Very low	132 Å²	132	147.7 Å²	147.7	81%	0.81	81%	0.813	S	S	*	*			trans	-73.5	113.8	-172.9	-47.9	0	0	0	0	110.1	T10	T8-T10 PolarHBondContact O-N 3.41Å; T8-T10 VanDerWaalsContact O-N 3.12Å
9	E	32.8	Very low	35.5	Very low	193 Å²	193	147.6 Å²	147.6	90%	0.902	81%	0.811	S	S	*	*			trans	-71.6	101.5	170.6	-75.4	-172.1	161.9	0	0	110.3	D7	D7-E9 PolarHBondContact O-N 3.12Å
10	T	33	Very low	36.7	Very low	117 Å²	117	146.3 Å²	146.3	72%	0.718	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-67.6	134.3	156.4	33.5	0	0	0	0	109.6	T8 L12	T8-T10 PolarHBondContact O-N 3.41Å; T8-T10 VanDerWaalsContact O-N 3.12Å; T10-L12 PolarHBondContact O-N 3.16Å; T10-L12 VanDerWaalsContact O-N 3.16Å
11	P	35.9	Very low	37.9	Very low	127 Å²	127	148.3 Å²	148.3	83%	0.825	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.7	118.6	178.3	-6.2	19	0	0	0	109.7	A13	P11-A13 PolarHBondContact O-N 3.01Å
12	L	36.1	Very low	39.1	Very low	147 Å²	147	141.3 Å²	141.3	77%	0.77	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-58.3	120.1	168.1	-118.6	97.2	0	0	0	108.3	T10	T10-L12 PolarHBondContact O-N 3.16Å; T10-L12 VanDerWaalsContact O-N 3.16Å
13	A	37.1	Very low	40.9	Very low	78 Å²	78	143.5 Å²	143.5	65%	0.645	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-52.2	141.3	169.7	0	0	0	0	0	110.2	P11 Q15	P11-A13 PolarHBondContact O-N 3.01Å; A13-Q15 PolarHBondContact O-N 3.18Å
14	P	35.1	Very low	42.3	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	75%	0.752	S	S	*	*			trans	-60.5	113.9	-177.6	23.2	-31.7	0	0	0	109.5
15	Q	32.7	Very low	43.4	Very low	128 Å²	128	143.3 Å²	143.3	60%	0.598	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-62.3	132.5	172.6	-68.1	-173.7	8.1	0	0	108.4	A13	A13-Q15 PolarHBondContact O-N 3.18Å
16	P	36.1	Very low	44.4	Very low	107 Å²	107	147.5 Å²	147.5	70%	0.695	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-58.7	145.7	175	23.8	-31.8	0	0	0	109.7	R18	P16-R18 PolarHBondContact O-N 3.13Å; P16-R18 VanDerWaalsContact O-N 3.13Å
17	P	40.9	Very low	45.3	Very low	121 Å²	121	149.7 Å²	149.7	79%	0.786	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-56.2	123.5	-179.1	22	-31.4	0	0	0	109.3	L19	P17-L19 PolarHBondContact O-N 2.98Å
18	R	38.4	Very low	46.5	Very low	224 Å²	224	148.5 Å²	148.5	85%	0.845	75%	0.75	S	S	*	*			trans	-61.7	99.2	177.5	-68.6	-172	179.8	-173.8	0.5	108.9	P16 L20	P16-R18 PolarHBondContact O-N 3.13Å; P16-R18 VanDerWaalsContact O-N 3.13Å; R18-L20 PolarHBondContact O-N 2.85Å
19	L	55.1	Low	48.3	Very low	146 Å²	146	146.4 Å²	146.4	76%	0.764	74%	0.739	S	S	*	*			trans	-57.8	123.3	169.5	-82.2	154.7	0	0	0	108	P17 E21	P17-L19 PolarHBondContact O-N 2.98Å; L19-E21 PolarHBondContact O-N 3.25Å
20	L	58.6	Low	50	Low	120 Å²	120	141.1 Å²	141.1	63%	0.628	73%	0.729	S	S	*	*			trans	-53.9	110.6	171.8	-83.1	154.8	0	0	0	108.8	R18 Y692	R18-L20 PolarHBondContact O-N 2.85Å; L20-Y692 HydrophobicContact CB-CD2 4.4Å; L20-Y692 HydrophobicContact CB-CE1 4.14Å; L20-Y692 HydrophobicContact CB-CE2 3.89Å; L20-Y692 HydrophobicContact CD1-CD1 3.98Å; L20-Y692 HydrophobicContact CD1-CD2 4.11Å; L20-Y692 HydrophobicContact CD1-CE1 4.31Å; L20-Y692 HydrophobicContact CD1-CE2 4.42Å; L20-Y692 HydrophobicContact CD1-CG 3.88Å; L20-Y692 PolarHBondContact O-OH 3.5Å
21	E	63	Low	51.7	Low	190 Å²	190	139 Å²	139	89%	0.888	72%	0.723	S	S	*	*			trans	-86	121.1	180	-160.4	176.1	-171.2	0	0	109.7	L19 R23	L19-E21 PolarHBondContact O-N 3.25Å; E21-R23 PolarHBondContact O-N 3.18Å
22	R	66.2	Low	53.4	Low	96 Å²	96	135.1 Å²	135.1	36%	0.362	70%	0.702	S	S	.	*			trans	-72.8	120.1	-175.8	-174.9	179.9	-179.2	-163.9	-1	110.3	V24 D671	R22-V24 PolarHBondContact O-N 3.49Å; R22-D671 IonicContact CZ-OD1 3.8Å; R22-D671 IonicContact CZ-OD2 2.75Å; R22-D671 IonicContact NH1-OD1 2.64Å; R22-D671 PolarHBondContact NH1-OD1 3.07Å; R22-D671 IonicContact NH2-OD1 3.53Å; R22-D671 PolarHBondContact NH2-OD1 3.41Å; R22-D671 IonicContact NH2-OD2 2.65Å; R22-D671 PolarHBondContact NH2-OD2 2.95Å
23	R	67.8	Low	55	Low	244 Å²	244	131.2 Å²	131.2	92%	0.921	68%	0.681	S	S	*	*			trans	-72.7	94	166.1	-167.7	177.8	-83.3	-174.4	-5.3	109.3	E21 R25	E21-R23 PolarHBondContact O-N 3.18Å; R23-R25 PolarHBondContact O-N 3.37Å; R23-R25 VanDerWaalsContact O-N 3.08Å
24	V	59.3	Low	56.5	Low	106 Å²	106	132.7 Å²	132.7	64%	0.642	68%	0.677	S	S	*	*			trans	-64.4	109.6	176.8	-177.6	0	0	0	0	108.8	R22 Q26	R22-V24 PolarHBondContact O-N 3.49Å; V24-Q26 PolarHBondContact O-N 3.36Å
25	R	53	Low	58.4	Low	232 Å²	232	134.4 Å²	134.4	88%	0.875	67%	0.671	S	S	*	*			trans	-70.7	103.6	170.9	-161.9	174.7	-169.5	175.2	3.7	107	R23 Q27	R23-R25 PolarHBondContact O-N 3.37Å; R23-R25 VanDerWaalsContact O-N 3.08Å; R25-Q27 PolarHBondContact O-N 2.89Å
26	Q	52.2	Low	60.1	Low	184 Å²	184	130.6 Å²	130.6	86%	0.86	66%	0.659	S	S	*	*			trans	-52.5	106	174.8	-94.7	177.9	-14.4	0	0	109.3	V24 Q28	V24-Q26 PolarHBondContact O-N 3.36Å; Q26-Q28 PolarHBondContact O-N 3.07Å
27	Q	53.6	Low	61.6	Low	166 Å²	166	132.6 Å²	132.6	78%	0.776	66%	0.657	S	S	*	*			trans	-71.5	114.6	170.7	-75.7	-172	-7.1	0	0	107.2	R25	R25-Q27 PolarHBondContact O-N 2.89Å
28	Q	57.3	Low	62.8	Low	132 Å²	132	131.8 Å²	131.8	62%	0.617	65%	0.646	S	S	*	*			trans	-58.8	137.2	170.7	-72.2	-178.1	-13.7	0	0	108.9	Q26 A30 I33	Q26-Q28 PolarHBondContact O-N 3.07Å; Q28-A30 PolarHBondContact O-N 3.33Å; Q28-I33 HydrophobicContact CB-CD1 4.05Å; Q28-I33 HydrophobicContact CB-CG1 3.85Å; Q28-I33 VanDerWaalsContact O-CD1 3.31Å; Q28-I33 WeakPolarHBondContact O-CD1 3.47Å
29	P	71.1	Confident	64.1	Low	89 Å²	89	128.5 Å²	128.5	58%	0.578	64%	0.637	S	S	*	*			trans	-57.7	139.2	-177.8	16.5	-25.9	0	0	0	110.4	A31 A32 I33	P29-A31 PolarHBondContact O-N 3.3Å; P29-A32 HydrophobicContact CG-CB 3.82Å; P29-A32 WeakPolarHBondContact O-CA 3.35Å; P29-A32 WeakPolarHBondContact O-CB 3.44Å; P29-A32 PolarHBondContact O-N 3.01Å; P29-I33 PolarHBondContact O-N 3.12Å
30	A	67.9	Low	64.3	Low	82 Å²	82	125.9 Å²	125.9	68%	0.678	62%	0.624	S	S	*	*	H	α-helix	trans	-52.8	-34.7	-177.3	0	0	0	0	0	111.9	Q28 I33 L34	Q28-A30 PolarHBondContact O-N 3.33Å; A30-I33 PolarHBondContact O-N 3.08Å; A30-L34 VanDerWaalsContact O-CB 3.24Å; A30-L34 WeakPolarHBondContact O-CB 3.26Å; A30-L34 PolarHBondContact O-N 3.3Å
31	A	68.1	Low	64.3	Low	73 Å²	73	123.1 Å²	123.1	60%	0.603	63%	0.625	S	S	*	*	H	α-helix	trans	-64.1	-38.9	173.8	0	0	0	0	0	113.5	P29 L34 K35	P29-A31 PolarHBondContact O-N 3.3Å; A31-L34 PolarHBondContact O-N 3.42Å; A31-K35 WeakPolarHBondContact O-CB 3.4Å; A31-K35 PolarHBondContact O-N 3.47Å
32	A	71.8	Confident	64.1	Low	45 Å²	45	120.7 Å²	120.7	37%	0.372	62%	0.617	S	S	.	*	H	α-helix	trans	-71.5	-35.6	175.6	0	0	0	0	0	111.9	P29 S36	P29-A32 HydrophobicContact CG-CB 3.82Å; P29-A32 WeakPolarHBondContact O-CA 3.35Å; P29-A32 WeakPolarHBondContact O-CB 3.44Å; P29-A32 PolarHBondContact O-N 3.01Å; A32-S36 WeakPolarHBondContact O-CB 3.42Å; A32-S36 PolarHBondContact O-N 2.89Å; A32-S36 PolarHBondContact O-OG 3.48Å; A32-S36 VanDerWaalsContact O-OG 3.04Å
33	I	70.3	Confident	63.7	Low	64 Å²	64	119.3 Å²	119.3	33%	0.328	62%	0.619	S	S	.	*	H	α-helix	trans	-68.4	-41.7	173.2	-60.9	172.8	0	0	0	110.6	Q28 P29 A30 S36 K37	Q28-I33 HydrophobicContact CB-CD1 4.05Å; Q28-I33 HydrophobicContact CB-CG1 3.85Å; Q28-I33 VanDerWaalsContact O-CD1 3.31Å; Q28-I33 WeakPolarHBondContact O-CD1 3.47Å; P29-I33 PolarHBondContact O-N 3.12Å; A30-I33 PolarHBondContact O-N 3.08Å; I33-S36 WeakPolarHBondContact CA-OG 3.46Å; I33-S36 PolarHBondContact O-OG 2.97Å; I33-K37 HydrophobicContact CG2-CD 4.24Å; I33-K37 VanDerWaalsContact O-CB 3.27Å; I33-K37 WeakPolarHBondContact O-CB 3.29Å; I33-K37 VanDerWaalsContact O-CG 3.3Å; I33-K37 WeakPolarHBondContact O-CG 3.34Å; I33-K37 PolarHBondContact O-N 3.13Å
34	L	68.6	Low	63.2	Low	110 Å²	110	113.2 Å²	113.2	58%	0.576	61%	0.613	S	S	*	*	H	α-helix	trans	-69.2	-44.5	179	-161.8	78.6	0	0	0	110.8	A30 A31 S36 K37 L38	A30-L34 VanDerWaalsContact O-CB 3.24Å; A30-L34 WeakPolarHBondContact O-CB 3.26Å; A30-L34 PolarHBondContact O-N 3.3Å; A31-L34 PolarHBondContact O-N 3.42Å; L34-S36 PolarHBondContact O-N 3.29Å; L34-K37 PolarHBondContact O-N 2.97Å; L34-L38 HydrophobicContact CG-CD1 4.22Å; L34-L38 WeakPolarHBondContact O-CB 3.42Å; L34-L38 PolarHBondContact O-N 2.98Å
35	K	74.1	Confident	64	Low	163 Å²	163	110.3 Å²	110.3	71%	0.709	60%	0.597	S	S	*	*	H	α-helix	trans	-64.7	-38.7	176.4	-164.8	173.3	-173.3	176.9	0	111.4	A31 K39	A31-K35 WeakPolarHBondContact O-CB 3.4Å; A31-K35 PolarHBondContact O-N 3.47Å; K35-K39 WeakPolarHBondContact O-CB 3.16Å; K35-K39 PolarHBondContact O-N 3.26Å
36	S	67.9	Low	65.1	Low	49 Å²	49	102 Å²	102	34%	0.343	58%	0.583	S	S	.	*	H	α-helix	trans	-69.9	-38.7	173.2	71.5	0	0	0	0	112.2	A32 I33 L34 N40	A32-S36 WeakPolarHBondContact O-CB 3.42Å; A32-S36 PolarHBondContact O-N 2.89Å; A32-S36 PolarHBondContact O-OG 3.48Å; A32-S36 VanDerWaalsContact O-OG 3.04Å; I33-S36 WeakPolarHBondContact CA-OG 3.46Å; I33-S36 PolarHBondContact O-OG 2.97Å; L34-S36 PolarHBondContact O-N 3.29Å; S36-N40 WeakPolarHBondContact O-CB 3.49Å; S36-N40 PolarHBondContact O-N 3.27Å; S36-N40 PolarHBondContact O-ND2 3.4Å; S36-N40 VanDerWaalsContact O-ND2 3.08Å
37	K	67.5	Low	66.4	Low	148 Å²	148	97.9 Å²	97.9	64%	0.643	57%	0.573	S	S	*	*	H	α-helix	trans	-65.7	-40.9	173.5	-80.9	-177.4	178.1	179.4	0	112.8	I33 L34 G41	I33-K37 HydrophobicContact CG2-CD 4.24Å; I33-K37 VanDerWaalsContact O-CB 3.27Å; I33-K37 WeakPolarHBondContact O-CB 3.29Å; I33-K37 VanDerWaalsContact O-CG 3.3Å; I33-K37 WeakPolarHBondContact O-CG 3.34Å; I33-K37 PolarHBondContact O-N 3.13Å; L34-K37 PolarHBondContact O-N 2.97Å; K37-G41 PolarHBondContact O-N 3.27Å
38	L	66	Low	67.5	Low	105 Å²	105	93.7 Å²	93.7	55%	0.55	55%	0.552	S	S	.	*	H	α-helix	trans	-66.2	-48.7	175	-113.4	109.5	0	0	0	111	L34 N40 G41 L42	L34-L38 HydrophobicContact CG-CD1 4.22Å; L34-L38 WeakPolarHBondContact O-CB 3.42Å; L34-L38 PolarHBondContact O-N 2.98Å; L38-N40 VanDerWaalsContact C-N 3.28Å; L38-N40 PolarHBondContact O-N 3.28Å; L38-G41 WeakPolarHBondContact O-CA 3.09Å; L38-G41 PolarHBondContact O-N 3.13Å; L38-L42 HydrophobicContact CD2-CD1 4.3Å; L38-L42 PolarHBondContact O-N 3.34Å
39	K	66.6	Low	68.5	Low	155 Å²	155	91.1 Å²	91.1	67%	0.674	55%	0.545	S	S	*	.	H	α-helix	trans	-60.4	-40	177	-166.1	174.1	-178.1	-178.7	0	111	K35 L42 T43	K35-K39 WeakPolarHBondContact O-CB 3.16Å; K35-K39 PolarHBondContact O-N 3.26Å; K39-L42 PolarHBondContact O-N 3.5Å; K39-T43 WeakPolarHBondContact O-CG2 3.49Å; K39-T43 PolarHBondContact O-N 3.28Å; K39-T43 PolarHBondContact O-OG1 2.65Å
40	N	59.9	Low	69	Low	90 Å²	90	95.1 Å²	95.1	48%	0.481	55%	0.549	S	S	.	.	H	α-helix	trans	-71.5	-27.4	173.7	-75	-30.3	0	0	0	113.6	S36 L38 T43 K48	S36-N40 WeakPolarHBondContact O-CB 3.49Å; S36-N40 PolarHBondContact O-N 3.27Å; S36-N40 PolarHBondContact O-ND2 3.4Å; S36-N40 VanDerWaalsContact O-ND2 3.08Å; L38-N40 VanDerWaalsContact C-N 3.28Å; L38-N40 PolarHBondContact O-N 3.28Å; N40-T43 PolarHBondContact O-OG1 3.25Å; N40-K48 PolarHBondContact O-NZ 3.23Å
41	G	58.2	Low	69.6	Low	62 Å²	62	94.5 Å²	94.5	64%	0.639	54%	0.539	S	S	*	.	H	α-helix	trans	-74.1	-32.4	174.7	0	0	0	0	0	113	K37 L38	K37-G41 PolarHBondContact O-N 3.27Å; L38-G41 WeakPolarHBondContact O-CA 3.09Å; L38-G41 PolarHBondContact O-N 3.13Å
42	L	59.3	Low	70.2	Confident	139 Å²	139	95.8 Å²	95.8	73%	0.728	54%	0.54	S	S	*	.	H	α-helix	trans	-84.8	-20.7	179.8	-79.8	150.2	0	0	0	113.9	L38 K39 C44	L38-L42 HydrophobicContact CD2-CD1 4.3Å; L38-L42 PolarHBondContact O-N 3.34Å; K39-L42 PolarHBondContact O-N 3.5Å; L42-C44 PolarHBondContact O-N 2.91Å
43	T	56.7	Low	70.8	Confident	67 Å²	67	98 Å²	98	41%	0.411	55%	0.545	S	S	.	.			trans	-79.8	100.5	173	54.3	0	0	0	0	111.1	K39 N40 S45 K48	K39-T43 WeakPolarHBondContact O-CG2 3.49Å; K39-T43 PolarHBondContact O-N 3.28Å; K39-T43 PolarHBondContact O-OG1 2.65Å; N40-T43 PolarHBondContact O-OG1 3.25Å; T43-S45 VanDerWaalsContact C-N 3.31Å; T43-S45 PolarHBondContact O-N 2.99Å; T43-K48 PolarHBondContact OG1-NZ 3.16Å; T43-K48 VanDerWaalsContact OG1-NZ 3.1Å
44	C	57.8	Low	71.3	Confident	117 Å²	117	97.1 Å²	97.1	79%	0.791	54%	0.54	S	S	*	.			trans	-75.4	79.9	169.1	-79.6	0	0	0	0	110.7	L42	L42-C44 PolarHBondContact O-N 2.91Å
45	S	75.4	Confident	72	Confident	45 Å²	45	92.3 Å²	92.3	32%	0.315	52%	0.518	S	S	.	.			trans	-80.1	137.4	167.7	67.2	0	0	0	0	109.7	T43 P47 K48 V49	T43-S45 VanDerWaalsContact C-N 3.31Å; T43-S45 PolarHBondContact O-N 2.99Å; S45-P47 VanDerWaalsContact C-N 3.28Å; S45-P47 VanDerWaalsContact O-N 3.13Å; S45-K48 WeakPolarHBondContact O-CA 3.1Å; S45-K48 WeakPolarHBondContact O-CB 3.2Å; S45-K48 PolarHBondContact O-N 3.1Å; S45-K48 WeakPolarHBondContact OG-CB 3.27Å; S45-K48 WeakPolarHBondContact OG-CG 3.3Å; S45-K48 PolarHBondContact OG-N 3.01Å; S45-V49 PolarHBondContact O-N 3.35Å
46	G	76.6	Confident	72.6	Confident	56 Å²	56	88.5 Å²	88.5	58%	0.577	50%	0.501	S	S	*	.	H	α-helix	trans	-45.3	-42	175.6	0	0	0	0	0	115.3	K48 V49 R50	G46-K48 VanDerWaalsContact C-N 3.35Å; G46-K48 PolarHBondContact O-N 3.03Å; G46-V49 PolarHBondContact O-N 2.81Å; G46-R50 PolarHBondContact O-N 3.2Å
47	P	79.2	Confident	73.8	Confident	99 Å²	99	89.6 Å²	89.6	64%	0.643	50%	0.5	S	S	*	.	H	α-helix	trans	-62.2	-34	175	-24.8	34.5	0	0	0	114.7	S45 S51	S45-P47 VanDerWaalsContact C-N 3.28Å; S45-P47 VanDerWaalsContact O-N 3.13Å; P47-S51 WeakPolarHBondContact O-CB 3.49Å; P47-S51 PolarHBondContact O-N 2.72Å
48	K	76.9	Confident	74.9	Confident	77 Å²	77	83 Å²	83	34%	0.335	47%	0.472	S	S	.	.	H	α-helix	trans	-70	-44	175.1	-83.4	175.7	-177.3	161.5	0	111.3	N40 T43 S45 G46 R50 S51 T52	N40-K48 PolarHBondContact O-NZ 3.23Å; T43-K48 PolarHBondContact OG1-NZ 3.16Å; T43-K48 VanDerWaalsContact OG1-NZ 3.1Å; S45-K48 WeakPolarHBondContact O-CA 3.1Å; S45-K48 WeakPolarHBondContact O-CB 3.2Å; S45-K48 PolarHBondContact O-N 3.1Å; S45-K48 WeakPolarHBondContact OG-CB 3.27Å; S45-K48 WeakPolarHBondContact OG-CG 3.3Å; S45-K48 PolarHBondContact OG-N 3.01Å; G46-K48 VanDerWaalsContact C-N 3.35Å; G46-K48 PolarHBondContact O-N 3.03Å; K48-R50 VanDerWaalsContact C-N 3.31Å; K48-R50 PolarHBondContact O-N 2.84Å; K48-S51 PolarHBondContact O-N 2.91Å; K48-T52 WeakPolarHBondContact O-CB 3.47Å; K48-T52 PolarHBondContact O-N 2.84Å; K48-T52 PolarHBondContact O-OG1 3.5Å
49	V	79.5	Confident	76.2	Confident	79 Å²	79	78.5 Å²	78.5	48%	0.479	45%	0.449	S	S	.	.	H	α-helix	trans	-59.6	-45.8	176.1	178.6	0	0	0	0	110.1	S45 G46 S51 T52 L53	S45-V49 PolarHBondContact O-N 3.35Å; G46-V49 PolarHBondContact O-N 2.81Å; V49-S51 PolarHBondContact O-N 2.94Å; V49-T52 PolarHBondContact O-N 3.26Å; V49-L53 VanDerWaalsContact O-CB 3.31Å; V49-L53 WeakPolarHBondContact O-CB 3.45Å; V49-L53 PolarHBondContact O-N 3.37Å
50	R	81.1	Confident	77.3	Confident	172 Å²	172	74.1 Å²	74.1	65%	0.649	44%	0.435	S	S	*	.	H	α-helix	trans	-59.3	-44.7	174.3	-172.9	178.1	179.9	178	2.2	112.2	G46 K48 M54	G46-R50 PolarHBondContact O-N 3.2Å; K48-R50 VanDerWaalsContact C-N 3.31Å; K48-R50 PolarHBondContact O-N 2.84Å; R50-M54 HydrophobicContact CG-CE 4.26Å; R50-M54 HydrophobicContact CG-CG 4.46Å; R50-M54 HydrophobicContact CG-SD 4.14Å; R50-M54 VanDerWaalsContact O-CB 3.28Å; R50-M54 WeakPolarHBondContact O-CB 3.24Å; R50-M54 VanDerWaalsContact O-CG 3.22Å; R50-M54 WeakPolarHBondContact O-CG 3.41Å; R50-M54 PolarHBondContact O-N 3.48Å
51	S	80.8	Confident	78.7	Confident	69 Å²	69	75 Å²	75	48%	0.483	43%	0.431	S	S	.	.	H	α-helix	trans	-63.8	-42.4	178.5	-176.6	0	0	0	0	112.7	P47 K48 V49 G55	P47-S51 WeakPolarHBondContact O-CB 3.49Å; P47-S51 PolarHBondContact O-N 2.72Å; K48-S51 PolarHBondContact O-N 2.91Å; V49-S51 PolarHBondContact O-N 2.94Å; S51-G55 PolarHBondContact O-N 2.97Å
52	T	80.8	Confident	80.2	Confident	100 Å²	100	74.1 Å²	74.1	61%	0.613	41%	0.409	S	S	*	.	H	α-helix	trans	-66.1	-46.5	176.8	-58.2	0	0	0	0	111.2	K48 V49 G55 F56	K48-T52 WeakPolarHBondContact O-CB 3.47Å; K48-T52 PolarHBondContact O-N 2.84Å; K48-T52 PolarHBondContact O-OG1 3.5Å; V49-T52 PolarHBondContact O-N 3.26Å; T52-G55 CarbonylContact O-C 3.51Å; T52-G55 WeakPolarHBondContact O-CA 3.49Å; T52-G55 PolarHBondContact O-N 3.49Å; T52-F56 PolarHBondContact O-N 3.08Å
53	L	82.7	Confident	81.8	Confident	93 Å²	93	71.3 Å²	71.3	49%	0.487	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-43.1	178.9	-167.5	133.6	0	0	0	111.6	V49 G55 F56 F57	V49-L53 VanDerWaalsContact O-CB 3.31Å; V49-L53 WeakPolarHBondContact O-CB 3.45Å; V49-L53 PolarHBondContact O-N 3.37Å; L53-G55 PolarHBondContact O-N 2.79Å; L53-F56 PolarHBondContact O-N 2.89Å; L53-F57 HydrophobicContact CG-CD2 4.34Å; L53-F57 PolarHBondContact O-N 2.83Å
54	M	81.9	Confident	83.4	Confident	44 Å²	44	73.2 Å²	73.2	22%	0.217	41%	0.408	C	S	.	.	H	α-helix	trans	-67.5	-21	171	-70.8	-175.3	160.6	0	0	113.1	R50 V60 R61	R50-M54 HydrophobicContact CG-CE 4.26Å; R50-M54 HydrophobicContact CG-CG 4.46Å; R50-M54 HydrophobicContact CG-SD 4.14Å; R50-M54 VanDerWaalsContact O-CB 3.28Å; R50-M54 WeakPolarHBondContact O-CB 3.24Å; R50-M54 VanDerWaalsContact O-CG 3.22Å; R50-M54 WeakPolarHBondContact O-CG 3.41Å; R50-M54 PolarHBondContact O-N 3.48Å; M54-V60 HydrophobicContact CE-CG1 4.15Å; M54-V60 HydrophobicContact CG-CG1 4.33Å; M54-R61 HydrophobicContact CB-CG 4Å; M54-R61 HydrophobicContact CG-CG 4.44Å; M54-R61 PolarHBondContact O-NE 3.49Å; M54-R61 HydrophobicContact SD-CG 4.49Å
55	G	82.8	Confident	85.1	Confident	10 Å²	10	75.7 Å²	75.7	10%	0.103	41%	0.405	C	S	.	.	H	α-helix	trans	-74.3	-42.8	173.9	0	0	0	0	0	111.7	S51 T52 L53 R387 Q390	S51-G55 PolarHBondContact O-N 2.97Å; T52-G55 CarbonylContact O-C 3.51Å; T52-G55 WeakPolarHBondContact O-CA 3.49Å; T52-G55 PolarHBondContact O-N 3.49Å; L53-G55 PolarHBondContact O-N 2.79Å; G55-R387 PolarHBondContact O-NH1 2.92Å; G55-R387 PolarHBondContact O-NH2 3.38Å; G55-Q390 PolarHBondContact O-OE1 2.96Å; G55-Q390 VanDerWaalsContact O-OE1 3.13Å
56	F	87.8	Confident	85.9	Confident	83 Å²	83	75.2 Å²	75.2	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-78.8	-34.5	-178.4	-170	-93.2	0	0	0	113.4	T52 L53 P58 M118 Q390 V393 L397	T52-F56 PolarHBondContact O-N 3.08Å; L53-F56 PolarHBondContact O-N 2.89Å; F56-P58 WeakPolarHBondContact O-CD 3.42Å; F56-M118 HydrophobicContact CD1-CE 3.88Å; F56-M118 HydrophobicContact CD2-CE 4.45Å; F56-M118 HydrophobicContact CE1-CE 3.4Å; F56-M118 VanDerWaalsContact CE1-CE 3.4Å; F56-M118 HydrophobicContact CE2-CE 4.03Å; F56-M118 HydrophobicContact CG-CE 4.4Å; F56-M118 HydrophobicContact CZ-CE 3.5Å; F56-M118 VanDerWaalsContact CZ-CE 3.5Å; F56-Q390 PolarHBondContact O-NE2 3.46Å; F56-V393 HydrophobicContact CD2-CG1 4.44Å; F56-V393 HydrophobicContact CE2-CG1 3.81Å; F56-V393 HydrophobicContact CZ-CG1 4.37Å; F56-L397 HydrophobicContact CZ-CD1 3.95Å
57	F	92.5	Very high	86.7	Confident	72 Å²	72	77.2 Å²	77.2	32%	0.316	39%	0.39	S	S	.	.			trans	-114.3	84.4	172.3	-65.2	-71	0	0	0	110.8	L53 V59 V60 L117 M118	L53-F57 HydrophobicContact CG-CD2 4.34Å; L53-F57 PolarHBondContact O-N 2.83Å; F57-V59 HydrophobicContact CB-CG1 4.27Å; F57-V59 PolarHBondContact O-N 3.07Å; F57-V59 VanDerWaalsContact O-N 3.13Å; F57-V60 HydrophobicContact CB-CG2 4.07Å; F57-V60 PolarHBondContact O-N 3.04Å; F57-L117 HydrophobicContact CD1-CB 4.47Å; F57-M118 HydrophobicContact CD1-CG 4.4Å; F57-M118 HydrophobicContact CE1-CG 4.43Å
58	P	91.6	Very high	87.3	Confident	9 Å²	9	78.2 Å²	78.2	6%	0.058	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.8	178.7	-25	35.4	0	0	0	113.8	F56 V60 R61 W62 M118 T120 Q390	F56-P58 WeakPolarHBondContact O-CD 3.42Å; P58-V60 PolarHBondContact O-N 2.81Å; P58-R61 WeakPolarHBondContact O-CB 3.31Å; P58-R61 PolarHBondContact O-N 3.05Å; P58-W62 PolarHBondContact O-N 3.22Å; P58-M118 WeakPolarHBondContact CD-O 3.33Å; P58-M118 WeakPolarHBondContact CG-O 3.31Å; P58-T120 HydrophobicContact CB-CG2 4.37Å; P58-T120 HydrophobicContact CG-CG2 3.77Å; P58-Q390 HydrophobicContact CG-CG 4.17Å
59	V	91.8	Very high	88	Confident	11 Å²	11	84.1 Å²	84.1	7%	0.067	42%	0.415	C	S	.	.	H	α-helix	trans	-50.7	-39.3	176.4	67.5	0	0	0	0	112.9	F57 R61 W62 L63 F116 L117	F57-V59 HydrophobicContact CB-CG1 4.27Å; F57-V59 PolarHBondContact O-N 3.07Å; F57-V59 VanDerWaalsContact O-N 3.13Å; V59-R61 PolarHBondContact O-N 3.42Å; V59-R61 VanDerWaalsContact O-N 3.16Å; V59-W62 HydrophobicContact CG2-CZ2 3.95Å; V59-W62 PolarHBondContact O-N 2.88Å; V59-L63 HydrophobicContact CG2-CB 4.1Å; V59-L63 HydrophobicContact CG2-CD2 4.13Å; V59-L63 WeakPolarHBondContact O-CB 3.44Å; V59-L63 PolarHBondContact O-N 3.23Å; V59-F116 HydrophobicContact CG2-CE1 3.99Å; V59-F116 HydrophobicContact CG2-CE2 4.48Å; V59-F116 HydrophobicContact CG2-CZ 3.9Å; V59-L117 HydrophobicContact CG1-CD2 4.15Å; V59-L117 WeakPolarHBondContact CG1-O 3.27Å
60	V	90.3	Very high	88.6	Confident	63 Å²	63	86 Å²	86	38%	0.382	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-22.6	-179.4	-174.5	0	0	0	0	112.1	M54 F57 P58 P64	M54-V60 HydrophobicContact CE-CG1 4.15Å; M54-V60 HydrophobicContact CG-CG1 4.33Å; F57-V60 HydrophobicContact CB-CG2 4.07Å; F57-V60 PolarHBondContact O-N 3.04Å; P58-V60 PolarHBondContact O-N 2.81Å; V60-P64 VanDerWaalsContact O-CD 3.31Å; V60-P64 WeakPolarHBondContact O-CD 3.47Å; V60-P64 WeakPolarHBondContact O-CG 3.46Å
61	R	88.3	Confident	89.2	Confident	107 Å²	107	80.6 Å²	80.6	40%	0.404	40%	0.398	S	S	.	.	H	α-helix	trans	-84.3	-37.8	179.5	-65.2	-175.3	176.2	177.2	4.5	113.4	M54 P58 V59	M54-R61 HydrophobicContact CB-CG 4Å; M54-R61 HydrophobicContact CG-CG 4.44Å; M54-R61 PolarHBondContact O-NE 3.49Å; M54-R61 HydrophobicContact SD-CG 4.49Å; P58-R61 WeakPolarHBondContact O-CB 3.31Å; P58-R61 PolarHBondContact O-N 3.05Å; V59-R61 PolarHBondContact O-N 3.42Å; V59-R61 VanDerWaalsContact O-N 3.16Å
62	W	90.8	Very high	89.8	Confident	44 Å²	44	80 Å²	80	17%	0.167	39%	0.389	C	S	.	.	H	α-helix	trans	-102.2	-29.9	-171.8	69	-103.5	0	0	0	113.3	P58 V59 K65 Y66 F116 T427 Q428 V429	P58-W62 PolarHBondContact O-N 3.22Å; V59-W62 HydrophobicContact CG2-CZ2 3.95Å; V59-W62 PolarHBondContact O-N 2.88Å; W62-K65 CarbonylContact O-C 3.34Å; W62-K65 WeakPolarHBondContact O-CA 3.48Å; W62-K65 PolarHBondContact O-N 3.39Å; W62-Y66 HydrophobicContact CZ3-CD2 4.19Å; W62-Y66 PolarHBondContact O-N 2.93Å; W62-F116 HydrophobicContact CH2-CD2 4.25Å; W62-F116 AromaticContact CH2-CE2 3.65Å; W62-F116 HydrophobicContact CH2-CE2 3.65Å; W62-F116 HydrophobicContact CH2-CZ 4.43Å; W62-F116 HydrophobicContact CZ2-CD2 4.18Å; W62-F116 AromaticContact CZ2-CE2 3.88Å; W62-F116 HydrophobicContact CZ2-CE2 3.88Å; W62-T427 HydrophobicContact CE3-CG2 4.29Å; W62-T427 HydrophobicContact CZ3-CG2 4.13Å; W62-Q428 HydrophobicContact CH2-CB 4.41Å; W62-Q428 HydrophobicContact CZ2-CB 4.04Å; W62-V429 HydrophobicContact CH2-CG2 3.94Å; W62-V429 HydrophobicContact CZ3-CG2 4.09Å
63	L	91.9	Very high	90.3	Very high	80 Å²	80	83.7 Å²	83.7	42%	0.419	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-60	-40.5	-179	-171.1	66.8	0	0	0	113	V59 K65 Y66	V59-L63 HydrophobicContact CG2-CB 4.1Å; V59-L63 HydrophobicContact CG2-CD2 4.13Å; V59-L63 WeakPolarHBondContact O-CB 3.44Å; V59-L63 PolarHBondContact O-N 3.23Å; L63-K65 PolarHBondContact O-N 3.02Å; L63-Y66 WeakPolarHBondContact O-CB 3.3Å; L63-Y66 PolarHBondContact O-N 3.31Å; L63-Y66 VanDerWaalsContact O-N 3.15Å
64	P	91.8	Very high	90.7	Very high	108 Å²	108	79.9 Å²	79.9	70%	0.701	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18.7	174.3	-20.9	34.2	0	0	0	114.1	V60 Y66	V60-P64 VanDerWaalsContact O-CD 3.31Å; V60-P64 WeakPolarHBondContact O-CD 3.47Å; V60-P64 WeakPolarHBondContact O-CG 3.46Å; P64-Y66 VanDerWaalsContact C-N 3.31Å
65	K	92.4	Very high	91.3	Very high	168 Å²	168	77.8 Å²	77.8	73%	0.73	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-94.8	11.2	177.8	-57.8	-175.5	-178.6	-174.5	0	111.9	W62 L63 K67	W62-K65 CarbonylContact O-C 3.34Å; W62-K65 WeakPolarHBondContact O-CA 3.48Å; W62-K65 PolarHBondContact O-N 3.39Å; L63-K65 PolarHBondContact O-N 3.02Å; K65-K67 PolarHBondContact O-N 2.77Å
66	Y	93.2	Very high	91.9	Very high	35 Å²	35	79.2 Å²	79.2	14%	0.137	37%	0.371	C	S	.	.			trans	-71.6	118.4	-177.4	-169.9	-102.8	0	0	0	111.1	W62 L63 P64 L68 Y71 I72 D75 T427 V429	W62-Y66 HydrophobicContact CZ3-CD2 4.19Å; W62-Y66 PolarHBondContact O-N 2.93Å; L63-Y66 WeakPolarHBondContact O-CB 3.3Å; L63-Y66 PolarHBondContact O-N 3.31Å; L63-Y66 VanDerWaalsContact O-N 3.15Å; P64-Y66 VanDerWaalsContact C-N 3.31Å; Y66-L68 HydrophobicContact CD1-CD2 4.04Å; Y66-L68 HydrophobicContact CD1-CG 4.03Å; Y66-L68 HydrophobicContact CE1-CD2 4.03Å; Y66-L68 HydrophobicContact CE1-CG 4.38Å; Y66-L68 PolarHBondContact O-N 3Å; Y66-Y71 HydrophobicContact CD2-CD2 4.07Å; Y66-Y71 AromaticContact CE2-CD2 3.99Å; Y66-Y71 HydrophobicContact CE2-CD2 3.99Å; Y66-Y71 HydrophobicContact CE2-CG 4.34Å; Y66-Y71 VanDerWaalsContact OH-C 3.29Å; Y66-Y71 WeakPolarHBondContact OH-CB 3.32Å; Y66-Y71 PolarHBondContact OH-O 3.22Å; Y66-I72 HydrophobicContact CE1-CD1 4.49Å; Y66-I72 WeakPolarHBondContact OH-CA 3.5Å; Y66-I72 PolarHBondContact OH-N 3.39Å; Y66-D75 VanDerWaalsContact CE2-OD2 3.26Å; Y66-D75 WeakPolarHBondContact CE2-OD2 3.36Å; Y66-D75 PolarHBondContact OH-OD2 2.85Å; Y66-T427 HydrophobicContact CD2-CG2 3.71Å; Y66-T427 HydrophobicContact CE2-CG2 3.52Å; Y66-T427 VanDerWaalsContact CE2-OG1 3.31Å; Y66-T427 WeakPolarHBondContact CE2-OG1 3.33Å; Y66-V429 HydrophobicContact CE2-CG2 4.07Å
67	K	93.3	Very high	92	Very high	99 Å²	99	78.3 Å²	78.3	43%	0.43	37%	0.369	S	S	.	.			trans	-85.1	90.4	176.7	-64	-173.3	178.9	-172.5	0	110.5	K65 K69 E70 Y71	K65-K67 PolarHBondContact O-N 2.77Å; K67-K69 VanDerWaalsContact C-N 3.31Å; K67-K69 PolarHBondContact O-N 2.64Å; K67-E70 HydrophobicContact CB-CB 4.21Å; K67-E70 VanDerWaalsContact CD-CD 3.45Å; K67-E70 HydrophobicContact CD-CG 4.42Å; K67-E70 WeakPolarHBondContact CD-OE1 3.49Å; K67-E70 WeakPolarHBondContact CD-OE2 3.42Å; K67-E70 IonicContact NZ-OE1 2.71Å; K67-E70 PolarHBondContact NZ-OE1 3.03Å; K67-E70 IonicContact NZ-OE2 3.47Å; K67-E70 PolarHBondContact NZ-OE2 2.84Å; K67-E70 PolarHBondContact O-N 3.03Å; K67-E70 VanDerWaalsContact O-N 3.12Å; K67-Y71 HydrophobicContact CB-CD2 4Å; K67-Y71 HydrophobicContact CB-CE2 3.88Å; K67-Y71 HydrophobicContact CB-CG 4.39Å; K67-Y71 HydrophobicContact CD-CE2 4.33Å; K67-Y71 HydrophobicContact CG-CE2 4.11Å; K67-Y71 PolarHBondContact O-N 3.16Å
68	L	92.4	Very high	92	Very high	119 Å²	119	74.9 Å²	74.9	62%	0.623	35%	0.354	S	S	*	.	H	α-helix	trans	-48.5	-47.2	-177.4	-79.6	158.2	0	0	0	113.5	Y66 E70 I72	Y66-L68 HydrophobicContact CD1-CD2 4.04Å; Y66-L68 HydrophobicContact CD1-CG 4.03Å; Y66-L68 HydrophobicContact CE1-CD2 4.03Å; Y66-L68 HydrophobicContact CE1-CG 4.38Å; Y66-L68 PolarHBondContact O-N 3Å; L68-E70 VanDerWaalsContact C-N 3.35Å; L68-E70 PolarHBondContact O-N 2.97Å; L68-I72 VanDerWaalsContact O-CB 3.24Å; L68-I72 WeakPolarHBondContact O-CB 3.33Å; L68-I72 WeakPolarHBondContact O-CG2 3.4Å; L68-I72 PolarHBondContact O-N 3.32Å
69	K	90.9	Very high	92.2	Very high	202 Å²	202	74.4 Å²	74.4	88%	0.878	35%	0.351	S	S	*	.	H	α-helix	trans	-67.4	-31.6	-176.1	-67.1	-175.5	178.5	-178.3	0	113.9	K67	K67-K69 VanDerWaalsContact C-N 3.31Å; K67-K69 PolarHBondContact O-N 2.64Å
70	E	92	Very high	92.2	Very high	118 Å²	118	77.1 Å²	77.1	55%	0.551	37%	0.365	S	S	*	.	H	α-helix	trans	-91.5	-40.9	-175.1	-69.4	174.1	-150.4	0	0	111.8	K67 L68	K67-E70 HydrophobicContact CB-CB 4.21Å; K67-E70 VanDerWaalsContact CD-CD 3.45Å; K67-E70 HydrophobicContact CD-CG 4.42Å; K67-E70 WeakPolarHBondContact CD-OE1 3.49Å; K67-E70 WeakPolarHBondContact CD-OE2 3.42Å; K67-E70 IonicContact NZ-OE1 2.71Å; K67-E70 PolarHBondContact NZ-OE1 3.03Å; K67-E70 IonicContact NZ-OE2 3.47Å; K67-E70 PolarHBondContact NZ-OE2 2.84Å; K67-E70 PolarHBondContact O-N 3.03Å; K67-E70 VanDerWaalsContact O-N 3.12Å; L68-E70 VanDerWaalsContact C-N 3.35Å; L68-E70 PolarHBondContact O-N 2.97Å
71	Y	93.4	Very high	92.3	Very high	58 Å²	58	74.7 Å²	74.7	23%	0.227	35%	0.35	C	S	.	.	H	α-helix	trans	-98.6	-24	-164.9	-59	-17.2	0	0	0	114.2	Y66 K67 W73 G74 D75 Q426 T427	Y66-Y71 HydrophobicContact CD2-CD2 4.07Å; Y66-Y71 AromaticContact CE2-CD2 3.99Å; Y66-Y71 HydrophobicContact CE2-CD2 3.99Å; Y66-Y71 HydrophobicContact CE2-CG 4.34Å; Y66-Y71 VanDerWaalsContact OH-C 3.29Å; Y66-Y71 WeakPolarHBondContact OH-CB 3.32Å; Y66-Y71 PolarHBondContact OH-O 3.22Å; K67-Y71 HydrophobicContact CB-CD2 4Å; K67-Y71 HydrophobicContact CB-CE2 3.88Å; K67-Y71 HydrophobicContact CB-CG 4.39Å; K67-Y71 HydrophobicContact CD-CE2 4.33Å; K67-Y71 HydrophobicContact CG-CE2 4.11Å; K67-Y71 PolarHBondContact O-N 3.16Å; Y71-W73 PolarHBondContact O-N 3.45Å; Y71-G74 PolarHBondContact O-N 3.45Å; Y71-D75 PolarHBondContact O-N 3.19Å; Y71-Q426 HydrophobicContact CD1-CB 3.88Å; Y71-Q426 HydrophobicContact CD1-CG 3.67Å; Y71-Q426 HydrophobicContact CD2-CB 4.27Å; Y71-Q426 HydrophobicContact CE1-CB 4.31Å; Y71-Q426 HydrophobicContact CE1-CG 4.02Å; Y71-Q426 HydrophobicContact CG-CB 3.87Å; Y71-Q426 HydrophobicContact CG-CG 4.18Å; Y71-T427 HydrophobicContact CD2-CG2 4.2Å
72	I	93.5	Very high	92.4	Very high	56 Å²	56	69.7 Å²	69.7	29%	0.287	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-42.6	-169.4	-166.8	61.7	0	0	0	112.8	Y66 L68 D75 V76	Y66-I72 HydrophobicContact CE1-CD1 4.49Å; Y66-I72 WeakPolarHBondContact OH-CA 3.5Å; Y66-I72 PolarHBondContact OH-N 3.39Å; L68-I72 VanDerWaalsContact O-CB 3.24Å; L68-I72 WeakPolarHBondContact O-CB 3.33Å; L68-I72 WeakPolarHBondContact O-CG2 3.4Å; L68-I72 PolarHBondContact O-N 3.32Å; I72-D75 PolarHBondContact O-N 3.39Å; I72-V76 HydrophobicContact CD1-CG2 3.92Å; I72-V76 HydrophobicContact CG1-CG2 4Å; I72-V76 VanDerWaalsContact O-CB 3.3Å; I72-V76 WeakPolarHBondContact O-CB 3.45Å; I72-V76 WeakPolarHBondContact O-CG2 3.44Å; I72-V76 PolarHBondContact O-N 3.43Å
73	W	91.1	Very high	92.5	Very high	178 Å²	178	67.6 Å²	67.6	67%	0.674	32%	0.323	S	S	*	.	H	α-helix	trans	-66.4	-42.2	-177.6	-74.9	109.2	0	0	0	112.1	Y71 M77	Y71-W73 PolarHBondContact O-N 3.45Å; W73-M77 HydrophobicContact CE3-CE 4.45Å; W73-M77 HydrophobicContact CZ3-CE 4.4Å; W73-M77 WeakPolarHBondContact O-CB 3.41Å; W73-M77 VanDerWaalsContact O-CG 3.27Å; W73-M77 WeakPolarHBondContact O-CG 3.44Å; W73-M77 PolarHBondContact O-N 3.41Å
74	G	91.1	Very high	92.5	Very high	14 Å²	14	65.9 Å²	65.9	14%	0.144	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-47.2	175.8	0	0	0	0	0	111.5	Y71 S78	Y71-G74 PolarHBondContact O-N 3.45Å; G74-S78 WeakPolarHBondContact O-CB 3.28Å; G74-S78 PolarHBondContact O-N 3.43Å
75	D	94.6	Very high	92.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-67.9	-38	-178.9	-69.6	-20.2	0	0	0	112.4	Y66 Y71 I72 G79 C425 Q426 T427 V429 S430	Y66-D75 VanDerWaalsContact CE2-OD2 3.26Å; Y66-D75 WeakPolarHBondContact CE2-OD2 3.36Å; Y66-D75 PolarHBondContact OH-OD2 2.85Å; Y71-D75 PolarHBondContact O-N 3.19Å; I72-D75 PolarHBondContact O-N 3.39Å; D75-G79 PolarHBondContact O-N 3.03Å; D75-C425 PolarHBondContact OD1-SG 3.25Å; D75-Q426 PolarHBondContact OD1-N 2.86Å; D75-T427 PolarHBondContact OD1-N 2.6Å; D75-T427 PolarHBondContact OD2-OG1 2.98Å; D75-V429 HydrophobicContact CB-CB 4.22Å; D75-V429 HydrophobicContact CB-CG1 4.43Å; D75-S430 VanDerWaalsContact O-CA 3.31Å; D75-S430 WeakPolarHBondContact O-CA 3.45Å; D75-S430 VanDerWaalsContact O-CB 3.26Å; D75-S430 WeakPolarHBondContact O-CB 3.3Å
76	V	94.6	Very high	92.3	Very high	39 Å²	39	53.3 Å²	53.3	24%	0.236	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-51.1	176.5	172.8	0	0	0	0	111.8	I72 S78 G79 L80 I433	I72-V76 HydrophobicContact CD1-CG2 3.92Å; I72-V76 HydrophobicContact CG1-CG2 4Å; I72-V76 VanDerWaalsContact O-CB 3.3Å; I72-V76 WeakPolarHBondContact O-CB 3.45Å; I72-V76 WeakPolarHBondContact O-CG2 3.44Å; I72-V76 PolarHBondContact O-N 3.43Å; V76-S78 VanDerWaalsContact C-N 3.29Å; V76-S78 PolarHBondContact O-N 3.46Å; V76-G79 PolarHBondContact O-N 2.91Å; V76-L80 HydrophobicContact CG1-CD1 3.95Å; V76-L80 HydrophobicContact CG1-CG 4.42Å; V76-L80 WeakPolarHBondContact O-CB 3.42Å; V76-L80 WeakPolarHBondContact O-CG 3.27Å; V76-L80 PolarHBondContact O-N 2.98Å; V76-I433 VanDerWaalsContact CA-CD1 3.46Å; V76-I433 HydrophobicContact CB-CD1 3.95Å; V76-I433 HydrophobicContact CG1-CD1 4.49Å; V76-I433 HydrophobicContact CG2-CD1 3.46Å; V76-I433 VanDerWaalsContact CG2-CD1 3.46Å
77	M	91.5	Very high	92.1	Very high	64 Å²	64	52 Å²	52	32%	0.315	24%	0.244	S	C	.	.	H	α-helix	trans	-61.8	-42.6	179	-72.7	-66.1	143.4	0	0	111.1	W73 L80 I81	W73-M77 HydrophobicContact CE3-CE 4.45Å; W73-M77 HydrophobicContact CZ3-CE 4.4Å; W73-M77 WeakPolarHBondContact O-CB 3.41Å; W73-M77 VanDerWaalsContact O-CG 3.27Å; W73-M77 WeakPolarHBondContact O-CG 3.44Å; W73-M77 PolarHBondContact O-N 3.41Å; M77-L80 PolarHBondContact O-N 3.19Å; M77-I81 WeakPolarHBondContact O-CB 2.96Å; M77-I81 WeakPolarHBondContact O-CD1 3.46Å; M77-I81 VanDerWaalsContact O-CG1 3.22Å; M77-I81 WeakPolarHBondContact O-CG1 3.21Å; M77-I81 PolarHBondContact O-N 3.5Å; M77-I81 VanDerWaalsContact O-N 3.08Å
78	S	92.6	Very high	91.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-50.2	174.2	-173.6	0	0	0	0	112.3	G74 V76 L80 I81 V82 K420 T423 S430	G74-S78 WeakPolarHBondContact O-CB 3.28Å; G74-S78 PolarHBondContact O-N 3.43Å; V76-S78 VanDerWaalsContact C-N 3.29Å; V76-S78 PolarHBondContact O-N 3.46Å; S78-L80 PolarHBondContact O-N 3.17Å; S78-I81 PolarHBondContact O-N 2.96Å; S78-V82 WeakPolarHBondContact O-CB 3.34Å; S78-V82 VanDerWaalsContact O-CG2 3.23Å; S78-V82 WeakPolarHBondContact O-CG2 3.33Å; S78-V82 PolarHBondContact O-N 3.25Å; S78-K420 VanDerWaalsContact OG-CA 3.31Å; S78-K420 WeakPolarHBondContact OG-CA 3.31Å; S78-K420 WeakPolarHBondContact OG-CG 3.49Å; S78-K420 PolarHBondContact OG-O 3.46Å; S78-T423 WeakPolarHBondContact CA-OG1 3.46Å; S78-T423 WeakPolarHBondContact CB-OG1 3.22Å; S78-T423 PolarHBondContact OG-OG1 3.05Å; S78-S430 WeakPolarHBondContact CB-OG 3.35Å; S78-S430 PolarHBondContact OG-OG 3.17Å; S78-S430 VanDerWaalsContact OG-OG 3.05Å
79	G	94	Very high	91.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.9	-38.2	-178.1	0	0	0	0	0	113.5	D75 V76 G83 S430 S434	D75-G79 PolarHBondContact O-N 3.03Å; V76-G79 PolarHBondContact O-N 2.91Å; G79-G83 PolarHBondContact O-N 3.44Å; G79-S430 WeakPolarHBondContact CA-O 3.35Å; G79-S430 PolarHBondContact N-OG 3.43Å; G79-S434 WeakPolarHBondContact CA-OG 3.43Å; G79-S434 WeakPolarHBondContact O-CA 3.47Å; G79-S434 PolarHBondContact O-OG 2.98Å; G79-S434 VanDerWaalsContact O-OG 3.11Å
80	L	93.6	Very high	91.8	Very high	67 Å²	67	32.2 Å²	32.2	35%	0.351	15%	0.153	S	C	.	.	H	α-helix	trans	-61.7	-49.8	174.4	-74.1	171.4	0	0	0	111.2	V76 M77 S78 G83 I84 I433 V437	V76-L80 HydrophobicContact CG1-CD1 3.95Å; V76-L80 HydrophobicContact CG1-CG 4.42Å; V76-L80 WeakPolarHBondContact O-CB 3.42Å; V76-L80 WeakPolarHBondContact O-CG 3.27Å; V76-L80 PolarHBondContact O-N 2.98Å; M77-L80 PolarHBondContact O-N 3.19Å; S78-L80 PolarHBondContact O-N 3.17Å; L80-G83 PolarHBondContact O-N 3.13Å; L80-I84 WeakPolarHBondContact O-CB 3.35Å; L80-I84 WeakPolarHBondContact O-CD1 3.45Å; L80-I84 VanDerWaalsContact O-CG1 3.23Å; L80-I84 WeakPolarHBondContact O-CG1 3.5Å; L80-I84 PolarHBondContact O-N 3.46Å; L80-I433 HydrophobicContact CD2-CG2 4.48Å; L80-I433 HydrophobicContact CG-CG2 4.28Å; L80-V437 HydrophobicContact CD2-CG2 3.83Å
81	I	90.8	Very high	91.7	Very high	13 Å²	13	26.7 Å²	26.7	7%	0.067	13%	0.127	C	C	.	.	H	α-helix	trans	-68.6	-43.6	-176.4	-64.6	171.1	0	0	0	110.9	M77 S78 I84 I85 I305 P306 V419 T423	M77-I81 WeakPolarHBondContact O-CB 2.96Å; M77-I81 WeakPolarHBondContact O-CD1 3.46Å; M77-I81 VanDerWaalsContact O-CG1 3.22Å; M77-I81 WeakPolarHBondContact O-CG1 3.21Å; M77-I81 PolarHBondContact O-N 3.5Å; M77-I81 VanDerWaalsContact O-N 3.08Å; S78-I81 PolarHBondContact O-N 2.96Å; I81-I84 PolarHBondContact O-N 3.5Å; I81-I85 HydrophobicContact CG2-CD1 3.86Å; I81-I85 WeakPolarHBondContact O-CB 3.49Å; I81-I85 VanDerWaalsContact O-CG1 3.31Å; I81-I85 WeakPolarHBondContact O-CG1 3.49Å; I81-I85 PolarHBondContact O-N 3.47Å; I81-I305 HydrophobicContact CD1-CG2 3.87Å; I81-P306 HydrophobicContact CD1-CG 3.6Å; I81-P306 HydrophobicContact CG2-CG 4.2Å; I81-V419 HydrophobicContact CG2-CG1 3.7Å; I81-T423 HydrophobicContact CD1-CG2 3.92Å
82	V	91.8	Very high	91.5	Very high	1 Å²	1	24 Å²	24	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-64.1	-43.3	176.2	172.7	0	0	0	0	110.6	S78 I84 I85 L86 K416 V419 K420	S78-V82 WeakPolarHBondContact O-CB 3.34Å; S78-V82 VanDerWaalsContact O-CG2 3.23Å; S78-V82 WeakPolarHBondContact O-CG2 3.33Å; S78-V82 PolarHBondContact O-N 3.25Å; V82-I84 PolarHBondContact O-N 2.93Å; V82-I85 PolarHBondContact O-N 3.26Å; V82-L86 WeakPolarHBondContact O-CB 3.37Å; V82-L86 PolarHBondContact O-N 3.42Å; V82-K416 HydrophobicContact CG1-CB 4.39Å; V82-V419 HydrophobicContact CG2-CG1 4.25Å; V82-K420 HydrophobicContact CG2-CB 4.08Å
83	G	92.9	Very high	91.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.8	-44.8	175.4	0	0	0	0	0	112.8	G79 L80 L86 V87	G79-G83 PolarHBondContact O-N 3.44Å; L80-G83 PolarHBondContact O-N 3.13Å; G83-L86 WeakPolarHBondContact O-CB 3.45Å; G83-L86 PolarHBondContact O-N 3.16Å; G83-V87 WeakPolarHBondContact O-CG2 3.44Å; G83-V87 PolarHBondContact O-N 3.19Å
84	I	90.7	Very high	91.4	Very high	45 Å²	45	13.4 Å²	13.4	23%	0.231	7%	0.074	C	C	.	.	H	α-helix	trans	-62.3	-46.2	176.6	-73.5	166.2	0	0	0	111.6	L80 I81 V82 L86 P88 P308 L311 V437	L80-I84 WeakPolarHBondContact O-CB 3.35Å; L80-I84 WeakPolarHBondContact O-CD1 3.45Å; L80-I84 VanDerWaalsContact O-CG1 3.23Å; L80-I84 WeakPolarHBondContact O-CG1 3.5Å; L80-I84 PolarHBondContact O-N 3.46Å; I81-I84 PolarHBondContact O-N 3.5Å; V82-I84 PolarHBondContact O-N 2.93Å; I84-L86 VanDerWaalsContact C-N 3.28Å; I84-L86 PolarHBondContact O-N 2.77Å; I84-P88 WeakPolarHBondContact O-CD 3.43Å; I84-P308 HydrophobicContact CG2-CB 4.22Å; I84-L311 HydrophobicContact CD1-CD2 4.48Å; I84-L311 HydrophobicContact CG2-CB 3.59Å; I84-L311 HydrophobicContact CG2-CD1 4.19Å; I84-L311 HydrophobicContact CG2-CD2 3.68Å; I84-L311 HydrophobicContact CG2-CG 4.01Å; I84-V437 HydrophobicContact CG1-CG1 4.4Å
85	I	89.1	Confident	91	Very high	12 Å²	12	14.4 Å²	14.4	6%	0.062	8%	0.075	C	C	.	.	H	α-helix	trans	-64.1	-35.5	178.1	-74.8	170.9	0	0	0	111.3	I81 V82 V87 P88 Q89 E310 V419	I81-I85 HydrophobicContact CG2-CD1 3.86Å; I81-I85 WeakPolarHBondContact O-CB 3.49Å; I81-I85 VanDerWaalsContact O-CG1 3.31Å; I81-I85 WeakPolarHBondContact O-CG1 3.49Å; I81-I85 PolarHBondContact O-N 3.47Å; V82-I85 PolarHBondContact O-N 3.26Å; I85-V87 VanDerWaalsContact C-N 3.33Å; I85-V87 PolarHBondContact O-N 2.78Å; I85-P88 WeakPolarHBondContact O-CD 3.47Å; I85-Q89 VanDerWaalsContact CG2-NE2 3.3Å; I85-Q89 VanDerWaalsContact O-CG 3.29Å; I85-Q89 WeakPolarHBondContact O-CG 3.35Å; I85-E310 WeakPolarHBondContact CG2-OE2 3.45Å; I85-V419 HydrophobicContact CD1-CG1 4.06Å; I85-V419 HydrophobicContact CD1-CG2 4.14Å
86	L	90.5	Very high	90.6	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-67.4	-31.5	-175.1	-173.9	60.2	0	0	0	113.1	V82 G83 I84 A90 I128 K416 V438	V82-L86 WeakPolarHBondContact O-CB 3.37Å; V82-L86 PolarHBondContact O-N 3.42Å; G83-L86 WeakPolarHBondContact O-CB 3.45Å; G83-L86 PolarHBondContact O-N 3.16Å; I84-L86 VanDerWaalsContact C-N 3.28Å; I84-L86 PolarHBondContact O-N 2.77Å; L86-A90 VanDerWaalsContact O-CB 3.26Å; L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 3.38Å; L86-I128 HydrophobicContact CD1-CD1 3.9Å; L86-I128 HydrophobicContact CD1-CG1 3.82Å; L86-K416 HydrophobicContact CD1-CD 3.63Å; L86-V438 HydrophobicContact CD2-CG2 3.83Å; L86-V438 HydrophobicContact CG-CG2 4.36Å
87	V	90.2	Very high	90.3	Very high	6 Å²	6	12.6 Å²	12.6	4%	0.036	7%	0.065	C	C	.	.	H	α-helix	trans	-61.5	-60.4	-176.5	170.4	0	0	0	0	112.9	G83 I85 Q89 A90 I91 L105 V441 F449	G83-V87 WeakPolarHBondContact O-CG2 3.44Å; G83-V87 PolarHBondContact O-N 3.19Å; I85-V87 VanDerWaalsContact C-N 3.33Å; I85-V87 PolarHBondContact O-N 2.78Å; V87-Q89 VanDerWaalsContact C-N 3.28Å; V87-Q89 PolarHBondContact O-N 3.31Å; V87-A90 WeakPolarHBondContact O-CB 3.49Å; V87-A90 PolarHBondContact O-N 3Å; V87-A90 VanDerWaalsContact O-N 3.15Å; V87-I91 PolarHBondContact O-N 2.91Å; V87-L105 HydrophobicContact CB-CD2 4.46Å; V87-L105 HydrophobicContact CG1-CD2 4.32Å; V87-L105 HydrophobicContact CG2-CD2 4.38Å; V87-V441 HydrophobicContact CG1-CG1 3.8Å; V87-V441 HydrophobicContact CG2-CB 4.16Å; V87-V441 HydrophobicContact CG2-CG1 4.1Å; V87-V441 HydrophobicContact CG2-CG2 3.8Å; V87-F449 HydrophobicContact CG1-CE2 3.77Å; V87-F449 HydrophobicContact CG1-CZ 3.68Å
88	P	89.1	Confident	90.1	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.013	7%	0.067	C	C	.	.	H	α-helix	trans	-66.8	-32.2	179.6	27.3	-35.3	0	0	0	111.9	I84 I85 A90 I91 A92 V314 L457 I460	I84-P88 WeakPolarHBondContact O-CD 3.43Å; I85-P88 WeakPolarHBondContact O-CD 3.47Å; P88-A90 VanDerWaalsContact C-N 3.3Å; P88-A90 PolarHBondContact O-N 2.96Å; P88-I91 PolarHBondContact O-N 3.35Å; P88-A92 WeakPolarHBondContact O-CB 3.41Å; P88-A92 PolarHBondContact O-N 3.45Å; P88-V314 HydrophobicContact CB-CG2 3.6Å; P88-V314 HydrophobicContact CG-CG2 4.08Å; P88-L457 HydrophobicContact CB-CD2 4.45Å; P88-L457 WeakPolarHBondContact O-CD2 3.45Å; P88-I460 HydrophobicContact CB-CD1 3.88Å; P88-I460 HydrophobicContact CG-CD1 4.41Å
89	Q	90.1	Very high	90	Very high	4 Å²	4	11.6 Å²	11.6	2%	0.019	7%	0.069	C	C	.	.	H	α-helix	trans	-63.5	-36.2	173.8	-69.4	-179.4	-1.5	0	0	112	I85 V87 A92 Y93 E310 I460	I85-Q89 VanDerWaalsContact CG2-NE2 3.3Å; I85-Q89 VanDerWaalsContact O-CG 3.29Å; I85-Q89 WeakPolarHBondContact O-CG 3.35Å; V87-Q89 VanDerWaalsContact C-N 3.28Å; V87-Q89 PolarHBondContact O-N 3.31Å; Q89-A92 PolarHBondContact O-N 3.27Å; Q89-Y93 HydrophobicContact CB-CD2 4.49Å; Q89-Y93 HydrophobicContact CB-CE2 4.13Å; Q89-Y93 VanDerWaalsContact O-CB 3.25Å; Q89-Y93 WeakPolarHBondContact O-CB 3.44Å; Q89-Y93 WeakPolarHBondContact O-CD2 3.33Å; Q89-Y93 PolarHBondContact O-N 3.48Å; Q89-E310 PolarHBondContact NE2-OE2 3.05Å; Q89-I460 HydrophobicContact CG-CG2 3.99Å
90	A	91.3	Very high	89.7	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.9	-48	174.8	0	0	0	0	0	113.4	L86 V87 P88 A92 Y93 C94 L105 I128	L86-A90 VanDerWaalsContact O-CB 3.26Å; L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 3.38Å; V87-A90 WeakPolarHBondContact O-CB 3.49Å; V87-A90 PolarHBondContact O-N 3Å; V87-A90 VanDerWaalsContact O-N 3.15Å; P88-A90 VanDerWaalsContact C-N 3.3Å; P88-A90 PolarHBondContact O-N 2.96Å; A90-A92 VanDerWaalsContact C-N 3.34Å; A90-A92 PolarHBondContact O-N 3.26Å; A90-Y93 PolarHBondContact O-N 2.61Å; A90-C94 PolarHBondContact O-N 2.94Å; A90-C94 VanDerWaalsContact O-N 3.09Å; A90-C94 PolarHBondContact O-SG 2.91Å; A90-L105 HydrophobicContact CB-CD2 3.76Å; A90-L105 HydrophobicContact CB-CG 4.23Å; A90-I128 HydrophobicContact CB-CD1 3.38Å; A90-I128 VanDerWaalsContact N-CD1 3.28Å
91	I	89.5	Confident	89.5	Confident	1 Å²	1	10.3 Å²	10.3	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-61.2	-47.9	176.5	-61.1	171.7	0	0	0	109.2	V87 P88 Y93 C94 L95 P101 I338 F449 L457	V87-I91 PolarHBondContact O-N 2.91Å; P88-I91 PolarHBondContact O-N 3.35Å; I91-Y93 PolarHBondContact O-N 2.85Å; I91-C94 PolarHBondContact O-N 3.17Å; I91-L95 PolarHBondContact O-N 3.45Å; I91-P101 HydrophobicContact CB-CB 4.32Å; I91-P101 HydrophobicContact CG1-CB 4.32Å; I91-P101 HydrophobicContact CG2-CB 3.86Å; I91-P101 HydrophobicContact CG2-CG 4.3Å; I91-I338 HydrophobicContact CD1-CD1 4.4Å; I91-F449 HydrophobicContact CD1-CB 4.02Å; I91-F449 HydrophobicContact CD1-CD1 4.31Å; I91-F449 HydrophobicContact CD1-CD2 4.02Å; I91-F449 HydrophobicContact CD1-CG 3.85Å; I91-L457 HydrophobicContact CB-CD1 4.44Å; I91-L457 HydrophobicContact CB-CD2 4.26Å; I91-L457 HydrophobicContact CG2-CD1 3.56Å; I91-L457 HydrophobicContact CG2-CD2 4.12Å
92	A	89.1	Confident	89.5	Confident	2 Å²	2	10 Å²	10	2%	0.017	6%	0.063	C	C	.	.	H	α-helix	trans	-61	-42.4	-179.7	0	0	0	0	0	113.2	P88 Q89 A90 L95 L96 L457 I461	P88-A92 WeakPolarHBondContact O-CB 3.41Å; P88-A92 PolarHBondContact O-N 3.45Å; Q89-A92 PolarHBondContact O-N 3.27Å; A90-A92 VanDerWaalsContact C-N 3.34Å; A90-A92 PolarHBondContact O-N 3.26Å; A92-L95 PolarHBondContact O-N 2.87Å; A92-L96 PolarHBondContact O-N 3.11Å; A92-L457 HydrophobicContact CB-CB 3.71Å; A92-L457 HydrophobicContact CB-CD2 4.02Å; A92-L457 HydrophobicContact CB-CG 4.33Å; A92-I461 HydrophobicContact CB-CD1 3.59Å; A92-I461 HydrophobicContact CB-CG1 3.77Å
93	Y	91.1	Very high	89.5	Confident	11 Å²	11	11.2 Å²	11.2	4%	0.043	7%	0.068	C	C	.	.	H	α-helix	trans	-75.1	-27.9	-177.2	-68.8	-14.8	0	0	0	113.1	Q89 A90 I91 L96 A97 I128 S130 S133 I461	Q89-Y93 HydrophobicContact CB-CD2 4.49Å; Q89-Y93 HydrophobicContact CB-CE2 4.13Å; Q89-Y93 VanDerWaalsContact O-CB 3.25Å; Q89-Y93 WeakPolarHBondContact O-CB 3.44Å; Q89-Y93 WeakPolarHBondContact O-CD2 3.33Å; Q89-Y93 PolarHBondContact O-N 3.48Å; A90-Y93 PolarHBondContact O-N 2.61Å; I91-Y93 PolarHBondContact O-N 2.85Å; Y93-L96 HydrophobicContact CD1-CD1 3.99Å; Y93-L96 VanDerWaalsContact O-CB 3.31Å; Y93-L96 WeakPolarHBondContact O-CB 3.24Å; Y93-L96 PolarHBondContact O-N 2.88Å; Y93-A97 PolarHBondContact O-N 3.39Å; Y93-I128 HydrophobicContact CD2-CB 4.06Å; Y93-I128 HydrophobicContact CD2-CD1 3.77Å; Y93-I128 HydrophobicContact CD2-CG1 3.88Å; Y93-I128 HydrophobicContact CE2-CD1 4.49Å; Y93-I128 HydrophobicContact CE2-CG1 4.46Å; Y93-S130 VanDerWaalsContact CE1-CB 3.45Å; Y93-S133 WeakPolarHBondContact CB-OG 3.43Å; Y93-S133 WeakPolarHBondContact O-CB 3.41Å; Y93-I461 HydrophobicContact CD1-CD1 3.91Å; Y93-I461 HydrophobicContact CD1-CG1 4.05Å; Y93-I461 HydrophobicContact CE1-CB 4.46Å; Y93-I461 HydrophobicContact CE1-CD1 4.02Å; Y93-I461 HydrophobicContact CE1-CG1 3.68Å; Y93-I461 HydrophobicContact CE1-CG2 4.21Å
94	C	90.5	Very high	89.4	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63	-42.9	170.1	-68.5	0	0	0	0	112.2	A90 I91 L96 A97 G98 V99 P101 G104	A90-C94 PolarHBondContact O-N 2.94Å; A90-C94 VanDerWaalsContact O-N 3.09Å; A90-C94 PolarHBondContact O-SG 2.91Å; I91-C94 PolarHBondContact O-N 3.17Å; C94-L96 PolarHBondContact O-N 3.25Å; C94-A97 CarbonylContact O-C 3.46Å; C94-A97 WeakPolarHBondContact O-CA 3.42Å; C94-A97 PolarHBondContact O-N 3.16Å; C94-G98 PolarHBondContact O-N 2.97Å; C94-V99 CarbonylContact C-O 3.51Å; C94-V99 HydrophobicContact CB-CG2 3.91Å; C94-V99 WeakPolarHBondContact CB-O 3.44Å; C94-V99 PolarHBondContact O-N 2.98Å; C94-P101 PolarHBondContact SG-O 2.96Å; C94-G104 WeakPolarHBondContact SG-CA 3.29Å; C94-G104 PolarHBondContact SG-N 2.85Å
95	L	83.9	Confident	89.5	Confident	35 Å²	35	9.1 Å²	9.1	18%	0.183	6%	0.057	C	C	.	.	H	α-helix	trans	-61	-37.1	175.7	-62.3	174.5	0	0	0	111.2	I91 A92 A97 G98 P101 K454 L457	I91-L95 PolarHBondContact O-N 3.45Å; A92-L95 PolarHBondContact O-N 2.87Å; L95-A97 VanDerWaalsContact C-N 3.32Å; L95-A97 PolarHBondContact O-N 3.42Å; L95-G98 PolarHBondContact O-N 3.46Å; L95-P101 HydrophobicContact CD2-CG 4.4Å; L95-K454 HydrophobicContact CD1-CB 4.49Å; L95-K454 HydrophobicContact CD1-CD 4.42Å; L95-K454 HydrophobicContact CD1-CG 4.01Å; L95-L457 HydrophobicContact CD1-CD1 3.49Å; L95-L457 VanDerWaalsContact CD1-CD1 3.49Å
96	L	84.9	Confident	89.8	Confident	2 Å²	2	8.7 Å²	8.7	1%	0.01	6%	0.055	C	C	.	.	H	α-helix	trans	-63.5	-35.5	171.4	-95.4	175.4	0	0	0	113.8	A92 Y93 C94 G98 L134 I238 V241 R253 I461	A92-L96 PolarHBondContact O-N 3.11Å; Y93-L96 HydrophobicContact CD1-CD1 3.99Å; Y93-L96 VanDerWaalsContact O-CB 3.31Å; Y93-L96 WeakPolarHBondContact O-CB 3.24Å; Y93-L96 PolarHBondContact O-N 2.88Å; C94-L96 PolarHBondContact O-N 3.25Å; L96-G98 VanDerWaalsContact C-N 3.3Å; L96-L134 HydrophobicContact CD2-CD1 3.85Å; L96-I238 HydrophobicContact CD1-CG2 4.38Å; L96-V241 HydrophobicContact CD2-CG1 3.82Å; L96-R253 PolarHBondContact O-NH1 2.9Å; L96-I461 HydrophobicContact CD1-CD1 3.71Å; L96-I461 HydrophobicContact CG-CD1 4.26Å
97	A	89.9	Confident	90	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-82.8	-4.1	177.6	0	0	0	0	0	113.4	Y93 C94 L95 V99 S133 V136 G137	Y93-A97 PolarHBondContact O-N 3.39Å; C94-A97 CarbonylContact O-C 3.46Å; C94-A97 WeakPolarHBondContact O-CA 3.42Å; C94-A97 PolarHBondContact O-N 3.16Å; L95-A97 VanDerWaalsContact C-N 3.32Å; L95-A97 PolarHBondContact O-N 3.42Å; A97-V99 VanDerWaalsContact C-N 3.28Å; A97-V99 HydrophobicContact CB-CG2 4.04Å; A97-V99 PolarHBondContact O-N 3.22Å; A97-S133 VanDerWaalsContact CA-O 3.25Å; A97-S133 WeakPolarHBondContact CA-O 3.32Å; A97-S133 WeakPolarHBondContact CB-O 3.36Å; A97-V136 HydrophobicContact CB-CG1 4.39Å; A97-G137 VanDerWaalsContact O-CA 3.3Å; A97-G137 WeakPolarHBondContact O-CA 3.47Å
98	G	86.4	Confident	90.1	Very high	36 Å²	36	8.4 Å²	8.4	37%	0.371	5%	0.053	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	28.5	-177.6	0	0	0	0	0	113.3	C94 L95 L96	C94-G98 PolarHBondContact O-N 2.97Å; L95-G98 PolarHBondContact O-N 3.46Å; L96-G98 VanDerWaalsContact C-N 3.3Å
99	V	90.2	Very high	90.4	Very high	7 Å²	7	9.5 Å²	9.5	4%	0.042	6%	0.058	C	C	.	.	S	Bend	trans	-121.8	157.2	178.8	-59.7	0	0	0	0	111.1	C94 A97 Y103 I193 A196 F408	C94-V99 CarbonylContact C-O 3.51Å; C94-V99 HydrophobicContact CB-CG2 3.91Å; C94-V99 WeakPolarHBondContact CB-O 3.44Å; C94-V99 PolarHBondContact O-N 2.98Å; A97-V99 VanDerWaalsContact C-N 3.28Å; A97-V99 HydrophobicContact CB-CG2 4.04Å; A97-V99 PolarHBondContact O-N 3.22Å; V99-Y103 HydrophobicContact CB-CD2 4.5Å; V99-I193 HydrophobicContact CB-CD1 4.42Å; V99-I193 HydrophobicContact CG1-CD1 4.29Å; V99-A196 HydrophobicContact CG1-CB 4.08Å; V99-F408 HydrophobicContact CG2-CD1 4.27Å; V99-F408 HydrophobicContact CG2-CE1 4.18Å
100	P	88.9	Confident	90.7	Very high	25 Å²	25	11.3 Å²	11.3	16%	0.162	7%	0.065	C	C	.	.			trans	-56.4	144.7	176.7	-29.5	36.3	0	0	0	113.8	I102 Y103 D189	P100-I102 VanDerWaalsContact C-N 3.26Å; P100-I102 PolarHBondContact O-N 3.46Å; P100-I102 VanDerWaalsContact O-N 3.11Å; P100-Y103 HydrophobicContact CB-CD2 3.87Å; P100-Y103 HydrophobicContact CB-CE2 3.79Å; P100-Y103 HydrophobicContact CG-CD2 4.14Å; P100-Y103 HydrophobicContact CG-CE2 3.75Å; P100-Y103 WeakPolarHBondContact O-CD2 3.41Å; P100-Y103 PolarHBondContact O-N 3.33Å; P100-D189 HydrophobicContact CG-CB 3.75Å
101	P	87.8	Confident	90.9	Very high	14 Å²	14	11.3 Å²	11.3	9%	0.091	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-27.3	-172.5	-28.5	35.9	0	0	0	117	I91 C94 L95 Y103 G104 I338	I91-P101 HydrophobicContact CB-CB 4.32Å; I91-P101 HydrophobicContact CG1-CB 4.32Å; I91-P101 HydrophobicContact CG2-CB 3.86Å; I91-P101 HydrophobicContact CG2-CG 4.3Å; C94-P101 PolarHBondContact SG-O 2.96Å; L95-P101 HydrophobicContact CD2-CG 4.4Å; P101-Y103 VanDerWaalsContact C-N 3.28Å; P101-Y103 PolarHBondContact O-N 2.91Å; P101-G104 PolarHBondContact O-N 2.81Å; P101-I338 HydrophobicContact CB-CD1 4.23Å; P101-I338 HydrophobicContact CB-CG1 4.32Å
102	I	90.5	Very high	91.2	Very high	6 Å²	6	11.3 Å²	11.3	3%	0.031	6%	0.064	C	C	.	.	H	α-helix	trans	-62.5	-35.4	-176.7	-169.7	169	0	0	0	112.6	P100 G104 L105 Y106 I338 P339 L442	P100-I102 VanDerWaalsContact C-N 3.26Å; P100-I102 PolarHBondContact O-N 3.46Å; P100-I102 VanDerWaalsContact O-N 3.11Å; I102-G104 PolarHBondContact O-N 3.16Å; I102-L105 WeakPolarHBondContact O-CB 3.33Å; I102-L105 PolarHBondContact O-N 3.02Å; I102-Y106 HydrophobicContact CD1-CE1 4.11Å; I102-Y106 HydrophobicContact CD1-CE2 4.27Å; I102-Y106 WeakPolarHBondContact CD1-OH 3.16Å; I102-Y106 HydrophobicContact CG1-CE1 3.9Å; I102-Y106 HydrophobicContact CG1-CE2 4.09Å; I102-Y106 PolarHBondContact O-N 3.41Å; I102-I338 HydrophobicContact CB-CG2 4.24Å; I102-P339 HydrophobicContact CD1-CB 4.16Å; I102-P339 HydrophobicContact CD1-CG 3.69Å; I102-P339 VanDerWaalsContact CD1-O 3.23Å; I102-P339 WeakPolarHBondContact CD1-O 3.5Å; I102-P339 HydrophobicContact CG2-CG 4.5Å; I102-L442 HydrophobicContact CG1-CD2 4.11Å
103	Y	92.4	Very high	91.6	Very high	27 Å²	27	13.7 Å²	13.7	11%	0.106	8%	0.076	C	C	.	.	H	α-helix	trans	-66.8	-24.1	-173.6	-62.8	-58.8	0	0	0	113	V99 P100 P101 Y106 T107 I193 H406	V99-Y103 HydrophobicContact CB-CD2 4.5Å; P100-Y103 HydrophobicContact CB-CD2 3.87Å; P100-Y103 HydrophobicContact CB-CE2 3.79Å; P100-Y103 HydrophobicContact CG-CD2 4.14Å; P100-Y103 HydrophobicContact CG-CE2 3.75Å; P100-Y103 WeakPolarHBondContact O-CD2 3.41Å; P100-Y103 PolarHBondContact O-N 3.33Å; P101-Y103 VanDerWaalsContact C-N 3.28Å; P101-Y103 PolarHBondContact O-N 2.91Å; Y103-Y106 AromaticContact CD1-CD2 3.86Å; Y103-Y106 HydrophobicContact CD1-CD2 3.86Å; Y103-Y106 HydrophobicContact CD1-CE2 4.1Å; Y103-Y106 HydrophobicContact CE1-CD2 4.43Å; Y103-Y106 HydrophobicContact CE1-CE2 4.27Å; Y103-Y106 PolarHBondContact O-N 2.91Å; Y103-T107 VanDerWaalsContact O-CB 3.27Å; Y103-T107 WeakPolarHBondContact O-CB 3.44Å; Y103-T107 PolarHBondContact O-N 2.79Å; Y103-T107 PolarHBondContact O-OG1 3.22Å; Y103-I193 HydrophobicContact CD1-CD1 4.01Å; Y103-I193 HydrophobicContact CD1-CG1 3.89Å; Y103-I193 HydrophobicContact CD2-CB 4.12Å; Y103-I193 HydrophobicContact CD2-CD1 3.65Å; Y103-I193 HydrophobicContact CD2-CG1 3.71Å; Y103-I193 HydrophobicContact CE1-CG1 3.9Å; Y103-I193 HydrophobicContact CE2-CB 3.78Å; Y103-I193 HydrophobicContact CE2-CD1 4.16Å; Y103-I193 HydrophobicContact CE2-CG1 3.68Å; Y103-I193 HydrophobicContact CE2-CG2 4.01Å; Y103-I193 HydrophobicContact CG-CD1 3.55Å; Y103-I193 HydrophobicContact CG-CG1 3.81Å; Y103-H406 HydrophobicContact CD1-CB 3.51Å; Y103-H406 WeakPolarHBondContact CD1-O 3.31Å; Y103-H406 HydrophobicContact CE1-CB 3.36Å; Y103-H406 AromaticContact CE1-CG 3.99Å
104	G	92	Very high	91.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-73.2	-31.5	175.2	0	0	0	0	0	112.7	C94 P101 I102 S108	C94-G104 WeakPolarHBondContact SG-CA 3.29Å; C94-G104 PolarHBondContact SG-N 2.85Å; P101-G104 PolarHBondContact O-N 2.81Å; I102-G104 PolarHBondContact O-N 3.16Å; G104-S108 VanDerWaalsContact O-CB 3.28Å; G104-S108 WeakPolarHBondContact O-CB 3.3Å; G104-S108 PolarHBondContact O-N 2.94Å; G104-S108 PolarHBondContact O-OG 2.93Å
105	L	92.3	Very high	92.1	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-70.4	-42.9	174	-64.1	173	0	0	0	109.8	V87 A90 I102 S108 F109 V438 V441 L442	V87-L105 HydrophobicContact CB-CD2 4.46Å; V87-L105 HydrophobicContact CG1-CD2 4.32Å; V87-L105 HydrophobicContact CG2-CD2 4.38Å; A90-L105 HydrophobicContact CB-CD2 3.76Å; A90-L105 HydrophobicContact CB-CG 4.23Å; I102-L105 WeakPolarHBondContact O-CB 3.33Å; I102-L105 PolarHBondContact O-N 3.02Å; L105-S108 PolarHBondContact O-N 3.2Å; L105-F109 WeakPolarHBondContact O-CB 3.2Å; L105-F109 PolarHBondContact O-N 3.03Å; L105-V438 HydrophobicContact CB-CG1 4.2Å; L105-V438 HydrophobicContact CD2-CG1 4.31Å; L105-V438 WeakPolarHBondContact O-CG1 3.14Å; L105-V441 HydrophobicContact CD1-CG1 4.41Å; L105-L442 HydrophobicContact CB-CD1 4.13Å; L105-L442 HydrophobicContact CB-CD2 3.46Å; L105-L442 VanDerWaalsContact CB-CD2 3.46Å; L105-L442 HydrophobicContact CB-CG 3.8Å; L105-L442 HydrophobicContact CD1-CD2 3.74Å; L105-L442 HydrophobicContact CD1-CG 4.27Å; L105-L442 HydrophobicContact CG-CD2 4.25Å
106	Y	94.3	Very high	92.6	Very high	3 Å²	3	13.5 Å²	13.5	1%	0.012	8%	0.075	C	C	.	.	H	α-helix	trans	-59.1	-49.9	172.2	-62.8	-18.2	0	0	0	112	I102 Y103 S108 F109 Y110 G341 F342 T343 C407 L442	I102-Y106 HydrophobicContact CD1-CE1 4.11Å; I102-Y106 HydrophobicContact CD1-CE2 4.27Å; I102-Y106 WeakPolarHBondContact CD1-OH 3.16Å; I102-Y106 HydrophobicContact CG1-CE1 3.9Å; I102-Y106 HydrophobicContact CG1-CE2 4.09Å; I102-Y106 PolarHBondContact O-N 3.41Å; Y103-Y106 AromaticContact CD1-CD2 3.86Å; Y103-Y106 HydrophobicContact CD1-CD2 3.86Å; Y103-Y106 HydrophobicContact CD1-CE2 4.1Å; Y103-Y106 HydrophobicContact CE1-CD2 4.43Å; Y103-Y106 HydrophobicContact CE1-CE2 4.27Å; Y103-Y106 PolarHBondContact O-N 2.91Å; Y106-S108 VanDerWaalsContact C-N 3.25Å; Y106-S108 PolarHBondContact O-N 3.44Å; Y106-F109 WeakPolarHBondContact O-CB 3.29Å; Y106-F109 PolarHBondContact O-N 2.95Å; Y106-F109 VanDerWaalsContact O-N 3.12Å; Y106-Y110 VanDerWaalsContact O-CD2 3.31Å; Y106-Y110 WeakPolarHBondContact O-CD2 3.46Å; Y106-Y110 PolarHBondContact O-N 3Å; Y106-G341 WeakPolarHBondContact CE1-O 3.44Å; Y106-G341 PolarHBondContact OH-O 3.23Å; Y106-F342 HydrophobicContact CD1-CD1 4.18Å; Y106-F342 HydrophobicContact CD1-CE1 4.18Å; Y106-F342 AromaticContact CE1-CD1 3.98Å; Y106-F342 HydrophobicContact CE1-CD1 3.98Å; Y106-F342 HydrophobicContact CE1-CE1 4.32Å; Y106-F342 WeakPolarHBondContact OH-CA 3Å; Y106-T343 HydrophobicContact CE2-CG2 4.37Å; Y106-T343 WeakPolarHBondContact CE2-OG1 3.13Å; Y106-T343 PolarHBondContact OH-N 3.05Å; Y106-C407 VanDerWaalsContact C-SG 3.56Å; Y106-L442 HydrophobicContact CD1-CD1 3.79Å; Y106-L442 HydrophobicContact CD1-CD2 3.81Å; Y106-L442 HydrophobicContact CD1-CG 4.47Å; Y106-L442 HydrophobicContact CE1-CD1 4.13Å; Y106-L442 HydrophobicContact CE1-CD2 3.63Å; Y106-L442 HydrophobicContact CE1-CG 4.49Å
107	T	94.8	Very high	93.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-55.4	-44.5	179.8	-62.6	0	0	0	0	111.1	Y103 A111 I128 C407 F408 T410	Y103-T107 VanDerWaalsContact O-CB 3.27Å; Y103-T107 WeakPolarHBondContact O-CB 3.44Å; Y103-T107 PolarHBondContact O-N 2.79Å; Y103-T107 PolarHBondContact O-OG1 3.22Å; T107-A111 WeakPolarHBondContact O-CB 3.22Å; T107-A111 PolarHBondContact O-N 3.26Å; T107-A111 VanDerWaalsContact O-N 3.14Å; T107-I128 HydrophobicContact CG2-CG2 3.63Å; T107-C407 VanDerWaalsContact CA-SG 3.58Å; T107-C407 HydrophobicContact CG2-CB 4.41Å; T107-C407 PolarHBondContact N-SG 2.75Å; T107-C407 VanDerWaalsContact N-SG 3.43Å; T107-C407 WeakPolarHBondContact OG1-CA 3.38Å; T107-C407 VanDerWaalsContact OG1-CB 3.27Å; T107-C407 WeakPolarHBondContact OG1-CB 3.35Å; T107-F408 WeakPolarHBondContact CG2-O 3.13Å; T107-F408 PolarHBondContact OG1-N 2.85Å; T107-T410 HydrophobicContact CG2-CG2 3.17Å
108	S	93.6	Very high	93.4	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-69.3	-38.6	178.6	-66.2	0	0	0	0	113.5	G104 L105 Y106 N112 I128	G104-S108 VanDerWaalsContact O-CB 3.28Å; G104-S108 WeakPolarHBondContact O-CB 3.3Å; G104-S108 PolarHBondContact O-N 2.94Å; G104-S108 PolarHBondContact O-OG 2.93Å; L105-S108 PolarHBondContact O-N 3.2Å; Y106-S108 VanDerWaalsContact C-N 3.25Å; Y106-S108 PolarHBondContact O-N 3.44Å; S108-N112 WeakPolarHBondContact O-CB 3.35Å; S108-N112 PolarHBondContact O-N 3.39Å; S108-N112 PolarHBondContact O-ND2 3.47Å; S108-I128 WeakPolarHBondContact OG-CD1 3.44Å; S108-I128 WeakPolarHBondContact OG-CG1 3.47Å
109	F	95.8	Very high	93.7	Very high	26 Å²	26	15.3 Å²	15.3	11%	0.114	8%	0.076	C	C	.	.	H	α-helix	trans	-62	-55.8	177.3	170.7	-104	0	0	0	111.4	L105 Y106 I113 F342 A435 V438 L439	L105-F109 WeakPolarHBondContact O-CB 3.2Å; L105-F109 PolarHBondContact O-N 3.03Å; Y106-F109 WeakPolarHBondContact O-CB 3.29Å; Y106-F109 PolarHBondContact O-N 2.95Å; Y106-F109 VanDerWaalsContact O-N 3.12Å; F109-I113 HydrophobicContact CD1-CD1 4.38Å; F109-I113 HydrophobicContact CD2-CD1 4.19Å; F109-I113 HydrophobicContact CE1-CD1 3.88Å; F109-I113 HydrophobicContact CE2-CD1 3.66Å; F109-I113 HydrophobicContact CZ-CD1 3.5Å; F109-I113 VanDerWaalsContact CZ-CD1 3.5Å; F109-I113 PolarHBondContact O-N 2.99Å; F109-F342 AromaticContact CD1-CE1 3.95Å; F109-F342 HydrophobicContact CD1-CE1 3.95Å; F109-F342 HydrophobicContact CD1-CZ 4.01Å; F109-F342 AromaticContact CE1-CE1 3.99Å; F109-F342 HydrophobicContact CE1-CE1 3.99Å; F109-F342 AromaticContact CE1-CZ 3.79Å; F109-F342 HydrophobicContact CE1-CZ 3.79Å; F109-F342 HydrophobicContact CZ-CZ 4.18Å; F109-A435 HydrophobicContact CD2-CB 4.1Å; F109-A435 WeakPolarHBondContact CD2-O 3.14Å; F109-A435 HydrophobicContact CE2-CB 4.46Å; F109-V438 HydrophobicContact CB-CG1 4.04Å; F109-L439 HydrophobicContact CD2-CB 4.15Å; F109-L439 HydrophobicContact CE2-CB 3.93Å; F109-L439 HydrophobicContact CE2-CD1 4.19Å; F109-L439 HydrophobicContact CE2-CD2 4.3Å; F109-L439 HydrophobicContact CE2-CG 4.38Å; F109-L439 HydrophobicContact CZ-CD1 4.44Å
110	Y	96	Very high	93.8	Very high	42 Å²	42	16 Å²	16	17%	0.165	8%	0.081	C	C	.	.	H	α-helix	trans	-67.4	-41.4	-176.9	-73.2	-70.6	0	0	0	112.7	Y106 N112 I113 I114 F342 P402 F405	Y106-Y110 VanDerWaalsContact O-CD2 3.31Å; Y106-Y110 WeakPolarHBondContact O-CD2 3.46Å; Y106-Y110 PolarHBondContact O-N 3Å; Y110-N112 VanDerWaalsContact C-N 3.33Å; Y110-N112 PolarHBondContact O-N 2.72Å; Y110-I113 PolarHBondContact O-N 2.87Å; Y110-I114 WeakPolarHBondContact O-CG1 3.16Å; Y110-I114 PolarHBondContact O-N 3.3Å; Y110-F342 HydrophobicContact CE2-CE1 4.33Å; Y110-P402 HydrophobicContact CG-CB 4.45Å; Y110-F405 HydrophobicContact CD2-CB 4.14Å; Y110-F405 HydrophobicContact CE1-CD1 4.48Å; Y110-F405 HydrophobicContact CE1-CD2 4.23Å; Y110-F405 HydrophobicContact CE1-CE2 4.37Å; Y110-F405 HydrophobicContact CE1-CG 4.28Å; Y110-F405 HydrophobicContact CE2-CB 3.5Å; Y110-F405 VanDerWaalsContact CE2-CB 3.5Å; Y110-F405 HydrophobicContact CE2-CD1 4.2Å; Y110-F405 HydrophobicContact CE2-CD2 4.27Å; Y110-F405 AromaticContact CE2-CG 3.75Å; Y110-F405 HydrophobicContact CE2-CG 3.75Å; Y110-F405 AromaticContact CZ-CD1 3.73Å; Y110-F405 AromaticContact CZ-CG 3.62Å; Y110-F405 WeakPolarHBondContact OH-CD1 3.36Å
111	A	95.4	Very high	94.1	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.8	-38.5	-178.7	0	0	0	0	0	112.9	T107 I113 Y115 V126 T410	T107-A111 WeakPolarHBondContact O-CB 3.22Å; T107-A111 PolarHBondContact O-N 3.26Å; T107-A111 VanDerWaalsContact O-N 3.14Å; A111-I113 PolarHBondContact O-N 2.89Å; A111-Y115 WeakPolarHBondContact O-CB 3.48Å; A111-Y115 PolarHBondContact O-N 3.4Å; A111-V126 HydrophobicContact CB-CG1 4.36Å; A111-T410 HydrophobicContact CB-CG2 3.9Å
112	N	95.4	Very high	94.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.8	-40.6	176.2	-83.2	-36.4	0	0	0	112.2	S108 Y110 F116 V126 S431 A435	S108-N112 WeakPolarHBondContact O-CB 3.35Å; S108-N112 PolarHBondContact O-N 3.39Å; S108-N112 PolarHBondContact O-ND2 3.47Å; Y110-N112 VanDerWaalsContact C-N 3.33Å; Y110-N112 PolarHBondContact O-N 2.72Å; N112-F116 WeakPolarHBondContact O-CB 3.37Å; N112-F116 PolarHBondContact O-N 3.01Å; N112-F116 VanDerWaalsContact O-N 3.07Å; N112-V126 PolarHBondContact OD1-O 3.33Å; N112-S431 WeakPolarHBondContact CB-O 3.34Å; N112-A435 HydrophobicContact CB-CB 3.94Å
113	I	96.6	Very high	94.4	Very high	52 Å²	52	19.3 Å²	19.3	27%	0.267	9%	0.088	S	C	.	.	H	α-helix	trans	-69.7	-48.2	179.6	-64.4	170.7	0	0	0	110.7	F109 Y110 A111 Y115 F116 L117 L432 A435	F109-I113 HydrophobicContact CD1-CD1 4.38Å; F109-I113 HydrophobicContact CD2-CD1 4.19Å; F109-I113 HydrophobicContact CE1-CD1 3.88Å; F109-I113 HydrophobicContact CE2-CD1 3.66Å; F109-I113 HydrophobicContact CZ-CD1 3.5Å; F109-I113 VanDerWaalsContact CZ-CD1 3.5Å; F109-I113 PolarHBondContact O-N 2.99Å; Y110-I113 PolarHBondContact O-N 2.87Å; A111-I113 PolarHBondContact O-N 2.89Å; I113-Y115 PolarHBondContact O-N 3.2Å; I113-F116 WeakPolarHBondContact O-CB 3.39Å; I113-F116 PolarHBondContact O-N 3.49Å; I113-L117 PolarHBondContact O-N 3.4Å; I113-L432 HydrophobicContact CG1-CD1 4.46Å; I113-A435 HydrophobicContact CD1-CB 4.38Å; I113-A435 HydrophobicContact CG1-CB 3.93Å
114	I	96.5	Very high	94.5	Very high	20 Å²	20	18 Å²	18	10%	0.103	8%	0.083	C	C	.	.	H	α-helix	trans	-65	-43.3	-178.5	-63.3	163.5	0	0	0	110.2	Y110 F116 L117 M118 L397 V401 P402	Y110-I114 WeakPolarHBondContact O-CG1 3.16Å; Y110-I114 PolarHBondContact O-N 3.3Å; I114-F116 VanDerWaalsContact C-N 3.34Å; I114-F116 PolarHBondContact O-N 2.89Å; I114-L117 PolarHBondContact O-N 3.29Å; I114-L117 VanDerWaalsContact O-N 3.16Å; I114-M118 HydrophobicContact CG2-SD 4.25Å; I114-M118 WeakPolarHBondContact O-CG 3.32Å; I114-M118 PolarHBondContact O-N 3.48Å; I114-M118 VanDerWaalsContact O-N 3.08Å; I114-L397 HydrophobicContact CG2-CB 4.21Å; I114-V401 HydrophobicContact CD1-CB 3.87Å; I114-V401 HydrophobicContact CD1-CG1 4.08Å; I114-P402 HydrophobicContact CD1-CG 3.5Å
115	Y	96.1	Very high	94.5	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.2	-33.7	179	-164.7	-104.5	0	0	0	112.7	A111 I113 L117 M118 G119 S121 V124 V126 E391 A394	A111-Y115 WeakPolarHBondContact O-CB 3.48Å; A111-Y115 PolarHBondContact O-N 3.4Å; I113-Y115 PolarHBondContact O-N 3.2Å; Y115-L117 VanDerWaalsContact C-N 3.25Å; Y115-L117 PolarHBondContact O-N 3.04Å; Y115-M118 PolarHBondContact O-N 2.84Å; Y115-G119 WeakPolarHBondContact O-CA 3.27Å; Y115-G119 PolarHBondContact O-N 3.41Å; Y115-S121 WeakPolarHBondContact OH-CB 3.37Å; Y115-V124 HydrophobicContact CE1-CB 4.18Å; Y115-V124 HydrophobicContact CE1-CG1 4.11Å; Y115-V126 HydrophobicContact CD1-CB 4.21Å; Y115-V126 HydrophobicContact CD1-CG2 3.73Å; Y115-V126 HydrophobicContact CD2-CB 4.05Å; Y115-V126 HydrophobicContact CD2-CG2 3.4Å; Y115-V126 HydrophobicContact CE1-CG2 3.79Å; Y115-V126 HydrophobicContact CE2-CG2 3.48Å; Y115-V126 VanDerWaalsContact CE2-CG2 3.48Å; Y115-V126 HydrophobicContact CG-CB 3.84Å; Y115-V126 HydrophobicContact CG-CG2 3.52Å; Y115-E391 WeakPolarHBondContact CE2-OE2 3.5Å; Y115-E391 PolarHBondContact OH-OE2 3.33Å; Y115-A394 HydrophobicContact CD2-CB 4.34Å; Y115-A394 HydrophobicContact CE2-CB 4.4Å
116	F	95.7	Very high	94.6	Very high	22 Å²	22	18 Å²	18	10%	0.096	8%	0.083	C	C	.	.	H	α-helix	trans	-56.8	-39.5	171.8	163	-96.1	0	0	0	112.4	V59 W62 N112 I113 I114 Q428 V429 L432	V59-F116 HydrophobicContact CG2-CE1 3.99Å; V59-F116 HydrophobicContact CG2-CE2 4.48Å; V59-F116 HydrophobicContact CG2-CZ 3.9Å; W62-F116 HydrophobicContact CH2-CD2 4.25Å; W62-F116 AromaticContact CH2-CE2 3.65Å; W62-F116 HydrophobicContact CH2-CE2 3.65Å; W62-F116 HydrophobicContact CH2-CZ 4.43Å; W62-F116 HydrophobicContact CZ2-CD2 4.18Å; W62-F116 AromaticContact CZ2-CE2 3.88Å; W62-F116 HydrophobicContact CZ2-CE2 3.88Å; N112-F116 WeakPolarHBondContact O-CB 3.37Å; N112-F116 PolarHBondContact O-N 3.01Å; N112-F116 VanDerWaalsContact O-N 3.07Å; I113-F116 WeakPolarHBondContact O-CB 3.39Å; I113-F116 PolarHBondContact O-N 3.49Å; I114-F116 VanDerWaalsContact C-N 3.34Å; I114-F116 PolarHBondContact O-N 2.89Å; F116-Q428 HydrophobicContact CD2-CB 3.93Å; F116-Q428 WeakPolarHBondContact CD2-O 3.43Å; F116-V429 HydrophobicContact CE2-CG2 4.24Å; F116-L432 HydrophobicContact CD2-CB 4.5Å
117	L	95.4	Very high	94.5	Very high	66 Å²	66	17.9 Å²	17.9	35%	0.346	8%	0.082	S	C	.	.	H	α-helix	trans	-76.7	-38.6	-179	-63.4	173.6	0	0	0	112.8	F57 V59 I113 I114 Y115	F57-L117 HydrophobicContact CD1-CB 4.47Å; V59-L117 HydrophobicContact CG1-CD2 4.15Å; V59-L117 WeakPolarHBondContact CG1-O 3.27Å; I113-L117 PolarHBondContact O-N 3.4Å; I114-L117 PolarHBondContact O-N 3.29Å; I114-L117 VanDerWaalsContact O-N 3.16Å; Y115-L117 VanDerWaalsContact C-N 3.25Å; Y115-L117 PolarHBondContact O-N 3.04Å
118	M	94.3	Very high	94.3	Very high	10 Å²	10	17.9 Å²	17.9	5%	0.049	8%	0.082	C	C	.	.	H	α-helix	trans	-111.8	-21.5	-163.3	-57.7	-159.2	70	0	0	115.3	F56 F57 P58 I114 Y115 Q390 V393 A394 L397	F56-M118 HydrophobicContact CD1-CE 3.88Å; F56-M118 HydrophobicContact CD2-CE 4.45Å; F56-M118 HydrophobicContact CE1-CE 3.4Å; F56-M118 VanDerWaalsContact CE1-CE 3.4Å; F56-M118 HydrophobicContact CE2-CE 4.03Å; F56-M118 HydrophobicContact CG-CE 4.4Å; F56-M118 HydrophobicContact CZ-CE 3.5Å; F56-M118 VanDerWaalsContact CZ-CE 3.5Å; F57-M118 HydrophobicContact CD1-CG 4.4Å; F57-M118 HydrophobicContact CE1-CG 4.43Å; P58-M118 WeakPolarHBondContact CD-O 3.33Å; P58-M118 WeakPolarHBondContact CG-O 3.31Å; I114-M118 HydrophobicContact CG2-SD 4.25Å; I114-M118 WeakPolarHBondContact O-CG 3.32Å; I114-M118 PolarHBondContact O-N 3.48Å; I114-M118 VanDerWaalsContact O-N 3.08Å; Y115-M118 PolarHBondContact O-N 2.84Å; M118-Q390 PolarHBondContact O-NE2 3.47Å; M118-Q390 VanDerWaalsContact O-NE2 3.12Å; M118-V393 HydrophobicContact CE-CG1 3.95Å; M118-A394 HydrophobicContact CB-CB 3.75Å; M118-L397 HydrophobicContact CE-CD1 3.23Å; M118-L397 HydrophobicContact SD-CB 3.97Å; M118-L397 HydrophobicContact SD-CD1 3.28Å; M118-L397 WeakPolarHBondContact SD-CD1 3.33Å; M118-L397 HydrophobicContact SD-CG 4.25Å
119	G	93.5	Very high	94.2	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.01	9%	0.089	C	C	.	.			trans	-68.4	144.7	-177.6	0	0	0	0	0	112.7	Y115	Y115-G119 WeakPolarHBondContact O-CA 3.27Å; Y115-G119 PolarHBondContact O-N 3.41Å
120	T	93.2	Very high	93.8	Very high	22 Å²	22	18.3 Å²	18.3	14%	0.135	8%	0.084	C	C	.	.			trans	-97.3	-27.3	172.9	63.4	0	0	0	0	112.5	P58 R387 Q390 E391	P58-T120 HydrophobicContact CB-CG2 4.37Å; P58-T120 HydrophobicContact CG-CG2 3.77Å; T120-R387 HydrophobicContact CG2-CB 4.41Å; T120-R387 PolarHBondContact OG1-N 2.72Å; T120-Q390 HydrophobicContact CG2-CB 3.86Å; T120-Q390 HydrophobicContact CG2-CG 3.41Å; T120-Q390 VanDerWaalsContact CG2-CG 3.41Å; T120-E391 WeakPolarHBondContact CA-OE1 3.42Å; T120-E391 WeakPolarHBondContact CB-OE1 3.33Å; T120-E391 PolarHBondContact N-OE1 3.23Å; T120-E391 PolarHBondContact OG1-OE1 3.47Å
121	S	94.3	Very high	93.4	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.014	8%	0.077	C	C	.	.			trans	-69.2	140.8	172	-175.1	0	0	0	0	111.5	Y115 V124 S375 Y384 E391 Q428	Y115-S121 WeakPolarHBondContact OH-CB 3.37Å; S121-V124 WeakPolarHBondContact OG-CB 3.34Å; S121-V124 WeakPolarHBondContact OG-CG2 3.4Å; S121-V124 PolarHBondContact OG-N 3.49Å; S121-S375 WeakPolarHBondContact CB-OG 3.34Å; S121-Y384 PolarHBondContact OG-OH 2.9Å; S121-E391 PolarHBondContact N-OE1 2.88Å; S121-E391 VanDerWaalsContact N-OE1 3.12Å; S121-Q428 WeakPolarHBondContact O-CG 3.17Å; S121-Q428 PolarHBondContact O-NE2 3.29Å
122	R	92.4	Very high	93.3	Very high	110 Å²	110	16.3 Å²	16.3	42%	0.415	8%	0.077	S	C	.	.	S	Bend	trans	-89.4	-28.1	178.9	-63.6	-177.2	-168.7	168.9	4.2	113.7	Y384 Q426 T427 Q428	R122-Y384 PolarHBondContact N-OH 2.92Å; R122-Q426 WeakPolarHBondContact CB-O 3.22Å; R122-Q426 WeakPolarHBondContact CD-O 3.25Å; R122-T427 CarbonylContact O-C 3.47Å; R122-Q428 PolarHBondContact O-NE2 3.14Å; R122-Q428 VanDerWaalsContact O-NE2 3.17Å
123	H	93.3	Very high	93.1	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	8%	0.077	C	C	.	.	S	Bend	trans	-108.1	-25.3	-168.4	-61.4	79.6	0	0	0	112.6	S125 F378 H382 Y384 T417 K420 C425	H123-S125 PolarHBondContact O-N 3.43Å; H123-F378 HydrophobicContact CB-CB 4.28Å; H123-F378 HydrophobicContact CB-CD1 4.24Å; H123-F378 HydrophobicContact CB-CG 4.32Å; H123-H382 AromaticContact CD2-NE2 3.71Å; H123-H382 AromaticContact CE1-CD2 3.52Å; H123-H382 AromaticContact CE1-CG 3.73Å; H123-H382 AromaticContact CE1-NE2 3.82Å; H123-H382 AromaticContact ND1-CD2 3.78Å; H123-H382 AromaticContact NE2-CD2 3.68Å; H123-H382 AromaticContact NE2-CE1 3.72Å; H123-H382 AromaticContact NE2-NE2 3.47Å; H123-H382 PolarHBondContact NE2-NE2 3.47Å; H123-Y384 AromaticContact CE1-CE1 3.87Å; H123-Y384 AromaticContact ND1-CE1 3.56Å; H123-Y384 AromaticContact ND1-CZ 3.82Å; H123-Y384 PolarHBondContact ND1-OH 3.45Å; H123-T417 WeakPolarHBondContact O-CG2 3.35Å; H123-K420 WeakPolarHBondContact O-CD 3.24Å; H123-K420 WeakPolarHBondContact O-CE 3.34Å; H123-K420 WeakPolarHBondContact O-CG 3.41Å; H123-C425 PolarHBondContact CD2-O 3.24Å; H123-C425 PolarHBondContact NE2-O 3.37Å
124	V	93.6	Very high	92.7	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	6%	0.064	C	C	.	.			trans	-59.7	133.9	-178.2	168.5	0	0	0	0	110.8	Y115 S121 V126 L374 A412 T417 K420 Q428	Y115-V124 HydrophobicContact CE1-CB 4.18Å; Y115-V124 HydrophobicContact CE1-CG1 4.11Å; S121-V124 WeakPolarHBondContact OG-CB 3.34Å; S121-V124 WeakPolarHBondContact OG-CG2 3.4Å; S121-V124 PolarHBondContact OG-N 3.49Å; V124-V126 HydrophobicContact CG1-CG2 3.92Å; V124-L374 HydrophobicContact CG1-CD2 4.44Å; V124-L374 HydrophobicContact CG2-CB 4.24Å; V124-L374 HydrophobicContact CG2-CD2 4.18Å; V124-L374 HydrophobicContact CG2-CG 3.99Å; V124-A412 HydrophobicContact CG1-CB 3.56Å; V124-T417 HydrophobicContact CG2-CG2 4.25Å; V124-K420 PolarHBondContact O-NZ 3.04Å; V124-Q428 PolarHBondContact O-NE2 2.91Å; V124-Q428 PolarHBondContact O-OE1 3.19Å
125	S	92.3	Very high	92.4	Very high	1 Å²	1	13 Å²	13	1%	0.007	6%	0.059	C	C	.	.			trans	-104.7	115.2	170.8	174.7	0	0	0	0	108.6	H123 A413 T417	H123-S125 PolarHBondContact O-N 3.43Å; S125-A413 PolarHBondContact O-N 2.97Å; S125-T417 PolarHBondContact N-OG1 3.48Å
126	V	93.9	Very high	92.3	Very high	1 Å²	1	13 Å²	13	1%	0.006	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	140	176.3	177.4	0	0	0	0	109.5	A111 N112 Y115 V124 I395 A412	A111-V126 HydrophobicContact CB-CG1 4.36Å; N112-V126 PolarHBondContact OD1-O 3.33Å; Y115-V126 HydrophobicContact CD1-CB 4.21Å; Y115-V126 HydrophobicContact CD1-CG2 3.73Å; Y115-V126 HydrophobicContact CD2-CB 4.05Å; Y115-V126 HydrophobicContact CD2-CG2 3.4Å; Y115-V126 HydrophobicContact CE1-CG2 3.79Å; Y115-V126 HydrophobicContact CE2-CG2 3.48Å; Y115-V126 VanDerWaalsContact CE2-CG2 3.48Å; Y115-V126 HydrophobicContact CG-CB 3.84Å; Y115-V126 HydrophobicContact CG-CG2 3.52Å; V124-V126 HydrophobicContact CG1-CG2 3.92Å; V126-I395 HydrophobicContact CG1-CD1 3.59Å; V126-A412 HydrophobicContact CG2-CB 4.44Å
127	G	91.9	Very high	92	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.4	-146.8	171.3	0	0	0	0	0	109.6	T410 S411	G127-T410 WeakPolarHBondContact O-CA 3.42Å; G127-T410 WeakPolarHBondContact O-CB 3.4Å; G127-S411 PolarHBondContact N-O 3.44Å; G127-S411 PolarHBondContact O-N 3.29Å
128	I	91.8	Very high	91.6	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.048	C	C	.	.			trans	-57.9	145.6	170	59.6	176.9	0	0	0	111.8	L86 A90 Y93 T107 S108 F408 K416	L86-I128 HydrophobicContact CD1-CD1 3.9Å; L86-I128 HydrophobicContact CD1-CG1 3.82Å; A90-I128 HydrophobicContact CB-CD1 3.38Å; A90-I128 VanDerWaalsContact N-CD1 3.28Å; Y93-I128 HydrophobicContact CD2-CB 4.06Å; Y93-I128 HydrophobicContact CD2-CD1 3.77Å; Y93-I128 HydrophobicContact CD2-CG1 3.88Å; Y93-I128 HydrophobicContact CE2-CD1 4.49Å; Y93-I128 HydrophobicContact CE2-CG1 4.46Å; T107-I128 HydrophobicContact CG2-CG2 3.63Å; S108-I128 WeakPolarHBondContact OG-CD1 3.44Å; S108-I128 WeakPolarHBondContact OG-CG1 3.47Å; I128-F408 HydrophobicContact CG2-CE2 4.15Å; I128-F408 HydrophobicContact CG2-CZ 3.82Å; I128-K416 PolarHBondContact O-NZ 2.93Å
129	F	90.3	Very high	91.5	Very high	32 Å²	32	10.5 Å²	10.5	14%	0.14	5%	0.046	C	C	.	.			trans	-143.7	139.2	176.6	178.6	-136.5	0	0	0	109.4	L131 M132 S133 F370 A413	F129-L131 VanDerWaalsContact C-N 3.26Å; F129-L131 HydrophobicContact CD1-CB 3.7Å; F129-L131 HydrophobicContact CE1-CB 3.32Å; F129-L131 HydrophobicContact CE1-CD2 4.03Å; F129-L131 HydrophobicContact CE1-CG 4.31Å; F129-L131 HydrophobicContact CZ-CB 3.84Å; F129-L131 PolarHBondContact O-N 3.38Å; F129-M132 HydrophobicContact CB-CG 4.29Å; F129-M132 HydrophobicContact CD1-CG 4.13Å; F129-M132 PolarHBondContact O-N 3.19Å; F129-S133 PolarHBondContact O-N 3Å; F129-S133 PolarHBondContact O-OG 3.03Å; F129-F370 HydrophobicContact CE1-CD1 4.36Å; F129-F370 HydrophobicContact CE1-CE1 4.42Å; F129-F370 HydrophobicContact CZ-CE1 4.39Å; F129-A413 HydrophobicContact CD2-CB 4.27Å
130	S	88.4	Confident	91.4	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.014	5%	0.047	C	C	.	.	H	α-helix	trans	-54.5	-41.8	-175.7	51.6	0	0	0	0	112.8	Y93 S133 L134 I238	Y93-S130 VanDerWaalsContact CE1-CB 3.45Å; S130-S133 PolarHBondContact O-N 3.39Å; S130-L134 WeakPolarHBondContact O-CB 3.38Å; S130-L134 PolarHBondContact O-N 3.2Å; S130-I238 WeakPolarHBondContact OG-CD1 3.41Å
131	L	87.3	Confident	91.1	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-67.9	-46.4	-179.2	-170.7	60.3	0	0	0	112.6	F129 S133 L134 M135 F230 A234 I366 F370 V501	F129-L131 VanDerWaalsContact C-N 3.26Å; F129-L131 HydrophobicContact CD1-CB 3.7Å; F129-L131 HydrophobicContact CE1-CB 3.32Å; F129-L131 HydrophobicContact CE1-CD2 4.03Å; F129-L131 HydrophobicContact CE1-CG 4.31Å; F129-L131 HydrophobicContact CZ-CB 3.84Å; F129-L131 PolarHBondContact O-N 3.38Å; L131-S133 PolarHBondContact O-N 2.88Å; L131-L134 WeakPolarHBondContact O-CB 3.43Å; L131-L134 PolarHBondContact O-N 3.22Å; L131-M135 HydrophobicContact CG-SD 4.44Å; L131-M135 WeakPolarHBondContact O-CG 3.13Å; L131-M135 PolarHBondContact O-N 2.91Å; L131-F230 HydrophobicContact CD2-CE1 3.51Å; L131-F230 HydrophobicContact CD2-CZ 3.72Å; L131-A234 HydrophobicContact CD1-CB 3.67Å; L131-A234 HydrophobicContact CD2-CB 4.23Å; L131-I366 HydrophobicContact CD2-CG2 4.01Å; L131-F370 HydrophobicContact CD2-CE2 4.03Å; L131-F370 HydrophobicContact CD2-CZ 4.28Å; L131-V501 HydrophobicContact CD1-CB 4.29Å; L131-V501 HydrophobicContact CD1-CG1 3.43Å; L131-V501 VanDerWaalsContact CD1-CG1 3.43Å; L131-V501 HydrophobicContact CD1-CG2 3.94Å; L131-V501 HydrophobicContact CD2-CG1 4.14Å; L131-V501 HydrophobicContact CG-CG1 4.09Å
132	M	92.1	Very high	90.8	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61.5	-39	177.3	-62.9	-42.5	-61.4	0	0	110.7	F129 M135 V136 L363 I366 T409	F129-M132 HydrophobicContact CB-CG 4.29Å; F129-M132 HydrophobicContact CD1-CG 4.13Å; F129-M132 PolarHBondContact O-N 3.19Å; M132-M135 PolarHBondContact O-N 3.16Å; M132-V136 WeakPolarHBondContact O-CB 3.36Å; M132-V136 VanDerWaalsContact O-CG2 3.28Å; M132-V136 WeakPolarHBondContact O-CG2 3.15Å; M132-V136 PolarHBondContact O-N 3.05Å; M132-L363 HydrophobicContact CE-CB 3.81Å; M132-L363 HydrophobicContact CE-CD2 4Å; M132-L363 HydrophobicContact CE-CG 3.79Å; M132-L363 WeakPolarHBondContact CE-O 3.39Å; M132-I366 HydrophobicContact SD-CG2 3.97Å; M132-T409 HydrophobicContact CE-CG2 3.43Å; M132-T409 VanDerWaalsContact CE-CG2 3.43Å
133	S	92.6	Very high	90.6	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-66.5	-39.9	178.2	-47.6	0	0	0	0	111.5	Y93 A97 F129 S130 L131 G137	Y93-S133 WeakPolarHBondContact CB-OG 3.43Å; Y93-S133 WeakPolarHBondContact O-CB 3.41Å; A97-S133 VanDerWaalsContact CA-O 3.25Å; A97-S133 WeakPolarHBondContact CA-O 3.32Å; A97-S133 WeakPolarHBondContact CB-O 3.36Å; F129-S133 PolarHBondContact O-N 3Å; F129-S133 PolarHBondContact O-OG 3.03Å; S130-S133 PolarHBondContact O-N 3.39Å; L131-S133 PolarHBondContact O-N 2.88Å; S133-G137 PolarHBondContact O-N 3.32Å
134	L	87.9	Confident	90.2	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.005	4%	0.043	C	C	.	.	H	α-helix	trans	-60.2	-45.9	174.5	-171	81.1	0	0	0	111.6	L96 S130 L131 G137 Q138 T237 I238 V241 R253 V501	L96-L134 HydrophobicContact CD2-CD1 3.85Å; S130-L134 WeakPolarHBondContact O-CB 3.38Å; S130-L134 PolarHBondContact O-N 3.2Å; L131-L134 WeakPolarHBondContact O-CB 3.43Å; L131-L134 PolarHBondContact O-N 3.22Å; L134-G137 PolarHBondContact O-N 3.48Å; L134-Q138 PolarHBondContact O-N 2.93Å; L134-Q138 VanDerWaalsContact O-N 3.09Å; L134-T237 HydrophobicContact CD2-CG2 3.99Å; L134-I238 HydrophobicContact CD2-CG1 4.16Å; L134-V241 HydrophobicContact CD1-CB 4.29Å; L134-V241 HydrophobicContact CD1-CG1 4.13Å; L134-V241 HydrophobicContact CD1-CG2 4.11Å; L134-R253 PolarHBondContact O-NH2 3.35Å; L134-R253 VanDerWaalsContact O-NH2 3.14Å; L134-V501 HydrophobicContact CD2-CG2 4.27Å
135	M	89.9	Confident	89.8	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.5	-47.2	-179.4	-68.1	177.9	62.8	0	0	112.1	L131 M132 G137 Q138 V139 P362 L363 I366 V501 E502	L131-M135 HydrophobicContact CG-SD 4.44Å; L131-M135 WeakPolarHBondContact O-CG 3.13Å; L131-M135 PolarHBondContact O-N 2.91Å; M132-M135 PolarHBondContact O-N 3.16Å; M135-G137 PolarHBondContact O-N 3.46Å; M135-Q138 WeakPolarHBondContact O-CB 3.44Å; M135-Q138 PolarHBondContact O-N 3.33Å; M135-Q138 VanDerWaalsContact O-N 3.1Å; M135-V139 PolarHBondContact O-N 3.16Å; M135-P362 HydrophobicContact CE-CB 3.89Å; M135-L363 HydrophobicContact CB-CD1 4.27Å; M135-L363 HydrophobicContact CB-CG 4.32Å; M135-L363 HydrophobicContact CE-CD1 3.73Å; M135-L363 HydrophobicContact CE-CG 3.88Å; M135-I366 HydrophobicContact CE-CD1 3.72Å; M135-I366 HydrophobicContact SD-CD1 3.66Å; M135-I366 HydrophobicContact SD-CG2 4.45Å; M135-V501 HydrophobicContact SD-CG1 4.37Å; M135-E502 HydrophobicContact CE-CG 3.59Å; M135-E502 WeakPolarHBondContact CE-OE1 3.25Å
136	V	93.7	Very high	89.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-56.2	-44	172.4	171.3	0	0	0	0	109.8	A97 M132 Q138 V139 V140 A196 L363 F408	A97-V136 HydrophobicContact CB-CG1 4.39Å; M132-V136 WeakPolarHBondContact O-CB 3.36Å; M132-V136 VanDerWaalsContact O-CG2 3.28Å; M132-V136 WeakPolarHBondContact O-CG2 3.15Å; M132-V136 PolarHBondContact O-N 3.05Å; V136-Q138 VanDerWaalsContact C-N 3.29Å; V136-Q138 PolarHBondContact O-N 2.94Å; V136-V139 PolarHBondContact O-N 2.93Å; V136-V139 VanDerWaalsContact O-N 3.15Å; V136-V140 HydrophobicContact CG1-CG2 3.88Å; V136-V140 VanDerWaalsContact O-CG2 3.3Å; V136-V140 WeakPolarHBondContact O-CG2 3.38Å; V136-V140 PolarHBondContact O-N 3.26Å; V136-A196 HydrophobicContact CG1-CB 3.76Å; V136-L363 HydrophobicContact CG2-CD2 3.53Å; V136-F408 HydrophobicContact CG1-CB 4.32Å
137	G	90.3	Very high	88.7	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.3	-30.8	178	0	0	0	0	0	114.4	A97 S133 L134 M135 V141	A97-G137 VanDerWaalsContact O-CA 3.3Å; A97-G137 WeakPolarHBondContact O-CA 3.47Å; S133-G137 PolarHBondContact O-N 3.32Å; L134-G137 PolarHBondContact O-N 3.48Å; M135-G137 PolarHBondContact O-N 3.46Å; G137-V141 VanDerWaalsContact O-CB 3.28Å; G137-V141 WeakPolarHBondContact O-CB 3.37Å; G137-V141 WeakPolarHBondContact O-CG2 3.38Å; G137-V141 PolarHBondContact O-N 3.24Å
138	Q	87.4	Confident	87.9	Confident	43 Å²	43	22.6 Å²	22.6	20%	0.201	12%	0.12	C	C	.	.	H	α-helix	trans	-66.3	-43.6	173.8	-73.6	177.3	-45.4	0	0	111.3	L134 M135 V136 R142	L134-Q138 PolarHBondContact O-N 2.93Å; L134-Q138 VanDerWaalsContact O-N 3.09Å; M135-Q138 WeakPolarHBondContact O-CB 3.44Å; M135-Q138 PolarHBondContact O-N 3.33Å; M135-Q138 VanDerWaalsContact O-N 3.1Å; V136-Q138 VanDerWaalsContact C-N 3.29Å; V136-Q138 PolarHBondContact O-N 2.94Å; Q138-R142 WeakPolarHBondContact O-CB 3.41Å; Q138-R142 PolarHBondContact O-N 3.49Å; Q138-R142 VanDerWaalsContact O-N 3.15Å
139	V	91.1	Very high	87.3	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-66.3	-48.3	176.5	-176	0	0	0	0	110.7	M135 V136 V141 R142 E143 V195 V356 D359	M135-V139 PolarHBondContact O-N 3.16Å; V136-V139 PolarHBondContact O-N 2.93Å; V136-V139 VanDerWaalsContact O-N 3.15Å; V139-V141 PolarHBondContact O-N 3.07Å; V139-R142 PolarHBondContact O-N 3.23Å; V139-E143 HydrophobicContact CG1-CG 4.31Å; V139-E143 WeakPolarHBondContact O-CG 3.47Å; V139-E143 PolarHBondContact O-N 2.96Å; V139-V195 HydrophobicContact CG1-CG1 4.24Å; V139-V356 HydrophobicContact CG1-CB 4.26Å; V139-V356 HydrophobicContact CG1-CG1 3.67Å; V139-D359 HydrophobicContact CG1-CB 4.4Å; V139-D359 HydrophobicContact CG2-CB 3.59Å
140	V	91.6	Very high	86.3	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-59.1	-50.2	-179.8	170.2	0	0	0	0	111	V136 R142 E143 V144 A192 V195 A196	V136-V140 HydrophobicContact CG1-CG2 3.88Å; V136-V140 VanDerWaalsContact O-CG2 3.3Å; V136-V140 WeakPolarHBondContact O-CG2 3.38Å; V136-V140 PolarHBondContact O-N 3.26Å; V140-R142 VanDerWaalsContact C-N 3.28Å; V140-R142 PolarHBondContact O-N 2.81Å; V140-E143 PolarHBondContact O-N 3.15Å; V140-V144 HydrophobicContact CG1-CG2 4.06Å; V140-V144 VanDerWaalsContact O-CB 3.26Å; V140-V144 WeakPolarHBondContact O-CB 3.45Å; V140-V144 WeakPolarHBondContact O-CG2 3.33Å; V140-V144 PolarHBondContact O-N 3.24Å; V140-A192 HydrophobicContact CG1-CB 3.69Å; V140-V195 HydrophobicContact CG2-CB 4.44Å; V140-V195 HydrophobicContact CG2-CG1 4.17Å; V140-A196 HydrophobicContact CG2-CB 3.81Å
141	V	86.6	Confident	85.2	Confident	27 Å²	27	30.6 Å²	30.6	16%	0.164	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-36.2	-179.1	177.6	0	0	0	0	110.9	G137 V139 F145 L151 Q255	G137-V141 VanDerWaalsContact O-CB 3.28Å; G137-V141 WeakPolarHBondContact O-CB 3.37Å; G137-V141 WeakPolarHBondContact O-CG2 3.38Å; G137-V141 PolarHBondContact O-N 3.24Å; V139-V141 PolarHBondContact O-N 3.07Å; V141-F145 VanDerWaalsContact O-CB 3.3Å; V141-F145 WeakPolarHBondContact O-CB 3.26Å; V141-F145 PolarHBondContact O-N 3.27Å; V141-L151 HydrophobicContact CG1-CD1 4.38Å; V141-L151 HydrophobicContact CG1-CD2 3.81Å; V141-Q255 VanDerWaalsContact C-NE2 3.32Å
142	R	87.4	Confident	83.9	Confident	70 Å²	70	33 Å²	33	26%	0.264	18%	0.179	S	C	.	.	H	α-helix	trans	-64.2	-53.7	175.8	-172.5	-172.2	72.9	-154.1	-1.5	111.3	Q138 V139 V140 V144 F145 D146 Q255 D359	Q138-R142 WeakPolarHBondContact O-CB 3.41Å; Q138-R142 PolarHBondContact O-N 3.49Å; Q138-R142 VanDerWaalsContact O-N 3.15Å; V139-R142 PolarHBondContact O-N 3.23Å; V140-R142 VanDerWaalsContact C-N 3.28Å; V140-R142 PolarHBondContact O-N 2.81Å; R142-V144 VanDerWaalsContact C-N 3.32Å; R142-V144 PolarHBondContact O-N 3.37Å; R142-F145 WeakPolarHBondContact O-CB 3.28Å; R142-F145 PolarHBondContact O-N 2.67Å; R142-F145 VanDerWaalsContact O-N 3.15Å; R142-D146 VanDerWaalsContact O-CG 3.29Å; R142-D146 PolarHBondContact O-N 3.01Å; R142-Q255 VanDerWaalsContact N-NE2 3.11Å; R142-D359 IonicContact CZ-OD1 2.8Å; R142-D359 IonicContact CZ-OD2 3.46Å; R142-D359 IonicContact NH1-OD1 3.64Å; R142-D359 PolarHBondContact NH1-OD1 3.25Å; R142-D359 IonicContact NH1-OD2 3.19Å; R142-D359 PolarHBondContact NH1-OD2 2.61Å; R142-D359 IonicContact NH2-OD1 2.59Å; R142-D359 IonicContact NH2-OD2 3.71Å; R142-D359 PolarHBondContact NH2-OD2 2.89Å
143	E	88.6	Confident	82	Confident	7 Å²	7	37.6 Å²	37.6	3%	0.033	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-33.6	-177.7	-64	-63.3	140.1	0	0	112.6	V139 V140 A147 V195 V356	V139-E143 HydrophobicContact CG1-CG 4.31Å; V139-E143 WeakPolarHBondContact O-CG 3.47Å; V139-E143 PolarHBondContact O-N 2.96Å; V140-E143 PolarHBondContact O-N 3.15Å; E143-A147 WeakPolarHBondContact O-CB 3.49Å; E143-A147 PolarHBondContact O-N 2.73Å; E143-V195 HydrophobicContact CB-CG1 3.96Å; E143-V195 HydrophobicContact CB-CG2 3.93Å; E143-V195 HydrophobicContact CG-CG1 3.84Å; E143-V195 HydrophobicContact CG-CG2 4.49Å; E143-V356 HydrophobicContact CG-CG1 4.01Å
144	V	86.4	Confident	79.7	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.036	22%	0.219	C	C	.	.	H	α-helix	trans	-66.8	-39.1	174.1	170.4	0	0	0	0	110.7	V140 R142 A147 G148 F149 K188 Y191 A192	V140-V144 HydrophobicContact CG1-CG2 4.06Å; V140-V144 VanDerWaalsContact O-CB 3.26Å; V140-V144 WeakPolarHBondContact O-CB 3.45Å; V140-V144 WeakPolarHBondContact O-CG2 3.33Å; V140-V144 PolarHBondContact O-N 3.24Å; R142-V144 VanDerWaalsContact C-N 3.32Å; R142-V144 PolarHBondContact O-N 3.37Å; V144-A147 PolarHBondContact O-N 2.87Å; V144-G148 PolarHBondContact O-N 2.84Å; V144-F149 HydrophobicContact CG1-CB 3.7Å; V144-F149 HydrophobicContact CG1-CD2 4.14Å; V144-F149 HydrophobicContact CG1-CG 4.3Å; V144-F149 PolarHBondContact O-N 2.97Å; V144-K188 HydrophobicContact CG1-CG 4.21Å; V144-Y191 HydrophobicContact CG2-CD1 4.03Å; V144-Y191 HydrophobicContact CG2-CE1 4.48Å; V144-A192 HydrophobicContact CG2-CB 4.02Å
145	F	83.8	Confident	77.1	Confident	125 Å²	125	45 Å²	45	55%	0.548	25%	0.246	S	C	.	.	H	α-helix	trans	-66.3	-45.3	174.1	179.5	-101.9	0	0	0	111.9	V141 R142 A147 G148 L151	V141-F145 VanDerWaalsContact O-CB 3.3Å; V141-F145 WeakPolarHBondContact O-CB 3.26Å; V141-F145 PolarHBondContact O-N 3.27Å; R142-F145 WeakPolarHBondContact O-CB 3.28Å; R142-F145 PolarHBondContact O-N 2.67Å; R142-F145 VanDerWaalsContact O-N 3.15Å; F145-A147 PolarHBondContact O-N 2.87Å; F145-G148 WeakPolarHBondContact O-CA 3.28Å; F145-G148 PolarHBondContact O-N 2.99Å; F145-L151 HydrophobicContact CB-CD1 4.23Å; F145-L151 HydrophobicContact CB-CD2 4.09Å; F145-L151 HydrophobicContact CB-CG 4.39Å; F145-L151 HydrophobicContact CD2-CD1 3.59Å; F145-L151 HydrophobicContact CD2-CG 3.94Å; F145-L151 HydrophobicContact CE2-CD1 4.34Å; F145-L151 HydrophobicContact CG-CD1 4.22Å
146	D	82.1	Confident	74.3	Confident	102 Å²	102	50.8 Å²	50.8	55%	0.545	28%	0.282	S	S	.	.	H	α-helix	trans	-66	-26.6	179	-67.2	-21.3	0	0	0	112.2	R142 G148	R142-D146 VanDerWaalsContact O-CG 3.29Å; R142-D146 PolarHBondContact O-N 3.01Å; D146-G148 PolarHBondContact O-N 2.91Å
147	A	81.3	Confident	71.1	Confident	15 Å²	15	56.5 Å²	56.5	12%	0.124	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-8.5	169.9	0	0	0	0	0	113.5	E143 V144 F145 F149 V179 Y191	E143-A147 WeakPolarHBondContact O-CB 3.49Å; E143-A147 PolarHBondContact O-N 2.73Å; V144-A147 PolarHBondContact O-N 2.87Å; F145-A147 PolarHBondContact O-N 2.87Å; A147-F149 HydrophobicContact CB-CD2 3.72Å; A147-F149 HydrophobicContact CB-CE2 3.86Å; A147-V179 HydrophobicContact CB-CG2 3.86Å; A147-V179 WeakPolarHBondContact O-CG2 3.01Å; A147-Y191 HydrophobicContact CB-CD1 4.25Å; A147-Y191 HydrophobicContact CB-CE1 3.64Å
148	G	75.5	Confident	68	Low	39 Å²	39	59 Å²	59	40%	0.402	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	12.1	176.9	0	0	0	0	0	115.3	V144 F145 D146	V144-G148 PolarHBondContact O-N 2.84Å; F145-G148 WeakPolarHBondContact O-CA 3.28Å; F145-G148 PolarHBondContact O-N 2.99Å; D146-G148 PolarHBondContact O-N 2.91Å
149	F	78.5	Confident	65.3	Low	27 Å²	27	63.2 Å²	63.2	12%	0.118	37%	0.368	C	S	.	.			trans	-75.9	143.5	173.2	-66.3	-73.3	0	0	0	111.3	V144 A147 L151 L177 V179 K188 Y191	V144-F149 HydrophobicContact CG1-CB 3.7Å; V144-F149 HydrophobicContact CG1-CD2 4.14Å; V144-F149 HydrophobicContact CG1-CG 4.3Å; V144-F149 PolarHBondContact O-N 2.97Å; A147-F149 HydrophobicContact CB-CD2 3.72Å; A147-F149 HydrophobicContact CB-CE2 3.86Å; F149-L151 PolarHBondContact O-N 2.97Å; F149-L177 WeakPolarHBondContact CE1-O 3.47Å; F149-V179 HydrophobicContact CE2-CB 4.37Å; F149-V179 HydrophobicContact CE2-CG2 4.01Å; F149-V179 HydrophobicContact CZ-CB 4.34Å; F149-V179 HydrophobicContact CZ-CG2 4.19Å; F149-K188 HydrophobicContact CB-CG 4.42Å; F149-K188 HydrophobicContact CD1-CB 4.03Å; F149-K188 HydrophobicContact CE1-CB 4.37Å; F149-K188 HydrophobicContact CG-CB 4.31Å; F149-K188 HydrophobicContact CG-CG 4.47Å; F149-Y191 HydrophobicContact CD2-CD1 4.34Å; F149-Y191 AromaticContact CE2-CD1 3.94Å; F149-Y191 HydrophobicContact CE2-CD1 3.94Å; F149-Y191 HydrophobicContact CE2-CG 4.07Å
150	D	69	Low	62.3	Low	113 Å²	113	70.6 Å²	70.6	60%	0.604	40%	0.401	S	S	*	.			trans	-65.9	135.2	173.1	-172.2	9.2	0	0	0	110.9	S152 K188	D150-S152 VanDerWaalsContact C-N 3.28Å; D150-S152 PolarHBondContact O-N 3.06Å; D150-S152 PolarHBondContact OD1-N 3.05Å; D150-S152 PolarHBondContact OD2-OG 3.34Å; D150-K188 WeakPolarHBondContact O-CE 3.34Å; D150-K188 PolarHBondContact O-NZ 2.96Å
151	L	65.9	Low	59.5	Low	62 Å²	62	77.3 Å²	77.3	33%	0.325	43%	0.433	S	S	.	.			trans	-81.4	-5.2	-178.4	-67.9	-178.4	0	0	0	113.3	V141 F145 F149 E153	V141-L151 HydrophobicContact CG1-CD1 4.38Å; V141-L151 HydrophobicContact CG1-CD2 3.81Å; F145-L151 HydrophobicContact CB-CD1 4.23Å; F145-L151 HydrophobicContact CB-CD2 4.09Å; F145-L151 HydrophobicContact CB-CG 4.39Å; F145-L151 HydrophobicContact CD2-CD1 3.59Å; F145-L151 HydrophobicContact CD2-CG 3.94Å; F145-L151 HydrophobicContact CE2-CD1 4.34Å; F145-L151 HydrophobicContact CG-CD1 4.22Å; F149-L151 PolarHBondContact O-N 2.97Å; L151-E153 PolarHBondContact O-N 3.19Å
152	S	59.7	Low	57	Low	50 Å²	50	83.5 Å²	83.5	35%	0.35	46%	0.464	S	S	.	.			trans	-58.6	125.3	174.4	60.8	0	0	0	0	110.8	D150 D154 K188	D150-S152 VanDerWaalsContact C-N 3.28Å; D150-S152 PolarHBondContact O-N 3.06Å; D150-S152 PolarHBondContact OD1-N 3.05Å; D150-S152 PolarHBondContact OD2-OG 3.34Å; S152-D154 PolarHBondContact O-N 2.86Å; S152-K188 PolarHBondContact O-NZ 3.38Å
153	E	53.8	Low	54.3	Low	98 Å²	98	88.6 Å²	88.6	46%	0.458	49%	0.489	S	S	.	.	S	Bend	trans	-72.3	-7.2	-175.1	-76.2	-179.8	-153.6	0	0	113.3	L151 K244 Y245	L151-E153 PolarHBondContact O-N 3.19Å; E153-K244 IonicContact OE1-NZ 2.67Å; E153-K244 PolarHBondContact OE1-NZ 3.48Å; E153-Y245 VanDerWaalsContact CD-OH 3.3Å; E153-Y245 PolarHBondContact OE1-OH 3.16Å; E153-Y245 PolarHBondContact OE2-OH 3.46Å
154	D	44.3	Very low	51.3	Low	73 Å²	73	95.1 Å²	95.1	39%	0.39	52%	0.523	S	S	.	.			trans	-129.2	81.6	-176.2	-63.3	-27.7	0	0	0	110.9	S152 K250 K454	S152-D154 PolarHBondContact O-N 2.86Å; D154-K250 VanDerWaalsContact OD2-CE 3.23Å; D154-K250 WeakPolarHBondContact OD2-CE 3.33Å; D154-K250 IonicContact OD2-NZ 2.8Å; D154-K250 PolarHBondContact OD2-NZ 3.05Å; D154-K454 IonicContact OD1-NZ 3.28Å
155	S	32.6	Very low	48.8	Very low	82 Å²	82	104 Å²	104	57%	0.573	57%	0.565	S	S	*	*			trans	-103.2	93	156.2	9.9	0	0	0	0	107
156	T	30	Very low	46.6	Very low	122 Å²	122	103.6 Å²	103.6	75%	0.748	57%	0.572	S	S	*	*			trans	-71.1	128	159.6	45.5	0	0	0	0	107.6	S158	T156-S158 PolarHBondContact O-N 3.43Å; T156-S158 VanDerWaalsContact O-N 3.09Å
157	P	27.9	Very low	44.7	Very low	121 Å²	121	106.6 Å²	106.6	79%	0.786	59%	0.588	S	S	*	*			trans	-65.1	114	163.4	26.2	-27.1	0	0	0	106.4
158	S	24.8	Very low	42.1	Very low	53 Å²	53	113.6 Å²	113.6	37%	0.371	62%	0.623	S	S	.	*			trans	-70.3	137	175	77.5	0	0	0	0	108.2	T156 H160	T156-S158 PolarHBondContact O-N 3.43Å; T156-S158 VanDerWaalsContact O-N 3.09Å; S158-H160 PolarHBondContact O-N 3.15Å
159	P	31.2	Very low	40.4	Very low	131 Å²	131	120 Å²	120	85%	0.851	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-0.5	177.1	-18.4	30.5	0	0	0	114
160	H	28.5	Very low	38	Very low	157 Å²	157	125.4 Å²	125.4	73%	0.727	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-0.6	-172.7	-137.2	-68.4	0	0	0	113.8	S158	S158-H160 PolarHBondContact O-N 3.15Å
161	E	31.8	Very low	36.5	Very low	144 Å²	144	130.1 Å²	130.1	67%	0.673	69%	0.693	S	S	*	*	S	Bend	trans	-98	2.3	178.5	-74.2	179.4	160.8	0	0	114
162	L	34.8	Very low	34.8	Very low	156 Å²	156	134.1 Å²	134.1	82%	0.817	72%	0.72	S	S	*	*	S	Bend	trans	-86.5	-2.7	175.2	-153.2	78.4	0	0	0	113.6
163	F	29.1	Very low	33.4	Very low	178 Å²	178	135 Å²	135	78%	0.781	74%	0.737	S	S	*	*	S	Bend	trans	-119.3	-1.4	-170.9	-103.6	-85.2	0	0	0	116.5
164	N	27	Very low	32.3	Very low	143 Å²	143	139.9 Å²	139.9	77%	0.765	76%	0.756	S	S	*	*			trans	-115.2	41.4	177.2	-84	6.2	0	0	0	112.9	T166	N164-T166 VanDerWaalsContact C-N 3.3Å; N164-T166 PolarHBondContact O-N 2.91Å
165	E	34.2	Very low	31.8	Very low	194 Å²	194	141.1 Å²	141.1	91%	0.907	77%	0.768	S	S	*	*			trans	-92	66.6	158.1	-88.4	-160.7	154.4	0	0	110.2
166	T	36.5	Very low	32	Very low	115 Å²	115	145.1 Å²	145.1	71%	0.706	78%	0.778	S	S	*	*	S	Bend	trans	-141.8	110	157.3	44.1	0	0	0	0	108.9	N164	N164-T166 VanDerWaalsContact C-N 3.3Å; N164-T166 PolarHBondContact O-N 2.91Å
167	L	42.4	Very low	32.4	Very low	166 Å²	166	143.5 Å²	143.5	87%	0.869	77%	0.765	S	S	*	*			trans	48.1	91.6	155.6	-71.1	159.6	0	0	0	116.1
168	D	27.6	Very low	32.9	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	75%	0.749	S	S	*	*			trans	-154.3	111.7	140.2	-98.4	-29.3	0	0	0	111.9	N170	D168-N170 PolarHBondContact O-N 2.99Å; D168-N170 VanDerWaalsContact O-N 3.08Å
169	L	39	Very low	33.7	Very low	172 Å²	172	140.5 Å²	140.5	90%	0.901	74%	0.742	S	S	*	*			trans	-69	90.8	164.8	-84.3	154.8	0	0	0	108.4
170	N	27.4	Very low	34.1	Very low	142 Å²	142	142 Å²	142	76%	0.759	74%	0.737	S	S	*	*			trans	-141	108.2	160.6	-100.6	-27.4	0	0	0	111.5	D168 T172	D168-N170 PolarHBondContact O-N 2.99Å; D168-N170 VanDerWaalsContact O-N 3.08Å; N170-T172 PolarHBondContact O-N 3.03Å
171	F	37.6	Very low	34.7	Very low	211 Å²	211	137 Å²	137	93%	0.925	72%	0.715	S	S	*	*			trans	-73	85.2	178.6	-128	-91.3	0	0	0	109.1
172	T	30.9	Very low	34.9	Very low	146 Å²	146	139.6 Å²	139.6	90%	0.896	73%	0.73	S	S	*	*			trans	-172	29.5	161.1	24.6	0	0	0	0	114.2	N170	N170-T172 PolarHBondContact O-N 3.03Å
173	G	29.9	Very low	35	Very low	68 Å²	68	135.2 Å²	135.2	70%	0.701	72%	0.722	S	S	*	*	S	Bend	trans	-102	130.9	165.6	0	0	0	0	0	110.1
174	K	30.8	Very low	35.4	Very low	201 Å²	201	133.8 Å²	133.8	87%	0.874	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-51.3	128.1	177.9	-68.4	173.2	177.9	174.7	0	109.9	E176	K174-E176 PolarHBondContact O-N 3.04Å
175	P	34.3	Very low	36.1	Very low	99 Å²	99	134.3 Å²	134.3	64%	0.643	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-69.4	127.5	175.6	29.2	-29.9	0	0	0	107.7	L177	P175-L177 HydrophobicContact CB-CD1 4.41Å; P175-L177 HydrophobicContact CG-CD1 4.12Å; P175-L177 PolarHBondContact O-N 2.83Å
176	E	37.3	Very low	37.2	Very low	166 Å²	166	127.4 Å²	127.4	78%	0.776	69%	0.687	S	S	*	*			trans	-59.5	93.5	151.3	-78.8	-165.1	140.7	0	0	106.3	K174 T178	K174-E176 PolarHBondContact O-N 3.04Å; E176-T178 PolarHBondContact O-N 3.3Å; E176-T178 VanDerWaalsContact O-N 3.08Å
177	L	38	Very low	38.9	Very low	89 Å²	89	124.1 Å²	124.1	47%	0.466	68%	0.676	S	S	.	*			trans	-72.1	109.1	-171.4	-159.7	79.5	0	0	0	108.1	F149 P175	F149-L177 WeakPolarHBondContact CE1-O 3.47Å; P175-L177 HydrophobicContact CB-CD1 4.41Å; P175-L177 HydrophobicContact CG-CD1 4.12Å; P175-L177 PolarHBondContact O-N 2.83Å
178	T	39	Very low	40.7	Very low	74 Å²	74	118.7 Å²	118.7	45%	0.454	65%	0.645	S	S	.	*			trans	-93.8	122.3	179.9	39.5	0	0	0	0	108.5	E176 Q185	E176-T178 PolarHBondContact O-N 3.3Å; E176-T178 VanDerWaalsContact O-N 3.08Å; T178-Q185 HydrophobicContact CG2-CG 3.74Å
179	V	41.6	Very low	43.4	Very low	36 Å²	36	115.4 Å²	115.4	22%	0.218	63%	0.627	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.7	118.4	178.1	178.1	0	0	0	0	109.4	A147 F149 L181	A147-V179 HydrophobicContact CB-CG2 3.86Å; A147-V179 WeakPolarHBondContact O-CG2 3.01Å; F149-V179 HydrophobicContact CE2-CB 4.37Å; F149-V179 HydrophobicContact CE2-CG2 4.01Å; F149-V179 HydrophobicContact CZ-CB 4.34Å; F149-V179 HydrophobicContact CZ-CG2 4.19Å; V179-L181 PolarHBondContact O-N 2.83Å
180	E	38	Very low	45.6	Very low	163 Å²	163	109.8 Å²	109.8	76%	0.762	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.9	113.7	169.5	-78.9	-170.8	147.8	0	0	110.2
181	L	42.3	Very low	48.6	Very low	51 Å²	51	103.5 Å²	103.5	27%	0.267	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.9	113.6	163.1	-159.7	80.3	0	0	0	107.2	V179 G183 M184 A349 I352	V179-L181 PolarHBondContact O-N 2.83Å; L181-G183 VanDerWaalsContact C-N 3.28Å; L181-G183 PolarHBondContact O-N 2.85Å; L181-M184 PolarHBondContact O-N 3.22Å; L181-A349 HydrophobicContact CD2-CB 4.29Å; L181-I352 HydrophobicContact CD2-CD1 4.43Å
182	M	34.4	Very low	51.1	Low	200 Å²	200	93.7 Å²	93.7	99%	0.985	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	30.2	178.8	-103.5	-179.4	165	0	0	115.1	M184	M182-M184 VanDerWaalsContact C-N 3.32Å; M182-M184 PolarHBondContact O-N 2.89Å
183	G	38.1	Very low	54	Low	63 Å²	63	86.9 Å²	86.9	65%	0.649	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	17.4	176.1	0	0	0	0	0	115.2	L181	L181-G183 VanDerWaalsContact C-N 3.28Å; L181-G183 PolarHBondContact O-N 2.85Å
184	M	36.3	Very low	57	Low	148 Å²	148	84.2 Å²	84.2	73%	0.729	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.4	168.4	-78.6	-176	108.6	0	0	111	L181 M182 L186	L181-M184 PolarHBondContact O-N 3.22Å; M182-M184 VanDerWaalsContact C-N 3.32Å; M182-M184 PolarHBondContact O-N 2.89Å; M184-L186 PolarHBondContact O-N 3.22Å
185	Q	42.1	Very low	60	Low	154 Å²	154	74.6 Å²	74.6	72%	0.72	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	106.5	177.8	-149.6	166.3	9.7	0	0	108.8	T178	T178-Q185 HydrophobicContact CG2-CG 3.74Å
186	L	57.9	Low	62.9	Low	50 Å²	50	69.9 Å²	69.9	26%	0.262	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.3	-172.8	-153.4	71	0	0	0	110.6	M184	M184-L186 PolarHBondContact O-N 3.22Å
187	G	72.3	Confident	65.7	Low	45 Å²	45	62.2 Å²	62.2	46%	0.464	35%	0.348	S	S	.	.			trans	-64.9	156.2	175.9	0	0	0	0	0	112.7	D189 S190 Y191	G187-D189 VanDerWaalsContact C-N 3.29Å; G187-D189 PolarHBondContact O-N 3.09Å; G187-D189 VanDerWaalsContact O-N 3.16Å; G187-S190 WeakPolarHBondContact O-CB 3.38Å; G187-S190 PolarHBondContact O-N 3.22Å; G187-Y191 PolarHBondContact O-N 3.12Å
188	K	80.7	Confident	68.5	Low	52 Å²	52	58 Å²	58	23%	0.226	33%	0.325	C	S	.	.	H	α-helix	trans	-44.2	-49.8	-178.9	174.5	179.7	169.1	175.2	0	113.4	V144 F149 D150 S152 S190 Y191 A192	V144-K188 HydrophobicContact CG1-CG 4.21Å; F149-K188 HydrophobicContact CB-CG 4.42Å; F149-K188 HydrophobicContact CD1-CB 4.03Å; F149-K188 HydrophobicContact CE1-CB 4.37Å; F149-K188 HydrophobicContact CG-CB 4.31Å; F149-K188 HydrophobicContact CG-CG 4.47Å; D150-K188 WeakPolarHBondContact O-CE 3.34Å; D150-K188 PolarHBondContact O-NZ 2.96Å; S152-K188 PolarHBondContact O-NZ 3.38Å; K188-S190 VanDerWaalsContact C-N 3.33Å; K188-S190 PolarHBondContact O-N 2.88Å; K188-Y191 PolarHBondContact O-N 3.13Å; K188-A192 WeakPolarHBondContact O-CB 3.28Å; K188-A192 PolarHBondContact O-N 2.98Å
189	D	82.9	Confident	71.2	Confident	93 Å²	93	54.4 Å²	54.4	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-66.5	-34.3	-177.5	-73	-5.3	0	0	0	113.2	P100 G187 I193	P100-D189 HydrophobicContact CG-CB 3.75Å; G187-D189 VanDerWaalsContact C-N 3.29Å; G187-D189 PolarHBondContact O-N 3.09Å; G187-D189 VanDerWaalsContact O-N 3.16Å; D189-I193 WeakPolarHBondContact O-CG2 3.41Å; D189-I193 PolarHBondContact O-N 3.38Å
190	S	86.3	Confident	73.9	Confident	54 Å²	54	52.8 Å²	52.8	38%	0.378	29%	0.294	S	S	.	.	H	α-helix	trans	-75	-35.8	178.2	-68.1	0	0	0	0	111.4	G187 K188 I193 A194	G187-S190 WeakPolarHBondContact O-CB 3.38Å; G187-S190 PolarHBondContact O-N 3.22Å; K188-S190 VanDerWaalsContact C-N 3.33Å; K188-S190 PolarHBondContact O-N 2.88Å; S190-I193 VanDerWaalsContact O-CG2 3.23Å; S190-I193 WeakPolarHBondContact O-CG2 3.39Å; S190-A194 WeakPolarHBondContact O-CB 3.44Å; S190-A194 PolarHBondContact O-N 3.29Å; S190-A194 VanDerWaalsContact O-N 3.17Å
191	Y	89.1	Confident	76.7	Confident	11 Å²	11	46.4 Å²	46.4	4%	0.043	26%	0.264	C	S	.	.	H	α-helix	trans	-68.5	-43.8	171.6	-173.7	-104.5	0	0	0	111.8	V144 A147 F149 G187 K188 I193 A194 V195 I352	V144-Y191 HydrophobicContact CG2-CD1 4.03Å; V144-Y191 HydrophobicContact CG2-CE1 4.48Å; A147-Y191 HydrophobicContact CB-CD1 4.25Å; A147-Y191 HydrophobicContact CB-CE1 3.64Å; F149-Y191 HydrophobicContact CD2-CD1 4.34Å; F149-Y191 AromaticContact CE2-CD1 3.94Å; F149-Y191 HydrophobicContact CE2-CD1 3.94Å; F149-Y191 HydrophobicContact CE2-CG 4.07Å; G187-Y191 PolarHBondContact O-N 3.12Å; K188-Y191 PolarHBondContact O-N 3.13Å; Y191-I193 VanDerWaalsContact C-N 3.34Å; Y191-I193 PolarHBondContact O-N 2.72Å; Y191-A194 WeakPolarHBondContact O-CB 3.47Å; Y191-A194 PolarHBondContact O-N 2.88Å; Y191-A194 VanDerWaalsContact O-N 3.11Å; Y191-V195 HydrophobicContact CD1-CG2 4.17Å; Y191-V195 HydrophobicContact CE1-CG2 3.79Å; Y191-V195 HydrophobicContact CE2-CG2 4.49Å; Y191-V195 WeakPolarHBondContact O-CG2 3.1Å; Y191-V195 PolarHBondContact O-N 2.89Å; Y191-I352 HydrophobicContact CE2-CD1 3.85Å
192	A	90.9	Very high	79.3	Confident	4 Å²	4	45 Å²	45	3%	0.033	26%	0.256	C	S	.	.	H	α-helix	trans	-56.9	-45.3	178.2	0	0	0	0	0	112.4	V140 V144 K188 V195 A196	V140-A192 HydrophobicContact CG1-CB 3.69Å; V144-A192 HydrophobicContact CG2-CB 4.02Å; K188-A192 WeakPolarHBondContact O-CB 3.28Å; K188-A192 PolarHBondContact O-N 2.98Å; A192-V195 PolarHBondContact O-N 2.86Å; A192-A196 WeakPolarHBondContact O-CB 3.42Å; A192-A196 PolarHBondContact O-N 3.5Å
193	I	92.5	Very high	82.3	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-70.7	-32.9	176.8	-168.7	58.7	0	0	0	112.7	V99 Y103 D189 S190 Y191 A196 A197 H406	V99-I193 HydrophobicContact CB-CD1 4.42Å; V99-I193 HydrophobicContact CG1-CD1 4.29Å; Y103-I193 HydrophobicContact CD1-CD1 4.01Å; Y103-I193 HydrophobicContact CD1-CG1 3.89Å; Y103-I193 HydrophobicContact CD2-CB 4.12Å; Y103-I193 HydrophobicContact CD2-CD1 3.65Å; Y103-I193 HydrophobicContact CD2-CG1 3.71Å; Y103-I193 HydrophobicContact CE1-CG1 3.9Å; Y103-I193 HydrophobicContact CE2-CB 3.78Å; Y103-I193 HydrophobicContact CE2-CD1 4.16Å; Y103-I193 HydrophobicContact CE2-CG1 3.68Å; Y103-I193 HydrophobicContact CE2-CG2 4.01Å; Y103-I193 HydrophobicContact CG-CD1 3.55Å; Y103-I193 HydrophobicContact CG-CG1 3.81Å; D189-I193 WeakPolarHBondContact O-CG2 3.41Å; D189-I193 PolarHBondContact O-N 3.38Å; S190-I193 VanDerWaalsContact O-CG2 3.23Å; S190-I193 WeakPolarHBondContact O-CG2 3.39Å; Y191-I193 VanDerWaalsContact C-N 3.34Å; Y191-I193 PolarHBondContact O-N 2.72Å; I193-A196 HydrophobicContact CD1-CB 4.25Å; I193-A196 PolarHBondContact O-N 3.25Å; I193-A197 WeakPolarHBondContact O-CB 3.34Å; I193-A197 PolarHBondContact O-N 3.04Å; I193-H406 WeakPolarHBondContact CD1-O 3.49Å; I193-H406 HydrophobicContact CG1-CB 3.89Å
194	A	92.6	Very high	85.1	Confident	12 Å²	12	32.4 Å²	32.4	10%	0.099	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-42.4	175.3	0	0	0	0	0	111.6	S190 Y191 A197 A198	S190-A194 WeakPolarHBondContact O-CB 3.44Å; S190-A194 PolarHBondContact O-N 3.29Å; S190-A194 VanDerWaalsContact O-N 3.17Å; Y191-A194 WeakPolarHBondContact O-CB 3.47Å; Y191-A194 PolarHBondContact O-N 2.88Å; Y191-A194 VanDerWaalsContact O-N 3.11Å; A194-A197 PolarHBondContact O-N 3.42Å; A194-A198 WeakPolarHBondContact O-CB 3.41Å; A194-A198 PolarHBondContact O-N 3Å
195	V	94.4	Very high	88.1	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62	-48.5	173.1	174.8	0	0	0	0	110.5	V139 V140 E143 Y191 A192 A197 A198 V199 I352 V356	V139-V195 HydrophobicContact CG1-CG1 4.24Å; V140-V195 HydrophobicContact CG2-CB 4.44Å; V140-V195 HydrophobicContact CG2-CG1 4.17Å; E143-V195 HydrophobicContact CB-CG1 3.96Å; E143-V195 HydrophobicContact CB-CG2 3.93Å; E143-V195 HydrophobicContact CG-CG1 3.84Å; E143-V195 HydrophobicContact CG-CG2 4.49Å; Y191-V195 HydrophobicContact CD1-CG2 4.17Å; Y191-V195 HydrophobicContact CE1-CG2 3.79Å; Y191-V195 HydrophobicContact CE2-CG2 4.49Å; Y191-V195 WeakPolarHBondContact O-CG2 3.1Å; Y191-V195 PolarHBondContact O-N 2.89Å; A192-V195 PolarHBondContact O-N 2.86Å; V195-A197 VanDerWaalsContact C-N 3.34Å; V195-A197 PolarHBondContact O-N 3.19Å; V195-A198 PolarHBondContact O-N 2.84Å; V195-V199 PolarHBondContact O-N 2.84Å; V195-I352 HydrophobicContact CG2-CD1 4.08Å; V195-I352 HydrophobicContact CG2-CG2 4.31Å; V195-V356 HydrophobicContact CG1-CG1 4.35Å
196	A	95.4	Very high	90.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.1	-42	179.5	0	0	0	0	0	112.2	V99 V136 V140 A192 I193 V199 T200 F408	V99-A196 HydrophobicContact CG1-CB 4.08Å; V136-A196 HydrophobicContact CG1-CB 3.76Å; V140-A196 HydrophobicContact CG2-CB 3.81Å; A192-A196 WeakPolarHBondContact O-CB 3.42Å; A192-A196 PolarHBondContact O-N 3.5Å; I193-A196 HydrophobicContact CD1-CB 4.25Å; I193-A196 PolarHBondContact O-N 3.25Å; A196-V199 VanDerWaalsContact O-CG1 3.28Å; A196-V199 WeakPolarHBondContact O-CG1 3.37Å; A196-T200 VanDerWaalsContact O-CB 3.24Å; A196-T200 WeakPolarHBondContact O-CB 3.37Å; A196-T200 PolarHBondContact O-N 3.25Å; A196-T200 VanDerWaalsContact O-N 3.14Å; A196-T200 PolarHBondContact O-OG1 3.12Å; A196-F408 HydrophobicContact CB-CB 4.08Å
197	A	95.8	Very high	92.5	Very high	4 Å²	4	20.5 Å²	20.5	3%	0.033	12%	0.12	C	C	.	.	H	α-helix	trans	-67	-40.5	176	0	0	0	0	0	111.9	I193 A194 V195 T200 F201	I193-A197 WeakPolarHBondContact O-CB 3.34Å; I193-A197 PolarHBondContact O-N 3.04Å; A194-A197 PolarHBondContact O-N 3.42Å; V195-A197 VanDerWaalsContact C-N 3.34Å; V195-A197 PolarHBondContact O-N 3.19Å; A197-T200 PolarHBondContact O-N 3.23Å; A197-F201 WeakPolarHBondContact O-CB 3.19Å; A197-F201 PolarHBondContact O-N 3.19Å
198	A	96.3	Very high	93.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.9	-48.4	178.7	0	0	0	0	0	112.7	A194 V195 T200 F201 L202 M353	A194-A198 WeakPolarHBondContact O-CB 3.41Å; A194-A198 PolarHBondContact O-N 3Å; V195-A198 PolarHBondContact O-N 2.84Å; A198-T200 VanDerWaalsContact C-N 3.26Å; A198-T200 PolarHBondContact O-N 3.35Å; A198-F201 PolarHBondContact O-N 3.05Å; A198-L202 PolarHBondContact O-N 3.13Å; A198-L202 VanDerWaalsContact O-N 3.13Å; A198-M353 HydrophobicContact CB-CG 4.28Å
199	V	96.4	Very high	94.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-35.1	176.8	69.1	0	0	0	0	111.4	V195 A196 L202 A203 V356 A360 L363	V195-V199 PolarHBondContact O-N 2.84Å; A196-V199 VanDerWaalsContact O-CG1 3.28Å; A196-V199 WeakPolarHBondContact O-CG1 3.37Å; V199-L202 PolarHBondContact O-N 2.99Å; V199-A203 WeakPolarHBondContact O-CB 3.47Å; V199-A203 PolarHBondContact O-N 2.92Å; V199-V356 HydrophobicContact CB-CB 4.28Å; V199-V356 HydrophobicContact CB-CG2 4.21Å; V199-V356 HydrophobicContact CG2-CB 4.4Å; V199-A360 HydrophobicContact CG2-CB 3.96Å; V199-L363 HydrophobicContact CG2-CD2 4.42Å
200	T	96.8	Very high	94.8	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	11%	0.105	C	C	.	.	H	α-helix	trans	-68.7	-45.5	178.5	-60.5	0	0	0	0	112.3	A196 A197 A198 L202 A203 G204 N399 F408 T409	A196-T200 VanDerWaalsContact O-CB 3.24Å; A196-T200 WeakPolarHBondContact O-CB 3.37Å; A196-T200 PolarHBondContact O-N 3.25Å; A196-T200 VanDerWaalsContact O-N 3.14Å; A196-T200 PolarHBondContact O-OG1 3.12Å; A197-T200 PolarHBondContact O-N 3.23Å; A198-T200 VanDerWaalsContact C-N 3.26Å; A198-T200 PolarHBondContact O-N 3.35Å; T200-L202 VanDerWaalsContact C-N 3.29Å; T200-L202 PolarHBondContact O-N 3.12Å; T200-A203 PolarHBondContact O-N 3.39Å; T200-G204 PolarHBondContact O-N 3.28Å; T200-N399 HydrophobicContact CG2-CB 4.02Å; T200-F408 WeakPolarHBondContact OG1-CA 3.46Å; T200-T409 PolarHBondContact OG1-N 2.83Å; T200-T409 PolarHBondContact OG1-OG1 3.28Å
201	F	97.6	Very high	95.2	Very high	29 Å²	29	17.4 Å²	17.4	13%	0.127	9%	0.091	C	C	.	.	H	α-helix	trans	-55.5	-49	174.8	175.6	-98.8	0	0	0	110.2	A197 A198 G204 V205 P348 F350 M353 V400 S403 F404	A197-F201 WeakPolarHBondContact O-CB 3.19Å; A197-F201 PolarHBondContact O-N 3.19Å; A198-F201 PolarHBondContact O-N 3.05Å; F201-G204 PolarHBondContact O-N 2.99Å; F201-V205 HydrophobicContact CD1-CG2 4.2Å; F201-V205 HydrophobicContact CE1-CG2 3.81Å; F201-V205 HydrophobicContact CE2-CG2 4.35Å; F201-V205 HydrophobicContact CZ-CG2 3.89Å; F201-V205 WeakPolarHBondContact O-CG2 3.26Å; F201-V205 PolarHBondContact O-N 2.92Å; F201-P348 HydrophobicContact CB-CB 4.09Å; F201-P348 HydrophobicContact CB-CG 4.03Å; F201-P348 HydrophobicContact CD2-CG 4.18Å; F201-P348 HydrophobicContact CG-CB 4.37Å; F201-P348 HydrophobicContact CG-CG 4.18Å; F201-F350 HydrophobicContact CE1-CE1 4.3Å; F201-M353 HydrophobicContact CD1-CE 3.41Å; F201-M353 VanDerWaalsContact CD1-CE 3.41Å; F201-M353 HydrophobicContact CD1-SD 3.93Å; F201-M353 HydrophobicContact CE1-CE 3.83Å; F201-M353 HydrophobicContact CE1-SD 4.16Å; F201-M353 HydrophobicContact CG-CE 4.14Å; F201-V400 HydrophobicContact CD2-CG1 4.1Å; F201-V400 HydrophobicContact CE2-CG1 3.89Å; F201-S403 WeakPolarHBondContact CD2-OG 3.43Å; F201-F404 HydrophobicContact CD2-CE2 4.06Å; F201-F404 HydrophobicContact CD2-CZ 4.32Å; F201-F404 AromaticContact CE2-CE2 3.84Å; F201-F404 HydrophobicContact CE2-CE2 3.84Å; F201-F404 AromaticContact CE2-CZ 3.83Å; F201-F404 HydrophobicContact CE2-CZ 3.83Å
202	L	97.5	Very high	95.3	Very high	21 Å²	21	21.8 Å²	21.8	11%	0.11	12%	0.119	C	C	.	.	H	α-helix	trans	-67.4	-40.2	-178.4	-170.9	62.1	0	0	0	112.7	A198 V199 T200 G204 V205 Y206 A357 A360	A198-L202 PolarHBondContact O-N 3.13Å; A198-L202 VanDerWaalsContact O-N 3.13Å; V199-L202 PolarHBondContact O-N 2.99Å; T200-L202 VanDerWaalsContact C-N 3.29Å; T200-L202 PolarHBondContact O-N 3.12Å; L202-G204 VanDerWaalsContact C-N 3.28Å; L202-G204 PolarHBondContact O-N 3.21Å; L202-V205 PolarHBondContact O-N 2.95Å; L202-Y206 HydrophobicContact CD1-CD1 4.36Å; L202-Y206 HydrophobicContact CD1-CE1 3.77Å; L202-Y206 HydrophobicContact CD1-CE2 4.3Å; L202-Y206 HydrophobicContact CD2-CE2 4.07Å; L202-Y206 HydrophobicContact CG-CD2 4.27Å; L202-Y206 HydrophobicContact CG-CE1 4.13Å; L202-Y206 HydrophobicContact CG-CE2 3.72Å; L202-Y206 PolarHBondContact O-N 3.3Å; L202-A357 VanDerWaalsContact CD2-CA 3.4Å; L202-A357 HydrophobicContact CD2-CB 3.89Å; L202-A360 HydrophobicContact CB-CB 3.94Å; L202-A360 HydrophobicContact CD2-CB 3.86Å; L202-A360 HydrophobicContact CG-CB 3.87Å
203	A	97.1	Very high	95.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.4	-41.1	173.3	0	0	0	0	0	111.4	V199 T200 Y206 Q207 A360 L363 A364	V199-A203 WeakPolarHBondContact O-CB 3.47Å; V199-A203 PolarHBondContact O-N 2.92Å; T200-A203 PolarHBondContact O-N 3.39Å; A203-Y206 PolarHBondContact O-N 3.19Å; A203-Q207 VanDerWaalsContact O-CG 3.3Å; A203-Q207 WeakPolarHBondContact O-CG 3.48Å; A203-Q207 PolarHBondContact O-N 3.07Å; A203-A360 HydrophobicContact CB-CB 4.28Å; A203-L363 HydrophobicContact CB-CB 4.11Å; A203-A364 HydrophobicContact CB-CB 4.29Å; A203-A364 WeakPolarHBondContact O-CB 3.45Å
204	G	97.4	Very high	95.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.2	-41.9	174.2	0	0	0	0	0	113.3	T200 F201 L202 Q207 I208 V400	T200-G204 PolarHBondContact O-N 3.28Å; F201-G204 PolarHBondContact O-N 2.99Å; L202-G204 VanDerWaalsContact C-N 3.28Å; L202-G204 PolarHBondContact O-N 3.21Å; G204-Q207 WeakPolarHBondContact O-CB 3.3Å; G204-Q207 PolarHBondContact O-N 2.85Å; G204-I208 WeakPolarHBondContact O-CG1 3.42Å; G204-I208 PolarHBondContact O-N 3.12Å; G204-V400 VanDerWaalsContact C-CG2 3.41Å
205	V	97.3	Very high	95	Very high	44 Å²	44	39.5 Å²	39.5	27%	0.267	19%	0.19	S	C	.	.	H	α-helix	trans	-60.7	-45.7	174.1	169.6	0	0	0	0	110.5	F201 L202 Q207 I208 L209 V400	F201-V205 HydrophobicContact CD1-CG2 4.2Å; F201-V205 HydrophobicContact CE1-CG2 3.81Å; F201-V205 HydrophobicContact CE2-CG2 4.35Å; F201-V205 HydrophobicContact CZ-CG2 3.89Å; F201-V205 WeakPolarHBondContact O-CG2 3.26Å; F201-V205 PolarHBondContact O-N 2.92Å; L202-V205 PolarHBondContact O-N 2.95Å; V205-Q207 VanDerWaalsContact C-N 3.33Å; V205-Q207 PolarHBondContact O-N 3.13Å; V205-I208 PolarHBondContact O-N 3.4Å; V205-L209 HydrophobicContact CG1-CD1 3.97Å; V205-L209 HydrophobicContact CG1-CG 4.32Å; V205-L209 WeakPolarHBondContact O-CB 3.38Å; V205-L209 WeakPolarHBondContact O-CG 3.42Å; V205-L209 PolarHBondContact O-N 3.34Å; V205-V400 HydrophobicContact CG2-CG2 4.15Å
206	Y	96.8	Very high	94.6	Very high	57 Å²	57	39.6 Å²	39.6	22%	0.224	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-41.5	174.7	-66.9	-24	0	0	0	112.1	L202 A203 I208 L209 M210 A357 A360 I361	L202-Y206 HydrophobicContact CD1-CD1 4.36Å; L202-Y206 HydrophobicContact CD1-CE1 3.77Å; L202-Y206 HydrophobicContact CD1-CE2 4.3Å; L202-Y206 HydrophobicContact CD2-CE2 4.07Å; L202-Y206 HydrophobicContact CG-CD2 4.27Å; L202-Y206 HydrophobicContact CG-CE1 4.13Å; L202-Y206 HydrophobicContact CG-CE2 3.72Å; L202-Y206 PolarHBondContact O-N 3.3Å; A203-Y206 PolarHBondContact O-N 3.19Å; Y206-I208 PolarHBondContact O-N 3.26Å; Y206-L209 HydrophobicContact CD1-CD1 4.32Å; Y206-L209 PolarHBondContact O-N 3.49Å; Y206-M210 WeakPolarHBondContact O-CB 3.34Å; Y206-M210 WeakPolarHBondContact O-CG 3.48Å; Y206-M210 PolarHBondContact O-N 3.16Å; Y206-A357 WeakPolarHBondContact CE2-O 3.21Å; Y206-A357 PolarHBondContact OH-O 2.83Å; Y206-A360 HydrophobicContact CD2-CB 4Å; Y206-A360 HydrophobicContact CE2-CB 3.72Å; Y206-I361 HydrophobicContact CD2-CG1 3.89Å; Y206-I361 HydrophobicContact CE2-CG1 3.5Å; Y206-I361 VanDerWaalsContact CE2-CG1 3.5Å
207	Q	96.6	Very high	94	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-44	174.5	-72.6	171.5	-24.7	0	0	112.4	A203 G204 V205 M210 A211 A364 S367 M392 I395 G396 N399	A203-Q207 VanDerWaalsContact O-CG 3.3Å; A203-Q207 WeakPolarHBondContact O-CG 3.48Å; A203-Q207 PolarHBondContact O-N 3.07Å; G204-Q207 WeakPolarHBondContact O-CB 3.3Å; G204-Q207 PolarHBondContact O-N 2.85Å; V205-Q207 VanDerWaalsContact C-N 3.33Å; V205-Q207 PolarHBondContact O-N 3.13Å; Q207-M210 HydrophobicContact CB-CE 4.47Å; Q207-M210 HydrophobicContact CG-CE 4Å; Q207-M210 PolarHBondContact O-N 3.27Å; Q207-A211 PolarHBondContact O-N 3.18Å; Q207-A364 HydrophobicContact CG-CB 3.89Å; Q207-A364 PolarHBondContact NE2-O 3Å; Q207-S367 VanDerWaalsContact NE2-CB 3.26Å; Q207-S367 PolarHBondContact NE2-OG 2.8Å; Q207-S367 VanDerWaalsContact NE2-OG 3.11Å; Q207-M392 HydrophobicContact CB-CG 4.45Å; Q207-M392 VanDerWaalsContact O-CG 3.32Å; Q207-M392 WeakPolarHBondContact O-CG 3.23Å; Q207-I395 PolarHBondContact OE1-O 3.01Å; Q207-G396 VanDerWaalsContact OE1-CA 3.24Å; Q207-N399 PolarHBondContact OE1-ND2 3.42Å
208	I	96.1	Very high	93.3	Very high	51 Å²	51	47.2 Å²	47.2	26%	0.262	23%	0.229	S	C	.	.	H	α-helix	trans	-63.9	-44.5	176.1	-66.2	171.4	0	0	0	110.7	G204 V205 Y206 M210 A211 V212 L397 V400	G204-I208 WeakPolarHBondContact O-CG1 3.42Å; G204-I208 PolarHBondContact O-N 3.12Å; V205-I208 PolarHBondContact O-N 3.4Å; Y206-I208 PolarHBondContact O-N 3.26Å; I208-M210 PolarHBondContact O-N 3.49Å; I208-A211 WeakPolarHBondContact O-CA 3.4Å; I208-A211 WeakPolarHBondContact O-CB 3.49Å; I208-A211 PolarHBondContact O-N 2.91Å; I208-A211 VanDerWaalsContact O-N 3.1Å; I208-V212 WeakPolarHBondContact O-CG2 3.37Å; I208-V212 PolarHBondContact O-N 3.1Å; I208-L397 HydrophobicContact CD1-CD2 3.91Å; I208-L397 HydrophobicContact CD1-CG 4.13Å; I208-V400 HydrophobicContact CD1-CG2 3.83Å
209	L	95.6	Very high	92.6	Very high	80 Å²	80	47.4 Å²	47.4	42%	0.419	23%	0.23	S	C	.	.	H	α-helix	trans	-59.9	-46.9	176.2	-72.5	173.2	0	0	0	111.4	V205 Y206 A211 V212 F213	V205-L209 HydrophobicContact CG1-CD1 3.97Å; V205-L209 HydrophobicContact CG1-CG 4.32Å; V205-L209 WeakPolarHBondContact O-CB 3.38Å; V205-L209 WeakPolarHBondContact O-CG 3.42Å; V205-L209 PolarHBondContact O-N 3.34Å; Y206-L209 HydrophobicContact CD1-CD1 4.32Å; Y206-L209 PolarHBondContact O-N 3.49Å; L209-A211 PolarHBondContact O-N 2.99Å; L209-V212 PolarHBondContact O-N 2.99Å; L209-V212 VanDerWaalsContact O-N 3.12Å; L209-F213 WeakPolarHBondContact O-CD2 3.48Å; L209-F213 PolarHBondContact O-N 2.87Å
210	M	93	Very high	91.9	Very high	37 Å²	37	53 Å²	53	18%	0.182	26%	0.264	C	S	.	.	H	α-helix	trans	-57.4	-36.5	174.9	-70.7	-168.6	-73.8	0	0	111.4	Y206 Q207 I208 F213 R214 L215 A364 V365 M392	Y206-M210 WeakPolarHBondContact O-CB 3.34Å; Y206-M210 WeakPolarHBondContact O-CG 3.48Å; Y206-M210 PolarHBondContact O-N 3.16Å; Q207-M210 HydrophobicContact CB-CE 4.47Å; Q207-M210 HydrophobicContact CG-CE 4Å; Q207-M210 PolarHBondContact O-N 3.27Å; I208-M210 PolarHBondContact O-N 3.49Å; M210-F213 CarbonylContact O-C 3.54Å; M210-R214 PolarHBondContact O-N 2.96Å; M210-R214 VanDerWaalsContact O-N 3.16Å; M210-L215 HydrophobicContact CB-CB 4.22Å; M210-L215 HydrophobicContact CB-CD1 4.1Å; M210-L215 HydrophobicContact CG-CD1 3.93Å; M210-L215 WeakPolarHBondContact O-CB 3.4Å; M210-L215 PolarHBondContact O-N 3.39Å; M210-A364 HydrophobicContact CE-CB 3.81Å; M210-V365 HydrophobicContact SD-CG2 4.36Å; M210-M392 VanDerWaalsContact C-CE 3.49Å; M210-M392 HydrophobicContact CB-CE 4.23Å; M210-M392 HydrophobicContact CB-SD 3.39Å; M210-M392 WeakPolarHBondContact CB-SD 3.4Å; M210-M392 WeakPolarHBondContact O-CE 3.5Å
211	A	93.3	Very high	91.1	Very high	12 Å²	12	57.8 Å²	57.8	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-71.1	-37.9	174.8	0	0	0	0	0	114.5	Q207 I208 L209 F213 R214 M392 V393	Q207-A211 PolarHBondContact O-N 3.18Å; I208-A211 WeakPolarHBondContact O-CA 3.4Å; I208-A211 WeakPolarHBondContact O-CB 3.49Å; I208-A211 PolarHBondContact O-N 2.91Å; I208-A211 VanDerWaalsContact O-N 3.1Å; L209-A211 PolarHBondContact O-N 2.99Å; A211-F213 VanDerWaalsContact C-N 3.31Å; A211-F213 PolarHBondContact O-N 3.45Å; A211-R214 WeakPolarHBondContact O-CA 3.43Å; A211-R214 PolarHBondContact O-N 3.44Å; A211-M392 HydrophobicContact CB-CB 4.15Å; A211-M392 HydrophobicContact CB-CE 3.76Å; A211-M392 HydrophobicContact CB-CG 4.02Å; A211-M392 HydrophobicContact CB-SD 4.4Å; A211-V393 HydrophobicContact CB-CG2 3.47Å; A211-V393 VanDerWaalsContact CB-CG2 3.47Å
212	V	92.1	Very high	90.4	Very high	103 Å²	103	57.3 Å²	57.3	62%	0.624	28%	0.281	S	S	*	.	H	α-helix	trans	-60.5	-44.2	173.2	172.8	0	0	0	0	110.2	I208 L209 R214	I208-V212 WeakPolarHBondContact O-CG2 3.37Å; I208-V212 PolarHBondContact O-N 3.1Å; L209-V212 PolarHBondContact O-N 2.99Å; L209-V212 VanDerWaalsContact O-N 3.12Å; V212-R214 PolarHBondContact O-N 3.03Å
213	F	92.7	Very high	90	Very high	144 Å²	144	57.8 Å²	57.8	63%	0.632	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	2.1	174	-66.4	-62.7	0	0	0	114.1	L209 M210 A211 L215	L209-F213 WeakPolarHBondContact O-CD2 3.48Å; L209-F213 PolarHBondContact O-N 2.87Å; M210-F213 CarbonylContact O-C 3.54Å; A211-F213 VanDerWaalsContact C-N 3.31Å; A211-F213 PolarHBondContact O-N 3.45Å; F213-L215 HydrophobicContact CB-CD1 4.35Å; F213-L215 HydrophobicContact CB-CD2 4.29Å; F213-L215 HydrophobicContact CB-CG 3.89Å; F213-L215 PolarHBondContact O-N 3.21Å
214	R	89.3	Confident	89.4	Confident	186 Å²	186	61 Å²	61	70%	0.702	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	34.7	-179.9	-56.8	-176.5	177.6	-170	-0.8	113.6	M210 A211 V212 G216 N389	M210-R214 PolarHBondContact O-N 2.96Å; M210-R214 VanDerWaalsContact O-N 3.16Å; A211-R214 WeakPolarHBondContact O-CA 3.43Å; A211-R214 PolarHBondContact O-N 3.44Å; V212-R214 PolarHBondContact O-N 3.03Å; R214-G216 PolarHBondContact O-N 3.04Å; R214-N389 WeakPolarHBondContact CA-OD1 3.47Å
215	L	88.5	Confident	89.1	Confident	60 Å²	60	61.9 Å²	61.9	31%	0.314	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-70.5	6.7	178.4	-59.1	-177	0	0	0	113.5	M210 F213 F217 V218	M210-L215 HydrophobicContact CB-CB 4.22Å; M210-L215 HydrophobicContact CB-CD1 4.1Å; M210-L215 HydrophobicContact CG-CD1 3.93Å; M210-L215 WeakPolarHBondContact O-CB 3.4Å; M210-L215 PolarHBondContact O-N 3.39Å; F213-L215 HydrophobicContact CB-CD1 4.35Å; F213-L215 HydrophobicContact CB-CD2 4.29Å; F213-L215 HydrophobicContact CB-CG 3.89Å; F213-L215 PolarHBondContact O-N 3.21Å; L215-F217 HydrophobicContact CD2-CE1 3.65Å; L215-F217 HydrophobicContact CD2-CZ 4.35Å; L215-F217 PolarHBondContact O-N 3.4Å; L215-V218 HydrophobicContact CB-CG2 4.45Å; L215-V218 VanDerWaalsContact O-CB 3.3Å; L215-V218 WeakPolarHBondContact O-CB 3.39Å; L215-V218 VanDerWaalsContact O-CG2 3.23Å; L215-V218 WeakPolarHBondContact O-CG2 3.32Å; L215-V218 PolarHBondContact O-N 3.35Å
216	G	85	Confident	88.8	Confident	3 Å²	3	59.8 Å²	59.8	3%	0.031	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-60.6	-13.3	173.1	0	0	0	0	0	114.1	R214 V218 S219 N389	R214-G216 PolarHBondContact O-N 3.04Å; G216-V218 PolarHBondContact O-N 2.88Å; G216-S219 PolarHBondContact O-N 3.46Å; G216-S219 PolarHBondContact O-OG 3.32Å; G216-S219 VanDerWaalsContact O-OG 3.05Å; G216-N389 WeakPolarHBondContact CA-OD1 3.17Å; G216-N389 PolarHBondContact N-OD1 3.18Å
217	F	83.1	Confident	88.2	Confident	110 Å²	110	58 Å²	58	48%	0.482	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-64.2	-21.4	170.2	77.8	-91.1	0	0	0	112.8	L215 S219 V220 Y221	L215-F217 HydrophobicContact CD2-CE1 3.65Å; L215-F217 HydrophobicContact CD2-CZ 4.35Å; L215-F217 PolarHBondContact O-N 3.4Å; F217-S219 PolarHBondContact O-N 2.92Å; F217-S219 VanDerWaalsContact O-N 3.16Å; F217-V220 VanDerWaalsContact O-CB 3.32Å; F217-V220 WeakPolarHBondContact O-CB 3.47Å; F217-V220 WeakPolarHBondContact O-CG2 3.43Å; F217-V220 PolarHBondContact O-N 3.3Å; F217-Y221 AromaticContact CD2-CE2 3.74Å; F217-Y221 HydrophobicContact CD2-CE2 3.74Å; F217-Y221 AromaticContact CE2-CE2 3.8Å; F217-Y221 HydrophobicContact CE2-CE2 3.8Å
218	V	80.8	Confident	87.8	Confident	53 Å²	53	59.4 Å²	59.4	32%	0.321	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-59	-27	177.5	174.8	0	0	0	0	111.3	L215 G216 V220 Y221	L215-V218 HydrophobicContact CB-CG2 4.45Å; L215-V218 VanDerWaalsContact O-CB 3.3Å; L215-V218 WeakPolarHBondContact O-CB 3.39Å; L215-V218 VanDerWaalsContact O-CG2 3.23Å; L215-V218 WeakPolarHBondContact O-CG2 3.32Å; L215-V218 PolarHBondContact O-N 3.35Å; G216-V218 PolarHBondContact O-N 2.88Å; V218-V220 PolarHBondContact O-N 3.28Å; V218-V220 VanDerWaalsContact O-N 3.16Å; V218-Y221 PolarHBondContact O-N 3.15Å; V218-Y221 VanDerWaalsContact O-N 3.09Å
219	S	81.4	Confident	87.6	Confident	5 Å²	5	57 Å²	57	4%	0.035	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-59.8	-26.6	176.6	73.6	0	0	0	0	113.3	G216 F217 Y221 L222	G216-S219 PolarHBondContact O-N 3.46Å; G216-S219 PolarHBondContact O-OG 3.32Å; G216-S219 VanDerWaalsContact O-OG 3.05Å; F217-S219 PolarHBondContact O-N 2.92Å; F217-S219 VanDerWaalsContact O-N 3.16Å; S219-Y221 PolarHBondContact O-N 3.41Å; S219-L222 PolarHBondContact O-N 2.93Å
220	V	81.7	Confident	87.3	Confident	117 Å²	117	53.1 Å²	53.1	71%	0.709	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-65.3	-27	178.9	-179.8	0	0	0	0	112	F217 V218	F217-V220 VanDerWaalsContact O-CB 3.32Å; F217-V220 WeakPolarHBondContact O-CB 3.47Å; F217-V220 WeakPolarHBondContact O-CG2 3.43Å; F217-V220 PolarHBondContact O-N 3.3Å; V218-V220 PolarHBondContact O-N 3.28Å; V218-V220 VanDerWaalsContact O-N 3.16Å
221	Y	80.8	Confident	87.1	Confident	102 Å²	102	52.2 Å²	52.2	40%	0.4	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-88	-7.5	-179.2	-57.5	-65.7	0	0	0	113.5	F217 V218 S219 S223 M513	F217-Y221 AromaticContact CD2-CE2 3.74Å; F217-Y221 HydrophobicContact CD2-CE2 3.74Å; F217-Y221 AromaticContact CE2-CE2 3.8Å; F217-Y221 HydrophobicContact CE2-CE2 3.8Å; V218-Y221 PolarHBondContact O-N 3.15Å; V218-Y221 VanDerWaalsContact O-N 3.09Å; S219-Y221 PolarHBondContact O-N 3.41Å; Y221-S223 PolarHBondContact O-N 3.49Å; Y221-M513 HydrophobicContact CD1-CE 3.46Å; Y221-M513 VanDerWaalsContact CD1-CE 3.46Å; Y221-M513 HydrophobicContact CD1-SD 3.29Å; Y221-M513 WeakPolarHBondContact CD1-SD 3.38Å; Y221-M513 HydrophobicContact CE1-CE 3.48Å; Y221-M513 VanDerWaalsContact CE1-CE 3.48Å; Y221-M513 HydrophobicContact CE1-SD 3.9Å; Y221-M513 HydrophobicContact CG-CE 4.18Å; Y221-M513 HydrophobicContact CG-SD 4.02Å
222	L	83.3	Confident	87	Confident	18 Å²	18	51.8 Å²	51.8	9%	0.094	27%	0.269	C	S	.	.			trans	-83.6	90	177	-62.6	173.5	0	0	0	110	S219 M226 L227 A369 I509	S219-L222 PolarHBondContact O-N 2.93Å; L222-M226 HydrophobicContact CD2-SD 4.28Å; L222-L227 HydrophobicContact CB-CD1 4.02Å; L222-L227 HydrophobicContact CB-CD2 4.48Å; L222-L227 HydrophobicContact CB-CG 4.32Å; L222-A369 HydrophobicContact CD1-CB 3.44Å; L222-A369 VanDerWaalsContact CD1-CB 3.44Å; L222-I509 HydrophobicContact CD2-CD1 3.63Å; L222-I509 HydrophobicContact CD2-CG1 3.82Å
223	S	87.4	Confident	87.1	Confident	32 Å²	32	46.9 Å²	46.9	22%	0.224	24%	0.24	C	C	.	.			trans	-68.7	144	179.7	72.3	0	0	0	0	111.6	Y221 P225 M226 L227 S512	Y221-S223 PolarHBondContact O-N 3.49Å; S223-P225 VanDerWaalsContact C-CD 3.48Å; S223-M226 WeakPolarHBondContact O-CB 3.31Å; S223-M226 PolarHBondContact O-N 3.32Å; S223-M226 VanDerWaalsContact O-N 3.15Å; S223-M226 WeakPolarHBondContact OG-CB 3.27Å; S223-M226 PolarHBondContact OG-N 2.89Å; S223-L227 PolarHBondContact O-N 3.02Å; S223-S512 PolarHBondContact OG-OG 3.29Å; S223-S512 VanDerWaalsContact OG-OG 3.1Å
224	A	85.5	Confident	86.9	Confident	66 Å²	66	40.2 Å²	40.2	55%	0.545	21%	0.211	S	C	.	.	H	α-helix	trans	-57.4	-41.4	178.4	0	0	0	0	0	113.7	M226 L227 D228	A224-M226 VanDerWaalsContact C-N 3.33Å; A224-M226 PolarHBondContact O-N 3.31Å; A224-L227 PolarHBondContact O-N 2.93Å; A224-D228 WeakPolarHBondContact O-CB 3.41Å; A224-D228 VanDerWaalsContact O-CG 3.23Å; A224-D228 PolarHBondContact O-N 2.96Å
225	P	90.8	Very high	87	Confident	20 Å²	20	31.7 Å²	31.7	13%	0.13	18%	0.18	C	C	.	.	H	α-helix	trans	-62.1	-38.3	174.9	-20.9	32.9	0	0	0	113.1	S223 G229 D485 W489	S223-P225 VanDerWaalsContact C-CD 3.48Å; P225-G229 PolarHBondContact O-N 3.09Å; P225-D485 HydrophobicContact CB-CB 4.19Å; P225-D485 WeakPolarHBondContact CB-O 3.47Å; P225-D485 HydrophobicContact CG-CB 3.81Å; P225-W489 HydrophobicContact CB-CB 4.35Å
226	M	90.9	Very high	87.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.2	-49.9	177.5	176.8	-93	119.9	0	0	110.9	L222 S223 A224 D228 G229 F230 V488 A492 L505 I509	L222-M226 HydrophobicContact CD2-SD 4.28Å; S223-M226 WeakPolarHBondContact O-CB 3.31Å; S223-M226 PolarHBondContact O-N 3.32Å; S223-M226 VanDerWaalsContact O-N 3.15Å; S223-M226 WeakPolarHBondContact OG-CB 3.27Å; S223-M226 PolarHBondContact OG-N 2.89Å; A224-M226 VanDerWaalsContact C-N 3.33Å; A224-M226 PolarHBondContact O-N 3.31Å; M226-D228 PolarHBondContact O-N 3.03Å; M226-G229 PolarHBondContact O-N 3.02Å; M226-F230 HydrophobicContact CE-CB 3.64Å; M226-F230 HydrophobicContact CE-CD2 4.44Å; M226-F230 HydrophobicContact CE-CG 4.16Å; M226-F230 WeakPolarHBondContact O-CB 3.35Å; M226-F230 PolarHBondContact O-N 3.29Å; M226-V488 HydrophobicContact CB-CG1 3.77Å; M226-A492 HydrophobicContact CG-CB 4.44Å; M226-L505 HydrophobicContact CE-CD1 3.47Å; M226-L505 VanDerWaalsContact CE-CD1 3.47Å; M226-L505 HydrophobicContact SD-CD1 4.38Å; M226-I509 HydrophobicContact SD-CG1 4.06Å
227	L	85.5	Confident	87.5	Confident	20 Å²	20	30.7 Å²	30.7	11%	0.105	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-39.7	177.7	-70.3	168.2	0	0	0	113.1	L222 S223 A224 G229 A231 S373	L222-L227 HydrophobicContact CB-CD1 4.02Å; L222-L227 HydrophobicContact CB-CD2 4.48Å; L222-L227 HydrophobicContact CB-CG 4.32Å; S223-L227 PolarHBondContact O-N 3.02Å; A224-L227 PolarHBondContact O-N 2.93Å; L227-G229 VanDerWaalsContact C-N 3.35Å; L227-A231 VanDerWaalsContact O-CB 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.35Å; L227-A231 PolarHBondContact O-N 3.01Å; L227-S373 VanDerWaalsContact CD1-CB 3.5Å; L227-S373 WeakPolarHBondContact CD1-OG 3.34Å
228	D	87.4	Confident	87.9	Confident	28 Å²	28	25.6 Å²	25.6	15%	0.15	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-45.7	174.4	-79.5	-14.6	0	0	0	111.3	A224 M226 T232 K471 K478	A224-D228 WeakPolarHBondContact O-CB 3.41Å; A224-D228 VanDerWaalsContact O-CG 3.23Å; A224-D228 PolarHBondContact O-N 2.96Å; M226-D228 PolarHBondContact O-N 3.03Å; D228-T232 WeakPolarHBondContact O-CB 3.4Å; D228-T232 PolarHBondContact O-N 3.12Å; D228-T232 VanDerWaalsContact O-N 3.08Å; D228-T232 PolarHBondContact O-OG1 3.04Å; D228-K471 HydrophobicContact CB-CD 4.1Å; D228-K471 IonicContact OD1-NZ 3.22Å; D228-K471 PolarHBondContact OD1-NZ 3.48Å; D228-K478 IonicContact OD2-NZ 3.27Å; D228-K478 PolarHBondContact OD2-NZ 2.84Å
229	G	91.9	Very high	88.4	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-48.3	179.3	0	0	0	0	0	111.2	P225 M226 L227 A231 T232 G233 M493	P225-G229 PolarHBondContact O-N 3.09Å; M226-G229 PolarHBondContact O-N 3.02Å; L227-G229 VanDerWaalsContact C-N 3.35Å; G229-A231 PolarHBondContact O-N 3.08Å; G229-T232 WeakPolarHBondContact O-CB 3.43Å; G229-T232 PolarHBondContact O-N 2.91Å; G229-G233 PolarHBondContact O-N 3.32Å; G229-M493 VanDerWaalsContact O-CA 3.27Å; G229-M493 WeakPolarHBondContact O-CA 3.24Å; G229-M493 WeakPolarHBondContact O-CB 3.35Å
230	F	89.8	Confident	88.9	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.2	-50.3	174.4	173.3	-85.1	0	0	0	112.4	L131 M226 T232 G233 A234 I366 F370 T496 V501 L505	L131-F230 HydrophobicContact CD2-CE1 3.51Å; L131-F230 HydrophobicContact CD2-CZ 3.72Å; M226-F230 HydrophobicContact CE-CB 3.64Å; M226-F230 HydrophobicContact CE-CD2 4.44Å; M226-F230 HydrophobicContact CE-CG 4.16Å; M226-F230 WeakPolarHBondContact O-CB 3.35Å; M226-F230 PolarHBondContact O-N 3.29Å; F230-T232 VanDerWaalsContact C-N 3.25Å; F230-T232 PolarHBondContact O-N 2.78Å; F230-G233 PolarHBondContact O-N 2.93Å; F230-A234 HydrophobicContact CE1-CB 4.4Å; F230-A234 WeakPolarHBondContact O-CB 3.4Å; F230-A234 PolarHBondContact O-N 3.12Å; F230-I366 HydrophobicContact CZ-CD1 4.33Å; F230-F370 AromaticContact CD1-CE2 3.6Å; F230-F370 HydrophobicContact CD1-CE2 3.6Å; F230-F370 AromaticContact CD1-CZ 3.49Å; F230-F370 HydrophobicContact CD1-CZ 3.49Å; F230-F370 VanDerWaalsContact CD1-CZ 3.49Å; F230-F370 HydrophobicContact CE1-CD2 4.48Å; F230-F370 AromaticContact CE1-CE2 3.19Å; F230-F370 HydrophobicContact CE1-CE2 3.19Å; F230-F370 AromaticContact CE1-CZ 3.39Å; F230-F370 HydrophobicContact CE1-CZ 3.39Å; F230-F370 HydrophobicContact CZ-CE2 4.18Å; F230-T496 HydrophobicContact CD2-CG2 3.82Å; F230-T496 WeakPolarHBondContact CD2-OG1 3.33Å; F230-T496 HydrophobicContact CE2-CG2 3.89Å; F230-T496 HydrophobicContact CG-CG2 4.46Å; F230-V501 HydrophobicContact CE2-CG1 3.93Å; F230-V501 VanDerWaalsContact CE2-O 3.28Å; F230-V501 WeakPolarHBondContact CE2-O 3.36Å; F230-V501 HydrophobicContact CZ-CG1 3.59Å; F230-L505 HydrophobicContact CD2-CB 3.92Å; F230-L505 HydrophobicContact CD2-CD1 4.3Å; F230-L505 HydrophobicContact CE2-CB 3.61Å; F230-L505 HydrophobicContact CE2-CD1 4.42Å; F230-L505 HydrophobicContact CZ-CB 4.45Å
231	A	87.3	Confident	89.2	Confident	18 Å²	18	20.1 Å²	20.1	15%	0.149	12%	0.118	C	C	.	.	H	α-helix	trans	-62	-35.7	179.9	0	0	0	0	0	111.8	L227 G229 S235 F370	L227-A231 VanDerWaalsContact O-CB 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.35Å; L227-A231 PolarHBondContact O-N 3.01Å; G229-A231 PolarHBondContact O-N 3.08Å; A231-S235 WeakPolarHBondContact O-CB 3.47Å; A231-S235 PolarHBondContact O-N 3.23Å; A231-S235 PolarHBondContact O-OG 3.15Å; A231-F370 HydrophobicContact CB-CE1 4.3Å; A231-F370 HydrophobicContact CB-CZ 4.3Å
232	T	92.1	Very high	89.8	Confident	2 Å²	2	15.5 Å²	15.5	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-67.5	-46.4	175.5	-51.8	0	0	0	0	110.9	D228 G229 F230 S235 V236 A468 W489 M493	D228-T232 WeakPolarHBondContact O-CB 3.4Å; D228-T232 PolarHBondContact O-N 3.12Å; D228-T232 VanDerWaalsContact O-N 3.08Å; D228-T232 PolarHBondContact O-OG1 3.04Å; G229-T232 WeakPolarHBondContact O-CB 3.43Å; G229-T232 PolarHBondContact O-N 2.91Å; F230-T232 VanDerWaalsContact C-N 3.25Å; F230-T232 PolarHBondContact O-N 2.78Å; T232-S235 WeakPolarHBondContact O-CB 3.48Å; T232-S235 PolarHBondContact O-N 3.29Å; T232-V236 PolarHBondContact O-N 2.91Å; T232-A468 PolarHBondContact OG1-O 3.32Å; T232-W489 HydrophobicContact CG2-CH2 4.46Å; T232-W489 HydrophobicContact CG2-CZ2 4.08Å; T232-M493 HydrophobicContact CG2-CG 4.2Å
233	G	93.1	Very high	90.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.5	-45.4	177.4	0	0	0	0	0	112.6	G229 F230 S235 V236 T237	G229-G233 PolarHBondContact O-N 3.32Å; F230-G233 PolarHBondContact O-N 2.93Å; G233-S235 VanDerWaalsContact C-N 3.27Å; G233-S235 PolarHBondContact O-N 2.98Å; G233-V236 WeakPolarHBondContact O-CB 3.38Å; G233-V236 PolarHBondContact O-N 3.34Å; G233-V236 VanDerWaalsContact O-N 3.1Å; G233-T237 PolarHBondContact O-N 3.48Å; G233-T237 VanDerWaalsContact O-N 3.09Å; G233-T237 PolarHBondContact O-OG1 3.48Å
234	A	89.5	Confident	90.4	Very high	4 Å²	4	14.2 Å²	14.2	3%	0.033	9%	0.092	C	C	.	.	H	α-helix	trans	-58.8	-39	173.2	0	0	0	0	0	112.3	L131 F230 V236 T237 I238 T496	L131-A234 HydrophobicContact CD1-CB 3.67Å; L131-A234 HydrophobicContact CD2-CB 4.23Å; F230-A234 HydrophobicContact CE1-CB 4.4Å; F230-A234 WeakPolarHBondContact O-CB 3.4Å; F230-A234 PolarHBondContact O-N 3.12Å; A234-V236 VanDerWaalsContact C-N 3.32Å; A234-V236 PolarHBondContact O-N 3.33Å; A234-T237 PolarHBondContact O-N 2.97Å; A234-I238 WeakPolarHBondContact O-CD1 3.14Å; A234-I238 VanDerWaalsContact O-CG1 3.26Å; A234-I238 WeakPolarHBondContact O-CG1 3.23Å; A234-I238 PolarHBondContact O-N 3.05Å; A234-T496 HydrophobicContact CB-CG2 4.08Å
235	S	91.1	Very high	90.6	Very high	7 Å²	7	12.2 Å²	12.2	5%	0.049	7%	0.071	C	C	.	.	H	α-helix	trans	-64.7	-35.9	176.4	-60.4	0	0	0	0	112.3	A231 T232 G233 I238 L239 A468	A231-S235 WeakPolarHBondContact O-CB 3.47Å; A231-S235 PolarHBondContact O-N 3.23Å; A231-S235 PolarHBondContact O-OG 3.15Å; T232-S235 WeakPolarHBondContact O-CB 3.48Å; T232-S235 PolarHBondContact O-N 3.29Å; G233-S235 VanDerWaalsContact C-N 3.27Å; G233-S235 PolarHBondContact O-N 2.98Å; S235-I238 PolarHBondContact O-N 3.34Å; S235-L239 VanDerWaalsContact O-CB 3.3Å; S235-L239 WeakPolarHBondContact O-CB 3.47Å; S235-L239 PolarHBondContact O-N 2.98Å; S235-A468 WeakPolarHBondContact OG-CB 3.48Å
236	V	93.5	Very high	90.7	Very high	35 Å²	35	12.7 Å²	12.7	21%	0.212	7%	0.072	C	C	.	.	H	α-helix	trans	-64.4	-44.6	172.9	173.2	0	0	0	0	110.7	T232 G233 A234 I238 L239 T240 V260 L469 M493 A497	T232-V236 PolarHBondContact O-N 2.91Å; G233-V236 WeakPolarHBondContact O-CB 3.38Å; G233-V236 PolarHBondContact O-N 3.34Å; G233-V236 VanDerWaalsContact O-N 3.1Å; A234-V236 VanDerWaalsContact C-N 3.32Å; A234-V236 PolarHBondContact O-N 3.33Å; V236-I238 PolarHBondContact O-N 2.88Å; V236-L239 WeakPolarHBondContact O-CB 3.34Å; V236-L239 PolarHBondContact O-N 2.89Å; V236-T240 PolarHBondContact O-N 2.9Å; V236-T240 PolarHBondContact O-OG1 3.16Å; V236-V260 HydrophobicContact CG1-CG1 4.49Å; V236-L469 HydrophobicContact CG2-CD2 3.89Å; V236-M493 HydrophobicContact CG2-CE 3.96Å; V236-A497 HydrophobicContact CB-CB 4.39Å; V236-A497 HydrophobicContact CG1-CB 4.38Å
237	T	91	Very high	90.8	Very high	8 Å²	8	14.2 Å²	14.2	5%	0.049	8%	0.08	C	C	.	.	H	α-helix	trans	-60.1	-45.4	176	-48.7	0	0	0	0	112	L134 G233 A234 T240 V241 V260 V501	L134-T237 HydrophobicContact CD2-CG2 3.99Å; G233-T237 PolarHBondContact O-N 3.48Å; G233-T237 VanDerWaalsContact O-N 3.09Å; G233-T237 PolarHBondContact O-OG1 3.48Å; A234-T237 PolarHBondContact O-N 2.97Å; T237-T240 PolarHBondContact O-N 2.94Å; T237-V241 WeakPolarHBondContact O-CG2 3.38Å; T237-V241 PolarHBondContact O-N 3.04Å; T237-V260 HydrophobicContact CG2-CG2 4.22Å; T237-V501 HydrophobicContact CG2-CG2 4.45Å
238	I	90.2	Very high	90.9	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.01	8%	0.08	C	C	.	.	H	α-helix	trans	-64.4	-44.4	178.3	-62.4	157.8	0	0	0	110.5	L96 S130 L134 A234 S235 V236 T240 V241 Q242 I461 L465	L96-I238 HydrophobicContact CD1-CG2 4.38Å; S130-I238 WeakPolarHBondContact OG-CD1 3.41Å; L134-I238 HydrophobicContact CD2-CG1 4.16Å; A234-I238 WeakPolarHBondContact O-CD1 3.14Å; A234-I238 VanDerWaalsContact O-CG1 3.26Å; A234-I238 WeakPolarHBondContact O-CG1 3.23Å; A234-I238 PolarHBondContact O-N 3.05Å; S235-I238 PolarHBondContact O-N 3.34Å; V236-I238 PolarHBondContact O-N 2.88Å; I238-T240 VanDerWaalsContact C-N 3.3Å; I238-T240 PolarHBondContact O-N 3.12Å; I238-V241 PolarHBondContact O-N 2.85Å; I238-Q242 HydrophobicContact CG2-CG 4.17Å; I238-Q242 WeakPolarHBondContact O-CB 3.31Å; I238-Q242 VanDerWaalsContact O-CG 3.27Å; I238-Q242 WeakPolarHBondContact O-CG 3.47Å; I238-Q242 PolarHBondContact O-N 2.89Å; I238-I461 HydrophobicContact CG2-CG2 3.62Å; I238-L465 HydrophobicContact CB-CD1 3.86Å; I238-L465 HydrophobicContact CD1-CD2 4.21Å; I238-L465 HydrophobicContact CG2-CD1 3.7Å
239	L	92.9	Very high	91	Very high	52 Å²	52	12.8 Å²	12.8	27%	0.272	8%	0.075	S	C	.	.	H	α-helix	trans	-54.2	-47.1	175.6	175.5	66.3	0	0	0	111.2	S235 V236 Q242 A243 I462 L469	S235-L239 VanDerWaalsContact O-CB 3.3Å; S235-L239 WeakPolarHBondContact O-CB 3.47Å; S235-L239 PolarHBondContact O-N 2.98Å; V236-L239 WeakPolarHBondContact O-CB 3.34Å; V236-L239 PolarHBondContact O-N 2.89Å; L239-Q242 PolarHBondContact O-N 2.82Å; L239-A243 PolarHBondContact O-N 3.16Å; L239-I462 HydrophobicContact CD1-CB 4.27Å; L239-I462 HydrophobicContact CD1-CD1 3.78Å; L239-I462 HydrophobicContact CD1-CG1 3.68Å; L239-I462 HydrophobicContact CD1-CG2 3.71Å; L239-L469 HydrophobicContact CD2-CD1 4.37Å
240	T	91.8	Very high	90.5	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.012	11%	0.105	C	C	.	.	H	α-helix	trans	-63.8	-43.6	178.5	-65	0	0	0	0	112.5	V236 T237 I238 Q242 A243 V260 T263 W264	V236-T240 PolarHBondContact O-N 2.9Å; V236-T240 PolarHBondContact O-OG1 3.16Å; T237-T240 PolarHBondContact O-N 2.94Å; I238-T240 VanDerWaalsContact C-N 3.3Å; I238-T240 PolarHBondContact O-N 3.12Å; T240-Q242 VanDerWaalsContact C-N 3.26Å; T240-Q242 PolarHBondContact O-N 3.08Å; T240-A243 WeakPolarHBondContact O-CB 3.39Å; T240-A243 PolarHBondContact O-N 3.34Å; T240-V260 HydrophobicContact CG2-CG1 4.44Å; T240-T263 HydrophobicContact CG2-CG2 3.75Å; T240-W264 HydrophobicContact CG2-CG 4.26Å; T240-W264 PolarHBondContact OG1-NE1 2.77Å
241	V	88.3	Confident	90.2	Very high	6 Å²	6	20.6 Å²	20.6	4%	0.036	11%	0.109	C	C	.	.	H	α-helix	trans	-65.9	-31.1	178.2	171.9	0	0	0	0	111.8	L96 L134 T237 I238 T259	L96-V241 HydrophobicContact CD2-CG1 3.82Å; L134-V241 HydrophobicContact CD1-CB 4.29Å; L134-V241 HydrophobicContact CD1-CG1 4.13Å; L134-V241 HydrophobicContact CD1-CG2 4.11Å; T237-V241 WeakPolarHBondContact O-CG2 3.38Å; T237-V241 PolarHBondContact O-N 3.04Å; I238-V241 PolarHBondContact O-N 2.85Å; V241-T259 HydrophobicContact CG2-CG2 4.27Å
242	Q	92	Very high	89.5	Confident	6 Å²	6	24.5 Å²	24.5	3%	0.028	13%	0.133	C	C	.	.	H	α-helix	trans	-80.1	-22.1	177.8	-69.1	-55.8	-49.3	0	0	114	I238 L239 T240 K244 Y245 L246 A458 I461 I462	I238-Q242 HydrophobicContact CG2-CG 4.17Å; I238-Q242 WeakPolarHBondContact O-CB 3.31Å; I238-Q242 VanDerWaalsContact O-CG 3.27Å; I238-Q242 WeakPolarHBondContact O-CG 3.47Å; I238-Q242 PolarHBondContact O-N 2.89Å; L239-Q242 PolarHBondContact O-N 2.82Å; T240-Q242 VanDerWaalsContact C-N 3.26Å; T240-Q242 PolarHBondContact O-N 3.08Å; Q242-K244 PolarHBondContact O-N 3.43Å; Q242-K244 VanDerWaalsContact O-N 3.16Å; Q242-Y245 PolarHBondContact O-N 3.31Å; Q242-L246 PolarHBondContact O-N 3.4Å; Q242-A458 HydrophobicContact CB-CB 4.34Å; Q242-A458 VanDerWaalsContact OE1-CB 3.24Å; Q242-I461 HydrophobicContact CG-CB 4.24Å; Q242-I461 HydrophobicContact CG-CD1 4.26Å; Q242-I461 HydrophobicContact CG-CG2 3.93Å; Q242-I462 HydrophobicContact CB-CD1 3.95Å; Q242-I462 HydrophobicContact CB-CG1 4.02Å
243	A	92.7	Very high	88.5	Confident	10 Å²	10	26.9 Å²	26.9	8%	0.083	14%	0.142	C	C	.	.	H	α-helix	trans	-57.7	-32.9	-176.6	0	0	0	0	0	113.2	L239 T240 Y245 L246 L247 I267	L239-A243 PolarHBondContact O-N 3.16Å; T240-A243 WeakPolarHBondContact O-CB 3.39Å; T240-A243 PolarHBondContact O-N 3.34Å; A243-Y245 VanDerWaalsContact C-N 3.29Å; A243-Y245 PolarHBondContact O-N 3.05Å; A243-L246 PolarHBondContact O-N 2.71Å; A243-L247 PolarHBondContact O-N 3.35Å; A243-I267 HydrophobicContact CB-CD1 3.82Å
244	K	90.3	Very high	87.7	Confident	13 Å²	13	30 Å²	30	6%	0.057	16%	0.157	C	C	.	.	H	α-helix	trans	-60.6	-36.7	176.4	73.5	178.1	-171.5	164.1	0	112.9	E153 Q242 L247 G248 L249 I251	E153-K244 IonicContact OE1-NZ 2.67Å; E153-K244 PolarHBondContact OE1-NZ 3.48Å; Q242-K244 PolarHBondContact O-N 3.43Å; Q242-K244 VanDerWaalsContact O-N 3.16Å; K244-L247 PolarHBondContact O-N 2.84Å; K244-G248 PolarHBondContact O-N 3.25Å; K244-G248 VanDerWaalsContact O-N 3.15Å; K244-L249 HydrophobicContact CB-CB 4.49Å; K244-L249 PolarHBondContact O-N 2.9Å; K244-I251 PolarHBondContact NZ-O 2.99Å
245	Y	90.4	Very high	86.7	Confident	24 Å²	24	33.3 Å²	33.3	9%	0.094	17%	0.171	C	C	.	.	H	α-helix	trans	-76.5	-27.6	-179.3	-65	-62.6	0	0	0	112.6	E153 Q242 A243 L247 G248 K454 C455	E153-Y245 VanDerWaalsContact CD-OH 3.3Å; E153-Y245 PolarHBondContact OE1-OH 3.16Å; E153-Y245 PolarHBondContact OE2-OH 3.46Å; Q242-Y245 PolarHBondContact O-N 3.31Å; A243-Y245 VanDerWaalsContact C-N 3.29Å; A243-Y245 PolarHBondContact O-N 3.05Å; Y245-L247 VanDerWaalsContact C-N 3.26Å; Y245-L247 PolarHBondContact O-N 3.33Å; Y245-G248 PolarHBondContact O-N 3.04Å; Y245-K454 HydrophobicContact CD1-CB 4.24Å; Y245-K454 HydrophobicContact CE1-CD 4.33Å; Y245-C455 WeakPolarHBondContact O-CA 3.23Å; Y245-C455 WeakPolarHBondContact O-CB 3.45Å
246	L	93	Very high	85.7	Confident	29 Å²	29	34.8 Å²	34.8	15%	0.152	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-37.8	171.7	-64.3	-179	0	0	0	111.7	Q242 A243 D278 S282 I286 A458 C459 I462	Q242-L246 PolarHBondContact O-N 3.4Å; A243-L246 PolarHBondContact O-N 2.71Å; L246-D278 CarbonylContact O-C 3.59Å; L246-S282 PolarHBondContact O-OG 3.12Å; L246-S282 VanDerWaalsContact O-OG 3.05Å; L246-I286 HydrophobicContact CD1-CD1 4.28Å; L246-I286 HydrophobicContact CD2-CD1 4Å; L246-A458 HydrophobicContact CD2-CB 4.29Å; L246-C459 WeakPolarHBondContact CD2-SG 3.44Å; L246-I462 HydrophobicContact CD1-CD1 3.47Å; L246-I462 VanDerWaalsContact CD1-CD1 3.47Å; L246-I462 HydrophobicContact CD2-CD1 4.06Å; L246-I462 HydrophobicContact CG-CD1 3.88Å
247	L	92.2	Very high	85.3	Confident	32 Å²	32	41 Å²	41	17%	0.168	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-3.3	-179	-58	175.5	0	0	0	112.8	A243 K244 Y245 L249 I267 I271 T274 N275 L279	A243-L247 PolarHBondContact O-N 3.35Å; K244-L247 PolarHBondContact O-N 2.84Å; Y245-L247 VanDerWaalsContact C-N 3.26Å; Y245-L247 PolarHBondContact O-N 3.33Å; L247-L249 HydrophobicContact CB-CD1 3.78Å; L247-L249 HydrophobicContact CB-CG 3.7Å; L247-L249 HydrophobicContact CD1-CD1 3.73Å; L247-L249 HydrophobicContact CG-CD1 4.42Å; L247-L249 PolarHBondContact O-N 3.02Å; L247-I267 HydrophobicContact CD1-CG2 3.65Å; L247-I271 HydrophobicContact CD1-CD1 3.77Å; L247-T274 HydrophobicContact CB-CG2 4.13Å; L247-T274 HydrophobicContact CD2-CG2 4.34Å; L247-T274 WeakPolarHBondContact O-CA 3.21Å; L247-T274 VanDerWaalsContact O-CG2 3.26Å; L247-T274 WeakPolarHBondContact O-CG2 3.15Å; L247-N275 PolarHBondContact O-N 3.42Å; L247-L279 HydrophobicContact CD2-CD1 3.82Å
248	G	88.8	Confident	85	Confident	12 Å²	12	41.3 Å²	41.3	12%	0.124	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	25.9	-174.3	0	0	0	0	0	113.9	K244 Y245 D278	K244-G248 PolarHBondContact O-N 3.25Å; K244-G248 VanDerWaalsContact O-N 3.15Å; Y245-G248 PolarHBondContact O-N 3.04Å; G248-D278 WeakPolarHBondContact CA-OD2 3.38Å
249	L	88.8	Confident	84.8	Confident	7 Å²	7	41.7 Å²	41.7	4%	0.037	22%	0.216	C	C	.	.			trans	-86.2	129.1	-176.8	-65.6	174.2	0	0	0	111.5	K244 L247 I251 I267 N270 K273	K244-L249 HydrophobicContact CB-CB 4.49Å; K244-L249 PolarHBondContact O-N 2.9Å; L247-L249 HydrophobicContact CB-CD1 3.78Å; L247-L249 HydrophobicContact CB-CG 3.7Å; L247-L249 HydrophobicContact CD1-CD1 3.73Å; L247-L249 HydrophobicContact CG-CD1 4.42Å; L247-L249 PolarHBondContact O-N 3.02Å; L249-I251 HydrophobicContact CB-CD1 3.84Å; L249-I251 HydrophobicContact CB-CG1 3.98Å; L249-I251 HydrophobicContact CD1-CD1 3.92Å; L249-I251 HydrophobicContact CG-CD1 4.47Å; L249-I251 PolarHBondContact O-N 3.36Å; L249-I267 HydrophobicContact CD1-CG2 4.33Å; L249-N270 WeakPolarHBondContact CD2-O 3.34Å; L249-K273 VanDerWaalsContact CD2-C 3.44Å; L249-K273 HydrophobicContact CD2-CB 4.02Å; L249-K273 WeakPolarHBondContact CD2-O 3.5Å
250	K	82.4	Confident	84.7	Confident	145 Å²	145	39.9 Å²	39.9	63%	0.63	21%	0.207	S	C	*	.			trans	-90.7	77.5	175.2	-58.3	-172.5	-172.9	-170.5	0	110.7	D154	D154-K250 VanDerWaalsContact OD2-CE 3.23Å; D154-K250 WeakPolarHBondContact OD2-CE 3.33Å; D154-K250 IonicContact OD2-NZ 2.8Å; D154-K250 PolarHBondContact OD2-NZ 3.05Å
251	I	82	Confident	84.7	Confident	18 Å²	18	44.1 Å²	44.1	9%	0.092	23%	0.233	C	C	.	.			trans	-108.7	134	-178.2	-57.7	169.6	0	0	0	109.8	K244 L249 N266 I267 N270	K244-I251 PolarHBondContact NZ-O 2.99Å; L249-I251 HydrophobicContact CB-CD1 3.84Å; L249-I251 HydrophobicContact CB-CG1 3.98Å; L249-I251 HydrophobicContact CD1-CD1 3.92Å; L249-I251 HydrophobicContact CG-CD1 4.47Å; L249-I251 PolarHBondContact O-N 3.36Å; I251-N266 HydrophobicContact CG2-CB 4.02Å; I251-I267 HydrophobicContact CD1-CG1 4.07Å; I251-N270 HydrophobicContact CD1-CB 4.12Å; I251-N270 HydrophobicContact CG1-CB 4.44Å
252	P	73.1	Confident	84.8	Confident	100 Å²	100	46 Å²	46	65%	0.649	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-62.7	143	173.9	27.3	-34.7	0	0	0	110.5	H254	P252-H254 PolarHBondContact O-N 3.25Å
253	R	72.3	Confident	84.7	Confident	52 Å²	52	46.4 Å²	46.4	20%	0.196	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-78.3	124.1	-178.6	-170.2	167.3	172	-176.5	-18.4	109.6	L96 L134	L96-R253 PolarHBondContact O-NH1 2.9Å; L134-R253 PolarHBondContact O-NH2 3.35Å; L134-R253 VanDerWaalsContact O-NH2 3.14Å
254	H	76.3	Confident	84.7	Confident	67 Å²	67	50.4 Å²	50.4	31%	0.31	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-67.4	136.7	174	-174.9	68.2	0	0	0	110.4	P252 V262	P252-H254 PolarHBondContact O-N 3.25Å; H254-V262 HydrophobicContact CB-CB 4.4Å; H254-V262 HydrophobicContact CB-CG1 3.97Å
255	Q	67.7	Low	84.8	Confident	72 Å²	72	56.9 Å²	56.9	34%	0.336	29%	0.289	S	S	.	.			trans	-107.1	138.5	174.6	-63.7	-152.4	1.7	0	0	110.6	V141 R142	V141-Q255 VanDerWaalsContact C-NE2 3.32Å; R142-Q255 VanDerWaalsContact N-NE2 3.11Å
256	G	70.8	Confident	84.8	Confident	39 Å²	39	57.9 Å²	57.9	40%	0.402	30%	0.296	S	S	.	.	S	Bend	trans	108.4	-163.1	175.1	0	0	0	0	0	114.5	T259	G256-T259 PolarHBondContact O-OG1 3.09Å
257	Y	84.5	Confident	84.8	Confident	164 Å²	164	56.6 Å²	56.6	64%	0.643	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	145.6	-175.1	-53.1	-56.3	0	0	0	111.7	I499 L503	Y257-I499 VanDerWaalsContact CA-O 3.32Å; Y257-I499 WeakPolarHBondContact CA-O 3.26Å; Y257-I499 HydrophobicContact CD1-CG2 3.92Å; Y257-I499 HydrophobicContact CE1-CG2 4.49Å; Y257-L503 HydrophobicContact CD1-CD1 4.06Å; Y257-L503 HydrophobicContact CE1-CD1 3.33Å; Y257-L503 HydrophobicContact CE1-CG 4.35Å
258	G	85.6	Confident	84.9	Confident	15 Å²	15	61.3 Å²	61.3	16%	0.155	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	21.6	178.3	0	0	0	0	0	114.5	V260 V261 V262 L498 I499	G258-V260 PolarHBondContact O-N 2.85Å; G258-V261 PolarHBondContact O-N 2.8Å; G258-V262 PolarHBondContact O-N 3.12Å; G258-V262 VanDerWaalsContact O-N 3.12Å; G258-L498 VanDerWaalsContact CA-O 3.27Å; G258-L498 WeakPolarHBondContact CA-O 3.16Å; G258-L498 PolarHBondContact N-O 2.87Å; G258-I499 PolarHBondContact N-O 2.98Å
259	T	85.6	Confident	85	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.067	32%	0.324	C	S	.	.	H	α-helix	trans	-47.1	-41	179.3	-63.9	0	0	0	0	112.5	V241 G256 T263	V241-T259 HydrophobicContact CG2-CG2 4.27Å; G256-T259 PolarHBondContact O-OG1 3.09Å; T259-T263 WeakPolarHBondContact O-CB 3.3Å; T259-T263 PolarHBondContact O-N 2.88Å; T259-T263 PolarHBondContact O-OG1 3.28Å
260	V	90.9	Very high	85.2	Confident	14 Å²	14	65.2 Å²	65.2	9%	0.085	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-49.6	-179.8	171.1	0	0	0	0	111.7	V236 T237 T240 G258 W264 A497	V236-V260 HydrophobicContact CG1-CG1 4.49Å; T237-V260 HydrophobicContact CG2-CG2 4.22Å; T240-V260 HydrophobicContact CG2-CG1 4.44Å; G258-V260 PolarHBondContact O-N 2.85Å; V260-W264 VanDerWaalsContact O-CD1 3.23Å; V260-W264 PolarHBondContact O-N 3.34Å; V260-A497 WeakPolarHBondContact CG2-O 3.33Å
261	V	91.8	Very high	85.7	Confident	91 Å²	91	62.2 Å²	62.2	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-67.2	-48.3	-175.3	-179.6	0	0	0	0	110.6	G258 T263 W264 F265	G258-V261 PolarHBondContact O-N 2.8Å; V261-T263 PolarHBondContact O-N 3.47Å; V261-W264 PolarHBondContact O-N 2.76Å; V261-F265 PolarHBondContact O-N 2.72Å; V261-F265 VanDerWaalsContact O-N 3.09Å
262	V	90.2	Very high	86.2	Confident	45 Å²	45	68 Å²	68	27%	0.273	35%	0.35	S	S	.	.	H	α-helix	trans	-65.3	-40.5	-177.7	179.7	0	0	0	0	111.5	H254 G258 W264 F265 N266	H254-V262 HydrophobicContact CB-CB 4.4Å; H254-V262 HydrophobicContact CB-CG1 3.97Å; G258-V262 PolarHBondContact O-N 3.12Å; G258-V262 VanDerWaalsContact O-N 3.12Å; V262-W264 PolarHBondContact O-N 2.58Å; V262-F265 PolarHBondContact O-N 2.87Å; V262-N266 PolarHBondContact O-N 2.9Å
263	T	89.9	Confident	87	Confident	14 Å²	14	69.7 Å²	69.7	9%	0.086	35%	0.347	C	S	.	.	H	α-helix	trans	-64.9	-42.3	179.4	-57.4	0	0	0	0	111.4	T240 T259 V261 N266 I267	T240-T263 HydrophobicContact CG2-CG2 3.75Å; T259-T263 WeakPolarHBondContact O-CB 3.3Å; T259-T263 PolarHBondContact O-N 2.88Å; T259-T263 PolarHBondContact O-OG1 3.28Å; V261-T263 PolarHBondContact O-N 3.47Å; T263-N266 PolarHBondContact O-N 3.49Å; T263-I267 HydrophobicContact CG2-CD1 3.92Å; T263-I267 HydrophobicContact CG2-CG1 4.42Å; T263-I267 VanDerWaalsContact O-CG1 3.28Å; T263-I267 WeakPolarHBondContact O-CG1 3.36Å; T263-I267 PolarHBondContact O-N 3.18Å
264	W	92.8	Very high	88	Confident	94 Å²	94	69.1 Å²	69.1	36%	0.356	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-42.2	175.8	-85.6	115.9	0	0	0	112.3	T240 V260 V261 V262 N266 I267 F268	T240-W264 HydrophobicContact CG2-CG 4.26Å; T240-W264 PolarHBondContact OG1-NE1 2.77Å; V260-W264 VanDerWaalsContact O-CD1 3.23Å; V260-W264 PolarHBondContact O-N 3.34Å; V261-W264 PolarHBondContact O-N 2.76Å; V262-W264 PolarHBondContact O-N 2.58Å; W264-N266 VanDerWaalsContact C-N 3.34Å; W264-N266 PolarHBondContact O-N 2.88Å; W264-I267 HydrophobicContact CE3-CD1 4.48Å; W264-I267 PolarHBondContact O-N 3.47Å; W264-F268 HydrophobicContact CB-CE2 4.23Å; W264-F268 HydrophobicContact CD2-CE2 4.42Å; W264-F268 HydrophobicContact CE3-CD2 4.49Å; W264-F268 HydrophobicContact CE3-CE1 4.29Å; W264-F268 AromaticContact CE3-CE2 3.72Å; W264-F268 HydrophobicContact CE3-CE2 3.72Å; W264-F268 AromaticContact CE3-CZ 3.6Å; W264-F268 HydrophobicContact CE3-CZ 3.6Å; W264-F268 HydrophobicContact CZ3-CE1 4.35Å; W264-F268 HydrophobicContact CZ3-CE2 4.48Å; W264-F268 AromaticContact CZ3-CZ 3.9Å; W264-F268 HydrophobicContact CZ3-CZ 3.9Å; W264-F268 WeakPolarHBondContact O-CD2 3.24Å; W264-F268 WeakPolarHBondContact O-CG 3.1Å; W264-F268 PolarHBondContact O-N 3.23Å
265	F	92.5	Very high	88.8	Confident	149 Å²	149	67.3 Å²	67.3	65%	0.654	34%	0.342	S	S	*	.	H	α-helix	trans	-57.4	-47.1	173.6	-178.1	-95.2	0	0	0	111.7	V261 V262 I267 F268 A269	V261-F265 PolarHBondContact O-N 2.72Å; V261-F265 VanDerWaalsContact O-N 3.09Å; V262-F265 PolarHBondContact O-N 2.87Å; F265-I267 PolarHBondContact O-N 2.75Å; F265-F268 PolarHBondContact O-N 3.26Å; F265-A269 WeakPolarHBondContact O-CB 3.35Å; F265-A269 PolarHBondContact O-N 3.06Å
266	N	89.9	Confident	90	Very high	45 Å²	45	69.4 Å²	69.4	24%	0.241	36%	0.355	C	S	.	.	H	α-helix	trans	-64.9	-36	178.4	-71.2	-16.5	0	0	0	113.2	I251 V262 T263 W264 N270	I251-N266 HydrophobicContact CG2-CB 4.02Å; V262-N266 PolarHBondContact O-N 2.9Å; T263-N266 PolarHBondContact O-N 3.49Å; W264-N266 VanDerWaalsContact C-N 3.34Å; W264-N266 PolarHBondContact O-N 2.88Å; N266-N270 PolarHBondContact O-N 3.13Å; N266-N270 VanDerWaalsContact O-N 3.15Å; N266-N270 PolarHBondContact O-ND2 3.32Å
267	I	92.3	Very high	91.1	Very high	2 Å²	2	68.3 Å²	68.3	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-49.6	174.7	-72.9	167.7	0	0	0	110	A243 L247 L249 I251 T263 W264 F265 A269 N270 I271	A243-I267 HydrophobicContact CB-CD1 3.82Å; L247-I267 HydrophobicContact CD1-CG2 3.65Å; L249-I267 HydrophobicContact CD1-CG2 4.33Å; I251-I267 HydrophobicContact CD1-CG1 4.07Å; T263-I267 HydrophobicContact CG2-CD1 3.92Å; T263-I267 HydrophobicContact CG2-CG1 4.42Å; T263-I267 VanDerWaalsContact O-CG1 3.28Å; T263-I267 WeakPolarHBondContact O-CG1 3.36Å; T263-I267 PolarHBondContact O-N 3.18Å; W264-I267 HydrophobicContact CE3-CD1 4.48Å; W264-I267 PolarHBondContact O-N 3.47Å; F265-I267 PolarHBondContact O-N 2.75Å; I267-A269 VanDerWaalsContact C-N 3.32Å; I267-A269 PolarHBondContact O-N 2.89Å; I267-N270 CarbonylContact O-C 3.51Å; I267-N270 PolarHBondContact O-N 3.47Å; I267-I271 PolarHBondContact O-N 3.38Å
268	F	94	Very high	91.5	Very high	132 Å²	132	60.6 Å²	60.6	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-64.1	-37.2	179.8	-68.1	-52.4	0	0	0	112.2	W264 F265 N270 I271	W264-F268 HydrophobicContact CB-CE2 4.23Å; W264-F268 HydrophobicContact CD2-CE2 4.42Å; W264-F268 HydrophobicContact CE3-CD2 4.49Å; W264-F268 HydrophobicContact CE3-CE1 4.29Å; W264-F268 AromaticContact CE3-CE2 3.72Å; W264-F268 HydrophobicContact CE3-CE2 3.72Å; W264-F268 AromaticContact CE3-CZ 3.6Å; W264-F268 HydrophobicContact CE3-CZ 3.6Å; W264-F268 HydrophobicContact CZ3-CE1 4.35Å; W264-F268 HydrophobicContact CZ3-CE2 4.48Å; W264-F268 AromaticContact CZ3-CZ 3.9Å; W264-F268 HydrophobicContact CZ3-CZ 3.9Å; W264-F268 WeakPolarHBondContact O-CD2 3.24Å; W264-F268 WeakPolarHBondContact O-CG 3.1Å; W264-F268 PolarHBondContact O-N 3.23Å; F265-F268 PolarHBondContact O-N 3.26Å; F268-N270 VanDerWaalsContact C-N 3.32Å; F268-N270 PolarHBondContact O-N 3.22Å; F268-I271 WeakPolarHBondContact O-CG2 3.49Å
269	A	92.6	Very high	91.9	Very high	54 Å²	54	63 Å²	63	45%	0.446	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-34.9	175.2	0	0	0	0	0	113	F265 I267 H272	F265-A269 WeakPolarHBondContact O-CB 3.35Å; F265-A269 PolarHBondContact O-N 3.06Å; I267-A269 VanDerWaalsContact C-N 3.32Å; I267-A269 PolarHBondContact O-N 2.89Å; A269-H272 PolarHBondContact O-CE1 2.62Å; A269-H272 PolarHBondContact O-ND1 3.19Å
270	N	92.2	Very high	92.4	Very high	46 Å²	46	66.7 Å²	66.7	25%	0.246	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	12.6	-176.7	-69.3	-82.1	0	0	0	114	L249 I251 N266 I267 F268 H272 K273	L249-N270 WeakPolarHBondContact CD2-O 3.34Å; I251-N270 HydrophobicContact CD1-CB 4.12Å; I251-N270 HydrophobicContact CG1-CB 4.44Å; N266-N270 PolarHBondContact O-N 3.13Å; N266-N270 VanDerWaalsContact O-N 3.15Å; N266-N270 PolarHBondContact O-ND2 3.32Å; I267-N270 CarbonylContact O-C 3.51Å; I267-N270 PolarHBondContact O-N 3.47Å; F268-N270 VanDerWaalsContact C-N 3.32Å; F268-N270 PolarHBondContact O-N 3.22Å; N270-H272 PolarHBondContact O-N 2.89Å; N270-K273 PolarHBondContact O-N 3.35Å
271	I	92.8	Very high	92.6	Very high	82 Å²	82	67 Å²	67	42%	0.421	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-58.8	-26.3	-174.8	-160.7	65.9	0	0	0	113.2	L247 I267 F268 K273 T274	L247-I271 HydrophobicContact CD1-CD1 3.77Å; I267-I271 PolarHBondContact O-N 3.38Å; F268-I271 WeakPolarHBondContact O-CG2 3.49Å; I271-K273 PolarHBondContact O-N 2.86Å; I271-T274 WeakPolarHBondContact O-CB 3.4Å; I271-T274 PolarHBondContact O-N 3.43Å; I271-T274 PolarHBondContact O-OG1 3.5Å
272	H	92	Very high	92.8	Very high	139 Å²	139	62.9 Å²	62.9	64%	0.644	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-69.6	-17.2	177.2	63.7	-85.1	0	0	0	113.8	A269 N270 T274	A269-H272 PolarHBondContact O-CE1 2.62Å; A269-H272 PolarHBondContact O-ND1 3.19Å; N270-H272 PolarHBondContact O-N 2.89Å; H272-T274 VanDerWaalsContact C-N 3.33Å
273	K	90.7	Very high	93.1	Very high	136 Å²	136	63.5 Å²	63.5	59%	0.591	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-93.8	14.5	178.7	-59.8	-178.3	179.7	168.6	0	113.3	L249 N270 I271	L249-K273 VanDerWaalsContact CD2-C 3.44Å; L249-K273 HydrophobicContact CD2-CB 4.02Å; L249-K273 WeakPolarHBondContact CD2-O 3.5Å; N270-K273 PolarHBondContact O-N 3.35Å; I271-K273 PolarHBondContact O-N 2.86Å
274	T	92.5	Very high	93.3	Very high	40 Å²	40	67.2 Å²	67.2	25%	0.245	34%	0.344	C	S	.	.			trans	-63.8	134.7	-176.6	-64.8	0	0	0	0	110.9	L247 I271 H272 L276 L279	L247-T274 HydrophobicContact CB-CG2 4.13Å; L247-T274 HydrophobicContact CD2-CG2 4.34Å; L247-T274 WeakPolarHBondContact O-CA 3.21Å; L247-T274 VanDerWaalsContact O-CG2 3.26Å; L247-T274 WeakPolarHBondContact O-CG2 3.15Å; I271-T274 WeakPolarHBondContact O-CB 3.4Å; I271-T274 PolarHBondContact O-N 3.43Å; I271-T274 PolarHBondContact O-OG1 3.5Å; H272-T274 VanDerWaalsContact C-N 3.33Å; T274-L276 PolarHBondContact O-N 2.86Å; T274-L279 HydrophobicContact CG2-CB 4.24Å; T274-L279 HydrophobicContact CG2-CD2 4.2Å
275	N	93.5	Very high	93.5	Very high	30 Å²	30	63 Å²	63	16%	0.16	33%	0.329	C	S	.	.			trans	-82.5	116.1	172.9	-170.4	-38.7	0	0	0	109.8	L247 C277 D278 L279 Y330 H331	L247-N275 PolarHBondContact O-N 3.42Å; N275-C277 VanDerWaalsContact C-N 3.3Å; N275-C277 PolarHBondContact O-N 3.5Å; N275-C277 WeakPolarHBondContact OD1-CB 3.47Å; N275-C277 PolarHBondContact OD1-N 2.98Å; N275-D278 HydrophobicContact CB-CB 4.22Å; N275-D278 PolarHBondContact O-N 3.45Å; N275-L279 PolarHBondContact O-N 3.41Å; N275-Y330 PolarHBondContact ND2-O 3.09Å; N275-H331 PolarHBondContact ND2-O 3.22Å
276	L	92.9	Very high	93.6	Very high	115 Å²	115	58.4 Å²	58.4	60%	0.602	31%	0.311	S	S	*	.	H	α-helix	trans	-64	-34.2	-177	-173.2	63.4	0	0	0	112.7	T274 L279 I280	T274-L276 PolarHBondContact O-N 2.86Å; L276-L279 HydrophobicContact CD1-CD2 4.45Å; L276-L279 PolarHBondContact O-N 3.33Å; L276-I280 HydrophobicContact CD1-CD1 4.06Å; L276-I280 HydrophobicContact CD1-CG1 4.21Å; L276-I280 HydrophobicContact CD2-CD1 4.4Å; L276-I280 HydrophobicContact CG-CD1 3.82Å; L276-I280 HydrophobicContact CG-CG1 4.37Å; L276-I280 VanDerWaalsContact O-CG1 3.31Å; L276-I280 WeakPolarHBondContact O-CG1 3.41Å; L276-I280 PolarHBondContact O-N 3.39Å
277	C	93.5	Very high	93.8	Very high	17 Å²	17	59.1 Å²	59.1	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-45.9	178	-179.4	0	0	0	0	111	N275 T281 Y330	N275-C277 VanDerWaalsContact C-N 3.3Å; N275-C277 PolarHBondContact O-N 3.5Å; N275-C277 WeakPolarHBondContact OD1-CB 3.47Å; N275-C277 PolarHBondContact OD1-N 2.98Å; C277-T281 VanDerWaalsContact O-CB 3.3Å; C277-T281 WeakPolarHBondContact O-CB 3.39Å; C277-T281 PolarHBondContact O-N 3.33Å; C277-T281 PolarHBondContact O-OG1 2.83Å; C277-Y330 HydrophobicContact CB-CD1 4.4Å; C277-Y330 HydrophobicContact CB-CG 4.01Å
278	D	93.5	Very high	93.9	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.011	34%	0.343	C	S	.	.	H	α-helix	trans	-67.6	-38	177.9	-71.6	-28	0	0	0	112	L246 G248 N275 S282 S332 Q453 C455	L246-D278 CarbonylContact O-C 3.59Å; G248-D278 WeakPolarHBondContact CA-OD2 3.38Å; N275-D278 HydrophobicContact CB-CB 4.22Å; N275-D278 PolarHBondContact O-N 3.45Å; D278-S282 WeakPolarHBondContact O-CB 3.39Å; D278-S282 PolarHBondContact O-N 3.3Å; D278-S282 PolarHBondContact O-OG 3.39Å; D278-S332 WeakPolarHBondContact OD1-CB 3.5Å; D278-S332 PolarHBondContact OD1-OG 2.92Å; D278-Q453 PolarHBondContact OD1-NE2 3.39Å; D278-C455 HydrophobicContact CB-CB 4.04Å; D278-C455 PolarHBondContact OD1-SG 3.35Å
279	L	94.8	Very high	93.8	Very high	66 Å²	66	56.9 Å²	56.9	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-64	-47.9	176.8	-179.6	65.7	0	0	0	112.2	L247 T274 N275 L276 S282 A283	L247-L279 HydrophobicContact CD2-CD1 3.82Å; T274-L279 HydrophobicContact CG2-CB 4.24Å; T274-L279 HydrophobicContact CG2-CD2 4.2Å; N275-L279 PolarHBondContact O-N 3.41Å; L276-L279 HydrophobicContact CD1-CD2 4.45Å; L276-L279 PolarHBondContact O-N 3.33Å; L279-S282 PolarHBondContact O-N 3.03Å; L279-S282 PolarHBondContact O-OG 3.07Å; L279-A283 WeakPolarHBondContact O-CB 3.2Å; L279-A283 PolarHBondContact O-N 3.4Å
280	I	95.3	Very high	93.8	Very high	88 Å²	88	56.8 Å²	56.8	45%	0.451	31%	0.309	S	S	.	.	H	α-helix	trans	-64.9	-46.4	179	-68.2	170.1	0	0	0	109.9	L276 S282 A283 I284	L276-I280 HydrophobicContact CD1-CD1 4.06Å; L276-I280 HydrophobicContact CD1-CG1 4.21Å; L276-I280 HydrophobicContact CD2-CD1 4.4Å; L276-I280 HydrophobicContact CG-CD1 3.82Å; L276-I280 HydrophobicContact CG-CG1 4.37Å; L276-I280 VanDerWaalsContact O-CG1 3.31Å; L276-I280 WeakPolarHBondContact O-CG1 3.41Å; L276-I280 PolarHBondContact O-N 3.39Å; I280-S282 VanDerWaalsContact C-N 3.32Å; I280-S282 PolarHBondContact O-N 3.32Å; I280-A283 PolarHBondContact O-N 3.44Å; I280-I284 HydrophobicContact CG2-CD1 3.81Å; I280-I284 WeakPolarHBondContact O-CG1 3.38Å; I280-I284 PolarHBondContact O-N 3.32Å
281	T	94.8	Very high	93.8	Very high	21 Å²	21	56.8 Å²	56.8	13%	0.129	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-43.8	179.5	-55.7	0	0	0	0	111	C277 I284 C285 V456	C277-T281 VanDerWaalsContact O-CB 3.3Å; C277-T281 WeakPolarHBondContact O-CB 3.39Å; C277-T281 PolarHBondContact O-N 3.33Å; C277-T281 PolarHBondContact O-OG1 2.83Å; T281-I284 PolarHBondContact O-N 2.72Å; T281-C285 WeakPolarHBondContact O-CB 3.43Å; T281-C285 PolarHBondContact O-N 3.03Å; T281-C285 PolarHBondContact O-SG 3.04Å; T281-V456 HydrophobicContact CG2-CG2 3.96Å
282	S	95.6	Very high	93.6	Very high	4 Å²	4	53.3 Å²	53.3	3%	0.028	30%	0.301	C	S	.	.	H	α-helix	trans	-67.6	-38.3	179.5	65.3	0	0	0	0	112.9	L246 D278 L279 I280 C285 I286 C459	L246-S282 PolarHBondContact O-OG 3.12Å; L246-S282 VanDerWaalsContact O-OG 3.05Å; D278-S282 WeakPolarHBondContact O-CB 3.39Å; D278-S282 PolarHBondContact O-N 3.3Å; D278-S282 PolarHBondContact O-OG 3.39Å; L279-S282 PolarHBondContact O-N 3.03Å; L279-S282 PolarHBondContact O-OG 3.07Å; I280-S282 VanDerWaalsContact C-N 3.32Å; I280-S282 PolarHBondContact O-N 3.32Å; S282-C285 PolarHBondContact O-N 3.47Å; S282-I286 WeakPolarHBondContact O-CB 3.32Å; S282-I286 VanDerWaalsContact O-CG1 3.32Å; S282-I286 WeakPolarHBondContact O-CG1 3.33Å; S282-I286 PolarHBondContact O-N 2.65Å; S282-C459 VanDerWaalsContact CA-SG 3.55Å; S282-C459 VanDerWaalsContact CB-SG 3.53Å
283	A	96.1	Very high	93.2	Very high	58 Å²	58	48.7 Å²	48.7	48%	0.479	28%	0.279	S	S	.	.	H	α-helix	trans	-61.6	-46.2	174.4	0	0	0	0	0	111.9	L279 I280 A287	L279-A283 WeakPolarHBondContact O-CB 3.2Å; L279-A283 PolarHBondContact O-N 3.4Å; I280-A283 PolarHBondContact O-N 3.44Å; A283-A287 WeakPolarHBondContact O-CB 3.33Å; A283-A287 PolarHBondContact O-N 2.85Å
284	I	96.1	Very high	93	Very high	92 Å²	92	46.3 Å²	46.3	47%	0.472	27%	0.27	S	S	.	.	H	α-helix	trans	-63.7	-46.1	176.4	-66	169.1	0	0	0	110.5	I280 T281 I286 A287 I288	I280-I284 HydrophobicContact CG2-CD1 3.81Å; I280-I284 WeakPolarHBondContact O-CG1 3.38Å; I280-I284 PolarHBondContact O-N 3.32Å; T281-I284 PolarHBondContact O-N 2.72Å; I284-I286 PolarHBondContact O-N 3.39Å; I284-A287 PolarHBondContact O-N 3.04Å; I284-I288 HydrophobicContact CG2-CD1 3.71Å; I284-I288 HydrophobicContact CG2-CG1 4.4Å; I284-I288 WeakPolarHBondContact O-CG1 3.4Å; I284-I288 PolarHBondContact O-N 2.64Å
285	C	95.6	Very high	92.8	Very high	6 Å²	6	48.4 Å²	48.4	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-46.1	179.6	-72.8	0	0	0	0	112	T281 S282 A287 I288 L289 V313 C459	T281-C285 WeakPolarHBondContact O-CB 3.43Å; T281-C285 PolarHBondContact O-N 3.03Å; T281-C285 PolarHBondContact O-SG 3.04Å; S282-C285 PolarHBondContact O-N 3.47Å; C285-A287 VanDerWaalsContact C-N 3.35Å; C285-A287 PolarHBondContact O-N 3.21Å; C285-I288 PolarHBondContact O-N 3.43Å; C285-L289 VanDerWaalsContact O-CB 3.32Å; C285-L289 WeakPolarHBondContact O-CB 3.44Å; C285-L289 VanDerWaalsContact O-CG 3.23Å; C285-L289 WeakPolarHBondContact O-CG 3.18Å; C285-L289 PolarHBondContact O-N 3.3Å; C285-V313 HydrophobicContact CB-CG1 3.99Å; C285-C459 HydrophobicContact CB-CB 4.09Å
286	I	94.9	Very high	92.3	Very high	52 Å²	52	48.5 Å²	48.5	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-44.8	177.1	-72.1	170.1	0	0	0	110.3	L246 S282 I284 I288 L289 V290 C459	L246-I286 HydrophobicContact CD1-CD1 4.28Å; L246-I286 HydrophobicContact CD2-CD1 4Å; S282-I286 WeakPolarHBondContact O-CB 3.32Å; S282-I286 VanDerWaalsContact O-CG1 3.32Å; S282-I286 WeakPolarHBondContact O-CG1 3.33Å; S282-I286 PolarHBondContact O-N 2.65Å; I284-I286 PolarHBondContact O-N 3.39Å; I286-I288 PolarHBondContact O-N 2.86Å; I286-L289 PolarHBondContact O-N 2.96Å; I286-V290 HydrophobicContact CG2-CG2 4.09Å; I286-V290 VanDerWaalsContact O-CB 3.32Å; I286-V290 WeakPolarHBondContact O-CB 3.37Å; I286-V290 VanDerWaalsContact O-CG2 3.25Å; I286-V290 WeakPolarHBondContact O-CG2 3.41Å; I286-V290 PolarHBondContact O-N 3.22Å; I286-C459 HydrophobicContact CG1-CB 3.96Å
287	A	95	Very high	91.8	Very high	59 Å²	59	47 Å²	47	49%	0.488	27%	0.271	S	S	.	.	H	α-helix	trans	-58.3	-48.3	178.1	0	0	0	0	0	111.7	A283 I284 C285 A291	A283-A287 WeakPolarHBondContact O-CB 3.33Å; A283-A287 PolarHBondContact O-N 2.85Å; I284-A287 PolarHBondContact O-N 3.04Å; C285-A287 VanDerWaalsContact C-N 3.35Å; C285-A287 PolarHBondContact O-N 3.21Å; A287-A291 WeakPolarHBondContact O-CB 3.36Å; A287-A291 PolarHBondContact O-N 2.97Å
288	I	94.6	Very high	91.4	Very high	87 Å²	87	55.9 Å²	55.9	45%	0.446	30%	0.302	S	S	.	.	H	α-helix	trans	-65	-46.5	179.3	-65	169.6	0	0	0	111.2	I284 C285 I286 G292 V313	I284-I288 HydrophobicContact CG2-CD1 3.71Å; I284-I288 HydrophobicContact CG2-CG1 4.4Å; I284-I288 WeakPolarHBondContact O-CG1 3.4Å; I284-I288 PolarHBondContact O-N 2.64Å; C285-I288 PolarHBondContact O-N 3.43Å; I286-I288 PolarHBondContact O-N 2.86Å; I288-G292 PolarHBondContact O-N 3.13Å; I288-V313 HydrophobicContact CB-CG2 4.09Å; I288-V313 HydrophobicContact CG2-CG2 3.53Å
289	L	91.9	Very high	91	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-44.1	-178.8	-72.9	173.7	0	0	0	111.7	C285 I286 K293 E310 V313 C459 I460 V463	C285-L289 VanDerWaalsContact O-CB 3.32Å; C285-L289 WeakPolarHBondContact O-CB 3.44Å; C285-L289 VanDerWaalsContact O-CG 3.23Å; C285-L289 WeakPolarHBondContact O-CG 3.18Å; C285-L289 PolarHBondContact O-N 3.3Å; I286-L289 PolarHBondContact O-N 2.96Å; L289-K293 VanDerWaalsContact O-CG 3.31Å; L289-K293 WeakPolarHBondContact O-CG 3.26Å; L289-K293 PolarHBondContact O-N 3.48Å; L289-E310 HydrophobicContact CD2-CG 4.09Å; L289-V313 HydrophobicContact CD2-CB 4.14Å; L289-V313 HydrophobicContact CD2-CG2 3.82Å; L289-V313 HydrophobicContact CG-CB 4.48Å; L289-V313 HydrophobicContact CG-CG1 4.45Å; L289-V313 HydrophobicContact CG-CG2 4.03Å; L289-C459 HydrophobicContact CD1-CB 4.15Å; L289-I460 HydrophobicContact CD1-CG1 4.08Å; L289-V463 HydrophobicContact CB-CB 4.37Å; L289-V463 HydrophobicContact CB-CG1 4.14Å; L289-V463 HydrophobicContact CB-CG2 3.86Å; L289-V463 HydrophobicContact CD1-CB 4.43Å; L289-V463 HydrophobicContact CD1-CG2 4.06Å
290	V	91.4	Very high	90.2	Very high	51 Å²	51	65.2 Å²	65.2	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-67.3	-48.2	178	173	0	0	0	0	110.5	I286 G292 K293 E294 V463	I286-V290 HydrophobicContact CG2-CG2 4.09Å; I286-V290 VanDerWaalsContact O-CB 3.32Å; I286-V290 WeakPolarHBondContact O-CB 3.37Å; I286-V290 VanDerWaalsContact O-CG2 3.25Å; I286-V290 WeakPolarHBondContact O-CG2 3.41Å; I286-V290 PolarHBondContact O-N 3.22Å; V290-G292 VanDerWaalsContact C-N 3.3Å; V290-G292 PolarHBondContact O-N 3.4Å; V290-K293 PolarHBondContact O-N 2.82Å; V290-E294 HydrophobicContact CG1-CG 4.32Å; V290-E294 WeakPolarHBondContact O-CG 3.31Å; V290-E294 PolarHBondContact O-N 3.17Å; V290-V463 HydrophobicContact CG2-CG2 4.15Å
291	A	91.5	Very high	89.3	Confident	46 Å²	46	68.7 Å²	68.7	38%	0.38	36%	0.356	S	S	.	.	H	α-helix	trans	-57.6	-45.2	177	0	0	0	0	0	111.2	A287 K293 E294 I295	A287-A291 WeakPolarHBondContact O-CB 3.36Å; A287-A291 PolarHBondContact O-N 2.97Å; A291-K293 PolarHBondContact O-N 2.96Å; A291-E294 PolarHBondContact O-N 3.2Å; A291-I295 WeakPolarHBondContact O-CB 3.29Å; A291-I295 WeakPolarHBondContact O-CD1 3.45Å; A291-I295 WeakPolarHBondContact O-CG1 3.39Å; A291-I295 PolarHBondContact O-N 3.37Å
292	G	88.8	Confident	88.6	Confident	10 Å²	10	78.1 Å²	78.1	10%	0.103	39%	0.39	C	S	.	.	H	α-helix	trans	-58.7	-43.1	176.8	0	0	0	0	0	113.1	I288 V290 Q296	I288-G292 PolarHBondContact O-N 3.13Å; V290-G292 VanDerWaalsContact C-N 3.3Å; V290-G292 PolarHBondContact O-N 3.4Å; G292-Q296 WeakPolarHBondContact O-CB 3.24Å; G292-Q296 PolarHBondContact O-N 2.96Å
293	K	84.4	Confident	87.6	Confident	42 Å²	42	81 Å²	81	18%	0.183	40%	0.404	C	S	.	.	H	α-helix	trans	-68.1	-39.9	175.6	-66.5	-75	-175.6	-174.5	0	112.2	L289 V290 A291 Q296 D297 E310 V463	L289-K293 VanDerWaalsContact O-CG 3.31Å; L289-K293 WeakPolarHBondContact O-CG 3.26Å; L289-K293 PolarHBondContact O-N 3.48Å; V290-K293 PolarHBondContact O-N 2.82Å; A291-K293 PolarHBondContact O-N 2.96Å; K293-Q296 PolarHBondContact O-N 3.4Å; K293-D297 WeakPolarHBondContact O-CB 3.43Å; K293-D297 PolarHBondContact O-N 3.34Å; K293-E310 IonicContact NZ-OE1 2.9Å; K293-E310 PolarHBondContact NZ-OE1 3.13Å; K293-V463 HydrophobicContact CG-CG1 4.32Å
294	E	86.7	Confident	86.2	Confident	86 Å²	86	88 Å²	88	40%	0.402	42%	0.424	S	S	.	.	H	α-helix	trans	-67.5	-38.6	177.1	-65.4	-68.5	-154.7	0	0	112.5	V290 A291 Q296 D297 R298 R466	V290-E294 HydrophobicContact CG1-CG 4.32Å; V290-E294 WeakPolarHBondContact O-CG 3.31Å; V290-E294 PolarHBondContact O-N 3.17Å; A291-E294 PolarHBondContact O-N 3.2Å; E294-Q296 VanDerWaalsContact C-N 3.34Å; E294-D297 PolarHBondContact O-N 2.99Å; E294-R298 VanDerWaalsContact O-CB 3.28Å; E294-R298 WeakPolarHBondContact O-CB 3.4Å; E294-R298 PolarHBondContact O-N 3.19Å; E294-R466 IonicContact OE1-CZ 2.91Å; E294-R466 IonicContact OE1-NH1 3.5Å; E294-R466 IonicContact OE1-NH2 2.99Å; E294-R466 PolarHBondContact OE1-NH2 2.91Å; E294-R466 IonicContact OE2-CZ 2.73Å; E294-R466 IonicContact OE2-NH1 2.86Å; E294-R466 PolarHBondContact OE2-NH1 3.46Å; E294-R466 IonicContact OE2-NH2 2.91Å; E294-R466 PolarHBondContact OE2-NH2 3.47Å
295	I	87.9	Confident	85.1	Confident	84 Å²	84	88.4 Å²	88.4	43%	0.431	43%	0.426	S	S	.	.	H	α-helix	trans	-63.1	-45.5	174.1	-69.8	165	0	0	0	109.5	A291 D297 R298 Y299	A291-I295 WeakPolarHBondContact O-CB 3.29Å; A291-I295 WeakPolarHBondContact O-CD1 3.45Å; A291-I295 WeakPolarHBondContact O-CG1 3.39Å; A291-I295 PolarHBondContact O-N 3.37Å; I295-D297 PolarHBondContact O-N 2.89Å; I295-R298 PolarHBondContact O-N 3.33Å; I295-Y299 HydrophobicContact CG2-CD2 4.02Å; I295-Y299 WeakPolarHBondContact O-CD2 3.46Å; I295-Y299 PolarHBondContact O-N 3.07Å
296	Q	83.6	Confident	84	Confident	32 Å²	32	88.8 Å²	88.8	15%	0.15	43%	0.428	C	S	.	.	H	α-helix	trans	-60	-44.1	176.6	-175.3	-174.2	-16.6	0	0	111.9	G292 K293 E294 K300	G292-Q296 WeakPolarHBondContact O-CB 3.24Å; G292-Q296 PolarHBondContact O-N 2.96Å; K293-Q296 PolarHBondContact O-N 3.4Å; E294-Q296 VanDerWaalsContact C-N 3.34Å; Q296-K300 WeakPolarHBondContact O-CA 3.42Å; Q296-K300 PolarHBondContact O-N 3.25Å; Q296-K300 VanDerWaalsContact O-N 3.17Å
297	D	81.3	Confident	83.3	Confident	84 Å²	84	90.1 Å²	90.1	45%	0.449	44%	0.435	S	S	.	.	H	α-helix	trans	-66.6	-41.4	178.1	-78.7	-13.9	0	0	0	111.6	K293 E294 I295	K293-D297 WeakPolarHBondContact O-CB 3.43Å; K293-D297 PolarHBondContact O-N 3.34Å; E294-D297 PolarHBondContact O-N 2.99Å; I295-D297 PolarHBondContact O-N 2.89Å
298	R	86.5	Confident	82.7	Confident	203 Å²	203	89.4 Å²	89.4	77%	0.766	43%	0.426	S	S	*	.	H	α-helix	trans	-70.6	-39.1	-179.1	-179.3	175.6	-71.5	-172.2	-2	113.3	E294 I295	E294-R298 VanDerWaalsContact O-CB 3.28Å; E294-R298 WeakPolarHBondContact O-CB 3.4Å; E294-R298 PolarHBondContact O-N 3.19Å; I295-R298 PolarHBondContact O-N 3.33Å
299	Y	84.4	Confident	82.4	Confident	123 Å²	123	86 Å²	86	48%	0.482	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	23.4	-177.6	-67	-79.5	0	0	0	112.9	I295 D301 R302 L303	I295-Y299 HydrophobicContact CG2-CD2 4.02Å; I295-Y299 WeakPolarHBondContact O-CD2 3.46Å; I295-Y299 PolarHBondContact O-N 3.07Å; Y299-D301 PolarHBondContact O-N 3.49Å; Y299-D301 VanDerWaalsContact O-N 3.15Å; Y299-R302 PolarHBondContact O-N 2.93Å; Y299-L303 PolarHBondContact O-N 2.98Å
300	K	77.1	Confident	82.2	Confident	141 Å²	141	86.4 Å²	86.4	61%	0.613	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-35.2	-177.1	-173.1	176.2	177	-176.2	0	113.8	Q296 R302	Q296-K300 WeakPolarHBondContact O-CA 3.42Å; Q296-K300 PolarHBondContact O-N 3.25Å; Q296-K300 VanDerWaalsContact O-N 3.17Å; K300-R302 VanDerWaalsContact C-N 3.33Å
301	D	77.9	Confident	81.9	Confident	161 Å²	161	87.3 Å²	87.3	86%	0.861	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-21.2	179.9	-56.7	-34.1	0	0	0	113.1	Y299	Y299-D301 PolarHBondContact O-N 3.49Å; Y299-D301 VanDerWaalsContact O-N 3.15Å
302	R	79.8	Confident	81.9	Confident	219 Å²	219	89.7 Å²	89.7	83%	0.826	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-35.9	-179.8	-66.9	-90.3	-168.2	-145.2	0.3	111.9	Y299 K300 K304	Y299-R302 PolarHBondContact O-N 2.93Å; K300-R302 VanDerWaalsContact C-N 3.33Å; R302-K304 PolarHBondContact O-N 3.48Å
303	L	73.6	Confident	82.1	Confident	64 Å²	64	89.6 Å²	89.6	34%	0.335	42%	0.421	S	S	.	.			trans	-89.9	97.7	-179.2	-69.5	171.2	0	0	0	110.4	Y299 I305 L307	Y299-L303 PolarHBondContact O-N 2.98Å; L303-I305 PolarHBondContact O-N 3.21Å; L303-L307 HydrophobicContact CD1-CD1 4.26Å
304	K	67.6	Low	82.5	Confident	206 Å²	206	87.7 Å²	87.7	90%	0.896	41%	0.413	S	S	*	.	S	Bend	trans	-65.5	-20.9	175	-70	-179.6	179.2	177.6	0	113.7	R302	R302-K304 PolarHBondContact O-N 3.48Å
305	I	72.6	Confident	82.7	Confident	99 Å²	99	85.8 Å²	85.8	51%	0.508	41%	0.412	S	S	.	.	S	Bend	trans	-122.4	125.7	-177.2	-57.1	175	0	0	0	108.4	I81 L303 L307	I81-I305 HydrophobicContact CD1-CG2 3.87Å; L303-I305 PolarHBondContact O-N 3.21Å; I305-L307 PolarHBondContact O-N 3.46Å
306	P	73.2	Confident	83	Confident	15 Å²	15	83.7 Å²	83.7	10%	0.097	41%	0.411	C	S	.	.			trans	-68.2	131.8	175.8	28	-32.2	0	0	0	110.3	I81 T423	I81-P306 HydrophobicContact CD1-CG 3.6Å; I81-P306 HydrophobicContact CG2-CG 4.2Å; P306-T423 HydrophobicContact CG-CG2 3.49Å; P306-T423 VanDerWaalsContact CG-CG2 3.49Å
307	L	80.1	Confident	83.4	Confident	79 Å²	79	82.7 Å²	82.7	41%	0.414	41%	0.408	S	S	.	.			trans	-69	127	-178.2	-65.6	170.1	0	0	0	109.9	L303 I305 T309	L303-L307 HydrophobicContact CD1-CD1 4.26Å; I305-L307 PolarHBondContact O-N 3.46Å; L307-T309 HydrophobicContact CB-CG2 4Å; L307-T309 PolarHBondContact O-N 2.63Å
308	P	81.9	Confident	84	Confident	44 Å²	44	79.4 Å²	79.4	29%	0.286	39%	0.391	S	S	.	.			trans	-77.8	63	177.2	33.4	-35.6	0	0	0	110.6	I84 E310 L311 V312	I84-P308 HydrophobicContact CG2-CB 4.22Å; P308-E310 PolarHBondContact O-N 2.89Å; P308-L311 HydrophobicContact CB-CB 4.25Å; P308-L311 WeakPolarHBondContact O-CB 3.35Å; P308-L311 PolarHBondContact O-N 3.39Å; P308-V312 PolarHBondContact O-N 3.45Å
309	T	87.5	Confident	84.3	Confident	16 Å²	16	74.4 Å²	74.4	10%	0.098	38%	0.379	C	S	.	.	H	α-helix	trans	-59.5	-31.4	-176.6	56	0	0	0	0	112.2	L307 V312 V313	L307-T309 HydrophobicContact CB-CG2 4Å; L307-T309 PolarHBondContact O-N 2.63Å; T309-V312 PolarHBondContact O-N 3.3Å; T309-V313 WeakPolarHBondContact O-CG2 3.47Å; T309-V313 PolarHBondContact O-N 3.09Å
310	E	87.4	Confident	84.8	Confident	10 Å²	10	70.8 Å²	70.8	5%	0.047	37%	0.374	C	S	.	.	H	α-helix	trans	-61.1	-42.6	174.7	-66.1	173.1	-140.4	0	0	111.5	I85 Q89 L289 K293 P308 V314 I460	I85-E310 WeakPolarHBondContact CG2-OE2 3.45Å; Q89-E310 PolarHBondContact NE2-OE2 3.05Å; L289-E310 HydrophobicContact CD2-CG 4.09Å; K293-E310 IonicContact NZ-OE1 2.9Å; K293-E310 PolarHBondContact NZ-OE1 3.13Å; P308-E310 PolarHBondContact O-N 2.89Å; E310-V314 WeakPolarHBondContact O-CB 3.22Å; E310-V314 WeakPolarHBondContact O-CG2 3.46Å; E310-V314 PolarHBondContact O-N 3.16Å; E310-I460 HydrophobicContact CG-CG2 4.5Å
311	L	87.1	Confident	85.6	Confident	70 Å²	70	64.3 Å²	64.3	37%	0.366	35%	0.347	S	S	.	.	H	α-helix	trans	-67.8	-42.9	177.5	-179.1	64.7	0	0	0	111.9	I84 P308 V313 V314 A315	I84-L311 HydrophobicContact CD1-CD2 4.48Å; I84-L311 HydrophobicContact CG2-CB 3.59Å; I84-L311 HydrophobicContact CG2-CD1 4.19Å; I84-L311 HydrophobicContact CG2-CD2 3.68Å; I84-L311 HydrophobicContact CG2-CG 4.01Å; P308-L311 HydrophobicContact CB-CB 4.25Å; P308-L311 WeakPolarHBondContact O-CB 3.35Å; P308-L311 PolarHBondContact O-N 3.39Å; L311-V313 VanDerWaalsContact C-N 3.31Å; L311-V313 PolarHBondContact O-N 3.22Å; L311-V314 PolarHBondContact O-N 2.73Å; L311-A315 VanDerWaalsContact O-CB 3.31Å; L311-A315 WeakPolarHBondContact O-CB 3.05Å; L311-A315 PolarHBondContact O-N 2.75Å
312	V	90.2	Very high	86.3	Confident	96 Å²	96	62.3 Å²	62.3	58%	0.582	33%	0.332	S	S	*	.	H	α-helix	trans	-60	-44.9	179.8	176.5	0	0	0	0	110.5	P308 T309 G316	P308-V312 PolarHBondContact O-N 3.45Å; T309-V312 PolarHBondContact O-N 3.3Å; V312-G316 PolarHBondContact O-N 3.32Å
313	V	93	Very high	86.9	Confident	8 Å²	8	59.8 Å²	59.8	5%	0.048	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-43.3	178.2	172	0	0	0	0	111.2	C285 I288 L289 T309 L311 A317 V456	C285-V313 HydrophobicContact CB-CG1 3.99Å; I288-V313 HydrophobicContact CB-CG2 4.09Å; I288-V313 HydrophobicContact CG2-CG2 3.53Å; L289-V313 HydrophobicContact CD2-CB 4.14Å; L289-V313 HydrophobicContact CD2-CG2 3.82Å; L289-V313 HydrophobicContact CG-CB 4.48Å; L289-V313 HydrophobicContact CG-CG1 4.45Å; L289-V313 HydrophobicContact CG-CG2 4.03Å; T309-V313 WeakPolarHBondContact O-CG2 3.47Å; T309-V313 PolarHBondContact O-N 3.09Å; L311-V313 VanDerWaalsContact C-N 3.31Å; L311-V313 PolarHBondContact O-N 3.22Å; V313-A317 WeakPolarHBondContact O-CB 3.47Å; V313-A317 PolarHBondContact O-N 3.1Å; V313-V456 HydrophobicContact CG1-CG1 4.06Å
314	V	92.1	Very high	87.7	Confident	1 Å²	1	58 Å²	58	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-47.8	177.8	171.8	0	0	0	0	111.1	P88 E310 L311 T318 F449 L452 I460	P88-V314 HydrophobicContact CB-CG2 3.6Å; P88-V314 HydrophobicContact CG-CG2 4.08Å; E310-V314 WeakPolarHBondContact O-CB 3.22Å; E310-V314 WeakPolarHBondContact O-CG2 3.46Å; E310-V314 PolarHBondContact O-N 3.16Å; L311-V314 PolarHBondContact O-N 2.73Å; V314-T318 VanDerWaalsContact O-CB 3.23Å; V314-T318 WeakPolarHBondContact O-CB 3.33Å; V314-T318 PolarHBondContact O-N 3.3Å; V314-T318 PolarHBondContact O-OG1 2.97Å; V314-F449 HydrophobicContact CG1-CD1 4.02Å; V314-F449 HydrophobicContact CG1-CE1 3.65Å; V314-L452 HydrophobicContact CG1-CD1 4.16Å; V314-L452 HydrophobicContact CG1-CD2 4.07Å; V314-I460 HydrophobicContact CG2-CD1 3.42Å; V314-I460 VanDerWaalsContact CG2-CD1 3.42Å
315	A	92.1	Very high	88.8	Confident	47 Å²	47	54 Å²	54	39%	0.388	31%	0.309	S	S	.	.	H	α-helix	trans	-62.7	-49.1	178.9	0	0	0	0	0	111.2	L311 T318 L319	L311-A315 VanDerWaalsContact O-CB 3.31Å; L311-A315 WeakPolarHBondContact O-CB 3.05Å; L311-A315 PolarHBondContact O-N 2.75Å; A315-T318 PolarHBondContact O-N 3.03Å; A315-L319 WeakPolarHBondContact O-CB 3.48Å; A315-L319 VanDerWaalsContact O-CG 3.29Å; A315-L319 WeakPolarHBondContact O-CG 3.14Å; A315-L319 PolarHBondContact O-N 3.46Å
316	G	93.6	Very high	89.7	Confident	39 Å²	39	51.1 Å²	51.1	40%	0.402	29%	0.293	S	S	.	.	H	α-helix	trans	-61.3	-46.1	179.2	0	0	0	0	0	112.9	V312 L319 A320	V312-G316 PolarHBondContact O-N 3.32Å; G316-L319 PolarHBondContact O-N 3.2Å; G316-A320 WeakPolarHBondContact O-CB 3.49Å; G316-A320 PolarHBondContact O-N 3.07Å
317	A	93.2	Very high	90.5	Very high	11 Å²	11	54.3 Å²	54.3	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-69.1	-35.4	178.8	0	0	0	0	0	112.5	V313 A320 S321 V456	V313-A317 WeakPolarHBondContact O-CB 3.47Å; V313-A317 PolarHBondContact O-N 3.1Å; A317-A320 PolarHBondContact O-N 3Å; A317-S321 WeakPolarHBondContact O-CB 3.42Å; A317-S321 PolarHBondContact O-N 2.92Å; A317-V456 HydrophobicContact CB-CG1 4.16Å; A317-V456 HydrophobicContact CB-CG2 3.61Å
318	T	92.5	Very high	90.9	Very high	15 Å²	15	55 Å²	55	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-44.9	175.1	-56.8	0	0	0	0	111.1	V314 A315 S321 H322 Y448 A451 L452	V314-T318 VanDerWaalsContact O-CB 3.23Å; V314-T318 WeakPolarHBondContact O-CB 3.33Å; V314-T318 PolarHBondContact O-N 3.3Å; V314-T318 PolarHBondContact O-OG1 2.97Å; A315-T318 PolarHBondContact O-N 3.03Å; T318-S321 PolarHBondContact O-N 3.24Å; T318-H322 VanDerWaalsContact O-CB 3.31Å; T318-H322 WeakPolarHBondContact O-CB 3.31Å; T318-H322 PolarHBondContact O-N 3.38Å; T318-Y448 WeakPolarHBondContact CG2-O 3.45Å; T318-A451 HydrophobicContact CG2-CB 4.34Å; T318-L452 WeakPolarHBondContact OG1-CD1 3.27Å
319	L	93.8	Very high	91.3	Very high	99 Å²	99	61.2 Å²	61.2	52%	0.518	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-45.9	176.3	-70.2	169.8	0	0	0	111.1	A315 G316 S321 H322 F323	A315-L319 WeakPolarHBondContact O-CB 3.48Å; A315-L319 VanDerWaalsContact O-CG 3.29Å; A315-L319 WeakPolarHBondContact O-CG 3.14Å; A315-L319 PolarHBondContact O-N 3.46Å; G316-L319 PolarHBondContact O-N 3.2Å; L319-S321 VanDerWaalsContact C-N 3.35Å; L319-S321 PolarHBondContact O-N 3.31Å; L319-H322 PolarHBondContact O-N 2.91Å; L319-F323 HydrophobicContact CD2-CE2 4.09Å; L319-F323 VanDerWaalsContact O-CD2 3.22Å; L319-F323 WeakPolarHBondContact O-CD2 3.26Å; L319-F323 PolarHBondContact O-N 3.17Å
320	A	94.1	Very high	91.3	Very high	47 Å²	47	65.2 Å²	65.2	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-60.8	-42.7	177.1	0	0	0	0	0	112.1	G316 A317 G324 F326	G316-A320 WeakPolarHBondContact O-CB 3.49Å; G316-A320 PolarHBondContact O-N 3.07Å; A317-A320 PolarHBondContact O-N 3Å; A320-G324 VanDerWaalsContact O-CA 3.31Å; A320-G324 WeakPolarHBondContact O-CA 3.48Å; A320-G324 PolarHBondContact O-N 3.06Å; A320-F326 HydrophobicContact CB-CE2 4.32Å; A320-F326 HydrophobicContact CB-CZ 4.45Å
321	S	94.4	Very high	91.3	Very high	4 Å²	4	71.4 Å²	71.4	3%	0.028	38%	0.377	C	S	.	.	H	α-helix	trans	-68.4	-36.7	177.8	-179.1	0	0	0	0	112.8	A317 T318 L319 E325 F326 A451	A317-S321 WeakPolarHBondContact O-CB 3.42Å; A317-S321 PolarHBondContact O-N 2.92Å; T318-S321 PolarHBondContact O-N 3.24Å; L319-S321 VanDerWaalsContact C-N 3.35Å; L319-S321 PolarHBondContact O-N 3.31Å; S321-E325 WeakPolarHBondContact O-CA 3.26Å; S321-E325 PolarHBondContact O-N 2.68Å; S321-F326 VanDerWaalsContact CA-CD2 3.49Å; S321-F326 PolarHBondContact O-N 2.79Å; S321-A451 WeakPolarHBondContact CB-O 3.38Å; S321-A451 PolarHBondContact OG-O 3.26Å
322	H	92.1	Very high	91.4	Very high	120 Å²	120	68.1 Å²	68.1	56%	0.556	36%	0.36	S	S	*	.	H	α-helix	trans	-69	-51	177.9	-174.3	63.6	0	0	0	112	T318 L319 A451	T318-H322 VanDerWaalsContact O-CB 3.31Å; T318-H322 WeakPolarHBondContact O-CB 3.31Å; T318-H322 PolarHBondContact O-N 3.38Å; L319-H322 PolarHBondContact O-N 2.91Å; H322-A451 HydrophobicContact CB-CB 3.91Å
323	F	93.4	Very high	91.3	Very high	166 Å²	166	64.4 Å²	64.4	73%	0.728	34%	0.338	S	S	*	.	H	α-helix	trans	-76.4	-29.4	-179.8	-70.5	-63.8	0	0	0	113.3	L319 E325	L319-F323 HydrophobicContact CD2-CE2 4.09Å; L319-F323 VanDerWaalsContact O-CD2 3.22Å; L319-F323 WeakPolarHBondContact O-CD2 3.26Å; L319-F323 PolarHBondContact O-N 3.17Å; F323-E325 VanDerWaalsContact C-N 3.32Å
324	G	90.4	Very high	91.1	Very high	26 Å²	26	65.1 Å²	65.1	27%	0.268	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-4.3	177	0	0	0	0	0	114.1	A320 F326	A320-G324 VanDerWaalsContact O-CA 3.31Å; A320-G324 WeakPolarHBondContact O-CA 3.48Å; A320-G324 PolarHBondContact O-N 3.06Å; G324-F326 VanDerWaalsContact C-N 3.33Å; G324-F326 WeakPolarHBondContact O-CD1 3.45Å; G324-F326 PolarHBondContact O-N 2.71Å
325	E	91.3	Very high	90.8	Very high	123 Å²	123	65.8 Å²	65.8	58%	0.575	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	48.8	-179.7	-64.9	-172.3	-175.7	0	0	113.5	S321 F323 N327 T328 R329	S321-E325 WeakPolarHBondContact O-CA 3.26Å; S321-E325 PolarHBondContact O-N 2.68Å; F323-E325 VanDerWaalsContact C-N 3.32Å; E325-N327 VanDerWaalsContact C-N 3.27Å; E325-N327 PolarHBondContact O-N 3.21Å; E325-T328 WeakPolarHBondContact CB-OG1 3.31Å; E325-T328 PolarHBondContact O-N 3.46Å; E325-T328 PolarHBondContact O-OG1 2.98Å; E325-T328 VanDerWaalsContact O-OG1 3.13Å; E325-R329 WeakPolarHBondContact O-CB 3.19Å; E325-R329 PolarHBondContact O-N 3.43Å
326	F	90.6	Very high	90.3	Very high	38 Å²	38	64.8 Å²	64.8	17%	0.167	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-27.4	-168.9	-67.7	-11.8	0	0	0	114.6	A320 S321 G324 Y330 H331 S332	A320-F326 HydrophobicContact CB-CE2 4.32Å; A320-F326 HydrophobicContact CB-CZ 4.45Å; S321-F326 VanDerWaalsContact CA-CD2 3.49Å; S321-F326 PolarHBondContact O-N 2.79Å; G324-F326 VanDerWaalsContact C-N 3.33Å; G324-F326 WeakPolarHBondContact O-CD1 3.45Å; G324-F326 PolarHBondContact O-N 2.71Å; F326-Y330 AromaticContact CD1-CD2 3.89Å; F326-Y330 HydrophobicContact CD1-CD2 3.89Å; F326-Y330 HydrophobicContact CD1-CE2 4.12Å; F326-Y330 HydrophobicContact CE1-CE2 4.41Å; F326-Y330 CarbonylContact O-C 3.52Å; F326-Y330 WeakPolarHBondContact O-CA 3.5Å; F326-Y330 WeakPolarHBondContact O-CB 3.5Å; F326-Y330 PolarHBondContact O-N 2.83Å; F326-Y330 VanDerWaalsContact O-N 3.16Å; F326-H331 PolarHBondContact O-N 3.41Å; F326-S332 WeakPolarHBondContact O-CB 3.36Å; F326-S332 PolarHBondContact O-N 3.47Å
327	N	89.5	Confident	89.8	Confident	81 Å²	81	69.5 Å²	69.5	43%	0.433	35%	0.352	S	S	.	.	H	α-helix	trans	-70	-46.9	176.2	-173.7	26.2	0	0	0	112.2	E325 H331 S332 V334	E325-N327 VanDerWaalsContact C-N 3.27Å; E325-N327 PolarHBondContact O-N 3.21Å; N327-H331 VanDerWaalsContact O-CA 3.23Å; N327-H331 WeakPolarHBondContact O-CA 3.33Å; N327-H331 PolarHBondContact O-N 2.99Å; N327-S332 PolarHBondContact OD1-O 2.7Å; N327-V334 HydrophobicContact CB-CG1 4Å; N327-V334 HydrophobicContact CB-CG2 4.04Å
328	T	89.1	Confident	89.4	Confident	93 Å²	93	69 Å²	69	57%	0.571	35%	0.348	S	S	*	.	H	α-helix	trans	-77.8	-41.2	-176.9	48.4	0	0	0	0	111.7	E325	E325-T328 WeakPolarHBondContact CB-OG1 3.31Å; E325-T328 PolarHBondContact O-N 3.46Å; E325-T328 PolarHBondContact O-OG1 2.98Å; E325-T328 VanDerWaalsContact O-OG1 3.13Å
329	R	90.6	Very high	89	Confident	175 Å²	175	71.3 Å²	71.3	66%	0.66	36%	0.363	S	S	*	.	H	α-helix	trans	-83.7	-35.9	-174	-172.1	171.8	-177.1	176.9	2	114.2	E325	E325-R329 WeakPolarHBondContact O-CB 3.19Å; E325-R329 PolarHBondContact O-N 3.43Å
330	Y	87.6	Confident	88.6	Confident	101 Å²	101	70.3 Å²	70.3	40%	0.396	36%	0.362	S	S	.	.	H	α-helix	trans	-119.5	4.3	-173.7	-60.6	-77.1	0	0	0	113.1	N275 C277 F326 S332	N275-Y330 PolarHBondContact ND2-O 3.09Å; C277-Y330 HydrophobicContact CB-CD1 4.4Å; C277-Y330 HydrophobicContact CB-CG 4.01Å; F326-Y330 AromaticContact CD1-CD2 3.89Å; F326-Y330 HydrophobicContact CD1-CD2 3.89Å; F326-Y330 HydrophobicContact CD1-CE2 4.12Å; F326-Y330 HydrophobicContact CE1-CE2 4.41Å; F326-Y330 CarbonylContact O-C 3.52Å; F326-Y330 WeakPolarHBondContact O-CA 3.5Å; F326-Y330 WeakPolarHBondContact O-CB 3.5Å; F326-Y330 PolarHBondContact O-N 2.83Å; F326-Y330 VanDerWaalsContact O-N 3.16Å; Y330-S332 PolarHBondContact O-N 3.03Å; Y330-S332 VanDerWaalsContact O-N 3.11Å
331	H	87.8	Confident	88.3	Confident	140 Å²	140	69 Å²	69	65%	0.648	35%	0.352	S	S	*	.			trans	52.5	31.9	-177.5	-55.2	-63	0	0	0	113.4	N275 F326 N327	N275-H331 PolarHBondContact ND2-O 3.22Å; F326-H331 PolarHBondContact O-N 3.41Å; N327-H331 VanDerWaalsContact O-CA 3.23Å; N327-H331 WeakPolarHBondContact O-CA 3.33Å; N327-H331 PolarHBondContact O-N 2.99Å
332	S	88.3	Confident	88	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.007	37%	0.368	C	S	.	.			trans	-69.3	138.7	176	172.2	0	0	0	0	110.2	D278 F326 N327 Y330 V334 Q453	D278-S332 WeakPolarHBondContact OD1-CB 3.5Å; D278-S332 PolarHBondContact OD1-OG 2.92Å; F326-S332 WeakPolarHBondContact O-CB 3.36Å; F326-S332 PolarHBondContact O-N 3.47Å; N327-S332 PolarHBondContact OD1-O 2.7Å; Y330-S332 PolarHBondContact O-N 3.03Å; Y330-S332 VanDerWaalsContact O-N 3.11Å; S332-V334 PolarHBondContact O-N 3.42Å; S332-Q453 PolarHBondContact OG-NE2 3.48Å
333	S	87.6	Confident	87.7	Confident	17 Å²	17	69.2 Å²	69.2	12%	0.119	36%	0.355	C	S	.	.			trans	-76.4	117.9	-179.4	-58.5	0	0	0	0	110.8	Q453 K454	S333-Q453 WeakPolarHBondContact O-CA 2.94Å; S333-K454 PolarHBondContact O-N 3.43Å
334	V	89.9	Confident	87.5	Confident	24 Å²	24	66.2 Å²	66.2	15%	0.145	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-110	165	-179.8	-63.5	0	0	0	0	112.7	N327 S332 G336 L452 Q453 K454	N327-V334 HydrophobicContact CB-CG1 4Å; N327-V334 HydrophobicContact CB-CG2 4.04Å; S332-V334 PolarHBondContact O-N 3.42Å; V334-G336 VanDerWaalsContact C-N 3.29Å; V334-G336 PolarHBondContact O-N 3.09Å; V334-L452 CarbonylContact C-O 3.57Å; V334-L452 WeakPolarHBondContact CA-O 3.23Å; V334-Q453 HydrophobicContact CG1-CG 4.26Å; V334-K454 VanDerWaalsContact O-CE 3.25Å; V334-K454 WeakPolarHBondContact O-CE 3.31Å
335	S	84.3	Confident	87.6	Confident	14 Å²	14	69.1 Å²	69.1	10%	0.098	37%	0.366	C	S	.	.			trans	-70.3	-22.5	-176.2	-58.2	0	0	0	0	113.6	L452	S335-L452 WeakPolarHBondContact CB-O 3.48Å; S335-L452 PolarHBondContact N-O 3.45Å; S335-L452 PolarHBondContact OG-O 2.99Å
336	G	83.4	Confident	87.6	Confident	26 Å²	26	68.7 Å²	68.7	27%	0.268	36%	0.364	S	S	.	.			trans	79.5	-173.6	176.3	0	0	0	0	0	113.5	V334 I338 R450	V334-G336 VanDerWaalsContact C-N 3.29Å; V334-G336 PolarHBondContact O-N 3.09Å; G336-I338 PolarHBondContact O-N 2.83Å; G336-R450 PolarHBondContact N-O 2.92Å; G336-R450 VanDerWaalsContact O-CA 3.25Å; G336-R450 WeakPolarHBondContact O-CA 3.36Å
337	H	82.5	Confident	87.6	Confident	138 Å²	138	71 Å²	71	64%	0.639	38%	0.381	S	S	*	.			trans	-68.2	127.8	-178.1	-176.6	65.6	0	0	0	110.8
338	I	85.2	Confident	87.8	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.01	36%	0.362	C	S	.	.			trans	-112.8	115.7	176.9	-60.3	166.9	0	0	0	107.2	I91 P101 I102 G336 A446 F449	I91-I338 HydrophobicContact CD1-CD1 4.4Å; P101-I338 HydrophobicContact CB-CD1 4.23Å; P101-I338 HydrophobicContact CB-CG1 4.32Å; I102-I338 HydrophobicContact CB-CG2 4.24Å; G336-I338 PolarHBondContact O-N 2.83Å; I338-A446 HydrophobicContact CG2-CB 3.98Å; I338-F449 HydrophobicContact CD1-CB 3.8Å
339	P	82.9	Confident	87.7	Confident	62 Å²	62	63.9 Å²	63.9	40%	0.403	34%	0.343	S	S	.	.			trans	-65.7	156.4	-179.8	16.5	-17.8	0	0	0	111.5	I102	I102-P339 HydrophobicContact CD1-CB 4.16Å; I102-P339 HydrophobicContact CD1-CG 3.69Å; I102-P339 VanDerWaalsContact CD1-O 3.23Å; I102-P339 WeakPolarHBondContact CD1-O 3.5Å; I102-P339 HydrophobicContact CG2-CG 4.5Å
340	T	86.1	Confident	87.6	Confident	79 Å²	79	61.5 Å²	61.5	49%	0.485	34%	0.337	S	S	.	.			trans	-101.4	155.8	174.1	48.7	0	0	0	0	111.1	A446 P447	T340-A446 HydrophobicContact CG2-CB 4.19Å; T340-P447 HydrophobicContact CG2-CG 3.48Å; T340-P447 VanDerWaalsContact CG2-CG 3.48Å
341	G	86.8	Confident	87.6	Confident	18 Å²	18	60.3 Å²	60.3	19%	0.186	34%	0.344	C	S	.	.	S	Bend	trans	87.1	-170.4	176.6	0	0	0	0	0	114	Y106 L442	Y106-G341 WeakPolarHBondContact CE1-O 3.44Å; Y106-G341 PolarHBondContact OH-O 3.23Å; G341-L442 PolarHBondContact N-O 3Å
342	F	87.8	Confident	87.7	Confident	84 Å²	84	54 Å²	54	37%	0.368	32%	0.315	S	S	.	.			trans	-104.7	138.5	-178.8	-74.9	-83.1	0	0	0	111	Y106 F109 Y110 L439 L442	Y106-F342 HydrophobicContact CD1-CD1 4.18Å; Y106-F342 HydrophobicContact CD1-CE1 4.18Å; Y106-F342 AromaticContact CE1-CD1 3.98Å; Y106-F342 HydrophobicContact CE1-CD1 3.98Å; Y106-F342 HydrophobicContact CE1-CE1 4.32Å; Y106-F342 WeakPolarHBondContact OH-CA 3Å; F109-F342 AromaticContact CD1-CE1 3.95Å; F109-F342 HydrophobicContact CD1-CE1 3.95Å; F109-F342 HydrophobicContact CD1-CZ 4.01Å; F109-F342 AromaticContact CE1-CE1 3.99Å; F109-F342 HydrophobicContact CE1-CE1 3.99Å; F109-F342 AromaticContact CE1-CZ 3.79Å; F109-F342 HydrophobicContact CE1-CZ 3.79Å; F109-F342 HydrophobicContact CZ-CZ 4.18Å; Y110-F342 HydrophobicContact CE2-CE1 4.33Å; F342-L439 HydrophobicContact CE2-CD1 3.52Å; F342-L439 HydrophobicContact CZ-CD1 3.69Å; F342-L442 HydrophobicContact CE1-CD1 4.42Å; F342-L442 HydrophobicContact CZ-CD1 4.32Å
343	T	87.1	Confident	87.9	Confident	45 Å²	45	54.8 Å²	54.8	28%	0.276	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-77.9	146	165.5	48.5	0	0	0	0	110.4	Y106 H406	Y106-T343 HydrophobicContact CE2-CG2 4.37Å; Y106-T343 WeakPolarHBondContact CE2-OG1 3.13Å; Y106-T343 PolarHBondContact OH-N 3.05Å; T343-H406 PolarHBondContact OG1-CD2 3.27Å
344	P	89.5	Confident	88.2	Confident	103 Å²	103	58.7 Å²	58.7	67%	0.669	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-61.8	149.7	175.7	27.3	-34.3	0	0	0	110.4	H406	P344-H406 PolarHBondContact O-NE2 3.38Å
345	P	92.6	Very high	88.3	Confident	88 Å²	88	65.7 Å²	65.7	57%	0.571	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-64.4	138.1	178.7	25.9	-32.9	0	0	0	111.3	F404 F405	P345-F404 CarbonylContact C-O 3.54Å; P345-F404 WeakPolarHBondContact CA-O 3.35Å; P345-F404 WeakPolarHBondContact CB-O 3.27Å; P345-F405 HydrophobicContact CB-CD1 3.95Å; P345-F405 HydrophobicContact CB-CE1 3.79Å; P345-F405 HydrophobicContact CB-CZ 4.36Å; P345-F405 HydrophobicContact CG-CE1 4.27Å
346	Q	89.9	Confident	88.7	Confident	113 Å²	113	65 Å²	65	53%	0.528	36%	0.363	S	S	.	.			trans	-125.6	140.9	175.1	-168.2	-179.1	15.2	0	0	109.9	F404 H406	Q346-F404 PolarHBondContact N-O 3.1Å; Q346-F404 CarbonylContact O-C 3.53Å; Q346-F404 VanDerWaalsContact O-CA 3.26Å; Q346-F404 WeakPolarHBondContact O-CA 3.33Å; Q346-F404 VanDerWaalsContact O-O 3.09Å; Q346-H406 PolarHBondContact OE1-CE1 3.46Å
347	V	92.3	Very high	89.3	Confident	86 Å²	86	64.9 Å²	64.9	52%	0.521	36%	0.359	S	S	.	.			trans	-68.8	128.9	174.4	-179.3	0	0	0	0	109.5	A349 F350 F404	V347-A349 PolarHBondContact O-N 2.99Å; V347-F350 HydrophobicContact CG1-CD2 3.95Å; V347-F350 HydrophobicContact CG1-CE2 3.4Å; V347-F350 VanDerWaalsContact CG1-CE2 3.4Å; V347-F350 HydrophobicContact CG1-CZ 4.37Å; V347-F404 HydrophobicContact CG1-CE1 4.45Å
348	P	91.8	Very high	89.7	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.032	36%	0.363	C	S	.	.			trans	-55.6	135.7	175.1	-25.2	33.8	0	0	0	111.4	F201 F350 M353 S403	F201-P348 HydrophobicContact CB-CB 4.09Å; F201-P348 HydrophobicContact CB-CG 4.03Å; F201-P348 HydrophobicContact CD2-CG 4.18Å; F201-P348 HydrophobicContact CG-CB 4.37Å; F201-P348 HydrophobicContact CG-CG 4.18Å; P348-F350 PolarHBondContact O-N 3.35Å; P348-M353 HydrophobicContact CB-CE 3.78Å; P348-S403 WeakPolarHBondContact CG-OG 3.4Å
349	A	87.3	Confident	90	Very high	20 Å²	20	65.9 Å²	65.9	17%	0.165	37%	0.368	C	S	.	.			trans	-64.5	101.5	-171.3	0	0	0	0	0	112.4	L181 V347 S351 I352	L181-A349 HydrophobicContact CD2-CB 4.29Å; V347-A349 PolarHBondContact O-N 2.99Å; A349-S351 PolarHBondContact O-N 3.03Å; A349-I352 HydrophobicContact CB-CD1 3.91Å; A349-I352 HydrophobicContact CB-CG1 4.1Å; A349-I352 PolarHBondContact O-N 2.92Å
350	F	88.8	Confident	90.6	Very high	125 Å²	125	63 Å²	63	55%	0.548	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.9	179.2	-75.2	-76.7	0	0	0	113.8	F201 V347 P348 I352 M353 P354	F201-F350 HydrophobicContact CE1-CE1 4.3Å; V347-F350 HydrophobicContact CG1-CD2 3.95Å; V347-F350 HydrophobicContact CG1-CE2 3.4Å; V347-F350 VanDerWaalsContact CG1-CE2 3.4Å; V347-F350 HydrophobicContact CG1-CZ 4.37Å; P348-F350 PolarHBondContact O-N 3.35Å; F350-I352 VanDerWaalsContact C-N 3.32Å; F350-I352 PolarHBondContact O-N 3.41Å; F350-M353 HydrophobicContact CD1-CE 3.56Å; F350-M353 HydrophobicContact CD1-SD 3.39Å; F350-M353 WeakPolarHBondContact CD1-SD 3.4Å; F350-M353 HydrophobicContact CE1-CE 3.72Å; F350-M353 HydrophobicContact CE1-SD 3.82Å; F350-M353 HydrophobicContact CG-CE 4.02Å; F350-M353 HydrophobicContact CG-SD 4.2Å; F350-M353 HydrophobicContact CZ-CE 4.31Å; F350-M353 PolarHBondContact O-N 2.93Å; F350-P354 WeakPolarHBondContact O-CD 3.3Å
351	S	88	Confident	90.9	Very high	77 Å²	77	62.9 Å²	62.9	54%	0.538	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-30.6	177.4	50	0	0	0	0	113.4	A349	A349-S351 PolarHBondContact O-N 3.03Å
352	I	89.3	Confident	91	Very high	6 Å²	6	63.5 Å²	63.5	3%	0.031	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-27.2	-178.3	-54.8	176.5	0	0	0	110.9	L181 Y191 V195 A349 F350 P354 R355 V356	L181-I352 HydrophobicContact CD2-CD1 4.43Å; Y191-I352 HydrophobicContact CE2-CD1 3.85Å; V195-I352 HydrophobicContact CG2-CD1 4.08Å; V195-I352 HydrophobicContact CG2-CG2 4.31Å; A349-I352 HydrophobicContact CB-CD1 3.91Å; A349-I352 HydrophobicContact CB-CG1 4.1Å; A349-I352 PolarHBondContact O-N 2.92Å; F350-I352 VanDerWaalsContact C-N 3.32Å; F350-I352 PolarHBondContact O-N 3.41Å; I352-P354 VanDerWaalsContact C-CD 3.43Å; I352-R355 WeakPolarHBondContact O-CB 3.32Å; I352-R355 PolarHBondContact O-N 3.47Å; I352-V356 HydrophobicContact CG2-CG1 4.1Å; I352-V356 PolarHBondContact O-N 3.42Å
353	M	92.9	Very high	91.3	Very high	19 Å²	19	59.5 Å²	59.5	9%	0.094	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-41.6	-173.7	-67.1	-175.5	-171.4	0	0	115	A198 F201 P348 F350 R355 V356 A357	A198-M353 HydrophobicContact CB-CG 4.28Å; F201-M353 HydrophobicContact CD1-CE 3.41Å; F201-M353 VanDerWaalsContact CD1-CE 3.41Å; F201-M353 HydrophobicContact CD1-SD 3.93Å; F201-M353 HydrophobicContact CE1-CE 3.83Å; F201-M353 HydrophobicContact CE1-SD 4.16Å; F201-M353 HydrophobicContact CG-CE 4.14Å; P348-M353 HydrophobicContact CB-CE 3.78Å; F350-M353 HydrophobicContact CD1-CE 3.56Å; F350-M353 HydrophobicContact CD1-SD 3.39Å; F350-M353 WeakPolarHBondContact CD1-SD 3.4Å; F350-M353 HydrophobicContact CE1-CE 3.72Å; F350-M353 HydrophobicContact CE1-SD 3.82Å; F350-M353 HydrophobicContact CG-CE 4.02Å; F350-M353 HydrophobicContact CG-SD 4.2Å; F350-M353 HydrophobicContact CZ-CE 4.31Å; F350-M353 PolarHBondContact O-N 2.93Å; M353-R355 VanDerWaalsContact C-N 3.26Å; M353-R355 PolarHBondContact O-N 3.24Å; M353-V356 PolarHBondContact O-N 2.9Å; M353-A357 WeakPolarHBondContact O-CB 3.41Å; M353-A357 PolarHBondContact O-N 2.99Å; M353-A357 VanDerWaalsContact O-N 3.1Å
354	P	94.1	Very high	91.6	Very high	99 Å²	99	57.4 Å²	57.4	64%	0.643	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.1	178.4	-24.6	35.4	0	0	0	113.8	F350 I352 A357	F350-P354 WeakPolarHBondContact O-CD 3.3Å; I352-P354 VanDerWaalsContact C-CD 3.43Å; P354-A357 WeakPolarHBondContact O-CB 3.19Å
355	R	91.6	Very high	91.6	Very high	171 Å²	171	54.7 Å²	54.7	65%	0.645	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-40.7	-179.3	-62.1	-176.6	-176.4	-178.4	0.5	111.8	I352 M353 A357	I352-R355 WeakPolarHBondContact O-CB 3.32Å; I352-R355 PolarHBondContact O-N 3.47Å; M353-R355 VanDerWaalsContact C-N 3.26Å; M353-R355 PolarHBondContact O-N 3.24Å; R355-A357 VanDerWaalsContact C-N 3.27Å; R355-A357 PolarHBondContact O-N 3.39Å
356	V	93.8	Very high	91.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-88.2	8.6	179.8	-59	0	0	0	0	113.4	V139 E143 V195 V199 I352 M353 L358 D359 A360	V139-V356 HydrophobicContact CG1-CB 4.26Å; V139-V356 HydrophobicContact CG1-CG1 3.67Å; E143-V356 HydrophobicContact CG-CG1 4.01Å; V195-V356 HydrophobicContact CG1-CG1 4.35Å; V199-V356 HydrophobicContact CB-CB 4.28Å; V199-V356 HydrophobicContact CB-CG2 4.21Å; V199-V356 HydrophobicContact CG2-CB 4.4Å; I352-V356 HydrophobicContact CG2-CG1 4.1Å; I352-V356 PolarHBondContact O-N 3.42Å; M353-V356 PolarHBondContact O-N 2.9Å; V356-L358 VanDerWaalsContact C-N 3.35Å; V356-L358 PolarHBondContact O-N 3.36Å; V356-D359 WeakPolarHBondContact CA-OD2 3.46Å; V356-D359 PolarHBondContact O-N 3.49Å; V356-A360 PolarHBondContact O-N 2.87Å; V356-A360 VanDerWaalsContact O-N 3.17Å
357	A	94.6	Very high	91.6	Very high	22 Å²	22	45.2 Å²	45.2	18%	0.182	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-36.2	-169.1	0	0	0	0	0	114.4	L202 Y206 M353 P354 R355	L202-A357 VanDerWaalsContact CD2-CA 3.4Å; L202-A357 HydrophobicContact CD2-CB 3.89Å; Y206-A357 WeakPolarHBondContact CE2-O 3.21Å; Y206-A357 PolarHBondContact OH-O 2.83Å; M353-A357 WeakPolarHBondContact O-CB 3.41Å; M353-A357 PolarHBondContact O-N 2.99Å; M353-A357 VanDerWaalsContact O-N 3.1Å; P354-A357 WeakPolarHBondContact O-CB 3.19Å; R355-A357 VanDerWaalsContact C-N 3.27Å; R355-A357 PolarHBondContact O-N 3.39Å
358	L	92	Very high	91.6	Very high	137 Å²	137	41.4 Å²	41.4	72%	0.717	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-34.8	178.6	-66.2	176.6	0	0	0	111.5	V356 A360 I361 P362	V356-L358 VanDerWaalsContact C-N 3.35Å; V356-L358 PolarHBondContact O-N 3.36Å; L358-A360 VanDerWaalsContact C-N 3.27Å; L358-A360 PolarHBondContact O-N 3.38Å; L358-I361 HydrophobicContact CD2-CD1 4.24Å; L358-I361 PolarHBondContact O-N 3.18Å; L358-P362 VanDerWaalsContact O-CD 3.22Å; L358-P362 WeakPolarHBondContact O-CD 3.41Å
359	D	91.2	Very high	91.4	Very high	25 Å²	25	41.3 Å²	41.3	13%	0.134	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-32.3	178.2	-49.9	-69.8	0	0	0	111.5	V139 R142 V356 I361 P362 L363	V139-D359 HydrophobicContact CG1-CB 4.4Å; V139-D359 HydrophobicContact CG2-CB 3.59Å; R142-D359 IonicContact CZ-OD1 2.8Å; R142-D359 IonicContact CZ-OD2 3.46Å; R142-D359 IonicContact NH1-OD1 3.64Å; R142-D359 PolarHBondContact NH1-OD1 3.25Å; R142-D359 IonicContact NH1-OD2 3.19Å; R142-D359 PolarHBondContact NH1-OD2 2.61Å; R142-D359 IonicContact NH2-OD1 2.59Å; R142-D359 IonicContact NH2-OD2 3.71Å; R142-D359 PolarHBondContact NH2-OD2 2.89Å; V356-D359 WeakPolarHBondContact CA-OD2 3.46Å; V356-D359 PolarHBondContact O-N 3.49Å; D359-I361 PolarHBondContact O-N 3.43Å; D359-P362 WeakPolarHBondContact O-CD 3.31Å; D359-L363 WeakPolarHBondContact O-CD1 3.25Å
360	A	94.9	Very high	91.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-21.6	177.9	0	0	0	0	0	114.3	V199 L202 A203 Y206 V356 L358 L363 A364	V199-A360 HydrophobicContact CG2-CB 3.96Å; L202-A360 HydrophobicContact CB-CB 3.94Å; L202-A360 HydrophobicContact CD2-CB 3.86Å; L202-A360 HydrophobicContact CG-CB 3.87Å; A203-A360 HydrophobicContact CB-CB 4.28Å; Y206-A360 HydrophobicContact CD2-CB 4Å; Y206-A360 HydrophobicContact CE2-CB 3.72Å; V356-A360 PolarHBondContact O-N 2.87Å; V356-A360 VanDerWaalsContact O-N 3.17Å; L358-A360 VanDerWaalsContact C-N 3.27Å; L358-A360 PolarHBondContact O-N 3.38Å; A360-L363 PolarHBondContact O-N 3.22Å; A360-A364 WeakPolarHBondContact O-CB 3.17Å; A360-A364 PolarHBondContact O-N 2.87Å
361	I	92.4	Very high	91.6	Very high	77 Å²	77	36 Å²	36	40%	0.395	19%	0.194	S	C	.	.	H	α-helix	trans	-67.6	-55.1	-177.8	-62.4	171.3	0	0	0	111.3	Y206 L358 D359 L363 A364 V365	Y206-I361 HydrophobicContact CD2-CG1 3.89Å; Y206-I361 HydrophobicContact CE2-CG1 3.5Å; Y206-I361 VanDerWaalsContact CE2-CG1 3.5Å; L358-I361 HydrophobicContact CD2-CD1 4.24Å; L358-I361 PolarHBondContact O-N 3.18Å; D359-I361 PolarHBondContact O-N 3.43Å; I361-L363 VanDerWaalsContact C-N 3.27Å; I361-L363 PolarHBondContact O-N 3.21Å; I361-A364 PolarHBondContact O-N 3.39Å; I361-V365 WeakPolarHBondContact O-CG2 3.3Å; I361-V365 PolarHBondContact O-N 3.38Å
362	P	89.4	Confident	91.8	Very high	32 Å²	32	32.3 Å²	32.3	21%	0.208	17%	0.168	C	C	.	.	H	α-helix	trans	-53.7	-41.6	172.5	-26.8	31.8	0	0	0	113.3	M135 L358 D359 A364 V365 I366 E502	M135-P362 HydrophobicContact CE-CB 3.89Å; L358-P362 VanDerWaalsContact O-CD 3.22Å; L358-P362 WeakPolarHBondContact O-CD 3.41Å; D359-P362 WeakPolarHBondContact O-CD 3.31Å; P362-A364 PolarHBondContact O-N 2.64Å; P362-V365 PolarHBondContact O-N 3.38Å; P362-I366 VanDerWaalsContact O-CB 3.3Å; P362-I366 WeakPolarHBondContact O-CB 3.43Å; P362-I366 WeakPolarHBondContact O-CG1 3.36Å; P362-I366 PolarHBondContact O-N 2.95Å; P362-E502 HydrophobicContact CB-CB 4.2Å; P362-E502 HydrophobicContact CB-CG 3.79Å; P362-E502 HydrophobicContact CG-CB 4.48Å; P362-E502 HydrophobicContact CG-CG 4.31Å
363	L	93.1	Very high	91.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-45.8	178.2	-83.5	88.3	0	0	0	111.7	M132 M135 V136 V199 A203 D359 A360 I361 S367 T409	M132-L363 HydrophobicContact CE-CB 3.81Å; M132-L363 HydrophobicContact CE-CD2 4Å; M132-L363 HydrophobicContact CE-CG 3.79Å; M132-L363 WeakPolarHBondContact CE-O 3.39Å; M135-L363 HydrophobicContact CB-CD1 4.27Å; M135-L363 HydrophobicContact CB-CG 4.32Å; M135-L363 HydrophobicContact CE-CD1 3.73Å; M135-L363 HydrophobicContact CE-CG 3.88Å; V136-L363 HydrophobicContact CG2-CD2 3.53Å; V199-L363 HydrophobicContact CG2-CD2 4.42Å; A203-L363 HydrophobicContact CB-CB 4.11Å; D359-L363 WeakPolarHBondContact O-CD1 3.25Å; A360-L363 PolarHBondContact O-N 3.22Å; I361-L363 VanDerWaalsContact C-N 3.27Å; I361-L363 PolarHBondContact O-N 3.21Å; L363-S367 WeakPolarHBondContact O-CB 3.12Å; L363-S367 PolarHBondContact O-N 3.16Å; L363-T409 HydrophobicContact CD2-CG2 4.25Å; L363-T409 WeakPolarHBondContact CD2-OG1 3.39Å
364	A	94.3	Very high	91.5	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-47.5	179	0	0	0	0	0	111.9	A203 Q207 M210 A360 I361 P362 F368	A203-A364 HydrophobicContact CB-CB 4.29Å; A203-A364 WeakPolarHBondContact O-CB 3.45Å; Q207-A364 HydrophobicContact CG-CB 3.89Å; Q207-A364 PolarHBondContact NE2-O 3Å; M210-A364 HydrophobicContact CE-CB 3.81Å; A360-A364 WeakPolarHBondContact O-CB 3.17Å; A360-A364 PolarHBondContact O-N 2.87Å; I361-A364 PolarHBondContact O-N 3.39Å; P362-A364 PolarHBondContact O-N 2.64Å; A364-F368 WeakPolarHBondContact O-CB 3.48Å; A364-F368 PolarHBondContact O-N 3.31Å; A364-F368 VanDerWaalsContact O-N 3.09Å
365	V	90.2	Very high	91.4	Very high	46 Å²	46	28 Å²	28	28%	0.279	14%	0.142	S	C	.	.	H	α-helix	trans	-67	-47.9	-179	176.1	0	0	0	0	111.1	M210 I361 P362 F368 A369 L505	M210-V365 HydrophobicContact SD-CG2 4.36Å; I361-V365 WeakPolarHBondContact O-CG2 3.3Å; I361-V365 PolarHBondContact O-N 3.38Å; P362-V365 PolarHBondContact O-N 3.38Å; V365-F368 PolarHBondContact O-N 3.35Å; V365-A369 WeakPolarHBondContact O-CB 3.41Å; V365-A369 PolarHBondContact O-N 3.07Å; V365-L505 HydrophobicContact CG1-CD2 3.95Å
366	I	89.2	Confident	91.3	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-64.6	-46	-179.9	-73.2	165.1	0	0	0	110.7	L131 M132 M135 F230 P362 F368 A369 F370 L505	L131-I366 HydrophobicContact CD2-CG2 4.01Å; M132-I366 HydrophobicContact SD-CG2 3.97Å; M135-I366 HydrophobicContact CE-CD1 3.72Å; M135-I366 HydrophobicContact SD-CD1 3.66Å; M135-I366 HydrophobicContact SD-CG2 4.45Å; F230-I366 HydrophobicContact CZ-CD1 4.33Å; P362-I366 VanDerWaalsContact O-CB 3.3Å; P362-I366 WeakPolarHBondContact O-CB 3.43Å; P362-I366 WeakPolarHBondContact O-CG1 3.36Å; P362-I366 PolarHBondContact O-N 2.95Å; I366-F368 VanDerWaalsContact C-N 3.34Å; I366-F368 PolarHBondContact O-N 3.13Å; I366-A369 PolarHBondContact O-N 3.41Å; I366-F370 HydrophobicContact CG2-CD2 3.83Å; I366-F370 HydrophobicContact CG2-CE2 4.05Å; I366-F370 WeakPolarHBondContact O-CD2 3.31Å; I366-F370 PolarHBondContact O-N 2.76Å; I366-L505 HydrophobicContact CD1-CD2 4.23Å; I366-L505 HydrophobicContact CG1-CD2 3.41Å; I366-L505 VanDerWaalsContact CG1-CD2 3.41Å; I366-L505 HydrophobicContact CG1-CG 4.45Å
367	S	92.9	Very high	90.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.1	-43.1	178.6	168.5	0	0	0	0	111.7	Q207 L363 T371 I395 T410 S411	Q207-S367 VanDerWaalsContact NE2-CB 3.26Å; Q207-S367 PolarHBondContact NE2-OG 2.8Å; Q207-S367 VanDerWaalsContact NE2-OG 3.11Å; L363-S367 WeakPolarHBondContact O-CB 3.12Å; L363-S367 PolarHBondContact O-N 3.16Å; S367-T371 VanDerWaalsContact O-CB 3.31Å; S367-T371 WeakPolarHBondContact O-CB 3.38Å; S367-T371 PolarHBondContact O-N 2.98Å; S367-T371 PolarHBondContact O-OG1 3.43Å; S367-I395 VanDerWaalsContact OG-CG1 3.31Å; S367-I395 WeakPolarHBondContact OG-CG1 3.16Å; S367-T410 PolarHBondContact OG-O 2.88Å; S367-S411 PolarHBondContact O-OG 2.87Å
368	F	92.1	Very high	90.7	Very high	7 Å²	7	27.4 Å²	27.4	3%	0.031	14%	0.144	C	C	.	.	H	α-helix	trans	-65.5	-50.7	174.2	167	-114.1	0	0	0	112.2	A364 V365 I366 F370 T371 V372 P388 M392	A364-F368 WeakPolarHBondContact O-CB 3.48Å; A364-F368 PolarHBondContact O-N 3.31Å; A364-F368 VanDerWaalsContact O-N 3.09Å; V365-F368 PolarHBondContact O-N 3.35Å; I366-F368 VanDerWaalsContact C-N 3.34Å; I366-F368 PolarHBondContact O-N 3.13Å; F368-F370 PolarHBondContact O-N 3.42Å; F368-T371 PolarHBondContact O-N 3.31Å; F368-T371 VanDerWaalsContact O-N 3.13Å; F368-V372 HydrophobicContact CD2-CB 4.47Å; F368-V372 HydrophobicContact CE1-CG1 4.36Å; F368-V372 HydrophobicContact CE2-CB 3.91Å; F368-V372 HydrophobicContact CE2-CG1 4.13Å; F368-V372 HydrophobicContact CE2-CG2 4.4Å; F368-V372 HydrophobicContact CZ-CB 4.2Å; F368-V372 HydrophobicContact CZ-CG1 4.01Å; F368-V372 HydrophobicContact CZ-CG2 4.48Å; F368-V372 WeakPolarHBondContact O-CG1 3.16Å; F368-V372 PolarHBondContact O-N 3.09Å; F368-P388 HydrophobicContact CZ-CB 4.46Å; F368-M392 HydrophobicContact CD1-SD 4.31Å; F368-M392 HydrophobicContact CD2-CB 3.61Å; F368-M392 HydrophobicContact CD2-CG 3.78Å; F368-M392 HydrophobicContact CD2-SD 4.17Å; F368-M392 HydrophobicContact CE1-SD 4.37Å; F368-M392 HydrophobicContact CE2-CB 3.62Å; F368-M392 HydrophobicContact CE2-CG 4.13Å; F368-M392 HydrophobicContact CE2-SD 4.25Å; F368-M392 HydrophobicContact CG-CB 4.48Å; F368-M392 HydrophobicContact CG-CG 4.19Å; F368-M392 HydrophobicContact CG-SD 4.2Å; F368-M392 HydrophobicContact CZ-CB 4.49Å; F368-M392 HydrophobicContact CZ-SD 4.35Å
369	A	88.2	Confident	90.6	Very high	2 Å²	2	21.1 Å²	21.1	2%	0.017	11%	0.111	C	C	.	.	H	α-helix	trans	-54.6	-49.2	-178.3	0	0	0	0	0	112	L222 V365 I366 T371 V372 S373	L222-A369 HydrophobicContact CD1-CB 3.44Å; L222-A369 VanDerWaalsContact CD1-CB 3.44Å; V365-A369 WeakPolarHBondContact O-CB 3.41Å; V365-A369 PolarHBondContact O-N 3.07Å; I366-A369 PolarHBondContact O-N 3.41Å; A369-T371 PolarHBondContact O-N 2.84Å; A369-V372 WeakPolarHBondContact O-CG1 3.45Å; A369-S373 WeakPolarHBondContact O-CB 3.48Å; A369-S373 PolarHBondContact O-N 2.9Å; A369-S373 VanDerWaalsContact O-N 3.07Å; A369-S373 PolarHBondContact O-OG 3.11Å
370	F	87.7	Confident	90.5	Very high	33 Å²	33	28.8 Å²	28.8	15%	0.145	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-42.9	176.8	-91.8	-88.8	0	0	0	112.8	F129 L131 F230 A231 I366 F368 L374	F129-F370 HydrophobicContact CE1-CD1 4.36Å; F129-F370 HydrophobicContact CE1-CE1 4.42Å; F129-F370 HydrophobicContact CZ-CE1 4.39Å; L131-F370 HydrophobicContact CD2-CE2 4.03Å; L131-F370 HydrophobicContact CD2-CZ 4.28Å; F230-F370 AromaticContact CD1-CE2 3.6Å; F230-F370 HydrophobicContact CD1-CE2 3.6Å; F230-F370 AromaticContact CD1-CZ 3.49Å; F230-F370 HydrophobicContact CD1-CZ 3.49Å; F230-F370 VanDerWaalsContact CD1-CZ 3.49Å; F230-F370 HydrophobicContact CE1-CD2 4.48Å; F230-F370 AromaticContact CE1-CE2 3.19Å; F230-F370 HydrophobicContact CE1-CE2 3.19Å; F230-F370 AromaticContact CE1-CZ 3.39Å; F230-F370 HydrophobicContact CE1-CZ 3.39Å; F230-F370 HydrophobicContact CZ-CE2 4.18Å; A231-F370 HydrophobicContact CB-CE1 4.3Å; A231-F370 HydrophobicContact CB-CZ 4.3Å; I366-F370 HydrophobicContact CG2-CD2 3.83Å; I366-F370 HydrophobicContact CG2-CE2 4.05Å; I366-F370 WeakPolarHBondContact O-CD2 3.31Å; I366-F370 PolarHBondContact O-N 2.76Å; F368-F370 PolarHBondContact O-N 3.42Å; F370-L374 VanDerWaalsContact O-CB 3.3Å; F370-L374 WeakPolarHBondContact O-CB 3.33Å; F370-L374 PolarHBondContact O-N 3.02Å
371	T	92.5	Very high	90.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.8	-46.3	-177.2	-59.2	0	0	0	0	111.5	S367 F368 A369 S375 A412	S367-T371 VanDerWaalsContact O-CB 3.31Å; S367-T371 WeakPolarHBondContact O-CB 3.38Å; S367-T371 PolarHBondContact O-N 2.98Å; S367-T371 PolarHBondContact O-OG1 3.43Å; F368-T371 PolarHBondContact O-N 3.31Å; F368-T371 VanDerWaalsContact O-N 3.13Å; A369-T371 PolarHBondContact O-N 2.84Å; T371-S375 WeakPolarHBondContact O-CB 3.42Å; T371-S375 PolarHBondContact O-N 3.32Å; T371-S375 PolarHBondContact O-OG 3.24Å; T371-A412 HydrophobicContact CG2-CB 4.15Å; T371-A412 PolarHBondContact OG1-N 3.41Å
372	V	91.8	Very high	90.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.8	-43.6	178.8	70	0	0	0	0	111.5	F368 A369 L374 S375 E376 P388	F368-V372 HydrophobicContact CD2-CB 4.47Å; F368-V372 HydrophobicContact CE1-CG1 4.36Å; F368-V372 HydrophobicContact CE2-CB 3.91Å; F368-V372 HydrophobicContact CE2-CG1 4.13Å; F368-V372 HydrophobicContact CE2-CG2 4.4Å; F368-V372 HydrophobicContact CZ-CB 4.2Å; F368-V372 HydrophobicContact CZ-CG1 4.01Å; F368-V372 HydrophobicContact CZ-CG2 4.48Å; F368-V372 WeakPolarHBondContact O-CG1 3.16Å; F368-V372 PolarHBondContact O-N 3.09Å; A369-V372 WeakPolarHBondContact O-CG1 3.45Å; V372-L374 PolarHBondContact O-N 3.39Å; V372-S375 WeakPolarHBondContact O-CB 3.39Å; V372-S375 PolarHBondContact O-N 3.14Å; V372-E376 HydrophobicContact CG2-CG 4.33Å; V372-E376 WeakPolarHBondContact O-CB 3.4Å; V372-E376 WeakPolarHBondContact O-CG 3.47Å; V372-E376 PolarHBondContact O-N 2.75Å; V372-P388 HydrophobicContact CG2-CB 3.87Å; V372-P388 HydrophobicContact CG2-CG 3.98Å
373	S	87.3	Confident	90.3	Very high	21 Å²	21	36.5 Å²	36.5	15%	0.147	19%	0.193	C	C	.	.	H	α-helix	trans	-67	-38.7	-178.6	-59.7	0	0	0	0	112.8	L227 A369 M377	L227-S373 VanDerWaalsContact CD1-CB 3.5Å; L227-S373 WeakPolarHBondContact CD1-OG 3.34Å; A369-S373 WeakPolarHBondContact O-CB 3.48Å; A369-S373 PolarHBondContact O-N 2.9Å; A369-S373 VanDerWaalsContact O-N 3.07Å; A369-S373 PolarHBondContact O-OG 3.11Å; S373-M377 VanDerWaalsContact O-CB 3.31Å; S373-M377 WeakPolarHBondContact O-CB 3.4Å; S373-M377 PolarHBondContact O-N 3.48Å
374	L	88.4	Confident	90.2	Very high	12 Å²	12	38 Å²	38	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-67.2	-41.9	173.8	-164.4	64.5	0	0	0	110.8	V124 F370 V372 M377 F378 A412 L414 T417	V124-L374 HydrophobicContact CG1-CD2 4.44Å; V124-L374 HydrophobicContact CG2-CB 4.24Å; V124-L374 HydrophobicContact CG2-CD2 4.18Å; V124-L374 HydrophobicContact CG2-CG 3.99Å; F370-L374 VanDerWaalsContact O-CB 3.3Å; F370-L374 WeakPolarHBondContact O-CB 3.33Å; F370-L374 PolarHBondContact O-N 3.02Å; V372-L374 PolarHBondContact O-N 3.39Å; L374-M377 HydrophobicContact CD1-SD 4.44Å; L374-M377 PolarHBondContact O-N 3.21Å; L374-F378 HydrophobicContact CD1-CD2 3.99Å; L374-F378 HydrophobicContact CD1-CE2 3.61Å; L374-F378 HydrophobicContact CG-CD2 4.04Å; L374-F378 HydrophobicContact CG-CE2 4.04Å; L374-F378 WeakPolarHBondContact O-CD2 3.47Å; L374-F378 PolarHBondContact O-N 2.97Å; L374-F378 VanDerWaalsContact O-N 3.1Å; L374-A412 HydrophobicContact CB-CB 4.44Å; L374-A412 HydrophobicContact CD2-CB 3.89Å; L374-L414 HydrophobicContact CD1-CB 4.44Å; L374-L414 HydrophobicContact CD1-CD1 3.5Å; L374-L414 VanDerWaalsContact CD1-CD1 3.5Å; L374-T417 HydrophobicContact CD2-CG2 4.03Å; L374-T417 WeakPolarHBondContact CD2-OG1 3.49Å; L374-T417 HydrophobicContact CG-CG2 4.28Å
375	S	92	Very high	90.1	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-48.1	177.1	-63.5	0	0	0	0	111.7	S121 T371 V372 M377 F378 A379 E391	S121-S375 WeakPolarHBondContact CB-OG 3.34Å; T371-S375 WeakPolarHBondContact O-CB 3.42Å; T371-S375 PolarHBondContact O-N 3.32Å; T371-S375 PolarHBondContact O-OG 3.24Å; V372-S375 WeakPolarHBondContact O-CB 3.39Å; V372-S375 PolarHBondContact O-N 3.14Å; S375-M377 PolarHBondContact O-N 3Å; S375-F378 PolarHBondContact O-N 3.3Å; S375-A379 WeakPolarHBondContact O-CB 3.38Å; S375-A379 PolarHBondContact O-N 3.33Å; S375-E391 PolarHBondContact OG-OE2 3.42Å
376	E	89.4	Confident	90.2	Very high	77 Å²	77	41.8 Å²	41.8	36%	0.36	23%	0.226	S	C	.	.	H	α-helix	trans	-63.7	-39.4	177.2	-73.7	178.3	177.9	0	0	112.6	V372 A379 K380	V372-E376 HydrophobicContact CG2-CG 4.33Å; V372-E376 WeakPolarHBondContact O-CB 3.4Å; V372-E376 WeakPolarHBondContact O-CG 3.47Å; V372-E376 PolarHBondContact O-N 2.75Å; E376-A379 PolarHBondContact O-N 3.42Å; E376-K380 WeakPolarHBondContact O-CB 3.37Å; E376-K380 PolarHBondContact O-N 3.17Å
377	M	85.5	Confident	90.3	Very high	102 Å²	102	46.1 Å²	46.1	50%	0.502	24%	0.242	S	C	.	.	H	α-helix	trans	-58.3	-50	176.1	-178.6	-173	-62.7	0	0	111.6	S373 L374 S375 K381	S373-M377 VanDerWaalsContact O-CB 3.31Å; S373-M377 WeakPolarHBondContact O-CB 3.4Å; S373-M377 PolarHBondContact O-N 3.48Å; L374-M377 HydrophobicContact CD1-SD 4.44Å; L374-M377 PolarHBondContact O-N 3.21Å; S375-M377 PolarHBondContact O-N 3Å; M377-K381 WeakPolarHBondContact O-CB 3.44Å; M377-K381 PolarHBondContact O-N 2.98Å
378	F	89.1	Confident	90.3	Very high	3 Å²	3	47.7 Å²	47.7	1%	0.013	25%	0.252	C	S	.	.	H	α-helix	trans	-75.1	-29.1	179.2	-79.2	-81.7	0	0	0	113	H123 L374 S375 K381 H382 Y384 T417 M418 D421	H123-F378 HydrophobicContact CB-CB 4.28Å; H123-F378 HydrophobicContact CB-CD1 4.24Å; H123-F378 HydrophobicContact CB-CG 4.32Å; L374-F378 HydrophobicContact CD1-CD2 3.99Å; L374-F378 HydrophobicContact CD1-CE2 3.61Å; L374-F378 HydrophobicContact CG-CD2 4.04Å; L374-F378 HydrophobicContact CG-CE2 4.04Å; L374-F378 WeakPolarHBondContact O-CD2 3.47Å; L374-F378 PolarHBondContact O-N 2.97Å; L374-F378 VanDerWaalsContact O-N 3.1Å; S375-F378 PolarHBondContact O-N 3.3Å; F378-K381 HydrophobicContact CD1-CD 4.32Å; F378-K381 HydrophobicContact CE1-CD 4.41Å; F378-K381 PolarHBondContact O-N 3.07Å; F378-H382 PolarHBondContact O-CD2 3.32Å; F378-H382 PolarHBondContact O-N 2.92Å; F378-H382 VanDerWaalsContact O-N 3.07Å; F378-Y384 WeakPolarHBondContact O-CE1 3.3Å; F378-T417 HydrophobicContact CD2-CG2 3.58Å; F378-T417 HydrophobicContact CE1-CG2 4.27Å; F378-T417 HydrophobicContact CE2-CG2 3.27Å; F378-T417 HydrophobicContact CG-CG2 4.22Å; F378-T417 HydrophobicContact CZ-CG2 3.64Å; F378-M418 HydrophobicContact CE1-SD 4.39Å; F378-M418 HydrophobicContact CZ-CG 4.4Å; F378-M418 HydrophobicContact CZ-SD 3.65Å; F378-D421 HydrophobicContact CD1-CB 4.25Å; F378-D421 HydrophobicContact CE1-CB 3.54Å; F378-D421 HydrophobicContact CZ-CB 4.33Å
379	A	91.8	Very high	90.4	Very high	4 Å²	4	50 Å²	50	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-46.9	172.2	0	0	0	0	0	111.2	S375 E376 H382 G383 Y384 V386	S375-A379 WeakPolarHBondContact O-CB 3.38Å; S375-A379 PolarHBondContact O-N 3.33Å; E376-A379 PolarHBondContact O-N 3.42Å; A379-H382 PolarHBondContact O-N 3.37Å; A379-G383 PolarHBondContact O-N 3.4Å; A379-Y384 CarbonylContact C-O 3.59Å; A379-Y384 VanDerWaalsContact CA-CZ 3.45Å; A379-Y384 HydrophobicContact CB-CD2 3.66Å; A379-Y384 HydrophobicContact CB-CE1 4.48Å; A379-Y384 HydrophobicContact CB-CE2 3.51Å; A379-Y384 HydrophobicContact CB-CG 4.22Å; A379-Y384 VanDerWaalsContact CB-O 3.28Å; A379-Y384 WeakPolarHBondContact CB-O 3.34Å; A379-Y384 PolarHBondContact O-N 3.42Å; A379-Y384 VanDerWaalsContact O-O 3.09Å; A379-V386 HydrophobicContact CB-CB 4.33Å; A379-V386 HydrophobicContact CB-CG2 3.6Å
380	K	89.1	Confident	90.6	Very high	187 Å²	187	50.8 Å²	50.8	81%	0.813	27%	0.268	S	S	*	.	H	α-helix	trans	-63.5	-40.9	174.8	-171.3	176.2	-178.8	179	0	112.1	E376 H382	E376-K380 WeakPolarHBondContact O-CB 3.37Å; E376-K380 PolarHBondContact O-N 3.17Å; K380-H382 VanDerWaalsContact C-N 3.33Å; K380-H382 PolarHBondContact O-N 3.43Å
381	K	89.4	Confident	91	Very high	126 Å²	126	49.2 Å²	49.2	55%	0.548	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-38.4	178.5	-173.7	179.2	179.5	-178.3	0	113	M377 F378 D421	M377-K381 WeakPolarHBondContact O-CB 3.44Å; M377-K381 PolarHBondContact O-N 2.98Å; F378-K381 HydrophobicContact CD1-CD 4.32Å; F378-K381 HydrophobicContact CE1-CD 4.41Å; F378-K381 PolarHBondContact O-N 3.07Å; K381-D421 IonicContact NZ-OD1 2.83Å; K381-D421 IonicContact NZ-OD2 3.42Å; K381-D421 PolarHBondContact NZ-OD2 3.4Å
382	H	90.8	Very high	91.1	Very high	73 Å²	73	49.3 Å²	49.3	34%	0.338	26%	0.262	S	S	.	.	H	α-helix	trans	-108	8.1	-173.9	-72.5	-74.9	0	0	0	114.5	H123 F378 A379 K380 Y384 D421	H123-H382 AromaticContact CD2-NE2 3.71Å; H123-H382 AromaticContact CE1-CD2 3.52Å; H123-H382 AromaticContact CE1-CG 3.73Å; H123-H382 AromaticContact CE1-NE2 3.82Å; H123-H382 AromaticContact ND1-CD2 3.78Å; H123-H382 AromaticContact NE2-CD2 3.68Å; H123-H382 AromaticContact NE2-CE1 3.72Å; H123-H382 AromaticContact NE2-NE2 3.47Å; H123-H382 PolarHBondContact NE2-NE2 3.47Å; F378-H382 PolarHBondContact O-CD2 3.32Å; F378-H382 PolarHBondContact O-N 2.92Å; F378-H382 VanDerWaalsContact O-N 3.07Å; A379-H382 PolarHBondContact O-N 3.37Å; K380-H382 VanDerWaalsContact C-N 3.33Å; K380-H382 PolarHBondContact O-N 3.43Å; H382-Y384 HydrophobicContact CB-CD1 3.69Å; H382-Y384 HydrophobicContact CB-CE1 3.64Å; H382-D421 IonicContact CD2-OD1 3.26Å; H382-D421 IonicContact CE1-OD1 3.03Å; H382-D421 PolarHBondContact CE1-OD1 3.47Å; H382-D421 IonicContact NE2-OD1 3.47Å; H382-D421 PolarHBondContact NE2-OD1 2.93Å
383	G	91.2	Very high	91.3	Very high	72 Å²	72	50.5 Å²	50.5	74%	0.742	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	33.3	175.5	0	0	0	0	0	115.3	A379	A379-G383 PolarHBondContact O-N 3.4Å
384	Y	92.3	Very high	91.7	Very high	32 Å²	32	49.5 Å²	49.5	13%	0.125	26%	0.262	C	S	.	.			trans	-118.3	171.9	169.8	66.3	-90.7	0	0	0	111.6	S121 R122 H123 F378 A379 H382 V386	S121-Y384 PolarHBondContact OG-OH 2.9Å; R122-Y384 PolarHBondContact N-OH 2.92Å; H123-Y384 AromaticContact CE1-CE1 3.87Å; H123-Y384 AromaticContact ND1-CE1 3.56Å; H123-Y384 AromaticContact ND1-CZ 3.82Å; H123-Y384 PolarHBondContact ND1-OH 3.45Å; F378-Y384 WeakPolarHBondContact O-CE1 3.3Å; A379-Y384 CarbonylContact C-O 3.59Å; A379-Y384 VanDerWaalsContact CA-CZ 3.45Å; A379-Y384 HydrophobicContact CB-CD2 3.66Å; A379-Y384 HydrophobicContact CB-CE1 4.48Å; A379-Y384 HydrophobicContact CB-CE2 3.51Å; A379-Y384 HydrophobicContact CB-CG 4.22Å; A379-Y384 VanDerWaalsContact CB-O 3.28Å; A379-Y384 WeakPolarHBondContact CB-O 3.34Å; A379-Y384 PolarHBondContact O-N 3.42Å; A379-Y384 VanDerWaalsContact O-O 3.09Å; H382-Y384 HydrophobicContact CB-CD1 3.69Å; H382-Y384 HydrophobicContact CB-CE1 3.64Å; Y384-V386 HydrophobicContact CD2-CG2 4.19Å; Y384-V386 HydrophobicContact CE2-CG2 3.74Å
385	S	90.7	Very high	92.1	Very high	105 Å²	105	48.9 Å²	48.9	73%	0.734	26%	0.259	S	S	*	.			trans	-114.2	146.5	177.2	61.1	0	0	0	0	111.7
386	V	92.2	Very high	92.3	Very high	20 Å²	20	48.9 Å²	48.9	12%	0.121	26%	0.259	C	S	.	.			trans	-114.5	146.8	178.2	164	0	0	0	0	108.5	A379 Y384 P388 E391	A379-V386 HydrophobicContact CB-CB 4.33Å; A379-V386 HydrophobicContact CB-CG2 3.6Å; Y384-V386 HydrophobicContact CD2-CG2 4.19Å; Y384-V386 HydrophobicContact CE2-CG2 3.74Å; V386-P388 WeakPolarHBondContact O-CD 3.45Å; V386-E391 HydrophobicContact CG1-CG 3.53Å
387	R	92	Very high	92.7	Very high	93 Å²	93	46.9 Å²	46.9	35%	0.351	25%	0.25	S	S	.	.			trans	-106.3	107	178.6	-67.6	-176.8	-68.7	152.1	2.7	109.7	G55 T120 N389 Q390 E391	G55-R387 PolarHBondContact O-NH1 2.92Å; G55-R387 PolarHBondContact O-NH2 3.38Å; T120-R387 HydrophobicContact CG2-CB 4.41Å; T120-R387 PolarHBondContact OG1-N 2.72Å; R387-N389 PolarHBondContact O-N 3.14Å; R387-Q390 HydrophobicContact CB-CB 3.92Å; R387-Q390 PolarHBondContact O-N 2.85Å; R387-E391 PolarHBondContact O-N 3.35Å
388	P	93.3	Very high	93.2	Very high	32 Å²	32	42.1 Å²	42.1	21%	0.208	23%	0.227	C	C	.	.	H	α-helix	trans	-53.8	-47	-176.4	-31.5	37.2	0	0	0	114.7	F368 V372 V386 Q390 E391 M392	F368-P388 HydrophobicContact CZ-CB 4.46Å; V372-P388 HydrophobicContact CG2-CB 3.87Å; V372-P388 HydrophobicContact CG2-CG 3.98Å; V386-P388 WeakPolarHBondContact O-CD 3.45Å; P388-Q390 VanDerWaalsContact C-N 3.28Å; P388-Q390 PolarHBondContact O-N 3.49Å; P388-E391 PolarHBondContact O-N 3.17Å; P388-M392 PolarHBondContact O-N 3.07Å
389	N	93.4	Very high	93.6	Very high	57 Å²	57	42 Å²	42	31%	0.305	23%	0.226	S	C	.	.	H	α-helix	trans	-63.2	-33	178.5	-75.6	-40.4	0	0	0	112.9	R214 G216 R387 M392 V393	R214-N389 WeakPolarHBondContact CA-OD1 3.47Å; G216-N389 WeakPolarHBondContact CA-OD1 3.17Å; G216-N389 PolarHBondContact N-OD1 3.18Å; R387-N389 PolarHBondContact O-N 3.14Å; N389-M392 PolarHBondContact O-N 3.3Å; N389-M392 WeakPolarHBondContact OD1-CE 3.34Å; N389-V393 WeakPolarHBondContact O-CG2 3.37Å; N389-V393 PolarHBondContact O-N 3.04Å; N389-V393 VanDerWaalsContact O-N 3.15Å
390	Q	93.8	Very high	93.9	Very high	18 Å²	18	42.7 Å²	42.7	8%	0.084	23%	0.23	C	C	.	.	H	α-helix	trans	-75.2	-38.9	177.2	-178.7	63.6	29.6	0	0	111.2	G55 F56 P58 M118 T120 R387 P388 M392 V393 A394	G55-Q390 PolarHBondContact O-OE1 2.96Å; G55-Q390 VanDerWaalsContact O-OE1 3.13Å; F56-Q390 PolarHBondContact O-NE2 3.46Å; P58-Q390 HydrophobicContact CG-CG 4.17Å; M118-Q390 PolarHBondContact O-NE2 3.47Å; M118-Q390 VanDerWaalsContact O-NE2 3.12Å; T120-Q390 HydrophobicContact CG2-CB 3.86Å; T120-Q390 HydrophobicContact CG2-CG 3.41Å; T120-Q390 VanDerWaalsContact CG2-CG 3.41Å; R387-Q390 HydrophobicContact CB-CB 3.92Å; R387-Q390 PolarHBondContact O-N 2.85Å; P388-Q390 VanDerWaalsContact C-N 3.28Å; P388-Q390 PolarHBondContact O-N 3.49Å; Q390-M392 PolarHBondContact O-N 3.18Å; Q390-V393 PolarHBondContact O-N 3.06Å; Q390-A394 WeakPolarHBondContact O-CB 3.41Å; Q390-A394 PolarHBondContact O-N 3.15Å
391	E	94.8	Very high	94.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.8	-38.2	171.7	-71.1	-60.4	131.8	0	0	111.2	Y115 T120 S121 S375 V386 R387 P388 A394 I395	Y115-E391 WeakPolarHBondContact CE2-OE2 3.5Å; Y115-E391 PolarHBondContact OH-OE2 3.33Å; T120-E391 WeakPolarHBondContact CA-OE1 3.42Å; T120-E391 WeakPolarHBondContact CB-OE1 3.33Å; T120-E391 PolarHBondContact N-OE1 3.23Å; T120-E391 PolarHBondContact OG1-OE1 3.47Å; S121-E391 PolarHBondContact N-OE1 2.88Å; S121-E391 VanDerWaalsContact N-OE1 3.12Å; S375-E391 PolarHBondContact OG-OE2 3.42Å; V386-E391 HydrophobicContact CG1-CG 3.53Å; R387-E391 PolarHBondContact O-N 3.35Å; P388-E391 PolarHBondContact O-N 3.17Å; E391-A394 PolarHBondContact O-N 3.1Å; E391-I395 WeakPolarHBondContact O-CG2 3.3Å; E391-I395 PolarHBondContact O-N 3.3Å
392	M	94.9	Very high	94.5	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-41.1	176.3	-168.1	163.8	37.2	0	0	112.9	Q207 M210 A211 F368 P388 N389 Q390 I395 G396	Q207-M392 HydrophobicContact CB-CG 4.45Å; Q207-M392 VanDerWaalsContact O-CG 3.32Å; Q207-M392 WeakPolarHBondContact O-CG 3.23Å; M210-M392 VanDerWaalsContact C-CE 3.49Å; M210-M392 HydrophobicContact CB-CE 4.23Å; M210-M392 HydrophobicContact CB-SD 3.39Å; M210-M392 WeakPolarHBondContact CB-SD 3.4Å; M210-M392 WeakPolarHBondContact O-CE 3.5Å; A211-M392 HydrophobicContact CB-CB 4.15Å; A211-M392 HydrophobicContact CB-CE 3.76Å; A211-M392 HydrophobicContact CB-CG 4.02Å; A211-M392 HydrophobicContact CB-SD 4.4Å; F368-M392 HydrophobicContact CD1-SD 4.31Å; F368-M392 HydrophobicContact CD2-CB 3.61Å; F368-M392 HydrophobicContact CD2-CG 3.78Å; F368-M392 HydrophobicContact CD2-SD 4.17Å; F368-M392 HydrophobicContact CE1-SD 4.37Å; F368-M392 HydrophobicContact CE2-CB 3.62Å; F368-M392 HydrophobicContact CE2-CG 4.13Å; F368-M392 HydrophobicContact CE2-SD 4.25Å; F368-M392 HydrophobicContact CG-CB 4.48Å; F368-M392 HydrophobicContact CG-CG 4.19Å; F368-M392 HydrophobicContact CG-SD 4.2Å; F368-M392 HydrophobicContact CZ-CB 4.49Å; F368-M392 HydrophobicContact CZ-SD 4.35Å; P388-M392 PolarHBondContact O-N 3.07Å; N389-M392 PolarHBondContact O-N 3.3Å; N389-M392 WeakPolarHBondContact OD1-CE 3.34Å; Q390-M392 PolarHBondContact O-N 3.18Å; M392-I395 WeakPolarHBondContact O-CG2 3.3Å; M392-G396 PolarHBondContact O-N 2.86Å
393	V	95.6	Very high	94.8	Very high	25 Å²	25	27.3 Å²	27.3	15%	0.152	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-44.8	172.2	174.2	0	0	0	0	111	F56 M118 A211 N389 Q390 G396 L397	F56-V393 HydrophobicContact CD2-CG1 4.44Å; F56-V393 HydrophobicContact CE2-CG1 3.81Å; F56-V393 HydrophobicContact CZ-CG1 4.37Å; M118-V393 HydrophobicContact CE-CG1 3.95Å; A211-V393 HydrophobicContact CB-CG2 3.47Å; A211-V393 VanDerWaalsContact CB-CG2 3.47Å; N389-V393 WeakPolarHBondContact O-CG2 3.37Å; N389-V393 PolarHBondContact O-N 3.04Å; N389-V393 VanDerWaalsContact O-N 3.15Å; Q390-V393 PolarHBondContact O-N 3.06Å; V393-G396 PolarHBondContact O-N 3.05Å; V393-L397 HydrophobicContact CG1-CD1 3.82Å; V393-L397 PolarHBondContact O-N 3.08Å
394	A	96.1	Very high	95	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.5	-48.7	-178.7	0	0	0	0	0	111.3	Y115 M118 Q390 E391 L397 C398	Y115-A394 HydrophobicContact CD2-CB 4.34Å; Y115-A394 HydrophobicContact CE2-CB 4.4Å; M118-A394 HydrophobicContact CB-CB 3.75Å; Q390-A394 WeakPolarHBondContact O-CB 3.41Å; Q390-A394 PolarHBondContact O-N 3.15Å; E391-A394 PolarHBondContact O-N 3.1Å; A394-L397 PolarHBondContact O-N 3.01Å; A394-C398 PolarHBondContact O-N 3.4Å; A394-C398 PolarHBondContact O-SG 3.49Å
395	I	96.6	Very high	95.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-69.4	-36.1	178.3	-163.8	63.7	0	0	0	112.3	V126 Q207 S367 E391 M392 L397 C398 N399	V126-I395 HydrophobicContact CG1-CD1 3.59Å; Q207-I395 PolarHBondContact OE1-O 3.01Å; S367-I395 VanDerWaalsContact OG-CG1 3.31Å; S367-I395 WeakPolarHBondContact OG-CG1 3.16Å; E391-I395 WeakPolarHBondContact O-CG2 3.3Å; E391-I395 PolarHBondContact O-N 3.3Å; M392-I395 WeakPolarHBondContact O-CG2 3.3Å; I395-L397 VanDerWaalsContact C-N 3.31Å; I395-L397 PolarHBondContact O-N 2.73Å; I395-C398 HydrophobicContact CD1-CB 4.22Å; I395-C398 CarbonylContact O-C 3.41Å; I395-C398 WeakPolarHBondContact O-CB 3.47Å; I395-C398 PolarHBondContact O-N 2.92Å; I395-N399 PolarHBondContact O-N 3.31Å; I395-N399 VanDerWaalsContact O-N 3.13Å; I395-N399 PolarHBondContact O-ND2 3.07Å
396	G	97.1	Very high	95.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-56.4	-45.4	173	0	0	0	0	0	112	Q207 M392 V393 N399 V400	Q207-G396 VanDerWaalsContact OE1-CA 3.24Å; M392-G396 PolarHBondContact O-N 2.86Å; V393-G396 PolarHBondContact O-N 3.05Å; G396-N399 PolarHBondContact O-N 3.11Å; G396-N399 VanDerWaalsContact O-N 3.13Å; G396-V400 WeakPolarHBondContact O-CG2 3.22Å; G396-V400 PolarHBondContact O-N 3.22Å
397	L	97.1	Very high	95.3	Very high	35 Å²	35	23.1 Å²	23.1	18%	0.183	12%	0.115	C	C	.	.	H	α-helix	trans	-73.2	-31.3	177	-72.1	165.8	0	0	0	113.2	F56 I114 M118 I208 V393 A394 I395 N399 V401 P402	F56-L397 HydrophobicContact CZ-CD1 3.95Å; I114-L397 HydrophobicContact CG2-CB 4.21Å; M118-L397 HydrophobicContact CE-CD1 3.23Å; M118-L397 HydrophobicContact SD-CB 3.97Å; M118-L397 HydrophobicContact SD-CD1 3.28Å; M118-L397 WeakPolarHBondContact SD-CD1 3.33Å; M118-L397 HydrophobicContact SD-CG 4.25Å; I208-L397 HydrophobicContact CD1-CD2 3.91Å; I208-L397 HydrophobicContact CD1-CG 4.13Å; V393-L397 HydrophobicContact CG1-CD1 3.82Å; V393-L397 PolarHBondContact O-N 3.08Å; A394-L397 PolarHBondContact O-N 3.01Å; I395-L397 VanDerWaalsContact C-N 3.31Å; I395-L397 PolarHBondContact O-N 2.73Å; L397-N399 PolarHBondContact O-N 2.84Å; L397-V401 HydrophobicContact CD2-CG2 4.24Å; L397-V401 PolarHBondContact O-N 3.5Å; L397-V401 VanDerWaalsContact O-N 3.07Å; L397-P402 WeakPolarHBondContact O-CD 3.47Å
398	C	96.9	Very high	95.5	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.007	10%	0.099	C	C	.	.	H	α-helix	trans	-62.6	-14.9	168	-69.8	0	0	0	0	113.3	A394 I395 P402 T410	A394-C398 PolarHBondContact O-N 3.4Å; A394-C398 PolarHBondContact O-SG 3.49Å; I395-C398 HydrophobicContact CD1-CB 4.22Å; I395-C398 CarbonylContact O-C 3.41Å; I395-C398 WeakPolarHBondContact O-CB 3.47Å; I395-C398 PolarHBondContact O-N 2.92Å; C398-P402 VanDerWaalsContact O-CD 3.25Å; C398-P402 WeakPolarHBondContact O-CD 3.49Å; C398-P402 WeakPolarHBondContact O-CG 3.36Å; C398-T410 PolarHBondContact O-OG1 3.49Å
399	N	97.4	Very high	95.6	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-104.5	-42.4	175.6	-69.1	-32.7	0	0	0	112.1	T200 Q207 I395 G396 L397 S403 T410	T200-N399 HydrophobicContact CG2-CB 4.02Å; Q207-N399 PolarHBondContact OE1-ND2 3.42Å; I395-N399 PolarHBondContact O-N 3.31Å; I395-N399 VanDerWaalsContact O-N 3.13Å; I395-N399 PolarHBondContact O-ND2 3.07Å; G396-N399 PolarHBondContact O-N 3.11Å; G396-N399 VanDerWaalsContact O-N 3.13Å; L397-N399 PolarHBondContact O-N 2.84Å; N399-S403 WeakPolarHBondContact O-CB 3.49Å; N399-S403 PolarHBondContact O-N 2.84Å; N399-T410 PolarHBondContact OD1-N 3.08Å; N399-T410 PolarHBondContact OD1-OG1 3.37Å
400	V	97.6	Very high	95.6	Very high	20 Å²	20	14.5 Å²	14.5	12%	0.121	7%	0.074	C	C	.	.	H	α-helix	trans	-65.9	-54.5	179	173.1	0	0	0	0	111.9	F201 G204 V205 I208 G396 S403 F404	F201-V400 HydrophobicContact CD2-CG1 4.1Å; F201-V400 HydrophobicContact CE2-CG1 3.89Å; G204-V400 VanDerWaalsContact C-CG2 3.41Å; V205-V400 HydrophobicContact CG2-CG2 4.15Å; I208-V400 HydrophobicContact CD1-CG2 3.83Å; G396-V400 WeakPolarHBondContact O-CG2 3.22Å; G396-V400 PolarHBondContact O-N 3.22Å; V400-S403 PolarHBondContact O-N 2.89Å; V400-S403 PolarHBondContact O-OG 2.89Å; V400-F404 HydrophobicContact CG1-CE2 4.33Å; V400-F404 VanDerWaalsContact O-CD2 3.3Å; V400-F404 WeakPolarHBondContact O-CD2 3.23Å
401	V	96.7	Very high	95.6	Very high	60 Å²	60	13.7 Å²	13.7	36%	0.364	7%	0.07	S	C	.	.	H	α-helix	trans	-65.6	-46.8	-173	177.1	0	0	0	0	111.5	I114 L397 S403 F404 F405	I114-V401 HydrophobicContact CD1-CB 3.87Å; I114-V401 HydrophobicContact CD1-CG1 4.08Å; L397-V401 HydrophobicContact CD2-CG2 4.24Å; L397-V401 PolarHBondContact O-N 3.5Å; L397-V401 VanDerWaalsContact O-N 3.07Å; V401-S403 VanDerWaalsContact C-N 3.27Å; V401-S403 PolarHBondContact O-N 3.34Å; V401-F404 PolarHBondContact O-N 3.05Å; V401-F405 HydrophobicContact CG1-CE2 4.49Å; V401-F405 WeakPolarHBondContact O-CD2 3.38Å
402	P	95.5	Very high	95.5	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.006	7%	0.071	C	C	.	.	H	α-helix	trans	-69.2	-21.8	-179	-25.4	41.2	0	0	0	114	Y110 I114 L397 C398 F404 F405 C407	Y110-P402 HydrophobicContact CG-CB 4.45Å; I114-P402 HydrophobicContact CD1-CG 3.5Å; L397-P402 WeakPolarHBondContact O-CD 3.47Å; C398-P402 VanDerWaalsContact O-CD 3.25Å; C398-P402 WeakPolarHBondContact O-CD 3.49Å; C398-P402 WeakPolarHBondContact O-CG 3.36Å; P402-F404 PolarHBondContact O-N 2.81Å; P402-F404 VanDerWaalsContact O-N 3.16Å; P402-F405 CarbonylContact O-C 3.4Å; P402-F405 WeakPolarHBondContact O-CA 3.46Å; P402-F405 PolarHBondContact O-N 3.2Å; P402-C407 HydrophobicContact CB-CB 3.48Å; P402-C407 VanDerWaalsContact CB-CB 3.48Å; P402-C407 WeakPolarHBondContact O-CB 3.48Å; P402-C407 PolarHBondContact O-N 3.36Å; P402-C407 PolarHBondContact O-SG 3.49Å; P402-C407 VanDerWaalsContact O-SG 3.37Å
403	S	96.1	Very high	95.1	Very high	1 Å²	1	14 Å²	14	1%	0.007	7%	0.074	C	C	.	.	H	α-helix	trans	-58.7	-28.1	177.5	70.8	0	0	0	0	113.1	F201 P348 N399 V400 V401 F405 H406	F201-S403 WeakPolarHBondContact CD2-OG 3.43Å; P348-S403 WeakPolarHBondContact CG-OG 3.4Å; N399-S403 WeakPolarHBondContact O-CB 3.49Å; N399-S403 PolarHBondContact O-N 2.84Å; V400-S403 PolarHBondContact O-N 2.89Å; V400-S403 PolarHBondContact O-OG 2.89Å; V401-S403 VanDerWaalsContact C-N 3.27Å; V401-S403 PolarHBondContact O-N 3.34Å; S403-F405 PolarHBondContact O-N 3.28Å; S403-H406 PolarHBondContact O-N 2.9Å
404	F	95.6	Very high	94.5	Very high	66 Å²	66	16 Å²	16	29%	0.289	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.6	173.1	-66.9	-90	0	0	0	113.7	F201 P345 Q346 V347 V400 V401 P402	F201-F404 HydrophobicContact CD2-CE2 4.06Å; F201-F404 HydrophobicContact CD2-CZ 4.32Å; F201-F404 AromaticContact CE2-CE2 3.84Å; F201-F404 HydrophobicContact CE2-CE2 3.84Å; F201-F404 AromaticContact CE2-CZ 3.83Å; F201-F404 HydrophobicContact CE2-CZ 3.83Å; P345-F404 CarbonylContact C-O 3.54Å; P345-F404 WeakPolarHBondContact CA-O 3.35Å; P345-F404 WeakPolarHBondContact CB-O 3.27Å; Q346-F404 PolarHBondContact N-O 3.1Å; Q346-F404 CarbonylContact O-C 3.53Å; Q346-F404 VanDerWaalsContact O-CA 3.26Å; Q346-F404 WeakPolarHBondContact O-CA 3.33Å; Q346-F404 VanDerWaalsContact O-O 3.09Å; V347-F404 HydrophobicContact CG1-CE1 4.45Å; V400-F404 HydrophobicContact CG1-CE2 4.33Å; V400-F404 VanDerWaalsContact O-CD2 3.3Å; V400-F404 WeakPolarHBondContact O-CD2 3.23Å; V401-F404 PolarHBondContact O-N 3.05Å; P402-F404 PolarHBondContact O-N 2.81Å; P402-F404 VanDerWaalsContact O-N 3.16Å
405	F	94.9	Very high	93.8	Very high	53 Å²	53	18 Å²	18	23%	0.232	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	34.4	-179.4	-58.6	-87.3	0	0	0	110.8	Y110 P345 V401 P402 S403 C407	Y110-F405 HydrophobicContact CD2-CB 4.14Å; Y110-F405 HydrophobicContact CE1-CD1 4.48Å; Y110-F405 HydrophobicContact CE1-CD2 4.23Å; Y110-F405 HydrophobicContact CE1-CE2 4.37Å; Y110-F405 HydrophobicContact CE1-CG 4.28Å; Y110-F405 HydrophobicContact CE2-CB 3.5Å; Y110-F405 VanDerWaalsContact CE2-CB 3.5Å; Y110-F405 HydrophobicContact CE2-CD1 4.2Å; Y110-F405 HydrophobicContact CE2-CD2 4.27Å; Y110-F405 AromaticContact CE2-CG 3.75Å; Y110-F405 HydrophobicContact CE2-CG 3.75Å; Y110-F405 AromaticContact CZ-CD1 3.73Å; Y110-F405 AromaticContact CZ-CG 3.62Å; Y110-F405 WeakPolarHBondContact OH-CD1 3.36Å; P345-F405 HydrophobicContact CB-CD1 3.95Å; P345-F405 HydrophobicContact CB-CE1 3.79Å; P345-F405 HydrophobicContact CB-CZ 4.36Å; P345-F405 HydrophobicContact CG-CE1 4.27Å; V401-F405 HydrophobicContact CG1-CE2 4.49Å; V401-F405 WeakPolarHBondContact O-CD2 3.38Å; P402-F405 CarbonylContact O-C 3.4Å; P402-F405 WeakPolarHBondContact O-CA 3.46Å; P402-F405 PolarHBondContact O-N 3.2Å; S403-F405 PolarHBondContact O-N 3.28Å; F405-C407 VanDerWaalsContact C-N 3.26Å; F405-C407 PolarHBondContact O-N 3.07Å; F405-C407 PolarHBondContact O-SG 3.25Å; F405-C407 VanDerWaalsContact O-SG 3.4Å
406	H	92.6	Very high	93.4	Very high	23 Å²	23	18.1 Å²	18.1	11%	0.106	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	39.6	179.1	-52.8	-90.1	0	0	0	113.4	Y103 I193 T343 P344 Q346 S403	Y103-H406 HydrophobicContact CD1-CB 3.51Å; Y103-H406 WeakPolarHBondContact CD1-O 3.31Å; Y103-H406 HydrophobicContact CE1-CB 3.36Å; Y103-H406 AromaticContact CE1-CG 3.99Å; I193-H406 WeakPolarHBondContact CD1-O 3.49Å; I193-H406 HydrophobicContact CG1-CB 3.89Å; T343-H406 PolarHBondContact OG1-CD2 3.27Å; P344-H406 PolarHBondContact O-NE2 3.38Å; Q346-H406 PolarHBondContact OE1-CE1 3.46Å; S403-H406 PolarHBondContact O-N 2.9Å
407	C	94.6	Very high	93	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.1	C	C	.	.			trans	-101.1	156.3	175.6	-59.4	0	0	0	0	111	Y106 T107 P402 F405	Y106-C407 VanDerWaalsContact C-SG 3.56Å; T107-C407 VanDerWaalsContact CA-SG 3.58Å; T107-C407 HydrophobicContact CG2-CB 4.41Å; T107-C407 PolarHBondContact N-SG 2.75Å; T107-C407 VanDerWaalsContact N-SG 3.43Å; T107-C407 WeakPolarHBondContact OG1-CA 3.38Å; T107-C407 VanDerWaalsContact OG1-CB 3.27Å; T107-C407 WeakPolarHBondContact OG1-CB 3.35Å; P402-C407 HydrophobicContact CB-CB 3.48Å; P402-C407 VanDerWaalsContact CB-CB 3.48Å; P402-C407 WeakPolarHBondContact O-CB 3.48Å; P402-C407 PolarHBondContact O-N 3.36Å; P402-C407 PolarHBondContact O-SG 3.49Å; P402-C407 VanDerWaalsContact O-SG 3.37Å; F405-C407 VanDerWaalsContact C-N 3.26Å; F405-C407 PolarHBondContact O-N 3.07Å; F405-C407 PolarHBondContact O-SG 3.25Å; F405-C407 VanDerWaalsContact O-SG 3.4Å
408	F	94.5	Very high	92.4	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	11%	0.111	C	C	.	.			trans	-116.8	172.1	176.9	64.3	-89.1	0	0	0	112.1	V99 T107 I128 V136 A196 T200 T410	V99-F408 HydrophobicContact CG2-CD1 4.27Å; V99-F408 HydrophobicContact CG2-CE1 4.18Å; T107-F408 WeakPolarHBondContact CG2-O 3.13Å; T107-F408 PolarHBondContact OG1-N 2.85Å; I128-F408 HydrophobicContact CG2-CE2 4.15Å; I128-F408 HydrophobicContact CG2-CZ 3.82Å; V136-F408 HydrophobicContact CG1-CB 4.32Å; A196-F408 HydrophobicContact CB-CB 4.08Å; T200-F408 WeakPolarHBondContact OG1-CA 3.46Å; F408-T410 PolarHBondContact O-N 3.09Å
409	T	95.3	Very high	91.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.			trans	-54.5	130.2	-165.8	-50.5	0	0	0	0	113.9	M132 T200 L363	M132-T409 HydrophobicContact CE-CG2 3.43Å; M132-T409 VanDerWaalsContact CE-CG2 3.43Å; T200-T409 PolarHBondContact OG1-N 2.83Å; T200-T409 PolarHBondContact OG1-OG1 3.28Å; L363-T409 HydrophobicContact CD2-CG2 4.25Å; L363-T409 WeakPolarHBondContact CD2-OG1 3.39Å
410	T	94.3	Very high	91.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.			trans	-105.8	157.4	178.8	67.4	0	0	0	0	112.6	T107 A111 G127 S367 C398 N399 F408	T107-T410 HydrophobicContact CG2-CG2 3.17Å; A111-T410 HydrophobicContact CB-CG2 3.9Å; G127-T410 WeakPolarHBondContact O-CA 3.42Å; G127-T410 WeakPolarHBondContact O-CB 3.4Å; S367-T410 PolarHBondContact OG-O 2.88Å; C398-T410 PolarHBondContact O-OG1 3.49Å; N399-T410 PolarHBondContact OD1-N 3.08Å; N399-T410 PolarHBondContact OD1-OG1 3.37Å; F408-T410 PolarHBondContact O-N 3.09Å
411	S	93.8	Very high	91	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	168.2	174	-170.2	0	0	0	0	110.4	G127 S367	G127-S411 PolarHBondContact N-O 3.44Å; G127-S411 PolarHBondContact O-N 3.29Å; S367-S411 PolarHBondContact O-OG 2.87Å
412	A	92	Very high	90.4	Very high	2 Å²	2	21.5 Å²	21.5	2%	0.017	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	138.2	168.2	0	0	0	0	0	111.4	V124 V126 T371 L374	V124-A412 HydrophobicContact CG1-CB 3.56Å; V126-A412 HydrophobicContact CG2-CB 4.44Å; T371-A412 HydrophobicContact CG2-CB 4.15Å; T371-A412 PolarHBondContact OG1-N 3.41Å; L374-A412 HydrophobicContact CB-CB 4.44Å; L374-A412 HydrophobicContact CD2-CB 3.89Å
413	A	87.8	Confident	90	Very high	7 Å²	7	22.4 Å²	22.4	6%	0.058	13%	0.125	C	C	.	.			trans	-116	125.8	179	0	0	0	0	0	111.7	S125 F129 K416 T417	S125-A413 PolarHBondContact O-N 2.97Å; F129-A413 HydrophobicContact CD2-CB 4.27Å; A413-K416 HydrophobicContact CB-CB 4.38Å; A413-K416 HydrophobicContact CB-CD 4.43Å; A413-K416 HydrophobicContact CB-CG 4.46Å; A413-T417 VanDerWaalsContact O-CB 3.3Å; A413-T417 WeakPolarHBondContact O-CB 3.26Å; A413-T417 PolarHBondContact O-N 3.49Å; A413-T417 VanDerWaalsContact O-N 3.08Å; A413-T417 PolarHBondContact O-OG1 3.4Å
414	L	82.7	Confident	89.5	Confident	65 Å²	65	24.2 Å²	24.2	34%	0.34	14%	0.143	S	C	.	.	H	α-helix	trans	-62.5	-50.7	-177.2	176.9	62.5	0	0	0	112.5	L374 K416 T417 M418	L374-L414 HydrophobicContact CD1-CB 4.44Å; L374-L414 HydrophobicContact CD1-CD1 3.5Å; L374-L414 VanDerWaalsContact CD1-CD1 3.5Å; L414-K416 PolarHBondContact O-N 2.94Å; L414-T417 PolarHBondContact O-N 3.46Å; L414-M418 HydrophobicContact CD1-CG 3.88Å; L414-M418 HydrophobicContact CD1-SD 4.4Å; L414-M418 HydrophobicContact CG-CG 4.29Å; L414-M418 WeakPolarHBondContact O-CB 3.47Å; L414-M418 VanDerWaalsContact O-CG 3.3Å; L414-M418 WeakPolarHBondContact O-CG 3.11Å; L414-M418 PolarHBondContact O-N 3.15Å
415	A	80.6	Confident	89.3	Confident	42 Å²	42	21.1 Å²	21.1	35%	0.347	13%	0.13	S	C	.	.	H	α-helix	trans	-59.5	-46	-175.6	0	0	0	0	0	112.3	M418 V419	A415-M418 PolarHBondContact O-N 3.31Å; A415-V419 WeakPolarHBondContact O-CG2 3.17Å; A415-V419 PolarHBondContact O-N 3Å; A415-V419 VanDerWaalsContact O-N 3.07Å
416	K	87.6	Confident	89.1	Confident	3 Å²	3	21.7 Å²	21.7	1%	0.013	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-43.5	176.6	-67	-176.2	-68	-172.7	0	111.9	V82 L86 I128 A413 L414 M418 V419 K420	V82-K416 HydrophobicContact CG1-CB 4.39Å; L86-K416 HydrophobicContact CD1-CD 3.63Å; I128-K416 PolarHBondContact O-NZ 2.93Å; A413-K416 HydrophobicContact CB-CB 4.38Å; A413-K416 HydrophobicContact CB-CD 4.43Å; A413-K416 HydrophobicContact CB-CG 4.46Å; L414-K416 PolarHBondContact O-N 2.94Å; K416-M418 VanDerWaalsContact C-N 3.33Å; K416-M418 PolarHBondContact O-N 3.43Å; K416-V419 PolarHBondContact O-N 3.42Å; K416-K420 WeakPolarHBondContact O-CB 3.32Å; K416-K420 PolarHBondContact O-N 2.96Å
417	T	90.5	Very high	89.2	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-37.8	177.8	-57.7	0	0	0	0	111.9	H123 V124 S125 L374 F378 A413 L414 K420 D421	H123-T417 WeakPolarHBondContact O-CG2 3.35Å; V124-T417 HydrophobicContact CG2-CG2 4.25Å; S125-T417 PolarHBondContact N-OG1 3.48Å; L374-T417 HydrophobicContact CD2-CG2 4.03Å; L374-T417 WeakPolarHBondContact CD2-OG1 3.49Å; L374-T417 HydrophobicContact CG-CG2 4.28Å; F378-T417 HydrophobicContact CD2-CG2 3.58Å; F378-T417 HydrophobicContact CE1-CG2 4.27Å; F378-T417 HydrophobicContact CE2-CG2 3.27Å; F378-T417 HydrophobicContact CG-CG2 4.22Å; F378-T417 HydrophobicContact CZ-CG2 3.64Å; A413-T417 VanDerWaalsContact O-CB 3.3Å; A413-T417 WeakPolarHBondContact O-CB 3.26Å; A413-T417 PolarHBondContact O-N 3.49Å; A413-T417 VanDerWaalsContact O-N 3.08Å; A413-T417 PolarHBondContact O-OG1 3.4Å; L414-T417 PolarHBondContact O-N 3.46Å; T417-K420 WeakPolarHBondContact O-CB 3.22Å; T417-K420 PolarHBondContact O-N 3.48Å; T417-D421 WeakPolarHBondContact O-CB 3.34Å; T417-D421 PolarHBondContact O-N 3.37Å
418	M	84.3	Confident	89.2	Confident	86 Å²	86	21.1 Å²	21.1	42%	0.424	13%	0.131	S	C	.	.	H	α-helix	trans	-65.4	-41.1	174.7	-74.6	-65.3	-54.7	0	0	112.2	F378 L414 A415 K416 K420 D421 S422	F378-M418 HydrophobicContact CE1-SD 4.39Å; F378-M418 HydrophobicContact CZ-CG 4.4Å; F378-M418 HydrophobicContact CZ-SD 3.65Å; L414-M418 HydrophobicContact CD1-CG 3.88Å; L414-M418 HydrophobicContact CD1-SD 4.4Å; L414-M418 HydrophobicContact CG-CG 4.29Å; L414-M418 WeakPolarHBondContact O-CB 3.47Å; L414-M418 VanDerWaalsContact O-CG 3.3Å; L414-M418 WeakPolarHBondContact O-CG 3.11Å; L414-M418 PolarHBondContact O-N 3.15Å; A415-M418 PolarHBondContact O-N 3.31Å; K416-M418 VanDerWaalsContact C-N 3.33Å; K416-M418 PolarHBondContact O-N 3.43Å; M418-K420 VanDerWaalsContact C-N 3.35Å; M418-D421 PolarHBondContact O-N 2.98Å; M418-S422 WeakPolarHBondContact O-CB 3.41Å; M418-S422 PolarHBondContact O-N 3.1Å; M418-S422 PolarHBondContact O-OG 2.82Å
419	V	85.2	Confident	89.2	Confident	19 Å²	19	22.1 Å²	22.1	12%	0.115	14%	0.138	C	C	.	.	H	α-helix	trans	-63.7	-44.9	173.9	174	0	0	0	0	110.1	I81 V82 I85 A415 K416 D421 S422 T423	I81-V419 HydrophobicContact CG2-CG1 3.7Å; V82-V419 HydrophobicContact CG2-CG1 4.25Å; I85-V419 HydrophobicContact CD1-CG1 4.06Å; I85-V419 HydrophobicContact CD1-CG2 4.14Å; A415-V419 WeakPolarHBondContact O-CG2 3.17Å; A415-V419 PolarHBondContact O-N 3Å; A415-V419 VanDerWaalsContact O-N 3.07Å; K416-V419 PolarHBondContact O-N 3.42Å; V419-D421 VanDerWaalsContact C-N 3.32Å; V419-D421 PolarHBondContact O-N 3.37Å; V419-S422 WeakPolarHBondContact CA-OG 3.22Å; V419-S422 PolarHBondContact O-N 3.39Å; V419-S422 PolarHBondContact O-OG 3.13Å; V419-T423 HydrophobicContact CG1-CG2 4.41Å; V419-T423 WeakPolarHBondContact O-CG2 3.42Å; V419-T423 PolarHBondContact O-N 3.21Å; V419-T423 PolarHBondContact O-OG1 3.25Å
420	K	88.8	Confident	89.2	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-56.7	-44.9	176.2	-179	155.1	172.6	-169	0	112.2	S78 V82 H123 V124 K416 T417 M418 T423 C425 S430 S431	S78-K420 VanDerWaalsContact OG-CA 3.31Å; S78-K420 WeakPolarHBondContact OG-CA 3.31Å; S78-K420 WeakPolarHBondContact OG-CG 3.49Å; S78-K420 PolarHBondContact OG-O 3.46Å; V82-K420 HydrophobicContact CG2-CB 4.08Å; H123-K420 WeakPolarHBondContact O-CD 3.24Å; H123-K420 WeakPolarHBondContact O-CE 3.34Å; H123-K420 WeakPolarHBondContact O-CG 3.41Å; V124-K420 PolarHBondContact O-NZ 3.04Å; K416-K420 WeakPolarHBondContact O-CB 3.32Å; K416-K420 PolarHBondContact O-N 2.96Å; T417-K420 WeakPolarHBondContact O-CB 3.22Å; T417-K420 PolarHBondContact O-N 3.48Å; M418-K420 VanDerWaalsContact C-N 3.35Å; K420-T423 WeakPolarHBondContact CA-OG1 3.35Å; K420-T423 PolarHBondContact O-OG1 3.42Å; K420-C425 WeakPolarHBondContact CE-SG 3.44Å; K420-C425 HydrophobicContact CG-CB 3.62Å; K420-C425 VanDerWaalsContact CG-SG 3.53Å; K420-C425 WeakPolarHBondContact O-CB 3.27Å; K420-C425 PolarHBondContact O-N 3.25Å; K420-S430 WeakPolarHBondContact CE-OG 3.34Å; K420-S431 PolarHBondContact NZ-OG 2.88Å
421	D	88.2	Confident	89.2	Confident	20 Å²	20	22.2 Å²	22.2	11%	0.107	14%	0.138	C	C	.	.	H	α-helix	trans	-65.4	-45	174.9	179	69	0	0	0	113.2	F378 K381 H382 T417 M418 V419 T423 G424	F378-D421 HydrophobicContact CD1-CB 4.25Å; F378-D421 HydrophobicContact CE1-CB 3.54Å; F378-D421 HydrophobicContact CZ-CB 4.33Å; K381-D421 IonicContact NZ-OD1 2.83Å; K381-D421 IonicContact NZ-OD2 3.42Å; K381-D421 PolarHBondContact NZ-OD2 3.4Å; H382-D421 IonicContact CD2-OD1 3.26Å; H382-D421 IonicContact CE1-OD1 3.03Å; H382-D421 PolarHBondContact CE1-OD1 3.47Å; H382-D421 IonicContact NE2-OD1 3.47Å; H382-D421 PolarHBondContact NE2-OD1 2.93Å; T417-D421 WeakPolarHBondContact O-CB 3.34Å; T417-D421 PolarHBondContact O-N 3.37Å; M418-D421 PolarHBondContact O-N 2.98Å; V419-D421 VanDerWaalsContact C-N 3.32Å; V419-D421 PolarHBondContact O-N 3.37Å; D421-T423 PolarHBondContact O-N 3.24Å; D421-G424 PolarHBondContact O-N 3.3Å
422	S	84.2	Confident	89.3	Confident	62 Å²	62	25.9 Å²	25.9	43%	0.434	16%	0.157	S	C	.	.	H	α-helix	trans	-66.5	-22.4	-178.9	69	0	0	0	0	114.4	M418 V419 G424	M418-S422 WeakPolarHBondContact O-CB 3.41Å; M418-S422 PolarHBondContact O-N 3.1Å; M418-S422 PolarHBondContact O-OG 2.82Å; V419-S422 WeakPolarHBondContact CA-OG 3.22Å; V419-S422 PolarHBondContact O-N 3.39Å; V419-S422 PolarHBondContact O-OG 3.13Å; S422-G424 VanDerWaalsContact C-N 3.26Å; S422-G424 PolarHBondContact O-N 2.83Å
423	T	86.3	Confident	89.5	Confident	21 Å²	21	27.2 Å²	27.2	13%	0.129	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	3.3	178.7	43	0	0	0	0	113	S78 I81 P306 V419 K420 D421 C425	S78-T423 WeakPolarHBondContact CA-OG1 3.46Å; S78-T423 WeakPolarHBondContact CB-OG1 3.22Å; S78-T423 PolarHBondContact OG-OG1 3.05Å; I81-T423 HydrophobicContact CD1-CG2 3.92Å; P306-T423 HydrophobicContact CG-CG2 3.49Å; P306-T423 VanDerWaalsContact CG-CG2 3.49Å; V419-T423 HydrophobicContact CG1-CG2 4.41Å; V419-T423 WeakPolarHBondContact O-CG2 3.42Å; V419-T423 PolarHBondContact O-N 3.21Å; V419-T423 PolarHBondContact O-OG1 3.25Å; K420-T423 WeakPolarHBondContact CA-OG1 3.35Å; K420-T423 PolarHBondContact O-OG1 3.42Å; D421-T423 PolarHBondContact O-N 3.24Å; T423-C425 VanDerWaalsContact C-N 3.34Å
424	G	85.6	Confident	89.8	Confident	38 Å²	38	26.9 Å²	26.9	39%	0.392	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	22.1	-180	0	0	0	0	0	113.7	D421 S422	D421-G424 PolarHBondContact O-N 3.3Å; S422-G424 VanDerWaalsContact C-N 3.26Å; S422-G424 PolarHBondContact O-N 2.83Å
425	C	91	Very high	90.4	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.007	15%	0.146	C	C	.	.			trans	-55.3	140.6	171.8	-176	0	0	0	0	110.6	D75 H123 K420 T423 T427 S430	D75-C425 PolarHBondContact OD1-SG 3.25Å; H123-C425 PolarHBondContact CD2-O 3.24Å; H123-C425 PolarHBondContact NE2-O 3.37Å; K420-C425 WeakPolarHBondContact CE-SG 3.44Å; K420-C425 HydrophobicContact CG-CB 3.62Å; K420-C425 VanDerWaalsContact CG-SG 3.53Å; K420-C425 WeakPolarHBondContact O-CB 3.27Å; K420-C425 PolarHBondContact O-N 3.25Å; T423-C425 VanDerWaalsContact C-N 3.34Å; C425-T427 PolarHBondContact SG-O 2.83Å; C425-S430 VanDerWaalsContact SG-CB 3.54Å
426	Q	91.5	Very high	91.2	Very high	65 Å²	65	27.3 Å²	27.3	30%	0.304	16%	0.158	S	C	.	.			trans	-120.8	-24.1	178.2	-67	-65.1	-26.1	0	0	112.1	Y71 D75 R122	Y71-Q426 HydrophobicContact CD1-CB 3.88Å; Y71-Q426 HydrophobicContact CD1-CG 3.67Å; Y71-Q426 HydrophobicContact CD2-CB 4.27Å; Y71-Q426 HydrophobicContact CE1-CB 4.31Å; Y71-Q426 HydrophobicContact CE1-CG 4.02Å; Y71-Q426 HydrophobicContact CG-CB 3.87Å; Y71-Q426 HydrophobicContact CG-CG 4.18Å; D75-Q426 PolarHBondContact OD1-N 2.86Å; R122-Q426 WeakPolarHBondContact CB-O 3.22Å; R122-Q426 WeakPolarHBondContact CD-O 3.25Å
427	T	94.1	Very high	91.6	Very high	9 Å²	9	28.2 Å²	28.2	6%	0.055	16%	0.163	C	C	.	.	S	Bend	trans	-140.8	173.8	-175.6	81.4	0	0	0	0	114.4	W62 Y66 Y71 D75 R122 C425 V429	W62-T427 HydrophobicContact CE3-CG2 4.29Å; W62-T427 HydrophobicContact CZ3-CG2 4.13Å; Y66-T427 HydrophobicContact CD2-CG2 3.71Å; Y66-T427 HydrophobicContact CE2-CG2 3.52Å; Y66-T427 VanDerWaalsContact CE2-OG1 3.31Å; Y66-T427 WeakPolarHBondContact CE2-OG1 3.33Å; Y71-T427 HydrophobicContact CD2-CG2 4.2Å; D75-T427 PolarHBondContact OD1-N 2.6Å; D75-T427 PolarHBondContact OD2-OG1 2.98Å; R122-T427 CarbonylContact O-C 3.47Å; C425-T427 PolarHBondContact SG-O 2.83Å; T427-V429 PolarHBondContact O-N 3.32Å; T427-V429 WeakPolarHBondContact OG1-CG2 3.35Å; T427-V429 PolarHBondContact OG1-N 3.06Å
428	Q	94.6	Very high	91.7	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.009	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-3.3	177.2	-70.4	-63.2	-15.1	0	0	114.1	W62 F116 S121 R122 V124 S430 S431	W62-Q428 HydrophobicContact CH2-CB 4.41Å; W62-Q428 HydrophobicContact CZ2-CB 4.04Å; F116-Q428 HydrophobicContact CD2-CB 3.93Å; F116-Q428 WeakPolarHBondContact CD2-O 3.43Å; S121-Q428 WeakPolarHBondContact O-CG 3.17Å; S121-Q428 PolarHBondContact O-NE2 3.29Å; R122-Q428 PolarHBondContact O-NE2 3.14Å; R122-Q428 VanDerWaalsContact O-NE2 3.17Å; V124-Q428 PolarHBondContact O-NE2 2.91Å; V124-Q428 PolarHBondContact O-OE1 3.19Å; Q428-S430 PolarHBondContact O-N 3.35Å; Q428-S431 WeakPolarHBondContact O-CB 3.47Å; Q428-S431 PolarHBondContact O-N 3.35Å; Q428-S431 PolarHBondContact OE1-OG 3.47Å
429	V	95.3	Very high	92.2	Very high	23 Å²	23	26.2 Å²	26.2	14%	0.139	15%	0.154	C	C	.	.	H	α-helix	trans	-55.4	-34.2	172.9	175.6	0	0	0	0	111.1	W62 Y66 D75 F116 T427 S431 L432 I433	W62-V429 HydrophobicContact CH2-CG2 3.94Å; W62-V429 HydrophobicContact CZ3-CG2 4.09Å; Y66-V429 HydrophobicContact CE2-CG2 4.07Å; D75-V429 HydrophobicContact CB-CB 4.22Å; D75-V429 HydrophobicContact CB-CG1 4.43Å; F116-V429 HydrophobicContact CE2-CG2 4.24Å; T427-V429 PolarHBondContact O-N 3.32Å; T427-V429 WeakPolarHBondContact OG1-CG2 3.35Å; T427-V429 PolarHBondContact OG1-N 3.06Å; V429-S431 PolarHBondContact O-N 3.25Å; V429-L432 WeakPolarHBondContact O-CB 3.34Å; V429-L432 PolarHBondContact O-N 2.93Å; V429-I433 HydrophobicContact CG1-CD1 4.07Å; V429-I433 HydrophobicContact CG1-CG1 4.46Å; V429-I433 WeakPolarHBondContact O-CG1 3.26Å; V429-I433 PolarHBondContact O-N 3.22Å; V429-I433 VanDerWaalsContact O-N 3.09Å
430	S	94.8	Very high	92.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-54.4	-35.5	172.2	161.4	0	0	0	0	113.5	D75 S78 G79 K420 C425 Q428 I433 S434	D75-S430 VanDerWaalsContact O-CA 3.31Å; D75-S430 WeakPolarHBondContact O-CA 3.45Å; D75-S430 VanDerWaalsContact O-CB 3.26Å; D75-S430 WeakPolarHBondContact O-CB 3.3Å; S78-S430 WeakPolarHBondContact CB-OG 3.35Å; S78-S430 PolarHBondContact OG-OG 3.17Å; S78-S430 VanDerWaalsContact OG-OG 3.05Å; G79-S430 WeakPolarHBondContact CA-O 3.35Å; G79-S430 PolarHBondContact N-OG 3.43Å; K420-S430 WeakPolarHBondContact CE-OG 3.34Å; C425-S430 VanDerWaalsContact SG-CB 3.54Å; Q428-S430 PolarHBondContact O-N 3.35Å; S430-I433 PolarHBondContact O-N 3.45Å; S430-S434 PolarHBondContact O-N 2.97Å; S430-S434 PolarHBondContact O-OG 3.48Å
431	S	94.2	Very high	92.8	Very high	1 Å²	1	30 Å²	30	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-70.6	-36.4	177.1	-57.9	0	0	0	0	112.2	N112 K420 Q428 V429 I433 S434 A435	N112-S431 WeakPolarHBondContact CB-O 3.34Å; K420-S431 PolarHBondContact NZ-OG 2.88Å; Q428-S431 WeakPolarHBondContact O-CB 3.47Å; Q428-S431 PolarHBondContact O-N 3.35Å; Q428-S431 PolarHBondContact OE1-OG 3.47Å; V429-S431 PolarHBondContact O-N 3.25Å; S431-I433 VanDerWaalsContact C-N 3.33Å; S431-S434 WeakPolarHBondContact O-CB 3.28Å; S431-S434 PolarHBondContact O-N 2.68Å; S431-A435 PolarHBondContact O-N 3.37Å
432	L	95.8	Very high	92.9	Very high	77 Å²	77	29.1 Å²	29.1	40%	0.403	17%	0.169	S	C	.	.	H	α-helix	trans	-65.1	-40.6	174.8	-176.5	63.7	0	0	0	111.1	I113 F116 V429 S434 A435 L436	I113-L432 HydrophobicContact CG1-CD1 4.46Å; F116-L432 HydrophobicContact CD2-CB 4.5Å; V429-L432 WeakPolarHBondContact O-CB 3.34Å; V429-L432 PolarHBondContact O-N 2.93Å; L432-S434 VanDerWaalsContact C-N 3.34Å; L432-A435 WeakPolarHBondContact O-CB 3.1Å; L432-A435 PolarHBondContact O-N 2.87Å; L432-L436 PolarHBondContact O-N 3.46Å
433	I	96.4	Very high	93.2	Very high	30 Å²	30	29.7 Å²	29.7	15%	0.154	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-40.1	175.8	-63.6	174.5	0	0	0	110.6	V76 L80 V429 S430 S431 A435 L436 V437	V76-I433 VanDerWaalsContact CA-CD1 3.46Å; V76-I433 HydrophobicContact CB-CD1 3.95Å; V76-I433 HydrophobicContact CG1-CD1 4.49Å; V76-I433 HydrophobicContact CG2-CD1 3.46Å; V76-I433 VanDerWaalsContact CG2-CD1 3.46Å; L80-I433 HydrophobicContact CD2-CG2 4.48Å; L80-I433 HydrophobicContact CG-CG2 4.28Å; V429-I433 HydrophobicContact CG1-CD1 4.07Å; V429-I433 HydrophobicContact CG1-CG1 4.46Å; V429-I433 WeakPolarHBondContact O-CG1 3.26Å; V429-I433 PolarHBondContact O-N 3.22Å; V429-I433 VanDerWaalsContact O-N 3.09Å; S430-I433 PolarHBondContact O-N 3.45Å; S431-I433 VanDerWaalsContact C-N 3.33Å; I433-A435 VanDerWaalsContact C-N 3.3Å; I433-A435 PolarHBondContact O-N 3.3Å; I433-L436 WeakPolarHBondContact O-CB 3.49Å; I433-L436 PolarHBondContact O-N 3.12Å; I433-V437 PolarHBondContact O-N 3.37Å; I433-V437 VanDerWaalsContact O-N 3.07Å
434	S	94.6	Very high	93.5	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-59.1	-42.1	172.2	-55.1	0	0	0	0	111.6	G79 S430 S431 L432 L436 V437 V438	G79-S434 WeakPolarHBondContact CA-OG 3.43Å; G79-S434 WeakPolarHBondContact O-CA 3.47Å; G79-S434 PolarHBondContact O-OG 2.98Å; G79-S434 VanDerWaalsContact O-OG 3.11Å; S430-S434 PolarHBondContact O-N 2.97Å; S430-S434 PolarHBondContact O-OG 3.48Å; S431-S434 WeakPolarHBondContact O-CB 3.28Å; S431-S434 PolarHBondContact O-N 2.68Å; L432-S434 VanDerWaalsContact C-N 3.34Å; S434-L436 VanDerWaalsContact C-N 3.33Å; S434-L436 PolarHBondContact O-N 2.93Å; S434-V437 PolarHBondContact O-N 3Å; S434-V438 WeakPolarHBondContact O-CG2 3.38Å; S434-V438 PolarHBondContact O-N 3.43Å
435	A	95.9	Very high	93.6	Very high	2 Å²	2	38.2 Å²	38.2	2%	0.017	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-38.1	175.9	0	0	0	0	0	112.2	F109 N112 I113 S431 L432 I433 V438 L439	F109-A435 HydrophobicContact CD2-CB 4.1Å; F109-A435 WeakPolarHBondContact CD2-O 3.14Å; F109-A435 HydrophobicContact CE2-CB 4.46Å; N112-A435 HydrophobicContact CB-CB 3.94Å; I113-A435 HydrophobicContact CD1-CB 4.38Å; I113-A435 HydrophobicContact CG1-CB 3.93Å; S431-A435 PolarHBondContact O-N 3.37Å; L432-A435 WeakPolarHBondContact O-CB 3.1Å; L432-A435 PolarHBondContact O-N 2.87Å; I433-A435 VanDerWaalsContact C-N 3.3Å; I433-A435 PolarHBondContact O-N 3.3Å; A435-V438 PolarHBondContact O-N 3.35Å; A435-L439 WeakPolarHBondContact O-CB 3.28Å; A435-L439 PolarHBondContact O-N 3.05Å
436	L	96.5	Very high	93.4	Very high	114 Å²	114	38.1 Å²	38.1	60%	0.597	19%	0.191	S	C	*	.	H	α-helix	trans	-63.8	-40.1	175.4	-176.6	64.9	0	0	0	112.3	L432 I433 S434 L439 L440	L432-L436 PolarHBondContact O-N 3.46Å; I433-L436 WeakPolarHBondContact O-CB 3.49Å; I433-L436 PolarHBondContact O-N 3.12Å; S434-L436 VanDerWaalsContact C-N 3.33Å; S434-L436 PolarHBondContact O-N 2.93Å; L436-L439 HydrophobicContact CD1-CD2 4.4Å; L436-L439 WeakPolarHBondContact O-CB 3.32Å; L436-L439 PolarHBondContact O-N 3.27Å; L436-L440 PolarHBondContact O-N 3.23Å
437	V	95.1	Very high	93.3	Very high	22 Å²	22	37.8 Å²	37.8	13%	0.133	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-44.3	174.9	174.5	0	0	0	0	111	L80 I84 I433 S434 L439 L440 V441	L80-V437 HydrophobicContact CD2-CG2 3.83Å; I84-V437 HydrophobicContact CG1-CG1 4.4Å; I433-V437 PolarHBondContact O-N 3.37Å; I433-V437 VanDerWaalsContact O-N 3.07Å; S434-V437 PolarHBondContact O-N 3Å; V437-L439 VanDerWaalsContact C-N 3.31Å; V437-L439 PolarHBondContact O-N 3.02Å; V437-L440 WeakPolarHBondContact O-CB 3.36Å; V437-L440 PolarHBondContact O-N 2.83Å; V437-V441 WeakPolarHBondContact O-CG2 3.34Å; V437-V441 PolarHBondContact O-N 2.98Å
438	V	93.3	Very high	93.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-40.4	176.6	176.5	0	0	0	0	111	L86 L105 F109 S434 A435 V441 L442	L86-V438 HydrophobicContact CD2-CG2 3.83Å; L86-V438 HydrophobicContact CG-CG2 4.36Å; L105-V438 HydrophobicContact CB-CG1 4.2Å; L105-V438 HydrophobicContact CD2-CG1 4.31Å; L105-V438 WeakPolarHBondContact O-CG1 3.14Å; F109-V438 HydrophobicContact CB-CG1 4.04Å; S434-V438 WeakPolarHBondContact O-CG2 3.38Å; S434-V438 PolarHBondContact O-N 3.43Å; A435-V438 PolarHBondContact O-N 3.35Å; V438-V441 PolarHBondContact O-N 3.45Å; V438-L442 HydrophobicContact CG1-CD1 4.08Å; V438-L442 HydrophobicContact CG1-CG 4.46Å; V438-L442 WeakPolarHBondContact O-CG 3.46Å; V438-L442 PolarHBondContact O-N 2.87Å
439	L	94.9	Very high	92.8	Very high	43 Å²	43	46.3 Å²	46.3	23%	0.225	23%	0.227	C	C	.	.	H	α-helix	trans	-60.5	-46.3	175.6	178.9	64.2	0	0	0	111.5	F109 F342 A435 L436 V437 V441 L442 L443	F109-L439 HydrophobicContact CD2-CB 4.15Å; F109-L439 HydrophobicContact CE2-CB 3.93Å; F109-L439 HydrophobicContact CE2-CD1 4.19Å; F109-L439 HydrophobicContact CE2-CD2 4.3Å; F109-L439 HydrophobicContact CE2-CG 4.38Å; F109-L439 HydrophobicContact CZ-CD1 4.44Å; F342-L439 HydrophobicContact CE2-CD1 3.52Å; F342-L439 HydrophobicContact CZ-CD1 3.69Å; A435-L439 WeakPolarHBondContact O-CB 3.28Å; A435-L439 PolarHBondContact O-N 3.05Å; L436-L439 HydrophobicContact CD1-CD2 4.4Å; L436-L439 WeakPolarHBondContact O-CB 3.32Å; L436-L439 PolarHBondContact O-N 3.27Å; V437-L439 VanDerWaalsContact C-N 3.31Å; V437-L439 PolarHBondContact O-N 3.02Å; L439-V441 PolarHBondContact O-N 3.19Å; L439-L442 PolarHBondContact O-N 3.49Å; L439-L443 HydrophobicContact CD1-CD1 3.92Å; L439-L443 HydrophobicContact CD1-CG 4.15Å; L439-L443 HydrophobicContact CG-CD1 4.08Å; L439-L443 WeakPolarHBondContact O-CG 3.43Å; L439-L443 PolarHBondContact O-N 3.3Å
440	L	94.3	Very high	92.5	Very high	86 Å²	86	52.6 Å²	52.6	45%	0.45	25%	0.249	S	C	.	.	H	α-helix	trans	-57.6	-40.7	175.8	-175.1	73.5	0	0	0	111.3	L436 V437 F444 F445	L436-L440 PolarHBondContact O-N 3.23Å; V437-L440 WeakPolarHBondContact O-CB 3.36Å; V437-L440 PolarHBondContact O-N 2.83Å; L440-F444 HydrophobicContact CD1-CD2 3.84Å; L440-F444 HydrophobicContact CD1-CE2 4.26Å; L440-F444 PolarHBondContact O-N 2.92Å; L440-F445 HydrophobicContact CD2-CD2 4.44Å; L440-F445 HydrophobicContact CD2-CE2 3.86Å; L440-F445 HydrophobicContact CG-CD2 4.19Å; L440-F445 HydrophobicContact CG-CE2 3.94Å
441	V	91.9	Very high	92.3	Very high	14 Å²	14	53.5 Å²	53.5	9%	0.085	26%	0.256	C	S	.	.	I	π-helix	trans	-68.1	-44.7	178.5	169.3	0	0	0	0	111.9	V87 L105 V437 V438 L439 L443 F445 A446 F449	V87-V441 HydrophobicContact CG1-CG1 3.8Å; V87-V441 HydrophobicContact CG2-CB 4.16Å; V87-V441 HydrophobicContact CG2-CG1 4.1Å; V87-V441 HydrophobicContact CG2-CG2 3.8Å; L105-V441 HydrophobicContact CD1-CG1 4.41Å; V437-V441 WeakPolarHBondContact O-CG2 3.34Å; V437-V441 PolarHBondContact O-N 2.98Å; V438-V441 PolarHBondContact O-N 3.45Å; L439-V441 PolarHBondContact O-N 3.19Å; V441-L443 VanDerWaalsContact C-N 3.27Å; V441-L443 PolarHBondContact O-N 3Å; V441-F445 HydrophobicContact CB-CB 4.4Å; V441-F445 HydrophobicContact CG1-CB 4.26Å; V441-F445 HydrophobicContact CG2-CB 4.25Å; V441-F445 HydrophobicContact CG2-CD2 4.34Å; V441-F445 CarbonylContact O-C 3.4Å; V441-F445 PolarHBondContact O-N 3.25Å; V441-A446 PolarHBondContact O-N 2.89Å; V441-F449 HydrophobicContact CG1-CE2 3.9Å
442	L	90.3	Very high	92.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-59.4	-36.3	177.1	-82.6	169.6	0	0	0	113.2	I102 L105 Y106 G341 F342 V438 L439	I102-L442 HydrophobicContact CG1-CD2 4.11Å; L105-L442 HydrophobicContact CB-CD1 4.13Å; L105-L442 HydrophobicContact CB-CD2 3.46Å; L105-L442 VanDerWaalsContact CB-CD2 3.46Å; L105-L442 HydrophobicContact CB-CG 3.8Å; L105-L442 HydrophobicContact CD1-CD2 3.74Å; L105-L442 HydrophobicContact CD1-CG 4.27Å; L105-L442 HydrophobicContact CG-CD2 4.25Å; Y106-L442 HydrophobicContact CD1-CD1 3.79Å; Y106-L442 HydrophobicContact CD1-CD2 3.81Å; Y106-L442 HydrophobicContact CD1-CG 4.47Å; Y106-L442 HydrophobicContact CE1-CD1 4.13Å; Y106-L442 HydrophobicContact CE1-CD2 3.63Å; Y106-L442 HydrophobicContact CE1-CG 4.49Å; G341-L442 PolarHBondContact N-O 3Å; F342-L442 HydrophobicContact CE1-CD1 4.42Å; F342-L442 HydrophobicContact CZ-CD1 4.32Å; V438-L442 HydrophobicContact CG1-CD1 4.08Å; V438-L442 HydrophobicContact CG1-CG 4.46Å; V438-L442 WeakPolarHBondContact O-CG 3.46Å; V438-L442 PolarHBondContact O-N 2.87Å; L439-L442 PolarHBondContact O-N 3.49Å
443	L	91.6	Very high	92	Very high	74 Å²	74	49.8 Å²	49.8	39%	0.387	24%	0.237	S	C	.	.	I	π-helix	trans	-85.2	-35.6	-177.1	-63.8	179.3	0	0	0	113	L439 V441	L439-L443 HydrophobicContact CD1-CD1 3.92Å; L439-L443 HydrophobicContact CD1-CG 4.15Å; L439-L443 HydrophobicContact CG-CD1 4.08Å; L439-L443 WeakPolarHBondContact O-CG 3.43Å; L439-L443 PolarHBondContact O-N 3.3Å; V441-L443 VanDerWaalsContact C-N 3.27Å; V441-L443 PolarHBondContact O-N 3Å
444	F	91.2	Very high	91.8	Very high	136 Å²	136	49.4 Å²	49.4	60%	0.596	23%	0.234	S	C	*	.	I	π-helix	trans	-124	-44.2	-170.1	-61.8	-80.9	0	0	0	114.7	L440	L440-F444 HydrophobicContact CD1-CD2 3.84Å; L440-F444 HydrophobicContact CD1-CE2 4.26Å; L440-F444 PolarHBondContact O-N 2.92Å
445	F	89.3	Confident	91.8	Very high	102 Å²	102	49.4 Å²	49.4	45%	0.447	23%	0.234	S	C	.	.	I	π-helix	trans	-92.1	-13.6	-169.5	-66.4	-78.7	0	0	0	115	L440 V441 P447 Y448 F449	L440-F445 HydrophobicContact CD2-CD2 4.44Å; L440-F445 HydrophobicContact CD2-CE2 3.86Å; L440-F445 HydrophobicContact CG-CD2 4.19Å; L440-F445 HydrophobicContact CG-CE2 3.94Å; V441-F445 HydrophobicContact CB-CB 4.4Å; V441-F445 HydrophobicContact CG1-CB 4.26Å; V441-F445 HydrophobicContact CG2-CB 4.25Å; V441-F445 HydrophobicContact CG2-CD2 4.34Å; V441-F445 CarbonylContact O-C 3.4Å; V441-F445 PolarHBondContact O-N 3.25Å; F445-P447 VanDerWaalsContact C-CD 3.42Å; F445-Y448 HydrophobicContact CD1-CD2 4.3Å; F445-Y448 HydrophobicContact CD1-CE2 4.5Å; F445-Y448 WeakPolarHBondContact O-CB 3.47Å; F445-Y448 PolarHBondContact O-N 3.21Å; F445-Y448 VanDerWaalsContact O-N 3.14Å; F445-F449 HydrophobicContact CB-CE2 4.45Å
446	A	86.4	Confident	91.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-52.8	-42.6	-176.8	0	0	0	0	0	114.6	I338 T340 V441 Y448 F449	I338-A446 HydrophobicContact CG2-CB 3.98Å; T340-A446 HydrophobicContact CG2-CB 4.19Å; V441-A446 PolarHBondContact O-N 2.89Å; A446-Y448 PolarHBondContact O-N 3.06Å; A446-F449 PolarHBondContact O-N 3.3Å
447	P	88.3	Confident	91.5	Very high	57 Å²	57	44 Å²	44	37%	0.37	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-63.4	-27.2	-178.9	-24.3	36.3	0	0	0	114	T340 F445 F449 R450	T340-P447 HydrophobicContact CG2-CG 3.48Å; T340-P447 VanDerWaalsContact CG2-CG 3.48Å; F445-P447 VanDerWaalsContact C-CD 3.42Å; P447-F449 PolarHBondContact O-N 3.46Å; P447-R450 WeakPolarHBondContact O-CB 3.17Å; P447-R450 PolarHBondContact O-N 3.32Å
448	Y	89.6	Confident	91.3	Very high	167 Å²	167	42.9 Å²	42.9	66%	0.655	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-67.8	-22.4	-178.8	-67.8	-85.1	0	0	0	112.3	T318 F445 A446 R450	T318-Y448 WeakPolarHBondContact CG2-O 3.45Å; F445-Y448 HydrophobicContact CD1-CD2 4.3Å; F445-Y448 HydrophobicContact CD1-CE2 4.5Å; F445-Y448 WeakPolarHBondContact O-CB 3.47Å; F445-Y448 PolarHBondContact O-N 3.21Å; F445-Y448 VanDerWaalsContact O-N 3.14Å; A446-Y448 PolarHBondContact O-N 3.06Å; Y448-R450 PolarHBondContact O-N 2.87Å
449	F	89.6	Confident	91.4	Very high	23 Å²	23	42.9 Å²	42.9	10%	0.101	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-79.9	3.8	177.5	-60.4	-67.4	0	0	0	113.7	V87 I91 V314 I338 V441 F445 A446 P447 A451 L452	V87-F449 HydrophobicContact CG1-CE2 3.77Å; V87-F449 HydrophobicContact CG1-CZ 3.68Å; I91-F449 HydrophobicContact CD1-CB 4.02Å; I91-F449 HydrophobicContact CD1-CD1 4.31Å; I91-F449 HydrophobicContact CD1-CD2 4.02Å; I91-F449 HydrophobicContact CD1-CG 3.85Å; V314-F449 HydrophobicContact CG1-CD1 4.02Å; V314-F449 HydrophobicContact CG1-CE1 3.65Å; I338-F449 HydrophobicContact CD1-CB 3.8Å; V441-F449 HydrophobicContact CG1-CE2 3.9Å; F445-F449 HydrophobicContact CB-CE2 4.45Å; A446-F449 PolarHBondContact O-N 3.3Å; P447-F449 PolarHBondContact O-N 3.46Å; F449-A451 VanDerWaalsContact C-N 3.31Å; F449-A451 PolarHBondContact O-N 3.45Å; F449-L452 HydrophobicContact CD1-CD2 4.12Å; F449-L452 WeakPolarHBondContact O-CB 3.48Å; F449-L452 PolarHBondContact O-N 2.91Å; F449-L452 VanDerWaalsContact O-N 3.09Å
450	R	88.8	Confident	91.2	Very high	156 Å²	156	40.9 Å²	40.9	59%	0.589	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-57.9	-41.1	-179.6	179	179.7	-179.1	-174.1	1	113.6	G336 P447 Y448 L452	G336-R450 PolarHBondContact N-O 2.92Å; G336-R450 VanDerWaalsContact O-CA 3.25Å; G336-R450 WeakPolarHBondContact O-CA 3.36Å; P447-R450 WeakPolarHBondContact O-CB 3.17Å; P447-R450 PolarHBondContact O-N 3.32Å; Y448-R450 PolarHBondContact O-N 2.87Å; R450-L452 VanDerWaalsContact C-N 3.28Å; R450-L452 PolarHBondContact O-N 2.88Å
451	A	90.6	Very high	91	Very high	19 Å²	19	36.9 Å²	36.9	16%	0.157	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-82.9	-1.6	-179.1	0	0	0	0	0	113.3	T318 S321 H322 F449 Q453	T318-A451 HydrophobicContact CG2-CB 4.34Å; S321-A451 WeakPolarHBondContact CB-O 3.38Å; S321-A451 PolarHBondContact OG-O 3.26Å; H322-A451 HydrophobicContact CB-CB 3.91Å; F449-A451 VanDerWaalsContact C-N 3.31Å; F449-A451 PolarHBondContact O-N 3.45Å; A451-Q453 PolarHBondContact O-N 3.47Å
452	L	91.4	Very high	91	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.169	C	C	.	.			trans	-68.6	122.9	-175.8	-179.3	60.2	0	0	0	111	V314 T318 V334 S335 F449 R450 V456 L457	V314-L452 HydrophobicContact CG1-CD1 4.16Å; V314-L452 HydrophobicContact CG1-CD2 4.07Å; T318-L452 WeakPolarHBondContact OG1-CD1 3.27Å; V334-L452 CarbonylContact C-O 3.57Å; V334-L452 WeakPolarHBondContact CA-O 3.23Å; S335-L452 WeakPolarHBondContact CB-O 3.48Å; S335-L452 PolarHBondContact N-O 3.45Å; S335-L452 PolarHBondContact OG-O 2.99Å; F449-L452 HydrophobicContact CD1-CD2 4.12Å; F449-L452 WeakPolarHBondContact O-CB 3.48Å; F449-L452 PolarHBondContact O-N 2.91Å; F449-L452 VanDerWaalsContact O-N 3.09Å; R450-L452 VanDerWaalsContact C-N 3.28Å; R450-L452 PolarHBondContact O-N 2.88Å; L452-V456 HydrophobicContact CD1-CB 4.16Å; L452-V456 HydrophobicContact CD1-CG1 4.14Å; L452-L457 HydrophobicContact CD2-CD1 4.4Å; L452-L457 HydrophobicContact CD2-CD2 3.63Å; L452-L457 HydrophobicContact CD2-CG 4.09Å; L452-L457 HydrophobicContact CG-CD2 4.38Å; L452-L457 HydrophobicContact CG-CG 4.35Å
453	Q	93.2	Very high	90.9	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-71.7	140.3	179.2	-61.9	168.2	-80.4	0	0	111.9	D278 S332 S333 V334 A451 C455 V456	D278-Q453 PolarHBondContact OD1-NE2 3.39Å; S332-Q453 PolarHBondContact OG-NE2 3.48Å; S333-Q453 WeakPolarHBondContact O-CA 2.94Å; V334-Q453 HydrophobicContact CG1-CG 4.26Å; A451-Q453 PolarHBondContact O-N 3.47Å; Q453-C455 VanDerWaalsContact CB-SG 3.54Å; Q453-C455 PolarHBondContact O-N 2.94Å; Q453-V456 HydrophobicContact CB-CG2 4.17Å; Q453-V456 PolarHBondContact O-N 3Å
454	K	90.9	Very high	90.6	Very high	21 Å²	21	35.7 Å²	35.7	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-28.9	176.8	-62.2	-176.3	-170.8	169	0	111.8	L95 D154 Y245 S333 V334 V456 L457 A458	L95-K454 HydrophobicContact CD1-CB 4.49Å; L95-K454 HydrophobicContact CD1-CD 4.42Å; L95-K454 HydrophobicContact CD1-CG 4.01Å; D154-K454 IonicContact OD1-NZ 3.28Å; Y245-K454 HydrophobicContact CD1-CB 4.24Å; Y245-K454 HydrophobicContact CE1-CD 4.33Å; S333-K454 PolarHBondContact O-N 3.43Å; V334-K454 VanDerWaalsContact O-CE 3.25Å; V334-K454 WeakPolarHBondContact O-CE 3.31Å; K454-V456 PolarHBondContact O-N 3.3Å; K454-L457 WeakPolarHBondContact O-CB 3.44Å; K454-L457 PolarHBondContact O-N 3.41Å; K454-A458 PolarHBondContact O-N 2.89Å; K454-A458 VanDerWaalsContact O-N 3.09Å
455	C	93.9	Very high	90.4	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.007	14%	0.137	C	C	.	.	H	α-helix	trans	-63.5	-38.3	177.4	64.5	0	0	0	0	112.8	Y245 D278 Q453 A458 C459	Y245-C455 WeakPolarHBondContact O-CA 3.23Å; Y245-C455 WeakPolarHBondContact O-CB 3.45Å; D278-C455 HydrophobicContact CB-CB 4.04Å; D278-C455 PolarHBondContact OD1-SG 3.35Å; Q453-C455 VanDerWaalsContact CB-SG 3.54Å; Q453-C455 PolarHBondContact O-N 2.94Å; C455-A458 WeakPolarHBondContact O-CB 3.44Å; C455-A458 PolarHBondContact O-N 3Å; C455-C459 PolarHBondContact O-N 2.98Å; C455-C459 PolarHBondContact O-SG 3.44Å
456	V	94.8	Very high	90.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.1	-41.7	177.4	179.7	0	0	0	0	110.8	T281 V313 A317 L452 Q453 K454 A458 C459 I460	T281-V456 HydrophobicContact CG2-CG2 3.96Å; V313-V456 HydrophobicContact CG1-CG1 4.06Å; A317-V456 HydrophobicContact CB-CG1 4.16Å; A317-V456 HydrophobicContact CB-CG2 3.61Å; L452-V456 HydrophobicContact CD1-CB 4.16Å; L452-V456 HydrophobicContact CD1-CG1 4.14Å; Q453-V456 HydrophobicContact CB-CG2 4.17Å; Q453-V456 PolarHBondContact O-N 3Å; K454-V456 PolarHBondContact O-N 3.3Å; V456-A458 VanDerWaalsContact C-N 3.34Å; V456-A458 PolarHBondContact O-N 2.65Å; V456-C459 WeakPolarHBondContact O-CB 3.31Å; V456-C459 PolarHBondContact O-N 2.71Å; V456-I460 HydrophobicContact CG1-CD1 4.45Å; V456-I460 WeakPolarHBondContact O-CG1 3.42Å; V456-I460 PolarHBondContact O-N 3.46Å; V456-I460 VanDerWaalsContact O-N 3.11Å
457	L	91.7	Very high	89.8	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-43.2	175.4	-64.7	174.5	0	0	0	111	P88 I91 A92 L95 L452 K454 C459 I460 I461	P88-L457 HydrophobicContact CB-CD2 4.45Å; P88-L457 WeakPolarHBondContact O-CD2 3.45Å; I91-L457 HydrophobicContact CB-CD1 4.44Å; I91-L457 HydrophobicContact CB-CD2 4.26Å; I91-L457 HydrophobicContact CG2-CD1 3.56Å; I91-L457 HydrophobicContact CG2-CD2 4.12Å; A92-L457 HydrophobicContact CB-CB 3.71Å; A92-L457 HydrophobicContact CB-CD2 4.02Å; A92-L457 HydrophobicContact CB-CG 4.33Å; L95-L457 HydrophobicContact CD1-CD1 3.49Å; L95-L457 VanDerWaalsContact CD1-CD1 3.49Å; L452-L457 HydrophobicContact CD2-CD1 4.4Å; L452-L457 HydrophobicContact CD2-CD2 3.63Å; L452-L457 HydrophobicContact CD2-CG 4.09Å; L452-L457 HydrophobicContact CG-CD2 4.38Å; L452-L457 HydrophobicContact CG-CG 4.35Å; K454-L457 WeakPolarHBondContact O-CB 3.44Å; K454-L457 PolarHBondContact O-N 3.41Å; L457-C459 VanDerWaalsContact C-N 3.35Å; L457-C459 PolarHBondContact O-N 3.08Å; L457-I460 PolarHBondContact O-N 2.95Å; L457-I461 WeakPolarHBondContact O-CG1 3.48Å; L457-I461 PolarHBondContact O-N 3.25Å
458	A	92.3	Very high	89.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.1	-40.6	175	0	0	0	0	0	112.5	Q242 L246 K454 C455 V456 I460 I461 I462	Q242-A458 HydrophobicContact CB-CB 4.34Å; Q242-A458 VanDerWaalsContact OE1-CB 3.24Å; L246-A458 HydrophobicContact CD2-CB 4.29Å; K454-A458 PolarHBondContact O-N 2.89Å; K454-A458 VanDerWaalsContact O-N 3.09Å; C455-A458 WeakPolarHBondContact O-CB 3.44Å; C455-A458 PolarHBondContact O-N 3Å; V456-A458 VanDerWaalsContact C-N 3.34Å; V456-A458 PolarHBondContact O-N 2.65Å; A458-I460 VanDerWaalsContact C-N 3.34Å; A458-I460 PolarHBondContact O-N 3.16Å; A458-I461 PolarHBondContact O-N 2.95Å; A458-I462 WeakPolarHBondContact O-CG1 3.46Å; A458-I462 PolarHBondContact O-N 3.45Å
459	C	94.5	Very high	89.6	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-58.5	-44.4	173.8	-61.7	0	0	0	0	112	L246 S282 C285 I286 L289 C455 V456 L457 I461 I462 V463	L246-C459 WeakPolarHBondContact CD2-SG 3.44Å; S282-C459 VanDerWaalsContact CA-SG 3.55Å; S282-C459 VanDerWaalsContact CB-SG 3.53Å; C285-C459 HydrophobicContact CB-CB 4.09Å; I286-C459 HydrophobicContact CG1-CB 3.96Å; L289-C459 HydrophobicContact CD1-CB 4.15Å; C455-C459 PolarHBondContact O-N 2.98Å; C455-C459 PolarHBondContact O-SG 3.44Å; V456-C459 WeakPolarHBondContact O-CB 3.31Å; V456-C459 PolarHBondContact O-N 2.71Å; L457-C459 VanDerWaalsContact C-N 3.35Å; L457-C459 PolarHBondContact O-N 3.08Å; C459-I461 VanDerWaalsContact C-N 3.35Å; C459-I461 PolarHBondContact O-N 3.35Å; C459-I462 PolarHBondContact O-N 3.43Å; C459-V463 WeakPolarHBondContact O-CG2 3.44Å; C459-V463 PolarHBondContact O-N 3.38Å
460	I	90.9	Very high	89.5	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-45.1	178.4	-65.8	166.9	0	0	0	110.4	P88 Q89 L289 E310 V314 V456 L457 A458 I462 S464	P88-I460 HydrophobicContact CB-CD1 3.88Å; P88-I460 HydrophobicContact CG-CD1 4.41Å; Q89-I460 HydrophobicContact CG-CG2 3.99Å; L289-I460 HydrophobicContact CD1-CG1 4.08Å; E310-I460 HydrophobicContact CG-CG2 4.5Å; V314-I460 HydrophobicContact CG2-CD1 3.42Å; V314-I460 VanDerWaalsContact CG2-CD1 3.42Å; V456-I460 HydrophobicContact CG1-CD1 4.45Å; V456-I460 WeakPolarHBondContact O-CG1 3.42Å; V456-I460 PolarHBondContact O-N 3.46Å; V456-I460 VanDerWaalsContact O-N 3.11Å; L457-I460 PolarHBondContact O-N 2.95Å; A458-I460 VanDerWaalsContact C-N 3.34Å; A458-I460 PolarHBondContact O-N 3.16Å; I460-I462 PolarHBondContact O-N 3.45Å; I460-S464 WeakPolarHBondContact O-CB 3.43Å; I460-S464 PolarHBondContact O-N 3.31Å
461	I	89.4	Confident	89.4	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-58.3	-51.6	176.1	-61.5	175.7	0	0	0	109.8	A92 Y93 L96 I238 Q242 L457 A458 C459 V463 S464 L465	A92-I461 HydrophobicContact CB-CD1 3.59Å; A92-I461 HydrophobicContact CB-CG1 3.77Å; Y93-I461 HydrophobicContact CD1-CD1 3.91Å; Y93-I461 HydrophobicContact CD1-CG1 4.05Å; Y93-I461 HydrophobicContact CE1-CB 4.46Å; Y93-I461 HydrophobicContact CE1-CD1 4.02Å; Y93-I461 HydrophobicContact CE1-CG1 3.68Å; Y93-I461 HydrophobicContact CE1-CG2 4.21Å; L96-I461 HydrophobicContact CD1-CD1 3.71Å; L96-I461 HydrophobicContact CG-CD1 4.26Å; I238-I461 HydrophobicContact CG2-CG2 3.62Å; Q242-I461 HydrophobicContact CG-CB 4.24Å; Q242-I461 HydrophobicContact CG-CD1 4.26Å; Q242-I461 HydrophobicContact CG-CG2 3.93Å; L457-I461 WeakPolarHBondContact O-CG1 3.48Å; L457-I461 PolarHBondContact O-N 3.25Å; A458-I461 PolarHBondContact O-N 2.95Å; C459-I461 VanDerWaalsContact C-N 3.35Å; C459-I461 PolarHBondContact O-N 3.35Å; I461-V463 PolarHBondContact O-N 2.96Å; I461-S464 WeakPolarHBondContact O-CB 3.48Å; I461-S464 PolarHBondContact O-N 2.82Å; I461-S464 VanDerWaalsContact O-N 3.14Å; I461-S464 PolarHBondContact O-OG 2.92Å; I461-L465 HydrophobicContact CG2-CD1 4.29Å; I461-L465 WeakPolarHBondContact O-CG 3.34Å; I461-L465 PolarHBondContact O-N 3.14Å
462	I	91.6	Very high	89.3	Confident	24 Å²	24	25.9 Å²	25.9	12%	0.123	13%	0.131	C	C	.	.	H	α-helix	trans	-61.1	-45.5	-176.3	-71.4	172.7	0	0	0	111.9	L239 Q242 L246 A458 C459 I460 S464 L465	L239-I462 HydrophobicContact CD1-CB 4.27Å; L239-I462 HydrophobicContact CD1-CD1 3.78Å; L239-I462 HydrophobicContact CD1-CG1 3.68Å; L239-I462 HydrophobicContact CD1-CG2 3.71Å; Q242-I462 HydrophobicContact CB-CD1 3.95Å; Q242-I462 HydrophobicContact CB-CG1 4.02Å; L246-I462 HydrophobicContact CD1-CD1 3.47Å; L246-I462 VanDerWaalsContact CD1-CD1 3.47Å; L246-I462 HydrophobicContact CD2-CD1 4.06Å; L246-I462 HydrophobicContact CG-CD1 3.88Å; A458-I462 WeakPolarHBondContact O-CG1 3.46Å; A458-I462 PolarHBondContact O-N 3.45Å; C459-I462 PolarHBondContact O-N 3.43Å; I460-I462 PolarHBondContact O-N 3.45Å; I462-S464 VanDerWaalsContact C-N 3.29Å; I462-S464 PolarHBondContact O-N 3.17Å; I462-L465 WeakPolarHBondContact O-CB 3.49Å; I462-L465 PolarHBondContact O-N 3.22Å; I462-L465 VanDerWaalsContact O-N 3.15Å
463	V	89.5	Confident	89.3	Confident	14 Å²	14	35.6 Å²	35.6	9%	0.085	17%	0.168	C	C	.	.	H	α-helix	trans	-65.7	-34.3	178.3	175.2	0	0	0	0	111.3	L289 V290 K293 C459 I461 L465 R466	L289-V463 HydrophobicContact CB-CB 4.37Å; L289-V463 HydrophobicContact CB-CG1 4.14Å; L289-V463 HydrophobicContact CB-CG2 3.86Å; L289-V463 HydrophobicContact CD1-CB 4.43Å; L289-V463 HydrophobicContact CD1-CG2 4.06Å; V290-V463 HydrophobicContact CG2-CG2 4.15Å; K293-V463 HydrophobicContact CG-CG1 4.32Å; C459-V463 WeakPolarHBondContact O-CG2 3.44Å; C459-V463 PolarHBondContact O-N 3.38Å; I461-V463 PolarHBondContact O-N 2.96Å; V463-L465 PolarHBondContact O-N 3.3Å; V463-R466 WeakPolarHBondContact O-CB 3.45Å; V463-R466 PolarHBondContact O-N 3.33Å
464	S	84.7	Confident	89	Confident	25 Å²	25	39.1 Å²	39.1	18%	0.175	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-25.4	175.8	80.3	0	0	0	0	113.4	I460 I461 I462 R466	I460-S464 WeakPolarHBondContact O-CB 3.43Å; I460-S464 PolarHBondContact O-N 3.31Å; I461-S464 WeakPolarHBondContact O-CB 3.48Å; I461-S464 PolarHBondContact O-N 2.82Å; I461-S464 VanDerWaalsContact O-N 3.14Å; I461-S464 PolarHBondContact O-OG 2.92Å; I462-S464 VanDerWaalsContact C-N 3.29Å; I462-S464 PolarHBondContact O-N 3.17Å; S464-R466 VanDerWaalsContact C-N 3.33Å
465	L	86.4	Confident	89	Confident	11 Å²	11	39.4 Å²	39.4	6%	0.058	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-9.6	178.6	-60.7	170.1	0	0	0	113.4	I238 I461 I462 V463 G467 A468 L469	I238-L465 HydrophobicContact CB-CD1 3.86Å; I238-L465 HydrophobicContact CD1-CD2 4.21Å; I238-L465 HydrophobicContact CG2-CD1 3.7Å; I461-L465 HydrophobicContact CG2-CD1 4.29Å; I461-L465 WeakPolarHBondContact O-CG 3.34Å; I461-L465 PolarHBondContact O-N 3.14Å; I462-L465 WeakPolarHBondContact O-CB 3.49Å; I462-L465 PolarHBondContact O-N 3.22Å; I462-L465 VanDerWaalsContact O-N 3.15Å; V463-L465 PolarHBondContact O-N 3.3Å; L465-G467 PolarHBondContact O-N 3.39Å; L465-G467 VanDerWaalsContact O-N 3.13Å; L465-A468 PolarHBondContact O-N 3.17Å; L465-L469 HydrophobicContact CB-CD1 4.37Å; L465-L469 PolarHBondContact O-N 2.88Å
466	R	84.3	Confident	88.9	Confident	59 Å²	59	43.2 Å²	43.2	22%	0.223	22%	0.215	C	C	.	.	H	α-helix	trans	-49.4	-42.4	-178.3	-177.6	179.8	-179	-150.3	-9.7	112.9	E294 V463 S464 A468 L469 R470	E294-R466 IonicContact OE1-CZ 2.91Å; E294-R466 IonicContact OE1-NH1 3.5Å; E294-R466 IonicContact OE1-NH2 2.99Å; E294-R466 PolarHBondContact OE1-NH2 2.91Å; E294-R466 IonicContact OE2-CZ 2.73Å; E294-R466 IonicContact OE2-NH1 2.86Å; E294-R466 PolarHBondContact OE2-NH1 3.46Å; E294-R466 IonicContact OE2-NH2 2.91Å; E294-R466 PolarHBondContact OE2-NH2 3.47Å; V463-R466 WeakPolarHBondContact O-CB 3.45Å; V463-R466 PolarHBondContact O-N 3.33Å; S464-R466 VanDerWaalsContact C-N 3.33Å; R466-A468 PolarHBondContact O-N 2.92Å; R466-L469 PolarHBondContact O-N 3.35Å; R466-R470 WeakPolarHBondContact O-CB 3.44Å; R466-R470 PolarHBondContact O-N 3.24Å
467	G	80.3	Confident	88.8	Confident	45 Å²	45	45.8 Å²	45.8	46%	0.464	24%	0.236	S	C	.	.	H	α-helix	trans	-64.9	-37	-179.2	0	0	0	0	0	113.6	L465	L465-G467 PolarHBondContact O-N 3.39Å; L465-G467 VanDerWaalsContact O-N 3.13Å
468	A	83.9	Confident	88.7	Confident	11 Å²	11	48.1 Å²	48.1	9%	0.091	25%	0.246	C	C	.	.	H	α-helix	trans	-73.9	-43.5	176.3	0	0	0	0	0	111.2	T232 S235 L465 R466 R470 K471	T232-A468 PolarHBondContact OG1-O 3.32Å; S235-A468 WeakPolarHBondContact OG-CB 3.48Å; L465-A468 PolarHBondContact O-N 3.17Å; R466-A468 PolarHBondContact O-N 2.92Å; A468-R470 VanDerWaalsContact C-N 3.34Å; A468-R470 PolarHBondContact O-N 3.2Å; A468-K471 VanDerWaalsContact O-CB 3.31Å; A468-K471 WeakPolarHBondContact O-CB 3.28Å; A468-K471 WeakPolarHBondContact O-CG 2.96Å; A468-K471 PolarHBondContact O-N 3.37Å
469	L	88.5	Confident	88.9	Confident	52 Å²	52	54 Å²	54	27%	0.272	27%	0.268	S	S	.	.	H	α-helix	trans	-66.3	-32.5	179.6	-65.5	174.5	0	0	0	113	V236 L239 L465 R466 K471 F472	V236-L469 HydrophobicContact CG2-CD2 3.89Å; L239-L469 HydrophobicContact CD2-CD1 4.37Å; L465-L469 HydrophobicContact CB-CD1 4.37Å; L465-L469 PolarHBondContact O-N 2.88Å; R466-L469 PolarHBondContact O-N 3.35Å; L469-K471 PolarHBondContact O-N 2.97Å; L469-K471 VanDerWaalsContact O-N 3.16Å; L469-F472 WeakPolarHBondContact O-CB 3.36Å; L469-F472 PolarHBondContact O-N 3.11Å; L469-F472 VanDerWaalsContact O-N 3.17Å
470	R	87.1	Confident	88.9	Confident	114 Å²	114	64 Å²	64	43%	0.43	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-60.9	-24.2	176.8	-166.2	-174.5	-72.5	159.9	-6	112.7	R466 A468 F472 R473	R466-R470 WeakPolarHBondContact O-CB 3.44Å; R466-R470 PolarHBondContact O-N 3.24Å; A468-R470 VanDerWaalsContact C-N 3.34Å; A468-R470 PolarHBondContact O-N 3.2Å; R470-F472 PolarHBondContact O-N 3.17Å; R470-F472 VanDerWaalsContact O-N 3.12Å; R470-R473 VanDerWaalsContact O-CB 3.27Å; R470-R473 WeakPolarHBondContact O-CB 3.44Å; R470-R473 PolarHBondContact O-N 3.18Å
471	K	87.4	Confident	89	Confident	37 Å²	37	68.3 Å²	68.3	16%	0.161	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-60.8	-20.6	177.5	-63.7	-173.8	178.4	-179.4	0	113.3	D228 A468 L469 R473 D474	D228-K471 HydrophobicContact CB-CD 4.1Å; D228-K471 IonicContact OD1-NZ 3.22Å; D228-K471 PolarHBondContact OD1-NZ 3.48Å; A468-K471 VanDerWaalsContact O-CB 3.31Å; A468-K471 WeakPolarHBondContact O-CB 3.28Å; A468-K471 WeakPolarHBondContact O-CG 2.96Å; A468-K471 PolarHBondContact O-N 3.37Å; L469-K471 PolarHBondContact O-N 2.97Å; L469-K471 VanDerWaalsContact O-N 3.16Å; K471-R473 PolarHBondContact O-N 3.42Å; K471-D474 WeakPolarHBondContact O-CB 3.48Å; K471-D474 PolarHBondContact O-N 3.11Å
472	F	89.5	Confident	89.2	Confident	125 Å²	125	70 Å²	70	55%	0.548	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-58.8	-31.6	171.6	-152.5	-84.8	0	0	0	112	L469 R470 D474 V475 W489 M493	L469-F472 WeakPolarHBondContact O-CB 3.36Å; L469-F472 PolarHBondContact O-N 3.11Å; L469-F472 VanDerWaalsContact O-N 3.17Å; R470-F472 PolarHBondContact O-N 3.17Å; R470-F472 VanDerWaalsContact O-N 3.12Å; F472-D474 VanDerWaalsContact C-N 3.26Å; F472-D474 PolarHBondContact O-N 3.41Å; F472-V475 WeakPolarHBondContact O-CB 3.18Å; F472-V475 VanDerWaalsContact O-CG2 3.27Å; F472-V475 WeakPolarHBondContact O-CG2 3.27Å; F472-V475 PolarHBondContact O-N 3.48Å; F472-W489 AromaticContact CD2-CH2 3.66Å; F472-W489 HydrophobicContact CD2-CH2 3.66Å; F472-W489 HydrophobicContact CD2-CZ3 4.44Å; F472-W489 HydrophobicContact CE2-CH2 4.09Å; F472-W489 HydrophobicContact CE2-CZ3 4.47Å; F472-W489 HydrophobicContact CG-CH2 4.32Å; F472-M493 HydrophobicContact CD2-CE 4.33Å; F472-M493 HydrophobicContact CE2-CE 4.03Å
473	R	89.9	Confident	89.3	Confident	205 Å²	205	77.3 Å²	77.3	77%	0.774	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-70.8	-21.5	176.6	-158.8	178.2	89.4	140.7	3.1	113	R470 K471 V475 P476	R470-R473 VanDerWaalsContact O-CB 3.27Å; R470-R473 WeakPolarHBondContact O-CB 3.44Å; R470-R473 PolarHBondContact O-N 3.18Å; K471-R473 PolarHBondContact O-N 3.42Å; R473-V475 VanDerWaalsContact C-N 3.32Å; R473-P476 WeakPolarHBondContact O-CD 3.23Å
474	D	87.6	Confident	89.3	Confident	73 Å²	73	80 Å²	80	39%	0.39	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-84.9	-10.4	-178.1	-57.3	-26.7	0	0	0	112.1	K471 F472 A477 K478	K471-D474 WeakPolarHBondContact O-CB 3.48Å; K471-D474 PolarHBondContact O-N 3.11Å; F472-D474 VanDerWaalsContact C-N 3.26Å; F472-D474 PolarHBondContact O-N 3.41Å; D474-A477 WeakPolarHBondContact O-CB 3.15Å; D474-A477 PolarHBondContact O-N 2.99Å; D474-A477 VanDerWaalsContact O-N 3.14Å; D474-K478 PolarHBondContact O-N 2.71Å
475	V	90.9	Very high	89.7	Confident	28 Å²	28	82.3 Å²	82.3	17%	0.17	40%	0.402	C	S	.	.	H	α-helix	trans	-57.9	-45.2	-177.3	179.3	0	0	0	0	112.9	F472 R473 A477 K478 W479 W489	F472-V475 WeakPolarHBondContact O-CB 3.18Å; F472-V475 VanDerWaalsContact O-CG2 3.27Å; F472-V475 WeakPolarHBondContact O-CG2 3.27Å; F472-V475 PolarHBondContact O-N 3.48Å; R473-V475 VanDerWaalsContact C-N 3.32Å; V475-A477 VanDerWaalsContact C-N 3.28Å; V475-A477 PolarHBondContact O-N 2.83Å; V475-K478 PolarHBondContact O-N 3.37Å; V475-W479 WeakPolarHBondContact O-CB 3.45Å; V475-W479 PolarHBondContact O-N 3.32Å; V475-W489 HydrophobicContact CG1-CZ3 4.47Å; V475-W489 HydrophobicContact CG2-CD2 4.1Å; V475-W489 HydrophobicContact CG2-CE3 3.63Å; V475-W489 HydrophobicContact CG2-CH2 3.4Å; V475-W489 HydrophobicContact CG2-CZ2 3.85Å; V475-W489 HydrophobicContact CG2-CZ3 3.28Å
476	P	92.8	Very high	90.1	Very high	81 Å²	81	81.9 Å²	81.9	53%	0.526	40%	0.4	S	S	.	.	H	α-helix	trans	-63.8	-32.5	177.5	-22.3	35	0	0	0	113.1	R473 R480	R473-P476 WeakPolarHBondContact O-CD 3.23Å; P476-R480 WeakPolarHBondContact O-CG 3.28Å; P476-R480 PolarHBondContact O-N 3.37Å
477	A	92.2	Very high	90.6	Very high	53 Å²	53	81.8 Å²	81.8	44%	0.438	40%	0.404	S	S	.	.	H	α-helix	trans	-71	-44.6	174.5	0	0	0	0	0	111	D474 V475 W479 R480 A481	D474-A477 WeakPolarHBondContact O-CB 3.15Å; D474-A477 PolarHBondContact O-N 2.99Å; D474-A477 VanDerWaalsContact O-N 3.14Å; V475-A477 VanDerWaalsContact C-N 3.28Å; V475-A477 PolarHBondContact O-N 2.83Å; A477-W479 VanDerWaalsContact C-N 3.33Å; A477-W479 PolarHBondContact O-N 3.04Å; A477-R480 PolarHBondContact O-N 3.31Å; A477-A481 PolarHBondContact O-N 2.64Å; A477-A481 VanDerWaalsContact O-N 3.09Å
478	K	89.5	Confident	91.3	Very high	52 Å²	52	79.9 Å²	79.9	23%	0.226	38%	0.383	C	S	.	.	H	α-helix	trans	-59.8	-42.2	174.3	-71.8	-179.6	-173.8	-100	0	111.6	D228 D474 V475 R480 A481 S482 A486	D228-K478 IonicContact OD2-NZ 3.27Å; D228-K478 PolarHBondContact OD2-NZ 2.84Å; D474-K478 PolarHBondContact O-N 2.71Å; V475-K478 PolarHBondContact O-N 3.37Å; K478-R480 VanDerWaalsContact C-N 3.34Å; K478-R480 PolarHBondContact O-N 3.17Å; K478-A481 PolarHBondContact O-N 3.34Å; K478-S482 CarbonylContact O-C 3.47Å; K478-S482 PolarHBondContact O-N 3.33Å; K478-S482 VanDerWaalsContact O-O 3.14Å; K478-A486 HydrophobicContact CB-CB 4.36Å
479	W	95.1	Very high	91.9	Very high	124 Å²	124	79.5 Å²	79.5	47%	0.47	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-40.1	178.4	-174.3	-92	0	0	0	112.9	V475 A477 R483 A486 I487	V475-W479 WeakPolarHBondContact O-CB 3.45Å; V475-W479 PolarHBondContact O-N 3.32Å; A477-W479 VanDerWaalsContact C-N 3.33Å; A477-W479 PolarHBondContact O-N 3.04Å; W479-R483 HydrophobicContact CZ2-CG 4.42Å; W479-A486 HydrophobicContact CB-CB 4.14Å; W479-A486 HydrophobicContact CD2-CB 4.43Å; W479-A486 HydrophobicContact CE3-CB 3.63Å; W479-A486 HydrophobicContact CZ3-CB 4.43Å; W479-I487 HydrophobicContact CH2-CG1 4.3Å; W479-I487 HydrophobicContact CZ3-CD1 4.5Å; W479-I487 HydrophobicContact CZ3-CG1 3.82Å
480	R	95.4	Very high	92.2	Very high	210 Å²	210	81.6 Å²	81.6	79%	0.792	39%	0.39	S	S	*	.	H	α-helix	trans	-68.7	-33.7	175.2	-73.4	-173.7	-67.2	172.7	0.9	112.7	P476 A477 K478	P476-R480 WeakPolarHBondContact O-CG 3.28Å; P476-R480 PolarHBondContact O-N 3.37Å; A477-R480 PolarHBondContact O-N 3.31Å; K478-R480 VanDerWaalsContact C-N 3.34Å; K478-R480 PolarHBondContact O-N 3.17Å
481	A	93	Very high	92.6	Very high	90 Å²	90	77.7 Å²	77.7	74%	0.744	38%	0.379	S	S	*	.	H	α-helix	trans	-77.3	-50.2	179.5	0	0	0	0	0	112.7	A477 K478	A477-A481 PolarHBondContact O-N 2.64Å; A477-A481 VanDerWaalsContact O-N 3.09Å; K478-A481 PolarHBondContact O-N 3.34Å
482	S	93.6	Very high	93	Very high	37 Å²	37	76 Å²	76	26%	0.259	37%	0.371	S	S	.	.			trans	-153.1	107.5	-177.1	173.9	0	0	0	0	109.7	K478 M484 D485 A486	K478-S482 CarbonylContact O-C 3.47Å; K478-S482 PolarHBondContact O-N 3.33Å; K478-S482 VanDerWaalsContact O-O 3.14Å; S482-M484 VanDerWaalsContact C-N 3.27Å; S482-M484 PolarHBondContact O-N 3.35Å; S482-D485 WeakPolarHBondContact CB-OD2 3.45Å; S482-D485 PolarHBondContact O-N 2.92Å; S482-D485 PolarHBondContact OG-N 3.5Å; S482-D485 PolarHBondContact OG-OD2 3.35Å; S482-A486 PolarHBondContact O-N 3.03Å; S482-A486 VanDerWaalsContact O-N 3.16Å
483	R	92.9	Very high	93.3	Very high	178 Å²	178	71.4 Å²	71.4	67%	0.672	35%	0.352	S	S	*	.	H	α-helix	trans	-59	-40.5	179.2	-63.7	-178	-172.3	176.6	2.1	111.6	W479 D485 A486 I487	W479-R483 HydrophobicContact CZ2-CG 4.42Å; R483-D485 PolarHBondContact O-N 2.88Å; R483-A486 PolarHBondContact O-N 3.36Å; R483-I487 VanDerWaalsContact O-CG1 3.23Å; R483-I487 WeakPolarHBondContact O-CG1 3.38Å; R483-I487 PolarHBondContact O-N 3.47Å
484	M	91.3	Very high	93.5	Very high	70 Å²	70	63.7 Å²	63.7	35%	0.345	33%	0.33	S	S	.	.	H	α-helix	trans	-63.4	-43.5	-179.4	-64.9	-57.2	-66.3	0	0	112	S482 A486 I487 V488 C515	S482-M484 VanDerWaalsContact C-N 3.27Å; S482-M484 PolarHBondContact O-N 3.35Å; M484-A486 VanDerWaalsContact C-N 3.32Å; M484-A486 PolarHBondContact O-N 3.47Å; M484-I487 PolarHBondContact O-N 3.37Å; M484-I487 HydrophobicContact SD-CD1 4.44Å; M484-V488 WeakPolarHBondContact O-CG2 3.38Å; M484-V488 PolarHBondContact O-N 3.31Å; M484-C515 HydrophobicContact CE-CB 3.7Å
485	D	92.6	Very high	93.9	Very high	73 Å²	73	60.6 Å²	60.6	39%	0.39	31%	0.314	S	S	.	.	H	α-helix	trans	-67.1	-35.6	178.9	-65.4	-33.5	0	0	0	111.8	P225 S482 R483 W489	P225-D485 HydrophobicContact CB-CB 4.19Å; P225-D485 WeakPolarHBondContact CB-O 3.47Å; P225-D485 HydrophobicContact CG-CB 3.81Å; S482-D485 WeakPolarHBondContact CB-OD2 3.45Å; S482-D485 PolarHBondContact O-N 2.92Å; S482-D485 PolarHBondContact OG-N 3.5Å; S482-D485 PolarHBondContact OG-OD2 3.35Å; R483-D485 PolarHBondContact O-N 2.88Å; D485-W489 WeakPolarHBondContact O-CB 3.36Å; D485-W489 PolarHBondContact O-N 3.18Å
486	A	94.5	Very high	94	Very high	2 Å²	2	59.2 Å²	59.2	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-68.2	-37	174.7	0	0	0	0	0	112.4	K478 W479 S482 R483 M484 W489 L490	K478-A486 HydrophobicContact CB-CB 4.36Å; W479-A486 HydrophobicContact CB-CB 4.14Å; W479-A486 HydrophobicContact CD2-CB 4.43Å; W479-A486 HydrophobicContact CE3-CB 3.63Å; W479-A486 HydrophobicContact CZ3-CB 4.43Å; S482-A486 PolarHBondContact O-N 3.03Å; S482-A486 VanDerWaalsContact O-N 3.16Å; R483-A486 PolarHBondContact O-N 3.36Å; M484-A486 VanDerWaalsContact C-N 3.32Å; M484-A486 PolarHBondContact O-N 3.47Å; A486-W489 PolarHBondContact O-N 3.05Å; A486-L490 WeakPolarHBondContact O-CB 3.48Å; A486-L490 PolarHBondContact O-N 3.45Å
487	I	95	Very high	94	Very high	58 Å²	58	55.8 Å²	55.8	30%	0.297	28%	0.284	S	S	.	.	H	α-helix	trans	-65.8	-46.3	173.8	-64.6	163.6	0	0	0	110.4	W479 R483 M484 W489 L490 V491 F511	W479-I487 HydrophobicContact CH2-CG1 4.3Å; W479-I487 HydrophobicContact CZ3-CD1 4.5Å; W479-I487 HydrophobicContact CZ3-CG1 3.82Å; R483-I487 VanDerWaalsContact O-CG1 3.23Å; R483-I487 WeakPolarHBondContact O-CG1 3.38Å; R483-I487 PolarHBondContact O-N 3.47Å; M484-I487 PolarHBondContact O-N 3.37Å; M484-I487 HydrophobicContact SD-CD1 4.44Å; I487-W489 VanDerWaalsContact C-N 3.29Å; I487-W489 PolarHBondContact O-N 3.19Å; I487-L490 PolarHBondContact O-N 3.45Å; I487-L490 VanDerWaalsContact O-N 3.14Å; I487-V491 HydrophobicContact CG2-CG2 4.25Å; I487-V491 WeakPolarHBondContact O-CG2 3.4Å; I487-V491 PolarHBondContact O-N 3.09Å; I487-F511 HydrophobicContact CG2-CE1 3.74Å; I487-F511 HydrophobicContact CG2-CZ 3.68Å
488	V	94.8	Very high	94	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.024	29%	0.287	C	S	.	.	H	α-helix	trans	-57.5	-44.3	176.1	170.9	0	0	0	0	110.9	M226 M484 A492 F511 C515	M226-V488 HydrophobicContact CB-CG1 3.77Å; M484-V488 WeakPolarHBondContact O-CG2 3.38Å; M484-V488 PolarHBondContact O-N 3.31Å; V488-A492 WeakPolarHBondContact O-CB 3.41Å; V488-A492 PolarHBondContact O-N 3.49Å; V488-F511 HydrophobicContact CB-CD1 4.47Å; V488-F511 HydrophobicContact CG2-CD1 3.93Å; V488-F511 HydrophobicContact CG2-CE1 3.96Å; V488-C515 HydrophobicContact CG2-CB 4.37Å
489	W	95.4	Very high	94.2	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-60.1	-45.7	175.5	-177.3	95.5	0	0	0	112.1	P225 T232 F472 V475 D485 A486 I487 A492 M493	P225-W489 HydrophobicContact CB-CB 4.35Å; T232-W489 HydrophobicContact CG2-CH2 4.46Å; T232-W489 HydrophobicContact CG2-CZ2 4.08Å; F472-W489 AromaticContact CD2-CH2 3.66Å; F472-W489 HydrophobicContact CD2-CH2 3.66Å; F472-W489 HydrophobicContact CD2-CZ3 4.44Å; F472-W489 HydrophobicContact CE2-CH2 4.09Å; F472-W489 HydrophobicContact CE2-CZ3 4.47Å; F472-W489 HydrophobicContact CG-CH2 4.32Å; V475-W489 HydrophobicContact CG1-CZ3 4.47Å; V475-W489 HydrophobicContact CG2-CD2 4.1Å; V475-W489 HydrophobicContact CG2-CE3 3.63Å; V475-W489 HydrophobicContact CG2-CH2 3.4Å; V475-W489 HydrophobicContact CG2-CZ2 3.85Å; V475-W489 HydrophobicContact CG2-CZ3 3.28Å; D485-W489 WeakPolarHBondContact O-CB 3.36Å; D485-W489 PolarHBondContact O-N 3.18Å; A486-W489 PolarHBondContact O-N 3.05Å; I487-W489 VanDerWaalsContact C-N 3.29Å; I487-W489 PolarHBondContact O-N 3.19Å; W489-A492 PolarHBondContact O-N 2.75Å; W489-M493 HydrophobicContact CE3-CB 4.47Å; W489-M493 HydrophobicContact CH2-CB 4.34Å; W489-M493 HydrophobicContact CH2-CG 4.07Å; W489-M493 HydrophobicContact CZ2-CG 4.49Å; W489-M493 HydrophobicContact CZ3-CB 4.25Å; W489-M493 HydrophobicContact CZ3-CG 4.35Å; W489-M493 VanDerWaalsContact O-CB 3.29Å; W489-M493 WeakPolarHBondContact O-CB 3.5Å; W489-M493 PolarHBondContact O-N 3.36Å
490	L	95.6	Very high	93.8	Very high	96 Å²	96	53.7 Å²	53.7	50%	0.503	28%	0.278	S	S	.	.	H	α-helix	trans	-67.2	-42.8	-177.6	-173.1	145.9	0	0	0	111.9	A486 I487 M493 S494	A486-L490 WeakPolarHBondContact O-CB 3.48Å; A486-L490 PolarHBondContact O-N 3.45Å; I487-L490 PolarHBondContact O-N 3.45Å; I487-L490 VanDerWaalsContact O-N 3.14Å; L490-M493 PolarHBondContact O-N 3.43Å; L490-S494 WeakPolarHBondContact O-CB 3.21Å; L490-S494 PolarHBondContact O-N 3.02Å; L490-S494 PolarHBondContact O-OG 3.14Å
491	V	96.5	Very high	93.4	Very high	32 Å²	32	43.9 Å²	43.9	19%	0.194	24%	0.241	C	C	.	.	H	α-helix	trans	-63.9	-45.7	176	171.3	0	0	0	0	110.9	I487 M493 S494 A495 I507 F511	I487-V491 HydrophobicContact CG2-CG2 4.25Å; I487-V491 WeakPolarHBondContact O-CG2 3.4Å; I487-V491 PolarHBondContact O-N 3.09Å; V491-M493 PolarHBondContact O-N 3Å; V491-S494 PolarHBondContact O-OG 3.5Å; V491-A495 WeakPolarHBondContact O-CB 3.41Å; V491-A495 PolarHBondContact O-N 3.42Å; V491-I507 HydrophobicContact CG1-CG2 4Å; V491-F511 HydrophobicContact CB-CD1 4.09Å; V491-F511 HydrophobicContact CB-CE1 4.22Å; V491-F511 HydrophobicContact CB-CG 4.45Å; V491-F511 HydrophobicContact CG1-CB 4.29Å; V491-F511 HydrophobicContact CG1-CD1 4.1Å; V491-F511 HydrophobicContact CG1-CD2 4.32Å; V491-F511 HydrophobicContact CG1-CG 3.97Å; V491-F511 HydrophobicContact CG2-CD1 4.2Å; V491-F511 HydrophobicContact CG2-CE1 3.86Å; V491-F511 HydrophobicContact CG2-CE2 4.32Å; V491-F511 HydrophobicContact CG2-CZ 3.93Å
492	A	94.7	Very high	93	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-43.2	177.4	0	0	0	0	0	111.6	M226 V488 W489 T496	M226-A492 HydrophobicContact CG-CB 4.44Å; V488-A492 WeakPolarHBondContact O-CB 3.41Å; V488-A492 PolarHBondContact O-N 3.49Å; W489-A492 PolarHBondContact O-N 2.75Å; A492-T496 VanDerWaalsContact O-CB 3.26Å; A492-T496 WeakPolarHBondContact O-CB 3.44Å; A492-T496 PolarHBondContact O-N 3.24Å; A492-T496 VanDerWaalsContact O-N 3.11Å; A492-T496 PolarHBondContact O-OG1 2.93Å
493	M	95	Very high	92.8	Very high	30 Å²	30	43 Å²	43	15%	0.148	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-49.9	178.8	-176.4	-82.9	177.8	0	0	112	G229 T232 V236 F472 W489 L490 V491 T496 A497	G229-M493 VanDerWaalsContact O-CA 3.27Å; G229-M493 WeakPolarHBondContact O-CA 3.24Å; G229-M493 WeakPolarHBondContact O-CB 3.35Å; T232-M493 HydrophobicContact CG2-CG 4.2Å; V236-M493 HydrophobicContact CG2-CE 3.96Å; F472-M493 HydrophobicContact CD2-CE 4.33Å; F472-M493 HydrophobicContact CE2-CE 4.03Å; W489-M493 HydrophobicContact CE3-CB 4.47Å; W489-M493 HydrophobicContact CH2-CB 4.34Å; W489-M493 HydrophobicContact CH2-CG 4.07Å; W489-M493 HydrophobicContact CZ2-CG 4.49Å; W489-M493 HydrophobicContact CZ3-CB 4.25Å; W489-M493 HydrophobicContact CZ3-CG 4.35Å; W489-M493 VanDerWaalsContact O-CB 3.29Å; W489-M493 WeakPolarHBondContact O-CB 3.5Å; W489-M493 PolarHBondContact O-N 3.36Å; L490-M493 PolarHBondContact O-N 3.43Å; V491-M493 PolarHBondContact O-N 3Å; M493-T496 PolarHBondContact O-N 3.2Å; M493-A497 WeakPolarHBondContact O-CB 3.28Å; M493-A497 PolarHBondContact O-N 3.26Å
494	S	95.2	Very high	92.7	Very high	43 Å²	43	34.5 Å²	34.5	30%	0.301	19%	0.187	S	C	.	.	H	α-helix	trans	-68.4	-42.6	-177.1	64.4	0	0	0	0	112.2	L490 V491 T496 A497 L498	L490-S494 WeakPolarHBondContact O-CB 3.21Å; L490-S494 PolarHBondContact O-N 3.02Å; L490-S494 PolarHBondContact O-OG 3.14Å; V491-S494 PolarHBondContact O-OG 3.5Å; S494-T496 PolarHBondContact O-N 3.25Å; S494-A497 PolarHBondContact O-N 3.25Å; S494-L498 VanDerWaalsContact O-CB 3.28Å; S494-L498 WeakPolarHBondContact O-CB 3.42Å; S494-L498 WeakPolarHBondContact O-CG 3.32Å; S494-L498 PolarHBondContact O-N 2.99Å
495	A	95.8	Very high	92.5	Very high	7 Å²	7	31.6 Å²	31.6	6%	0.058	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-43.8	176.8	0	0	0	0	0	111.5	V491 I499 I507	V491-A495 WeakPolarHBondContact O-CB 3.41Å; V491-A495 PolarHBondContact O-N 3.42Å; A495-I499 HydrophobicContact CB-CD1 4.37Å; A495-I499 VanDerWaalsContact O-CB 3.3Å; A495-I499 WeakPolarHBondContact O-CB 3.39Å; A495-I499 PolarHBondContact O-N 2.62Å; A495-I507 HydrophobicContact CB-CB 4.22Å; A495-I507 HydrophobicContact CB-CD1 4.03Å; A495-I507 HydrophobicContact CB-CG2 4.03Å
496	T	92.8	Very high	92.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.5	-41.5	179	-52.3	0	0	0	0	112	F230 A234 A492 M493 S494 S500 V501 G504	F230-T496 HydrophobicContact CD2-CG2 3.82Å; F230-T496 WeakPolarHBondContact CD2-OG1 3.33Å; F230-T496 HydrophobicContact CE2-CG2 3.89Å; F230-T496 HydrophobicContact CG-CG2 4.46Å; A234-T496 HydrophobicContact CB-CG2 4.08Å; A492-T496 VanDerWaalsContact O-CB 3.26Å; A492-T496 WeakPolarHBondContact O-CB 3.44Å; A492-T496 PolarHBondContact O-N 3.24Å; A492-T496 VanDerWaalsContact O-N 3.11Å; A492-T496 PolarHBondContact O-OG1 2.93Å; M493-T496 PolarHBondContact O-N 3.2Å; S494-T496 PolarHBondContact O-N 3.25Å; T496-S500 CarbonylContact O-C 3.55Å; T496-V501 HydrophobicContact CG2-CB 4.43Å; T496-V501 HydrophobicContact CG2-CG1 4.44Å; T496-V501 HydrophobicContact CG2-CG2 4.35Å; T496-G504 WeakPolarHBondContact OG1-CA 3.48Å
497	A	93.3	Very high	92.3	Very high	8 Å²	8	35.8 Å²	35.8	7%	0.066	19%	0.193	C	C	.	.	H	α-helix	trans	-76	-42.1	-177.6	0	0	0	0	0	113.2	V236 V260 M493 S494	V236-A497 HydrophobicContact CB-CB 4.39Å; V236-A497 HydrophobicContact CG1-CB 4.38Å; V260-A497 WeakPolarHBondContact CG2-O 3.33Å; M493-A497 WeakPolarHBondContact O-CB 3.28Å; M493-A497 PolarHBondContact O-N 3.26Å; S494-A497 PolarHBondContact O-N 3.25Å
498	L	92.8	Very high	92.1	Very high	98 Å²	98	33 Å²	33	51%	0.513	18%	0.18	S	C	.	.	H	α-helix	trans	-93.6	-32.9	-170.3	-60.6	178.4	0	0	0	113.7	G258 S494	G258-L498 VanDerWaalsContact CA-O 3.27Å; G258-L498 WeakPolarHBondContact CA-O 3.16Å; G258-L498 PolarHBondContact N-O 2.87Å; S494-L498 VanDerWaalsContact O-CB 3.28Å; S494-L498 WeakPolarHBondContact O-CB 3.42Å; S494-L498 WeakPolarHBondContact O-CG 3.32Å; S494-L498 PolarHBondContact O-N 2.99Å
499	I	92.1	Very high	91.9	Very high	65 Å²	65	34.6 Å²	34.6	33%	0.333	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-79.3	-177.3	-55	173.6	0	0	0	108.9	Y257 G258 A495 L503 I507	Y257-I499 VanDerWaalsContact CA-O 3.32Å; Y257-I499 WeakPolarHBondContact CA-O 3.26Å; Y257-I499 HydrophobicContact CD1-CG2 3.92Å; Y257-I499 HydrophobicContact CE1-CG2 4.49Å; G258-I499 PolarHBondContact N-O 2.98Å; A495-I499 HydrophobicContact CB-CD1 4.37Å; A495-I499 VanDerWaalsContact O-CB 3.3Å; A495-I499 WeakPolarHBondContact O-CB 3.39Å; A495-I499 PolarHBondContact O-N 2.62Å; I499-L503 HydrophobicContact CG2-CB 4.22Å; I499-L503 HydrophobicContact CG2-CD1 3.7Å; I499-I507 HydrophobicContact CD1-CD1 3.84Å
500	S	88.1	Confident	91.8	Very high	23 Å²	23	38.3 Å²	38.3	16%	0.161	21%	0.211	C	C	.	.			trans	-164.7	159.9	175	66.7	0	0	0	0	108.7	T496 E502 L503 G504	T496-S500 CarbonylContact O-C 3.55Å; S500-E502 PolarHBondContact O-N 3.38Å; S500-L503 WeakPolarHBondContact OG-CB 3.44Å; S500-L503 WeakPolarHBondContact OG-CG 3.43Å; S500-L503 PolarHBondContact OG-N 3.44Å; S500-G504 PolarHBondContact O-N 2.86Å
501	V	86.4	Confident	91.7	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-59.4	-49.4	177.8	174.4	0	0	0	0	110.6	L131 L134 M135 F230 T237 T496 L503 G504 L505	L131-V501 HydrophobicContact CD1-CB 4.29Å; L131-V501 HydrophobicContact CD1-CG1 3.43Å; L131-V501 VanDerWaalsContact CD1-CG1 3.43Å; L131-V501 HydrophobicContact CD1-CG2 3.94Å; L131-V501 HydrophobicContact CD2-CG1 4.14Å; L131-V501 HydrophobicContact CG-CG1 4.09Å; L134-V501 HydrophobicContact CD2-CG2 4.27Å; M135-V501 HydrophobicContact SD-CG1 4.37Å; F230-V501 HydrophobicContact CE2-CG1 3.93Å; F230-V501 VanDerWaalsContact CE2-O 3.28Å; F230-V501 WeakPolarHBondContact CE2-O 3.36Å; F230-V501 HydrophobicContact CZ-CG1 3.59Å; T237-V501 HydrophobicContact CG2-CG2 4.45Å; T496-V501 HydrophobicContact CG2-CB 4.43Å; T496-V501 HydrophobicContact CG2-CG1 4.44Å; T496-V501 HydrophobicContact CG2-CG2 4.35Å; V501-L503 PolarHBondContact O-N 3.4Å; V501-G504 PolarHBondContact O-N 2.81Å; V501-L505 PolarHBondContact O-N 3.25Å
502	E	85.7	Confident	91.5	Very high	53 Å²	53	35.8 Å²	35.8	25%	0.248	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-48.1	-174.4	-63.3	175.2	-174.7	0	0	112.7	M135 P362 S500 G504 L505 L506	M135-E502 HydrophobicContact CE-CG 3.59Å; M135-E502 WeakPolarHBondContact CE-OE1 3.25Å; P362-E502 HydrophobicContact CB-CB 4.2Å; P362-E502 HydrophobicContact CB-CG 3.79Å; P362-E502 HydrophobicContact CG-CB 4.48Å; P362-E502 HydrophobicContact CG-CG 4.31Å; S500-E502 PolarHBondContact O-N 3.38Å; E502-G504 VanDerWaalsContact C-N 3.31Å; E502-G504 PolarHBondContact O-N 3.15Å; E502-L505 PolarHBondContact O-N 2.84Å; E502-L506 PolarHBondContact O-N 2.89Å
503	L	88.8	Confident	91.3	Very high	56 Å²	56	38.7 Å²	38.7	29%	0.293	21%	0.208	S	C	.	.	H	α-helix	trans	-69.1	-32.8	178.4	-65.1	-179	0	0	0	111.6	Y257 I499 S500 V501 L505 L506 I507	Y257-L503 HydrophobicContact CD1-CD1 4.06Å; Y257-L503 HydrophobicContact CE1-CD1 3.33Å; Y257-L503 HydrophobicContact CE1-CG 4.35Å; I499-L503 HydrophobicContact CG2-CB 4.22Å; I499-L503 HydrophobicContact CG2-CD1 3.7Å; S500-L503 WeakPolarHBondContact OG-CB 3.44Å; S500-L503 WeakPolarHBondContact OG-CG 3.43Å; S500-L503 PolarHBondContact OG-N 3.44Å; V501-L503 PolarHBondContact O-N 3.4Å; L503-L505 VanDerWaalsContact C-N 3.3Å; L503-L505 PolarHBondContact O-N 2.87Å; L503-L506 PolarHBondContact O-N 3.48Å; L503-I507 HydrophobicContact CB-CD1 4.31Å; L503-I507 WeakPolarHBondContact O-CB 3.38Å; L503-I507 WeakPolarHBondContact O-CD1 3.27Å; L503-I507 WeakPolarHBondContact O-CG1 3.26Å; L503-I507 PolarHBondContact O-N 3.43Å
504	G	90.7	Very high	91.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-57.2	-40.2	174.9	0	0	0	0	0	113.4	T496 S500 V501 E502 G508	T496-G504 WeakPolarHBondContact OG1-CA 3.48Å; S500-G504 PolarHBondContact O-N 2.86Å; V501-G504 PolarHBondContact O-N 2.81Å; E502-G504 VanDerWaalsContact C-N 3.31Å; E502-G504 PolarHBondContact O-N 3.15Å; G504-G508 PolarHBondContact O-N 3.46Å
505	L	86.3	Confident	91	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-52.5	174.2	179.8	70.8	0	0	0	110.8	M226 F230 V365 I366 V501 E502 L503 I507 G508 I509	M226-L505 HydrophobicContact CE-CD1 3.47Å; M226-L505 VanDerWaalsContact CE-CD1 3.47Å; M226-L505 HydrophobicContact SD-CD1 4.38Å; F230-L505 HydrophobicContact CD2-CB 3.92Å; F230-L505 HydrophobicContact CD2-CD1 4.3Å; F230-L505 HydrophobicContact CE2-CB 3.61Å; F230-L505 HydrophobicContact CE2-CD1 4.42Å; F230-L505 HydrophobicContact CZ-CB 4.45Å; V365-L505 HydrophobicContact CG1-CD2 3.95Å; I366-L505 HydrophobicContact CD1-CD2 4.23Å; I366-L505 HydrophobicContact CG1-CD2 3.41Å; I366-L505 VanDerWaalsContact CG1-CD2 3.41Å; I366-L505 HydrophobicContact CG1-CG 4.45Å; V501-L505 PolarHBondContact O-N 3.25Å; E502-L505 PolarHBondContact O-N 2.84Å; L503-L505 VanDerWaalsContact C-N 3.3Å; L503-L505 PolarHBondContact O-N 2.87Å; L505-I507 PolarHBondContact O-N 3.21Å; L505-G508 PolarHBondContact O-N 3.19Å; L505-I509 HydrophobicContact CD1-CD1 4.06Å; L505-I509 HydrophobicContact CD1-CG1 4.42Å; L505-I509 HydrophobicContact CD2-CD1 4.34Å; L505-I509 HydrophobicContact CG-CD1 3.89Å; L505-I509 WeakPolarHBondContact O-CG1 3.38Å; L505-I509 PolarHBondContact O-N 3.27Å
506	L	88.8	Confident	90.7	Very high	103 Å²	103	43.3 Å²	43.3	54%	0.539	23%	0.234	S	C	.	.	H	α-helix	trans	-59.3	-48.6	-176.5	-179.9	64	0	0	0	111.3	E502 L503 G508 I509 V510	E502-L506 PolarHBondContact O-N 2.89Å; L503-L506 PolarHBondContact O-N 3.48Å; L506-G508 VanDerWaalsContact C-N 3.31Å; L506-G508 PolarHBondContact O-N 3.3Å; L506-I509 PolarHBondContact O-N 2.91Å; L506-V510 HydrophobicContact CD1-CG2 4.25Å; L506-V510 WeakPolarHBondContact O-CG2 3.18Å; L506-V510 PolarHBondContact O-N 3.48Å
507	I	93.9	Very high	90.6	Very high	60 Å²	60	47 Å²	47	31%	0.308	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-44.3	177.2	-67.5	165.6	0	0	0	110	V491 A495 I499 L503 L505 I509 V510 F511	V491-I507 HydrophobicContact CG1-CG2 4Å; A495-I507 HydrophobicContact CB-CB 4.22Å; A495-I507 HydrophobicContact CB-CD1 4.03Å; A495-I507 HydrophobicContact CB-CG2 4.03Å; I499-I507 HydrophobicContact CD1-CD1 3.84Å; L503-I507 HydrophobicContact CB-CD1 4.31Å; L503-I507 WeakPolarHBondContact O-CB 3.38Å; L503-I507 WeakPolarHBondContact O-CD1 3.27Å; L503-I507 WeakPolarHBondContact O-CG1 3.26Å; L503-I507 PolarHBondContact O-N 3.43Å; L505-I507 PolarHBondContact O-N 3.21Å; I507-I509 PolarHBondContact O-N 2.96Å; I507-V510 PolarHBondContact O-N 3.01Å; I507-F511 WeakPolarHBondContact O-CB 3.41Å; I507-F511 PolarHBondContact O-N 2.92Å
508	G	91.9	Very high	90.5	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-45.3	177.5	0	0	0	0	0	113.3	G504 L505 L506 S512	G504-G508 PolarHBondContact O-N 3.46Å; L505-G508 PolarHBondContact O-N 3.19Å; L506-G508 VanDerWaalsContact C-N 3.31Å; L506-G508 PolarHBondContact O-N 3.3Å; G508-S512 VanDerWaalsContact O-CB 3.26Å; G508-S512 WeakPolarHBondContact O-CB 3.38Å; G508-S512 PolarHBondContact O-N 3.06Å
509	I	89.9	Confident	90.3	Very high	37 Å²	37	56.4 Å²	56.4	19%	0.19	29%	0.286	C	S	.	.	H	α-helix	trans	-65.8	-51.3	179.1	-66	170.5	0	0	0	110.8	L222 M226 L505 L506 I507 F511 S512 M513	L222-I509 HydrophobicContact CD2-CD1 3.63Å; L222-I509 HydrophobicContact CD2-CG1 3.82Å; M226-I509 HydrophobicContact SD-CG1 4.06Å; L505-I509 HydrophobicContact CD1-CD1 4.06Å; L505-I509 HydrophobicContact CD1-CG1 4.42Å; L505-I509 HydrophobicContact CD2-CD1 4.34Å; L505-I509 HydrophobicContact CG-CD1 3.89Å; L505-I509 WeakPolarHBondContact O-CG1 3.38Å; L505-I509 PolarHBondContact O-N 3.27Å; L506-I509 PolarHBondContact O-N 2.91Å; I507-I509 PolarHBondContact O-N 2.96Å; I509-F511 VanDerWaalsContact C-N 3.3Å; I509-F511 PolarHBondContact O-N 2.9Å; I509-S512 PolarHBondContact O-N 3.26Å; I509-M513 WeakPolarHBondContact O-CG 3.29Å; I509-M513 PolarHBondContact O-N 3.15Å
510	V	93.1	Very high	90.1	Very high	82 Å²	82	55.1 Å²	55.1	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-43.2	-178.8	172.5	0	0	0	0	110.4	L506 I507 M513 S514	L506-V510 HydrophobicContact CD1-CG2 4.25Å; L506-V510 WeakPolarHBondContact O-CG2 3.18Å; L506-V510 PolarHBondContact O-N 3.48Å; I507-V510 PolarHBondContact O-N 3.01Å; V510-M513 PolarHBondContact O-N 2.64Å; V510-S514 WeakPolarHBondContact O-CB 3.47Å; V510-S514 PolarHBondContact O-N 3.14Å; V510-S514 PolarHBondContact O-OG 3.2Å
511	F	95	Very high	90.3	Very high	65 Å²	65	57.1 Å²	57.1	29%	0.285	29%	0.288	S	S	.	.	H	α-helix	trans	-66.2	-45.1	178.4	-171.9	-96.8	0	0	0	112.1	I487 V488 V491 I507 I509 M513 S514 C515	I487-F511 HydrophobicContact CG2-CE1 3.74Å; I487-F511 HydrophobicContact CG2-CZ 3.68Å; V488-F511 HydrophobicContact CB-CD1 4.47Å; V488-F511 HydrophobicContact CG2-CD1 3.93Å; V488-F511 HydrophobicContact CG2-CE1 3.96Å; V491-F511 HydrophobicContact CB-CD1 4.09Å; V491-F511 HydrophobicContact CB-CE1 4.22Å; V491-F511 HydrophobicContact CB-CG 4.45Å; V491-F511 HydrophobicContact CG1-CB 4.29Å; V491-F511 HydrophobicContact CG1-CD1 4.1Å; V491-F511 HydrophobicContact CG1-CD2 4.32Å; V491-F511 HydrophobicContact CG1-CG 3.97Å; V491-F511 HydrophobicContact CG2-CD1 4.2Å; V491-F511 HydrophobicContact CG2-CE1 3.86Å; V491-F511 HydrophobicContact CG2-CE2 4.32Å; V491-F511 HydrophobicContact CG2-CZ 3.93Å; I507-F511 WeakPolarHBondContact O-CB 3.41Å; I507-F511 PolarHBondContact O-N 2.92Å; I509-F511 VanDerWaalsContact C-N 3.3Å; I509-F511 PolarHBondContact O-N 2.9Å; F511-M513 VanDerWaalsContact C-N 3.31Å; F511-M513 PolarHBondContact O-N 2.69Å; F511-S514 WeakPolarHBondContact O-CB 3.2Å; F511-S514 PolarHBondContact O-N 2.95Å; F511-S514 VanDerWaalsContact O-N 3.14Å; F511-C515 WeakPolarHBondContact CE1-SG 3.29Å; F511-C515 PolarHBondContact O-N 3.03Å; F511-C515 PolarHBondContact O-SG 3.41Å
512	S	92.1	Very high	90.3	Very high	9 Å²	9	61.4 Å²	61.4	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-42.3	175.8	-172.1	0	0	0	0	111.9	S223 G508 I509 C515 I516	S223-S512 PolarHBondContact OG-OG 3.29Å; S223-S512 VanDerWaalsContact OG-OG 3.1Å; G508-S512 VanDerWaalsContact O-CB 3.26Å; G508-S512 WeakPolarHBondContact O-CB 3.38Å; G508-S512 PolarHBondContact O-N 3.06Å; I509-S512 PolarHBondContact O-N 3.26Å; S512-C515 PolarHBondContact O-N 3.19Å; S512-I516 WeakPolarHBondContact O-CG1 3.39Å; S512-I516 PolarHBondContact O-N 3.05Å
513	M	90.8	Very high	90.4	Very high	62 Å²	62	60 Å²	60	31%	0.305	31%	0.306	S	S	.	.	H	α-helix	trans	-65.2	-42.2	175.5	-74.3	-67.5	-86.7	0	0	111.9	Y221 I509 V510 F511 C515 I516 I517	Y221-M513 HydrophobicContact CD1-CE 3.46Å; Y221-M513 VanDerWaalsContact CD1-CE 3.46Å; Y221-M513 HydrophobicContact CD1-SD 3.29Å; Y221-M513 WeakPolarHBondContact CD1-SD 3.38Å; Y221-M513 HydrophobicContact CE1-CE 3.48Å; Y221-M513 VanDerWaalsContact CE1-CE 3.48Å; Y221-M513 HydrophobicContact CE1-SD 3.9Å; Y221-M513 HydrophobicContact CG-CE 4.18Å; Y221-M513 HydrophobicContact CG-SD 4.02Å; I509-M513 WeakPolarHBondContact O-CG 3.29Å; I509-M513 PolarHBondContact O-N 3.15Å; V510-M513 PolarHBondContact O-N 2.64Å; F511-M513 VanDerWaalsContact C-N 3.31Å; F511-M513 PolarHBondContact O-N 2.69Å; M513-C515 VanDerWaalsContact C-N 3.32Å; M513-C515 PolarHBondContact O-N 3.44Å; M513-I516 PolarHBondContact O-N 3.34Å; M513-I517 WeakPolarHBondContact O-CG1 3.19Å; M513-I517 PolarHBondContact O-N 3.01Å
514	S	91.9	Very high	90.4	Very high	61 Å²	61	62 Å²	62	43%	0.427	31%	0.312	S	S	.	.	H	α-helix	trans	-62.9	-38.3	177.9	-58	0	0	0	0	111.8	V510 F511 I516 I517 Y518	V510-S514 WeakPolarHBondContact O-CB 3.47Å; V510-S514 PolarHBondContact O-N 3.14Å; V510-S514 PolarHBondContact O-OG 3.2Å; F511-S514 WeakPolarHBondContact O-CB 3.2Å; F511-S514 PolarHBondContact O-N 2.95Å; F511-S514 VanDerWaalsContact O-N 3.14Å; S514-I516 VanDerWaalsContact C-N 3.35Å; S514-I516 PolarHBondContact O-N 3.03Å; S514-I517 PolarHBondContact O-N 3.13Å; S514-Y518 WeakPolarHBondContact O-CB 3.36Å; S514-Y518 PolarHBondContact O-N 3.16Å
515	C	91.3	Very high	90.5	Very high	16 Å²	16	64 Å²	64	11%	0.108	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-39.2	174.1	-68.5	0	0	0	0	112.8	M484 V488 F511 S512 M513 Y518 K519	M484-C515 HydrophobicContact CE-CB 3.7Å; V488-C515 HydrophobicContact CG2-CB 4.37Å; F511-C515 WeakPolarHBondContact CE1-SG 3.29Å; F511-C515 PolarHBondContact O-N 3.03Å; F511-C515 PolarHBondContact O-SG 3.41Å; S512-C515 PolarHBondContact O-N 3.19Å; M513-C515 VanDerWaalsContact C-N 3.32Å; M513-C515 PolarHBondContact O-N 3.44Å; C515-Y518 PolarHBondContact O-N 3.23Å; C515-K519 WeakPolarHBondContact O-CB 3.39Å; C515-K519 PolarHBondContact O-N 3.43Å
516	I	89.3	Confident	90.8	Very high	100 Å²	100	63.9 Å²	63.9	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-46.5	175.5	-65.7	167	0	0	0	109.8	S512 M513 S514 Y518 K519 T520	S512-I516 WeakPolarHBondContact O-CG1 3.39Å; S512-I516 PolarHBondContact O-N 3.05Å; M513-I516 PolarHBondContact O-N 3.34Å; S514-I516 VanDerWaalsContact C-N 3.35Å; S514-I516 PolarHBondContact O-N 3.03Å; I516-Y518 PolarHBondContact O-N 3.41Å; I516-K519 PolarHBondContact O-N 3.48Å; I516-T520 WeakPolarHBondContact O-CG2 3.31Å; I516-T520 PolarHBondContact O-N 3.4Å; I516-T520 VanDerWaalsContact O-N 3.09Å
517	I	90.5	Very high	91	Very high	78 Å²	78	61.1 Å²	61.1	40%	0.4	31%	0.31	S	S	.	.	H	α-helix	trans	-58.8	-49	177.5	-65.9	167.4	0	0	0	110.1	M513 S514 K519 T520 Q521	M513-I517 WeakPolarHBondContact O-CG1 3.19Å; M513-I517 PolarHBondContact O-N 3.01Å; S514-I517 PolarHBondContact O-N 3.13Å; I517-K519 VanDerWaalsContact C-N 3.3Å; I517-K519 PolarHBondContact O-N 2.96Å; I517-T520 PolarHBondContact O-N 3.17Å; I517-T520 PolarHBondContact O-OG1 3.27Å; I517-Q521 WeakPolarHBondContact O-CG 3.47Å; I517-Q521 PolarHBondContact O-N 3.12Å; I517-Q521 VanDerWaalsContact O-N 3.1Å
518	Y	90.9	Very high	91	Very high	140 Å²	140	58.4 Å²	58.4	55%	0.549	30%	0.296	S	S	.	.	H	α-helix	trans	-56.2	-42.9	177.3	180	-100.5	0	0	0	112.5	S514 C515 I516 T520 Q521 N522	S514-Y518 WeakPolarHBondContact O-CB 3.36Å; S514-Y518 PolarHBondContact O-N 3.16Å; C515-Y518 PolarHBondContact O-N 3.23Å; I516-Y518 PolarHBondContact O-N 3.41Å; Y518-T520 VanDerWaalsContact C-N 3.32Å; Y518-T520 PolarHBondContact O-N 3.03Å; Y518-Q521 PolarHBondContact O-N 3.26Å; Y518-N522 PolarHBondContact O-N 3.19Å
519	K	88	Confident	91	Very high	163 Å²	163	58.4 Å²	58.4	71%	0.709	30%	0.295	S	S	*	.	H	α-helix	trans	-64.1	-35	177.6	-170.1	175.3	179.2	179.8	0	112.6	C515 I516 I517	C515-K519 WeakPolarHBondContact O-CB 3.39Å; C515-K519 PolarHBondContact O-N 3.43Å; I516-K519 PolarHBondContact O-N 3.48Å; I517-K519 VanDerWaalsContact C-N 3.3Å; I517-K519 PolarHBondContact O-N 2.96Å
520	T	89.7	Confident	91.2	Very high	38 Å²	38	60.2 Å²	60.2	23%	0.233	30%	0.3	C	S	.	.	H	α-helix	trans	-77.8	-19.7	177	62.8	0	0	0	0	114.3	I516 I517 Y518 Y562 N565	I516-T520 WeakPolarHBondContact O-CG2 3.31Å; I516-T520 PolarHBondContact O-N 3.4Å; I516-T520 VanDerWaalsContact O-N 3.09Å; I517-T520 PolarHBondContact O-N 3.17Å; I517-T520 PolarHBondContact O-OG1 3.27Å; Y518-T520 VanDerWaalsContact C-N 3.32Å; Y518-T520 PolarHBondContact O-N 3.03Å; T520-Y562 PolarHBondContact OG1-OH 3.4Å; T520-N565 PolarHBondContact O-ND2 3.39Å; T520-N565 VanDerWaalsContact O-ND2 3.12Å
521	Q	90.9	Very high	91.1	Very high	65 Å²	65	58.3 Å²	58.3	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-77.9	-30.5	178.3	-73.3	178.9	9	0	0	113.2	I517 Y518 P523 A564 S568	I517-Q521 WeakPolarHBondContact O-CG 3.47Å; I517-Q521 PolarHBondContact O-N 3.12Å; I517-Q521 VanDerWaalsContact O-N 3.1Å; Y518-Q521 PolarHBondContact O-N 3.26Å; Q521-P523 WeakPolarHBondContact O-CD 3.39Å; Q521-A564 HydrophobicContact CG-CB 4.19Å; Q521-S568 VanDerWaalsContact O-CB 3.26Å; Q521-S568 WeakPolarHBondContact O-CB 3.3Å; Q521-S568 PolarHBondContact O-OG 2.83Å
522	N	86.1	Confident	90.5	Very high	93 Å²	93	59.6 Å²	59.6	50%	0.497	30%	0.298	S	S	.	.	S	Bend	trans	-122.6	68.7	-179.7	-62.8	-53.9	0	0	0	110.8	Y518	Y518-N522 PolarHBondContact O-N 3.19Å
523	P	89.3	Confident	90	Very high	23 Å²	23	67.1 Å²	67.1	15%	0.149	34%	0.338	C	S	.	.			trans	-74.2	163.4	177.7	34.3	-37.2	0	0	0	111.9	Q521 V525 F557 A559	Q521-P523 WeakPolarHBondContact O-CD 3.39Å; P523-V525 PolarHBondContact O-N 3.38Å; P523-F557 HydrophobicContact CG-CD2 4.1Å; P523-F557 HydrophobicContact CG-CE1 4.05Å; P523-F557 HydrophobicContact CG-CE2 3.37Å; P523-F557 HydrophobicContact CG-CZ 3.36Å; P523-A559 HydrophobicContact CB-CB 3.53Å; P523-A559 HydrophobicContact CG-CB 3.66Å
524	K	88.6	Confident	89.9	Confident	97 Å²	97	68.9 Å²	68.9	42%	0.422	35%	0.347	S	S	.	.			trans	-65.8	134.8	168.1	-168.3	178	176.4	-175.3	0	108.7	D539 E542 Q558	K524-D539 IonicContact NZ-OD2 3.7Å; K524-E542 IonicContact NZ-OE1 3.73Å; K524-E542 IonicContact NZ-OE2 2.77Å; K524-E542 PolarHBondContact NZ-OE2 2.93Å; K524-Q558 WeakPolarHBondContact O-CB 3.45Å; K524-Q558 WeakPolarHBondContact O-CG 3.37Å; K524-Q558 PolarHBondContact O-N 2.96Å
525	V	92.4	Very high	89.6	Confident	44 Å²	44	70.5 Å²	70.5	27%	0.267	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142.4	173.2	-66.4	0	0	0	0	107.7	P523 F555 F557	P523-V525 PolarHBondContact O-N 3.38Å; V525-F555 HydrophobicContact CB-CE2 4.01Å; V525-F555 HydrophobicContact CB-CZ 4.07Å; V525-F555 HydrophobicContact CG1-CE2 4.38Å; V525-F555 HydrophobicContact CG1-CZ 3.94Å; V525-F557 HydrophobicContact CG1-CD2 3.67Å; V525-F557 HydrophobicContact CG1-CE2 4.11Å
526	S	92.4	Very high	89.5	Confident	5 Å²	5	73.9 Å²	73.9	4%	0.035	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137.9	-176.1	53.1	0	0	0	0	110.4	D539 R556	S526-D539 WeakPolarHBondContact CB-OD2 3.33Å; S526-R556 PolarHBondContact N-O 3.05Å; S526-R556 PolarHBondContact O-N 3.11Å
527	L	93.4	Very high	89.7	Confident	45 Å²	45	69.8 Å²	69.8	24%	0.236	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.3	167.3	-169.6	78.3	0	0	0	107.7	V540 K553 I554	L527-V540 WeakPolarHBondContact O-CG2 3.27Å; L527-V540 PolarHBondContact O-N 2.99Å; L527-V540 VanDerWaalsContact O-N 3.13Å; L527-K553 HydrophobicContact CD1-CB 4.4Å; L527-K553 HydrophobicContact CD1-CD 4.25Å; L527-K553 HydrophobicContact CD2-CD 4.35Å; L527-I554 WeakPolarHBondContact CA-O 3.23Å; L527-I554 WeakPolarHBondContact CD1-O 3.42Å
528	L	93.2	Very high	89.7	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.016	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.1	-174.5	-50.2	-179.5	0	0	0	111.8	E538 I554 R556 D631	L528-E538 CarbonylContact C-O 3.53Å; L528-E538 VanDerWaalsContact CA-O 3.28Å; L528-E538 WeakPolarHBondContact CA-O 3.48Å; L528-I554 HydrophobicContact CB-CB 4.04Å; L528-I554 HydrophobicContact CB-CG2 3.96Å; L528-I554 HydrophobicContact CD1-CG2 3.75Å; L528-I554 HydrophobicContact CG-CG2 4.09Å; L528-I554 PolarHBondContact N-O 3.32Å; L528-R556 HydrophobicContact CD1-CB 4.15Å; L528-R556 VanDerWaalsContact CD1-NH2 3.31Å; L528-R556 HydrophobicContact CD2-CB 4.22Å; L528-R556 HydrophobicContact CG-CB 4.22Å; L528-D631 HydrophobicContact CD1-CB 4.31Å
529	G	92.3	Very high	89.8	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	162.8	167.1	0	0	0	0	0	110.4	Y537 E538 V540	G529-Y537 CarbonylContact O-C 3.6Å; G529-Y537 VanDerWaalsContact O-CA 3.22Å; G529-Y537 WeakPolarHBondContact O-CA 3.35Å; G529-E538 PolarHBondContact N-O 3.26Å; G529-E538 PolarHBondContact O-N 3.33Å; G529-V540 VanDerWaalsContact N-CG2 3.32Å
530	R	93.1	Very high	89.8	Confident	75 Å²	75	57.8 Å²	57.8	28%	0.283	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	143.5	178.3	-165.1	-169.2	175.5	-178.9	3.1	109.9	I534 D535 L536 Y537 L546 T547 H695	R530-I534 WeakPolarHBondContact CG-O 3.31Å; R530-I534 PolarHBondContact NE-O 2.59Å; R530-D535 IonicContact CZ-OD1 3.38Å; R530-D535 IonicContact NH2-OD1 3.84Å; R530-D535 PolarHBondContact NH2-OD1 3.42Å; R530-L536 WeakPolarHBondContact CA-O 3.27Å; R530-Y537 HydrophobicContact CB-CD1 4.05Å; R530-Y537 HydrophobicContact CB-CE1 3.74Å; R530-Y537 HydrophobicContact CG-CD1 4.37Å; R530-Y537 HydrophobicContact CG-CE1 3.91Å; R530-Y537 HydrophobicContact CG-CE2 4.35Å; R530-L546 CarbonylContact O-C 3.14Å; R530-L546 WeakPolarHBondContact O-CA 3.48Å; R530-T547 PolarHBondContact N-O 2.86Å; R530-T547 PolarHBondContact O-N 3.22Å; R530-T547 PolarHBondContact O-OG1 2.91Å; R530-H695 PolarHBondContact NH2-CE1 3.15Å
531	V	91.1	Very high	89.8	Confident	42 Å²	42	64.5 Å²	64.5	26%	0.255	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	137.1	164.8	-179.4	0	0	0	0	108.9	D533 I534 L536 L546	V531-D533 PolarHBondContact O-N 3.41Å; V531-I534 HydrophobicContact CB-CB 4.39Å; V531-I534 HydrophobicContact CG1-CB 4.42Å; V531-I534 HydrophobicContact CG1-CD1 4.21Å; V531-I534 PolarHBondContact O-N 3.18Å; V531-L536 HydrophobicContact CG2-CB 4.26Å; V531-L536 HydrophobicContact CG2-CD2 4.28Å; V531-L536 HydrophobicContact CG2-CG 4.42Å; V531-L536 PolarHBondContact N-O 3.28Å; V531-L546 HydrophobicContact CB-CD2 4.5Å; V531-L546 HydrophobicContact CG2-CD2 3.55Å
532	D	83.8	Confident	89.7	Confident	93 Å²	93	67 Å²	67	50%	0.497	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	135.1	179.4	-60.7	-30.9	0	0	0	111.1	I534 T547	D532-I534 PolarHBondContact O-N 2.8Å; D532-T547 WeakPolarHBondContact OD1-CG2 3.46Å; D532-T547 PolarHBondContact OD1-OG1 3.19Å
533	D	80.3	Confident	89.8	Confident	166 Å²	166	68.8 Å²	68.8	89%	0.888	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	4.8	-179	-57.6	-36.9	0	0	0	117.6	V531	V531-D533 PolarHBondContact O-N 3.41Å
534	I	88.5	Confident	89.6	Confident	99 Å²	99	76.8 Å²	76.8	51%	0.508	37%	0.374	S	S	.	.	S	Bend	trans	-124.5	146.8	179.4	-51.5	176.7	0	0	0	110.6	R530 V531 D532 L536	R530-I534 WeakPolarHBondContact CG-O 3.31Å; R530-I534 PolarHBondContact NE-O 2.59Å; V531-I534 HydrophobicContact CB-CB 4.39Å; V531-I534 HydrophobicContact CG1-CB 4.42Å; V531-I534 HydrophobicContact CG1-CD1 4.21Å; V531-I534 PolarHBondContact O-N 3.18Å; D532-I534 PolarHBondContact O-N 2.8Å; I534-L536 HydrophobicContact CG2-CB 3.96Å; I534-L536 PolarHBondContact O-N 3.43Å
535	D	87.4	Confident	89.5	Confident	96 Å²	96	78.9 Å²	78.9	51%	0.513	39%	0.39	S	S	.	.			trans	-81.2	30.9	177.4	-62.4	-14.4	0	0	0	113.3	R530 H695	R530-D535 IonicContact CZ-OD1 3.38Å; R530-D535 IonicContact NH2-OD1 3.84Å; R530-D535 PolarHBondContact NH2-OD1 3.42Å; D535-H695 HydrophobicContact CB-CB 4.28Å; D535-H695 IonicContact OD1-CD2 2.85Å; D535-H695 IonicContact OD1-CE1 3.73Å; D535-H695 PolarHBondContact OD1-CE1 3.4Å; D535-H695 VanDerWaalsContact OD1-CE1 3.26Å; D535-H695 IonicContact OD1-CG 2.77Å; D535-H695 IonicContact OD1-ND1 3.91Å; D535-H695 PolarHBondContact OD1-ND1 2.89Å; D535-H695 IonicContact OD1-NE2 3.46Å; D535-H695 PolarHBondContact OD1-NE2 3.32Å; D535-H695 IonicContact OD2-CD2 3.13Å; D535-H695 PolarHBondContact OD2-CD2 3.43Å; D535-H695 IonicContact OD2-CG 2.64Å; D535-H695 IonicContact OD2-NE2 3.87Å
536	L	89.3	Confident	89.3	Confident	87 Å²	87	78.2 Å²	78.2	46%	0.455	38%	0.384	S	S	.	.			trans	-99.2	128.7	179.9	-175.7	63.5	0	0	0	110.4	R530 V531 I534 E538	R530-L536 WeakPolarHBondContact CA-O 3.27Å; V531-L536 HydrophobicContact CG2-CB 4.26Å; V531-L536 HydrophobicContact CG2-CD2 4.28Å; V531-L536 HydrophobicContact CG2-CG 4.42Å; V531-L536 PolarHBondContact N-O 3.28Å; I534-L536 HydrophobicContact CG2-CB 3.96Å; I534-L536 PolarHBondContact O-N 3.43Å; L536-E538 HydrophobicContact CG-CG 4.44Å
537	Y	91.5	Very high	88.9	Confident	13 Å²	13	81 Å²	81	5%	0.051	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119	-179.5	-67.6	-95	0	0	0	111.1	G529 R530 P549 I554 R556 V694 H695 V698	G529-Y537 CarbonylContact O-C 3.6Å; G529-Y537 VanDerWaalsContact O-CA 3.22Å; G529-Y537 WeakPolarHBondContact O-CA 3.35Å; R530-Y537 HydrophobicContact CB-CD1 4.05Å; R530-Y537 HydrophobicContact CB-CE1 3.74Å; R530-Y537 HydrophobicContact CG-CD1 4.37Å; R530-Y537 HydrophobicContact CG-CE1 3.91Å; R530-Y537 HydrophobicContact CG-CE2 4.35Å; Y537-P549 HydrophobicContact CE1-CG 4.1Å; Y537-I554 HydrophobicContact CD1-CD1 3.32Å; Y537-I554 HydrophobicContact CE1-CD1 3.31Å; Y537-I554 HydrophobicContact CG-CD1 4.33Å; Y537-R556 PolarHBondContact O-NH2 3.26Å; Y537-V694 HydrophobicContact CD1-CG1 4.16Å; Y537-V694 HydrophobicContact CD2-CB 4.21Å; Y537-V694 HydrophobicContact CD2-CG1 4.01Å; Y537-V694 HydrophobicContact CE1-CG1 4.33Å; Y537-V694 HydrophobicContact CE2-CB 4.5Å; Y537-V694 HydrophobicContact CE2-CG1 4.21Å; Y537-V694 HydrophobicContact CG-CG1 3.98Å; Y537-H695 HydrophobicContact CE2-CB 3.96Å; Y537-H695 PolarHBondContact OH-ND1 3.3Å; Y537-V698 HydrophobicContact CE1-CG2 4.38Å
538	E	91.9	Very high	88.5	Confident	60 Å²	60	82.5 Å²	82.5	28%	0.28	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	167.7	-178.4	-77	-59.2	170.8	0	0	113.5	L528 G529 L536 V540 Y543 L546 R556	L528-E538 CarbonylContact C-O 3.53Å; L528-E538 VanDerWaalsContact CA-O 3.28Å; L528-E538 WeakPolarHBondContact CA-O 3.48Å; G529-E538 PolarHBondContact N-O 3.26Å; G529-E538 PolarHBondContact O-N 3.33Å; L536-E538 HydrophobicContact CG-CG 4.44Å; E538-V540 PolarHBondContact O-N 3.43Å; E538-Y543 HydrophobicContact CB-CD2 4.04Å; E538-Y543 HydrophobicContact CB-CE2 4.48Å; E538-L546 HydrophobicContact CB-CD1 4.21Å; E538-L546 HydrophobicContact CB-CD2 4.48Å; E538-L546 WeakPolarHBondContact O-CD1 3.43Å; E538-R556 IonicContact OE2-NH1 3.83Å; E538-R556 PolarHBondContact OE2-NH1 3.47Å
539	D	91.7	Very high	87.9	Confident	3 Å²	3	83.3 Å²	83.3	2%	0.016	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	120.2	-176.6	-171.7	-2.3	0	0	0	112.1	K524 S526 E541 E542 Y543 L546	K524-D539 IonicContact NZ-OD2 3.7Å; S526-D539 WeakPolarHBondContact CB-OD2 3.33Å; D539-E541 PolarHBondContact O-N 2.89Å; D539-E541 PolarHBondContact OD1-N 3Å; D539-E542 HydrophobicContact CB-CB 4.02Å; D539-E542 PolarHBondContact O-N 3.37Å; D539-Y543 PolarHBondContact O-N 3.33Å; D539-Y543 VanDerWaalsContact O-N 3.07Å; D539-L546 WeakPolarHBondContact O-CD1 3.28Å
540	V	89.6	Confident	87.5	Confident	66 Å²	66	87.3 Å²	87.3	40%	0.4	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.2	180	-177.7	0	0	0	0	112.1	L527 G529 E538	L527-V540 WeakPolarHBondContact O-CG2 3.27Å; L527-V540 PolarHBondContact O-N 2.99Å; L527-V540 VanDerWaalsContact O-N 3.13Å; G529-V540 VanDerWaalsContact N-CG2 3.32Å; E538-V540 PolarHBondContact O-N 3.43Å
541	E	88.8	Confident	87.1	Confident	180 Å²	180	87.8 Å²	87.8	84%	0.841	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-24.3	178.4	-64	-174	179.6	0	0	112.7	D539	D539-E541 PolarHBondContact O-N 2.89Å; D539-E541 PolarHBondContact OD1-N 3Å
542	E	89.2	Confident	87.1	Confident	116 Å²	116	86 Å²	86	54%	0.542	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-32.8	-173.4	-168.6	160.8	-161	0	0	112.9	K524 D539	K524-E542 IonicContact NZ-OE1 3.73Å; K524-E542 IonicContact NZ-OE2 2.77Å; K524-E542 PolarHBondContact NZ-OE2 2.93Å; D539-E542 HydrophobicContact CB-CB 4.02Å; D539-E542 PolarHBondContact O-N 3.37Å
543	Y	88.9	Confident	87.5	Confident	131 Å²	131	84.4 Å²	84.4	51%	0.514	43%	0.433	S	S	.	.			trans	-117.8	142.3	-177.4	-67.3	-86.9	0	0	0	112.6	E538 D539	E538-Y543 HydrophobicContact CB-CD2 4.04Å; E538-Y543 HydrophobicContact CB-CE2 4.48Å; D539-Y543 PolarHBondContact O-N 3.33Å; D539-Y543 VanDerWaalsContact O-N 3.07Å
544	K	83.6	Confident	88.2	Confident	192 Å²	192	76.6 Å²	76.6	84%	0.835	39%	0.391	S	S	*	.	S	Bend	trans	-89.1	159.2	171.9	-63.5	179.7	-179.9	-179.7	0	109.9
545	N	86.6	Confident	88.6	Confident	141 Å²	141	72 Å²	72	75%	0.754	37%	0.368	S	S	*	.	S	Bend	trans	69.4	39.3	-178.3	-49	-21.9	0	0	0	114.4
546	L	88.2	Confident	88.9	Confident	29 Å²	29	69.2 Å²	69.2	15%	0.152	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.4	171.8	-67.2	170.5	0	0	0	109.5	R530 V531 E538 D539	R530-L546 CarbonylContact O-C 3.14Å; R530-L546 WeakPolarHBondContact O-CA 3.48Å; V531-L546 HydrophobicContact CB-CD2 4.5Å; V531-L546 HydrophobicContact CG2-CD2 3.55Å; E538-L546 HydrophobicContact CB-CD1 4.21Å; E538-L546 HydrophobicContact CB-CD2 4.48Å; E538-L546 WeakPolarHBondContact O-CD1 3.43Å; D539-L546 WeakPolarHBondContact O-CD1 3.28Å
547	T	85.7	Confident	89.1	Confident	63 Å²	63	65.1 Å²	65.1	39%	0.387	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.7	174.6	50	0	0	0	0	110.1	R530 D532	R530-T547 PolarHBondContact N-O 2.86Å; R530-T547 PolarHBondContact O-N 3.22Å; R530-T547 PolarHBondContact O-OG1 2.91Å; D532-T547 WeakPolarHBondContact OD1-CG2 3.46Å; D532-T547 PolarHBondContact OD1-OG1 3.19Å
548	A	83.3	Confident	89.1	Confident	77 Å²	77	68.5 Å²	68.5	64%	0.636	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-72	129.8	175.9	0	0	0	0	0	109.2	S550	A548-S550 PolarHBondContact O-N 2.85Å
549	P	82.4	Confident	89.1	Confident	21 Å²	21	66 Å²	66	14%	0.136	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-56.2	139	175.8	-22.3	32	0	0	0	111.3	Y537 R551 V552 I554 V698	Y537-P549 HydrophobicContact CE1-CG 4.1Å; P549-R551 PolarHBondContact O-N 3.47Å; P549-R551 VanDerWaalsContact O-N 3.15Å; P549-V552 HydrophobicContact CB-CB 4.2Å; P549-V552 PolarHBondContact O-N 3.15Å; P549-I554 HydrophobicContact CG-CD1 3.71Å; P549-I554 HydrophobicContact CG-CG1 4.43Å; P549-V698 HydrophobicContact CB-CG1 4.37Å
550	S	81.9	Confident	89.2	Confident	83 Å²	83	66.9 Å²	66.9	58%	0.58	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	120.4	-178.5	57.5	0	0	0	0	110.5	A548 V552	A548-S550 PolarHBondContact O-N 2.85Å; S550-V552 PolarHBondContact O-N 3.23Å
551	R	86.3	Confident	89.4	Confident	86 Å²	86	63.7 Å²	63.7	33%	0.325	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	20.4	177.1	-56.3	-169.7	75.7	169.8	8.8	116.1	P549 E622 L623 F625 H626	P549-R551 PolarHBondContact O-N 3.47Å; P549-R551 VanDerWaalsContact O-N 3.15Å; R551-E622 IonicContact CZ-OE2 3.75Å; R551-E622 IonicContact NH1-OE2 3.5Å; R551-E622 PolarHBondContact NH1-OE2 3.15Å; R551-E622 IonicContact NH2-OE2 3.91Å; R551-E622 PolarHBondContact NH2-OE2 3.32Å; R551-L623 PolarHBondContact NH2-O 3.21Å; R551-F625 VanDerWaalsContact O-CA 3.29Å; R551-F625 WeakPolarHBondContact O-CA 3.26Å; R551-F625 WeakPolarHBondContact O-CB 3.4Å; R551-H626 VanDerWaalsContact CB-CD2 3.49Å; R551-H626 WeakPolarHBondContact CB-CD2 3.39Å; R551-H626 PolarHBondContact O-CD2 3.3Å; R551-H626 PolarHBondContact O-N 3.49Å
552	V	91.1	Very high	89.6	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.03	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.8	175	179.7	0	0	0	0	110.1	P549 S550 I554 T627 V629 V698 A701 N702	P549-V552 HydrophobicContact CB-CB 4.2Å; P549-V552 PolarHBondContact O-N 3.15Å; S550-V552 PolarHBondContact O-N 3.23Å; V552-I554 HydrophobicContact CG1-CG1 4.39Å; V552-T627 WeakPolarHBondContact CA-O 3.11Å; V552-V629 HydrophobicContact CG1-CG2 3.78Å; V552-V698 HydrophobicContact CG1-CG2 4.29Å; V552-A701 HydrophobicContact CG2-CB 4.06Å; V552-N702 WeakPolarHBondContact CG2-OD1 3.43Å
553	K	92.6	Very high	89.8	Confident	59 Å²	59	57.4 Å²	57.4	26%	0.257	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.3	176.6	-67.2	-68.4	-175.1	177.5	0	109.9	L527 F625 T627 I628 V629	L527-K553 HydrophobicContact CD1-CB 4.4Å; L527-K553 HydrophobicContact CD1-CD 4.25Å; L527-K553 HydrophobicContact CD2-CD 4.35Å; K553-F625 HydrophobicContact CB-CD2 4.49Å; K553-F625 HydrophobicContact CG-CB 4.23Å; K553-F625 HydrophobicContact CG-CD1 4.01Å; K553-F625 HydrophobicContact CG-CD2 4Å; K553-F625 HydrophobicContact CG-CE1 4.45Å; K553-F625 HydrophobicContact CG-CE2 4.44Å; K553-F625 HydrophobicContact CG-CG 3.8Å; K553-T627 PolarHBondContact N-O 3.09Å; K553-I628 CarbonylContact O-C 3.58Å; K553-I628 VanDerWaalsContact O-CA 3.3Å; K553-I628 WeakPolarHBondContact O-CA 3.32Å; K553-V629 PolarHBondContact O-N 2.84Å
554	I	94.7	Very high	90	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	118.8	-179.6	-52.3	166.1	0	0	0	109.1	L527 L528 Y537 P549 V552 V629 V694 V698	L527-I554 WeakPolarHBondContact CA-O 3.23Å; L527-I554 WeakPolarHBondContact CD1-O 3.42Å; L528-I554 HydrophobicContact CB-CB 4.04Å; L528-I554 HydrophobicContact CB-CG2 3.96Å; L528-I554 HydrophobicContact CD1-CG2 3.75Å; L528-I554 HydrophobicContact CG-CG2 4.09Å; L528-I554 PolarHBondContact N-O 3.32Å; Y537-I554 HydrophobicContact CD1-CD1 3.32Å; Y537-I554 HydrophobicContact CE1-CD1 3.31Å; Y537-I554 HydrophobicContact CG-CD1 4.33Å; P549-I554 HydrophobicContact CG-CD1 3.71Å; P549-I554 HydrophobicContact CG-CG1 4.43Å; V552-I554 HydrophobicContact CG1-CG1 4.39Å; I554-V629 CarbonylContact C-O 3.56Å; I554-V629 WeakPolarHBondContact CA-O 3.25Å; I554-V629 HydrophobicContact CG1-CB 4.18Å; I554-V629 HydrophobicContact CG2-CB 4.33Å; I554-V629 HydrophobicContact CG2-CG1 4.43Å; I554-V694 HydrophobicContact CD1-CG1 3.72Å; I554-V694 HydrophobicContact CG1-CG1 4.31Å; I554-V694 HydrophobicContact CG2-CG1 3.81Å; I554-V698 HydrophobicContact CD1-CG2 3.8Å; I554-V698 HydrophobicContact CG1-CG2 4.25Å
555	F	95.4	Very high	90.5	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.009	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.6	-176.4	179.2	-98.5	0	0	0	111	V525 F557 F569 L573 A576 V629 L630 D631	V525-F555 HydrophobicContact CB-CE2 4.01Å; V525-F555 HydrophobicContact CB-CZ 4.07Å; V525-F555 HydrophobicContact CG1-CE2 4.38Å; V525-F555 HydrophobicContact CG1-CZ 3.94Å; F555-F557 HydrophobicContact CE1-CB 3.93Å; F555-F557 HydrophobicContact CE1-CD2 4.39Å; F555-F557 HydrophobicContact CZ-CD2 4.44Å; F555-F569 HydrophobicContact CD1-CE2 4.36Å; F555-F569 HydrophobicContact CE1-CD2 4.1Å; F555-F569 AromaticContact CE1-CE2 3.74Å; F555-F569 HydrophobicContact CE1-CE2 3.74Å; F555-L573 HydrophobicContact CB-CD1 3.84Å; F555-L573 HydrophobicContact CD1-CD1 3.59Å; F555-L573 HydrophobicContact CD2-CD1 3.9Å; F555-L573 HydrophobicContact CE1-CB 4.13Å; F555-L573 HydrophobicContact CE1-CD1 4.02Å; F555-L573 HydrophobicContact CE2-CB 4.41Å; F555-L573 HydrophobicContact CE2-CD1 4.33Å; F555-L573 HydrophobicContact CG-CD1 3.5Å; F555-L573 VanDerWaalsContact CG-CD1 3.5Å; F555-L573 HydrophobicContact CZ-CB 4.05Å; F555-L573 HydrophobicContact CZ-CD1 4.37Å; F555-A576 HydrophobicContact CD2-CB 3.92Å; F555-A576 HydrophobicContact CE2-CB 3.88Å; F555-V629 PolarHBondContact N-O 2.82Å; F555-L630 HydrophobicContact CB-CD2 4.2Å; F555-L630 HydrophobicContact CD1-CD2 3.91Å; F555-D631 PolarHBondContact O-N 3.34Å
556	R	94.8	Very high	90.9	Very high	38 Å²	38	40.2 Å²	40.2	14%	0.143	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.9	176.5	179.2	-173.9	-71.9	162.6	1.1	110.1	S526 L528 Y537 E538 Q558 D631	S526-R556 PolarHBondContact N-O 3.05Å; S526-R556 PolarHBondContact O-N 3.11Å; L528-R556 HydrophobicContact CD1-CB 4.15Å; L528-R556 VanDerWaalsContact CD1-NH2 3.31Å; L528-R556 HydrophobicContact CD2-CB 4.22Å; L528-R556 HydrophobicContact CG-CB 4.22Å; Y537-R556 PolarHBondContact O-NH2 3.26Å; E538-R556 IonicContact OE2-NH1 3.83Å; E538-R556 PolarHBondContact OE2-NH1 3.47Å; R556-Q558 HydrophobicContact CG-CG 4.31Å; R556-D631 HydrophobicContact CB-CB 4.06Å; R556-D631 HydrophobicContact CG-CB 4.38Å; R556-D631 IonicContact CZ-OD2 2.61Å; R556-D631 VanDerWaalsContact CZ-OD2 3.27Å; R556-D631 IonicContact NE-OD2 2.96Å; R556-D631 PolarHBondContact NE-OD2 3.47Å; R556-D631 IonicContact NH2-OD2 2.65Å; R556-D631 PolarHBondContact NH2-OD2 3.09Å
557	F	93.4	Very high	91	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.009	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	114.2	176.6	-173.8	-104.4	0	0	0	110.7	P523 V525 F555 A559 L561 F569	P523-F557 HydrophobicContact CG-CD2 4.1Å; P523-F557 HydrophobicContact CG-CE1 4.05Å; P523-F557 HydrophobicContact CG-CE2 3.37Å; P523-F557 HydrophobicContact CG-CZ 3.36Å; V525-F557 HydrophobicContact CG1-CD2 3.67Å; V525-F557 HydrophobicContact CG1-CE2 4.11Å; F555-F557 HydrophobicContact CE1-CB 3.93Å; F555-F557 HydrophobicContact CE1-CD2 4.39Å; F555-F557 HydrophobicContact CZ-CD2 4.44Å; F557-A559 VanDerWaalsContact C-N 3.31Å; F557-A559 HydrophobicContact CD1-CB 4.23Å; F557-A559 WeakPolarHBondContact CD1-O 3.3Å; F557-A559 HydrophobicContact CE1-CB 3.7Å; F557-A559 HydrophobicContact CZ-CB 4.24Å; F557-A559 PolarHBondContact O-N 3.1Å; F557-A559 VanDerWaalsContact O-N 3.12Å; F557-L561 HydrophobicContact CE1-CD1 4.41Å; F557-F569 HydrophobicContact CB-CD2 4.06Å; F557-F569 HydrophobicContact CB-CE2 4.18Å; F557-F569 HydrophobicContact CD1-CD2 4.09Å; F557-F569 HydrophobicContact CD2-CB 4.33Å; F557-F569 AromaticContact CD2-CD2 3.63Å; F557-F569 HydrophobicContact CD2-CD2 3.63Å; F557-F569 HydrophobicContact CD2-CG 4.47Å; F557-F569 HydrophobicContact CE1-CB 4.49Å; F557-F569 HydrophobicContact CE1-CD2 4.41Å; F557-F569 HydrophobicContact CE2-CB 3.82Å; F557-F569 AromaticContact CE2-CD2 4Å; F557-F569 HydrophobicContact CE2-CD2 4Å; F557-F569 HydrophobicContact CE2-CG 4.43Å; F557-F569 AromaticContact CG-CD2 3.67Å; F557-F569 HydrophobicContact CG-CD2 3.67Å; F557-F569 HydrophobicContact CG-CE2 4.28Å; F557-F569 HydrophobicContact CZ-CB 3.9Å; F557-F569 HydrophobicContact CZ-CD2 4.36Å
558	Q	92.1	Very high	91.4	Very high	84 Å²	84	42.4 Å²	42.4	39%	0.393	23%	0.228	S	C	.	.			trans	-89.9	50.5	-170.8	-55	-175.9	10	0	0	113.8	K524 R556 A634	K524-Q558 WeakPolarHBondContact O-CB 3.45Å; K524-Q558 WeakPolarHBondContact O-CG 3.37Å; K524-Q558 PolarHBondContact O-N 2.96Å; R556-Q558 HydrophobicContact CG-CG 4.31Å; Q558-A634 HydrophobicContact CB-CB 4.3Å; Q558-A634 HydrophobicContact CG-CB 4.34Å
559	A	92.1	Very high	91.9	Very high	7 Å²	7	38.9 Å²	38.9	6%	0.058	20%	0.198	C	C	.	.	S	Bend	trans	-160.4	162.6	175	0	0	0	0	0	113.1	P523 F557	P523-A559 HydrophobicContact CB-CB 3.53Å; P523-A559 HydrophobicContact CG-CB 3.66Å; F557-A559 VanDerWaalsContact C-N 3.31Å; F557-A559 HydrophobicContact CD1-CB 4.23Å; F557-A559 WeakPolarHBondContact CD1-O 3.3Å; F557-A559 HydrophobicContact CE1-CB 3.7Å; F557-A559 HydrophobicContact CZ-CB 4.24Å; F557-A559 PolarHBondContact O-N 3.1Å; F557-A559 VanDerWaalsContact O-N 3.12Å
560	P	93.7	Very high	92.4	Very high	21 Å²	21	39.5 Å²	39.5	14%	0.136	20%	0.2	C	C	.	.			trans	-57.2	145.7	164.2	24.2	-33.6	0	0	0	110.6	Y562 N565 P636 F637	P560-Y562 HydrophobicContact CB-CD1 4.3Å; P560-Y562 HydrophobicContact CG-CD1 4.27Å; P560-Y562 HydrophobicContact CG-CE1 4.23Å; P560-N565 PolarHBondContact O-ND2 3.41Å; P560-N565 PolarHBondContact O-OD1 2.98Å; P560-P636 HydrophobicContact CB-CG 3.96Å; P560-P636 HydrophobicContact CG-CG 4.39Å; P560-F637 HydrophobicContact CB-CD1 3.77Å; P560-F637 HydrophobicContact CB-CD2 4.29Å; P560-F637 HydrophobicContact CB-CE1 3.41Å; P560-F637 VanDerWaalsContact CB-CE1 3.41Å; P560-F637 HydrophobicContact CB-CE2 3.96Å; P560-F637 HydrophobicContact CB-CG 4.2Å; P560-F637 HydrophobicContact CB-CZ 3.51Å; P560-F637 HydrophobicContact CG-CE1 3.9Å; P560-F637 HydrophobicContact CG-CZ 4.02Å
561	L	93.2	Very high	92.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-103.4	116.1	176.9	-175.9	67.2	0	0	0	110	F557 F569 I635 F637 I638 D639 F646	F557-L561 HydrophobicContact CE1-CD1 4.41Å; L561-F569 HydrophobicContact CD1-CB 3.66Å; L561-F569 HydrophobicContact CD1-CD1 4.05Å; L561-F569 HydrophobicContact CD1-CD2 4.26Å; L561-F569 HydrophobicContact CD1-CG 3.72Å; L561-F569 HydrophobicContact CD2-CD1 4.5Å; L561-I635 HydrophobicContact CB-CG2 4.45Å; L561-F637 PolarHBondContact N-O 3.24Å; L561-I638 HydrophobicContact CB-CG1 4.23Å; L561-I638 WeakPolarHBondContact O-CA 3.35Å; L561-D639 PolarHBondContact O-N 3.02Å; L561-F646 HydrophobicContact CD2-CD1 3.52Å; L561-F646 HydrophobicContact CD2-CE1 3.22Å; L561-F646 HydrophobicContact CD2-CG 4.37Å; L561-F646 HydrophobicContact CD2-CZ 3.85Å
562	Y	93.5	Very high	93.2	Very high	28 Å²	28	40.6 Å²	40.6	11%	0.11	20%	0.201	C	C	.	.			trans	-150.3	178.2	-176.7	68.7	-78.9	0	0	0	112	T520 P560 A564 N565 K566 D639	T520-Y562 PolarHBondContact OG1-OH 3.4Å; P560-Y562 HydrophobicContact CB-CD1 4.3Å; P560-Y562 HydrophobicContact CG-CD1 4.27Å; P560-Y562 HydrophobicContact CG-CE1 4.23Å; Y562-A564 HydrophobicContact CD2-CB 3.89Å; Y562-A564 HydrophobicContact CE2-CB 3.24Å; Y562-A564 PolarHBondContact O-N 3.34Å; Y562-N565 HydrophobicContact CE1-CB 4.48Å; Y562-N565 PolarHBondContact N-OD1 3.09Å; Y562-N565 PolarHBondContact O-N 3.39Å; Y562-N565 VanDerWaalsContact O-N 3.12Å; Y562-N565 PolarHBondContact O-OD1 2.89Å; Y562-K566 PolarHBondContact O-N 3.14Å; Y562-K566 VanDerWaalsContact O-N 3.09Å; Y562-D639 VanDerWaalsContact CA-CG 3.48Å; Y562-D639 WeakPolarHBondContact CA-OD1 3.2Å; Y562-D639 WeakPolarHBondContact CA-OD2 3.49Å; Y562-D639 WeakPolarHBondContact CB-OD2 3.42Å
563	F	93.1	Very high	93.4	Very high	136 Å²	136	40.4 Å²	40.4	60%	0.596	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-34.5	-173.2	72.5	-89.7	0	0	0	114.8	D639 T641	F563-D639 PolarHBondContact N-OD2 2.91Å; F563-T641 HydrophobicContact CB-CG2 4.18Å
564	A	92.9	Very high	93.4	Very high	33 Å²	33	39.2 Å²	39.2	27%	0.273	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-23.9	-174.5	0	0	0	0	0	113.8	Q521 Y562	Q521-A564 HydrophobicContact CG-CB 4.19Å; Y562-A564 HydrophobicContact CD2-CB 3.89Å; Y562-A564 HydrophobicContact CE2-CB 3.24Å; Y562-A564 PolarHBondContact O-N 3.34Å
565	N	94.7	Very high	93.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	0.8	-175.6	73.6	-7	0	0	0	114.4	T520 P560 Y562 N567 S568 F569	T520-N565 PolarHBondContact O-ND2 3.39Å; T520-N565 VanDerWaalsContact O-ND2 3.12Å; P560-N565 PolarHBondContact O-ND2 3.41Å; P560-N565 PolarHBondContact O-OD1 2.98Å; Y562-N565 HydrophobicContact CE1-CB 4.48Å; Y562-N565 PolarHBondContact N-OD1 3.09Å; Y562-N565 PolarHBondContact O-N 3.39Å; Y562-N565 VanDerWaalsContact O-N 3.12Å; Y562-N565 PolarHBondContact O-OD1 2.89Å; N565-N567 VanDerWaalsContact C-N 3.25Å; N565-N567 PolarHBondContact O-N 3.49Å; N565-S568 WeakPolarHBondContact O-CB 3.46Å; N565-S568 PolarHBondContact O-N 3.43Å; N565-F569 PolarHBondContact O-N 2.79Å
566	K	93.1	Very high	92.9	Very high	69 Å²	69	49.6 Å²	49.6	30%	0.3	25%	0.245	S	C	.	.	H	α-helix	trans	-50.7	-42.1	176.4	78.7	-176.6	-172.3	170.9	0	113.6	Y562 F569 L570 T641	Y562-K566 PolarHBondContact O-N 3.14Å; Y562-K566 VanDerWaalsContact O-N 3.09Å; K566-F569 WeakPolarHBondContact O-CB 3.44Å; K566-F569 PolarHBondContact O-N 3.35Å; K566-L570 WeakPolarHBondContact O-CG 3.42Å; K566-L570 PolarHBondContact O-N 3.02Å; K566-T641 HydrophobicContact CD-CG2 3.49Å; K566-T641 VanDerWaalsContact CD-CG2 3.49Å
567	N	92.1	Very high	92.6	Very high	111 Å²	111	48.2 Å²	48.2	59%	0.594	24%	0.241	S	C	*	.	H	α-helix	trans	-72.6	-36	-177.8	-67.5	-12.2	0	0	0	111	N565 K571	N565-N567 VanDerWaalsContact C-N 3.25Å; N565-N567 PolarHBondContact O-N 3.49Å; N567-K571 VanDerWaalsContact O-CB 3.24Å; N567-K571 WeakPolarHBondContact O-CB 3.08Å; N567-K571 PolarHBondContact O-N 3.46Å
568	S	92.4	Very high	92.3	Very high	28 Å²	28	51.1 Å²	51.1	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-41	175.5	-172.8	0	0	0	0	110.8	Q521 N565 S572	Q521-S568 VanDerWaalsContact O-CB 3.26Å; Q521-S568 WeakPolarHBondContact O-CB 3.3Å; Q521-S568 PolarHBondContact O-OG 2.83Å; N565-S568 WeakPolarHBondContact O-CB 3.46Å; N565-S568 PolarHBondContact O-N 3.43Å; S568-S572 WeakPolarHBondContact O-CB 3.49Å; S568-S572 PolarHBondContact O-N 3.11Å; S568-S572 PolarHBondContact O-OG 3.2Å
569	F	94.3	Very high	92	Very high	3 Å²	3	47.7 Å²	47.7	1%	0.013	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-55.8	172.7	168	-98.9	0	0	0	111.6	F555 F557 L561 N565 K566 K571 S572 L573 T645 F646 L649	F555-F569 HydrophobicContact CD1-CE2 4.36Å; F555-F569 HydrophobicContact CE1-CD2 4.1Å; F555-F569 AromaticContact CE1-CE2 3.74Å; F555-F569 HydrophobicContact CE1-CE2 3.74Å; F557-F569 HydrophobicContact CB-CD2 4.06Å; F557-F569 HydrophobicContact CB-CE2 4.18Å; F557-F569 HydrophobicContact CD1-CD2 4.09Å; F557-F569 HydrophobicContact CD2-CB 4.33Å; F557-F569 AromaticContact CD2-CD2 3.63Å; F557-F569 HydrophobicContact CD2-CD2 3.63Å; F557-F569 HydrophobicContact CD2-CG 4.47Å; F557-F569 HydrophobicContact CE1-CB 4.49Å; F557-F569 HydrophobicContact CE1-CD2 4.41Å; F557-F569 HydrophobicContact CE2-CB 3.82Å; F557-F569 AromaticContact CE2-CD2 4Å; F557-F569 HydrophobicContact CE2-CD2 4Å; F557-F569 HydrophobicContact CE2-CG 4.43Å; F557-F569 AromaticContact CG-CD2 3.67Å; F557-F569 HydrophobicContact CG-CD2 3.67Å; F557-F569 HydrophobicContact CG-CE2 4.28Å; F557-F569 HydrophobicContact CZ-CB 3.9Å; F557-F569 HydrophobicContact CZ-CD2 4.36Å; L561-F569 HydrophobicContact CD1-CB 3.66Å; L561-F569 HydrophobicContact CD1-CD1 4.05Å; L561-F569 HydrophobicContact CD1-CD2 4.26Å; L561-F569 HydrophobicContact CD1-CG 3.72Å; L561-F569 HydrophobicContact CD2-CD1 4.5Å; N565-F569 PolarHBondContact O-N 2.79Å; K566-F569 WeakPolarHBondContact O-CB 3.44Å; K566-F569 PolarHBondContact O-N 3.35Å; F569-K571 PolarHBondContact O-N 3.46Å; F569-S572 PolarHBondContact O-N 3.26Å; F569-L573 HydrophobicContact CE1-CD2 4.32Å; F569-L573 HydrophobicContact CZ-CD2 4.11Å; F569-L573 WeakPolarHBondContact O-CB 3.3Å; F569-L573 PolarHBondContact O-N 3.28Å; F569-T645 HydrophobicContact CD1-CG2 4.36Å; F569-F646 HydrophobicContact CE1-CD1 4.23Å; F569-F646 AromaticContact CE1-CE1 3.9Å; F569-F646 HydrophobicContact CE1-CE1 3.9Å; F569-F646 HydrophobicContact CE2-CE1 4.23Å; F569-F646 HydrophobicContact CZ-CD1 4.31Å; F569-F646 AromaticContact CZ-CE1 3.59Å; F569-F646 HydrophobicContact CZ-CE1 3.59Å; F569-L649 HydrophobicContact CE1-CD2 3.99Å; F569-L649 HydrophobicContact CZ-CD2 4.1Å
570	L	93.5	Very high	91.8	Very high	34 Å²	34	51.7 Å²	51.7	18%	0.178	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-48.9	-179.5	-70	176.9	0	0	0	111.9	K566 S572 L573 Y574 T645 L649	K566-L570 WeakPolarHBondContact O-CG 3.42Å; K566-L570 PolarHBondContact O-N 3.02Å; L570-S572 VanDerWaalsContact C-N 3.31Å; L570-S572 PolarHBondContact O-N 3.26Å; L570-L573 PolarHBondContact O-N 3.06Å; L570-Y574 HydrophobicContact CB-CE2 4Å; L570-Y574 HydrophobicContact CD2-CE1 4.46Å; L570-Y574 WeakPolarHBondContact O-CB 3.41Å; L570-Y574 VanDerWaalsContact O-CD2 3.31Å; L570-Y574 WeakPolarHBondContact O-CD2 3.25Å; L570-Y574 PolarHBondContact O-N 2.88Å; L570-T645 HydrophobicContact CD1-CG2 3.93Å; L570-T645 HydrophobicContact CD2-CG2 3.75Å; L570-T645 HydrophobicContact CG-CG2 3.84Å; L570-L649 HydrophobicContact CD2-CD1 3.76Å
571	K	92.7	Very high	91.3	Very high	163 Å²	163	50.7 Å²	50.7	71%	0.709	27%	0.267	S	S	*	.	H	α-helix	trans	-61.1	-40.9	179.7	-173.3	176.8	-178.7	178.4	0	112	N567 F569 K575	N567-K571 VanDerWaalsContact O-CB 3.24Å; N567-K571 WeakPolarHBondContact O-CB 3.08Å; N567-K571 PolarHBondContact O-N 3.46Å; F569-K571 PolarHBondContact O-N 3.46Å; K571-K575 VanDerWaalsContact O-CB 3.27Å; K571-K575 WeakPolarHBondContact O-CB 3.43Å; K571-K575 PolarHBondContact O-N 3.47Å
572	S	92.8	Very high	90.8	Very high	29 Å²	29	57.9 Å²	57.9	20%	0.203	30%	0.299	C	S	.	.	H	α-helix	trans	-68.4	-41.1	178	-62.2	0	0	0	0	111.9	S568 F569 L570 K575 A576	S568-S572 WeakPolarHBondContact O-CB 3.49Å; S568-S572 PolarHBondContact O-N 3.11Å; S568-S572 PolarHBondContact O-OG 3.2Å; F569-S572 PolarHBondContact O-N 3.26Å; L570-S572 VanDerWaalsContact C-N 3.31Å; L570-S572 PolarHBondContact O-N 3.26Å; S572-K575 PolarHBondContact O-N 3.21Å; S572-A576 VanDerWaalsContact O-CB 3.23Å; S572-A576 WeakPolarHBondContact O-CB 3.31Å; S572-A576 PolarHBondContact O-N 3.14Å
573	L	93.6	Very high	90.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-50.2	176.5	176.6	65.8	0	0	0	111.3	F555 F569 L570 K575 A576 V577 I628 L630 L649 Y653	F555-L573 HydrophobicContact CB-CD1 3.84Å; F555-L573 HydrophobicContact CD1-CD1 3.59Å; F555-L573 HydrophobicContact CD2-CD1 3.9Å; F555-L573 HydrophobicContact CE1-CB 4.13Å; F555-L573 HydrophobicContact CE1-CD1 4.02Å; F555-L573 HydrophobicContact CE2-CB 4.41Å; F555-L573 HydrophobicContact CE2-CD1 4.33Å; F555-L573 HydrophobicContact CG-CD1 3.5Å; F555-L573 VanDerWaalsContact CG-CD1 3.5Å; F555-L573 HydrophobicContact CZ-CB 4.05Å; F555-L573 HydrophobicContact CZ-CD1 4.37Å; F569-L573 HydrophobicContact CE1-CD2 4.32Å; F569-L573 HydrophobicContact CZ-CD2 4.11Å; F569-L573 WeakPolarHBondContact O-CB 3.3Å; F569-L573 PolarHBondContact O-N 3.28Å; L570-L573 PolarHBondContact O-N 3.06Å; L573-K575 VanDerWaalsContact C-N 3.27Å; L573-K575 PolarHBondContact O-N 3.2Å; L573-A576 PolarHBondContact O-N 2.96Å; L573-V577 HydrophobicContact CD1-CG2 3.7Å; L573-V577 HydrophobicContact CG-CG2 4.41Å; L573-V577 WeakPolarHBondContact O-CB 3.39Å; L573-V577 WeakPolarHBondContact O-CG2 3.44Å; L573-V577 PolarHBondContact O-N 3.41Å; L573-I628 HydrophobicContact CD1-CG2 4.46Å; L573-L630 HydrophobicContact CD1-CD2 4.09Å; L573-L630 HydrophobicContact CD2-CD2 4.42Å; L573-L649 HydrophobicContact CD2-CD1 3.7Å; L573-L649 HydrophobicContact CD2-CD2 3.64Å; L573-L649 HydrophobicContact CD2-CG 4.24Å; L573-Y653 HydrophobicContact CD2-CE2 4.24Å
574	Y	93	Very high	89.8	Confident	35 Å²	35	56 Å²	56	14%	0.137	30%	0.295	C	S	.	.	H	α-helix	trans	-59.8	-40	178.6	-59.5	-22.8	0	0	0	111.6	L570 G578 V579 E580 P581 L649 E652 Y653	L570-Y574 HydrophobicContact CB-CE2 4Å; L570-Y574 HydrophobicContact CD2-CE1 4.46Å; L570-Y574 WeakPolarHBondContact O-CB 3.41Å; L570-Y574 VanDerWaalsContact O-CD2 3.31Å; L570-Y574 WeakPolarHBondContact O-CD2 3.25Å; L570-Y574 PolarHBondContact O-N 2.88Å; Y574-G578 WeakPolarHBondContact O-CA 3.47Å; Y574-G578 PolarHBondContact O-N 2.94Å; Y574-V579 PolarHBondContact O-N 3.45Å; Y574-E580 HydrophobicContact CD2-CG 3.95Å; Y574-E580 HydrophobicContact CE2-CG 4.31Å; Y574-E580 HydrophobicContact CG-CB 4.48Å; Y574-E580 HydrophobicContact CG-CG 4.32Å; Y574-P581 VanDerWaalsContact CE1-CD 3.48Å; Y574-P581 HydrophobicContact CE1-CG 4.05Å; Y574-L649 HydrophobicContact CE1-CD1 4.08Å; Y574-E652 PolarHBondContact OH-OE2 3.27Å; Y574-Y653 HydrophobicContact CD1-CE2 4.37Å; Y574-Y653 VanDerWaalsContact CD1-OH 3.27Å; Y574-Y653 WeakPolarHBondContact CD1-OH 3.35Å; Y574-Y653 HydrophobicContact CE1-CE2 4Å
575	K	91.5	Very high	89.2	Confident	182 Å²	182	56 Å²	56	79%	0.791	29%	0.29	S	S	*	.	H	α-helix	trans	-67.1	-43.1	175.6	-173.7	-177.7	176.1	-170.2	0	112.4	K571 S572 L573	K571-K575 VanDerWaalsContact O-CB 3.27Å; K571-K575 WeakPolarHBondContact O-CB 3.43Å; K571-K575 PolarHBondContact O-N 3.47Å; S572-K575 PolarHBondContact O-N 3.21Å; L573-K575 VanDerWaalsContact C-N 3.27Å; L573-K575 PolarHBondContact O-N 3.2Å
576	A	88.8	Confident	88.6	Confident	38 Å²	38	58 Å²	58	31%	0.314	30%	0.303	S	S	.	.	H	α-helix	trans	-71.2	-37.1	-177.5	0	0	0	0	0	112.6	F555 S572 L573	F555-A576 HydrophobicContact CD2-CB 3.92Å; F555-A576 HydrophobicContact CE2-CB 3.88Å; S572-A576 VanDerWaalsContact O-CB 3.23Å; S572-A576 WeakPolarHBondContact O-CB 3.31Å; S572-A576 PolarHBondContact O-N 3.14Å; L573-A576 PolarHBondContact O-N 2.96Å
577	V	88.5	Confident	88.1	Confident	10 Å²	10	59.8 Å²	59.8	6%	0.061	31%	0.31	C	S	.	.	H	α-helix	trans	-83.7	-25.1	179.2	176.3	0	0	0	0	111.6	L573 V579 F625 I628	L573-V577 HydrophobicContact CD1-CG2 3.7Å; L573-V577 HydrophobicContact CG-CG2 4.41Å; L573-V577 WeakPolarHBondContact O-CB 3.39Å; L573-V577 WeakPolarHBondContact O-CG2 3.44Å; L573-V577 PolarHBondContact O-N 3.41Å; V577-V579 VanDerWaalsContact C-N 3.27Å; V577-V579 HydrophobicContact CG1-CB 4.34Å; V577-V579 PolarHBondContact O-N 3.02Å; V577-F625 HydrophobicContact CG1-CE1 3.71Å; V577-F625 HydrophobicContact CG1-CE2 3.68Å; V577-F625 HydrophobicContact CG1-CZ 3.08Å; V577-I628 HydrophobicContact CG1-CD1 3.95Å; V577-I628 HydrophobicContact CG1-CG1 4.33Å; V577-I628 HydrophobicContact CG2-CD1 4.26Å
578	G	86.4	Confident	87.3	Confident	62 Å²	62	57.4 Å²	57.4	64%	0.639	30%	0.295	S	S	*	.	S	Bend	trans	80.1	4.5	-179.6	0	0	0	0	0	114.4	Y574	Y574-G578 WeakPolarHBondContact O-CA 3.47Å; Y574-G578 PolarHBondContact O-N 2.94Å
579	V	85.4	Confident	86.8	Confident	12 Å²	12	62.9 Å²	62.9	7%	0.073	32%	0.315	C	S	.	.			trans	-124.7	115.2	-179	178.1	0	0	0	0	109.5	Y574 V577 E584 L623 F625 Y653 V656 I658	Y574-V579 PolarHBondContact O-N 3.45Å; V577-V579 VanDerWaalsContact C-N 3.27Å; V577-V579 HydrophobicContact CG1-CB 4.34Å; V577-V579 PolarHBondContact O-N 3.02Å; V579-E584 HydrophobicContact CG1-CG 3.87Å; V579-L623 HydrophobicContact CG2-CD2 4.29Å; V579-F625 HydrophobicContact CB-CZ 4.16Å; V579-F625 HydrophobicContact CG2-CE1 3.66Å; V579-F625 HydrophobicContact CG2-CZ 3.71Å; V579-Y653 HydrophobicContact CB-CE1 4.45Å; V579-Y653 HydrophobicContact CG1-CE1 4.21Å; V579-Y653 PolarHBondContact O-OH 2.87Å; V579-V656 HydrophobicContact CG1-CG1 4.44Å; V579-I658 HydrophobicContact CG1-CD1 4.08Å
580	E	88.6	Confident	86.2	Confident	91 Å²	91	69.2 Å²	69.2	43%	0.425	34%	0.343	S	S	.	.			trans	-97.9	113.6	170.1	-174.8	170.6	-158.4	0	0	109.1	Y574 F582 L583 E584	Y574-E580 HydrophobicContact CD2-CG 3.95Å; Y574-E580 HydrophobicContact CE2-CG 4.31Å; Y574-E580 HydrophobicContact CG-CB 4.48Å; Y574-E580 HydrophobicContact CG-CG 4.32Å; E580-F582 PolarHBondContact O-N 3.25Å; E580-L583 HydrophobicContact CB-CB 4.16Å; E580-L583 HydrophobicContact CG-CB 4.35Å; E580-L583 PolarHBondContact O-N 3.27Å; E580-L583 VanDerWaalsContact O-N 3.12Å; E580-E584 PolarHBondContact O-N 3.35Å; E580-E584 VanDerWaalsContact O-N 3.09Å
581	P	83.9	Confident	85.5	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-56.1	-46	-170.4	-28.5	34.7	0	0	0	114.2	Y574 L583 E584 L585 E652 Y653 V656	Y574-P581 VanDerWaalsContact CE1-CD 3.48Å; Y574-P581 HydrophobicContact CE1-CG 4.05Å; P581-L583 VanDerWaalsContact C-N 3.3Å; P581-L583 PolarHBondContact O-N 3.09Å; P581-E584 PolarHBondContact O-N 3.47Å; P581-L585 WeakPolarHBondContact O-CB 3.42Å; P581-L585 WeakPolarHBondContact O-CG 3.34Å; P581-L585 PolarHBondContact O-N 2.99Å; P581-E652 HydrophobicContact CB-CB 3.95Å; P581-E652 HydrophobicContact CG-CB 4.26Å; P581-Y653 HydrophobicContact CG-CD1 3.88Å; P581-Y653 HydrophobicContact CG-CD2 4.04Å; P581-Y653 HydrophobicContact CG-CE1 3.69Å; P581-Y653 HydrophobicContact CG-CE2 3.87Å; P581-Y653 HydrophobicContact CG-CG 4.05Å; P581-V656 HydrophobicContact CB-CG2 3.86Å
582	F	82.9	Confident	84.8	Confident	152 Å²	152	66.7 Å²	66.7	67%	0.667	34%	0.341	S	S	*	.	H	α-helix	trans	-60.4	-39.6	-179.9	-179.8	-98.2	0	0	0	112.7	E580 T586	E580-F582 PolarHBondContact O-N 3.25Å; F582-T586 WeakPolarHBondContact O-CB 3.42Å; F582-T586 PolarHBondContact O-N 3.28Å; F582-T586 VanDerWaalsContact O-N 3.08Å; F582-T586 PolarHBondContact O-OG1 3.49Å
583	L	82.9	Confident	84.3	Confident	80 Å²	80	72 Å²	72	42%	0.419	36%	0.36	S	S	.	.	H	α-helix	trans	-72.2	-41.2	-178.8	-166.9	66.5	0	0	0	111	E580 P581 T586 K587	E580-L583 HydrophobicContact CB-CB 4.16Å; E580-L583 HydrophobicContact CG-CB 4.35Å; E580-L583 PolarHBondContact O-N 3.27Å; E580-L583 VanDerWaalsContact O-N 3.12Å; P581-L583 VanDerWaalsContact C-N 3.3Å; P581-L583 PolarHBondContact O-N 3.09Å; L583-T586 PolarHBondContact O-N 3.49Å; L583-K587 WeakPolarHBondContact O-CG 3.26Å; L583-K587 PolarHBondContact O-N 3.21Å
584	E	81.9	Confident	83.6	Confident	43 Å²	43	79 Å²	79	20%	0.201	39%	0.391	C	S	.	.	H	α-helix	trans	-65.5	-44	175.8	-76.7	-52.2	134.2	0	0	112.3	V579 E580 P581 T586 K587 K588 V656	V579-E584 HydrophobicContact CG1-CG 3.87Å; E580-E584 PolarHBondContact O-N 3.35Å; E580-E584 VanDerWaalsContact O-N 3.09Å; P581-E584 PolarHBondContact O-N 3.47Å; E584-T586 VanDerWaalsContact C-N 3.25Å; E584-T586 PolarHBondContact O-N 2.98Å; E584-K587 PolarHBondContact O-N 3.44Å; E584-K587 VanDerWaalsContact O-N 3.15Å; E584-K587 IonicContact OE1-NZ 3.7Å; E584-K587 PolarHBondContact OE1-NZ 3.39Å; E584-K588 WeakPolarHBondContact O-CG 3.49Å; E584-K588 PolarHBondContact O-N 3.1Å; E584-V656 HydrophobicContact CB-CG1 4.36Å
585	L	79.8	Confident	82.5	Confident	33 Å²	33	80.3 Å²	80.3	17%	0.173	40%	0.398	C	S	.	.	H	α-helix	trans	-59.1	-39.1	174	-72.6	168.1	0	0	0	111.7	P581 K588 K589 E655 V656	P581-L585 WeakPolarHBondContact O-CB 3.42Å; P581-L585 WeakPolarHBondContact O-CG 3.34Å; P581-L585 PolarHBondContact O-N 2.99Å; L585-K588 PolarHBondContact O-N 3.06Å; L585-K589 WeakPolarHBondContact O-CB 3.3Å; L585-K589 WeakPolarHBondContact O-CG 3.4Å; L585-K589 PolarHBondContact O-N 3.11Å; L585-E655 HydrophobicContact CD1-CB 4.21Å; L585-E655 HydrophobicContact CD2-CB 4.22Å; L585-V656 HydrophobicContact CD1-CG2 4.28Å; L585-V656 HydrophobicContact CD2-CG2 4.25Å; L585-V656 HydrophobicContact CG-CG2 3.88Å
586	T	81.9	Confident	81.6	Confident	43 Å²	43	76.3 Å²	76.3	26%	0.264	38%	0.381	S	S	.	.	H	α-helix	trans	-68.8	-39.1	177	-57.3	0	0	0	0	111.9	F582 L583 E584 K590	F582-T586 WeakPolarHBondContact O-CB 3.42Å; F582-T586 PolarHBondContact O-N 3.28Å; F582-T586 VanDerWaalsContact O-N 3.08Å; F582-T586 PolarHBondContact O-OG1 3.49Å; L583-T586 PolarHBondContact O-N 3.49Å; E584-T586 VanDerWaalsContact C-N 3.25Å; E584-T586 PolarHBondContact O-N 2.98Å; T586-K590 HydrophobicContact CG2-CD 4.34Å; T586-K590 WeakPolarHBondContact O-CB 3.11Å; T586-K590 WeakPolarHBondContact O-CG 3.42Å; T586-K590 PolarHBondContact O-N 3.45Å
587	K	82.1	Confident	81	Confident	106 Å²	106	78.3 Å²	78.3	46%	0.461	39%	0.386	S	S	.	.	H	α-helix	trans	-63.4	-46.4	173.8	-73.5	174.5	-169.5	167.3	0	111	L583 E584 K590 A591	L583-K587 WeakPolarHBondContact O-CG 3.26Å; L583-K587 PolarHBondContact O-N 3.21Å; E584-K587 PolarHBondContact O-N 3.44Å; E584-K587 VanDerWaalsContact O-N 3.15Å; E584-K587 IonicContact OE1-NZ 3.7Å; E584-K587 PolarHBondContact OE1-NZ 3.39Å; K587-K590 PolarHBondContact O-N 2.95Å; K587-A591 WeakPolarHBondContact O-CB 3.37Å; K587-A591 PolarHBondContact O-N 3.42Å
588	K	76.8	Confident	80.1	Confident	61 Å²	61	83.6 Å²	83.6	27%	0.265	41%	0.408	S	S	.	.	H	α-helix	trans	-55.8	-53.1	175.7	-73.9	-173.5	-178.7	-176.8	0	110.8	E584 L585 K590 A591 E592 V656	E584-K588 WeakPolarHBondContact O-CG 3.49Å; E584-K588 PolarHBondContact O-N 3.1Å; L585-K588 PolarHBondContact O-N 3.06Å; K588-K590 VanDerWaalsContact C-N 3.32Å; K588-K590 PolarHBondContact O-N 3.3Å; K588-A591 PolarHBondContact O-N 3.07Å; K588-A591 VanDerWaalsContact O-N 3.12Å; K588-E592 WeakPolarHBondContact O-CG 3.36Å; K588-E592 PolarHBondContact O-N 2.83Å; K588-V656 PolarHBondContact NZ-O 3.03Å
589	K	81.5	Confident	78.9	Confident	143 Å²	143	82.2 Å²	82.2	62%	0.622	39%	0.389	S	S	*	.	H	α-helix	trans	-59.1	-38.4	177.1	-72.4	177.3	-178.2	177.8	0	113.4	L585 K593	L585-K589 WeakPolarHBondContact O-CB 3.3Å; L585-K589 WeakPolarHBondContact O-CG 3.4Å; L585-K589 PolarHBondContact O-N 3.11Å; K589-K593 WeakPolarHBondContact O-CB 3.23Å; K589-K593 PolarHBondContact O-N 3.29Å
590	K	82.4	Confident	78	Confident	137 Å²	137	87.5 Å²	87.5	60%	0.596	41%	0.411	S	S	*	.	H	α-helix	trans	-70.2	-38.3	176.2	-78.1	-179.8	-179.5	178.7	0	112.3	T586 K587 K588 K593 K594	T586-K590 HydrophobicContact CG2-CD 4.34Å; T586-K590 WeakPolarHBondContact O-CB 3.11Å; T586-K590 WeakPolarHBondContact O-CG 3.42Å; T586-K590 PolarHBondContact O-N 3.45Å; K587-K590 PolarHBondContact O-N 2.95Å; K588-K590 VanDerWaalsContact C-N 3.32Å; K588-K590 PolarHBondContact O-N 3.3Å; K590-K593 PolarHBondContact O-N 3.03Å; K590-K594 WeakPolarHBondContact O-CB 3.31Å; K590-K594 WeakPolarHBondContact O-CG 3.46Å; K590-K594 PolarHBondContact O-N 3.14Å
591	A	77.9	Confident	76.8	Confident	50 Å²	50	90.8 Å²	90.8	41%	0.413	42%	0.424	S	S	.	.	H	α-helix	trans	-66.9	-47.5	176.8	0	0	0	0	0	110.8	K587 K588 K593 K594 E595	K587-A591 WeakPolarHBondContact O-CB 3.37Å; K587-A591 PolarHBondContact O-N 3.42Å; K588-A591 PolarHBondContact O-N 3.07Å; K588-A591 VanDerWaalsContact O-N 3.12Å; A591-K593 VanDerWaalsContact C-N 3.29Å; A591-K593 PolarHBondContact O-N 3.44Å; A591-K594 PolarHBondContact O-N 3.4Å; A591-K594 VanDerWaalsContact O-N 3.16Å; A591-E595 PolarHBondContact O-N 3.38Å
592	E	78.1	Confident	75.5	Confident	93 Å²	93	97.4 Å²	97.4	44%	0.435	46%	0.455	S	S	.	.	H	α-helix	trans	-55.8	-43.2	173.4	-73.5	170.5	-162.1	0	0	111.7	K588 K596	K588-E592 WeakPolarHBondContact O-CG 3.36Å; K588-E592 PolarHBondContact O-N 2.83Å; E592-K596 VanDerWaalsContact O-CB 3.32Å; E592-K596 WeakPolarHBondContact O-CB 3.25Å; E592-K596 VanDerWaalsContact O-CG 3.27Å; E592-K596 WeakPolarHBondContact O-CG 3.32Å; E592-K596 PolarHBondContact O-N 3.06Å
593	K	81.4	Confident	74.1	Confident	141 Å²	141	92.6 Å²	92.6	61%	0.613	44%	0.443	S	S	*	.	H	α-helix	trans	-65.4	-44.7	177.1	-169.6	176	-179.2	179	0	112	K589 K590 A591 K596 D597	K589-K593 WeakPolarHBondContact O-CB 3.23Å; K589-K593 PolarHBondContact O-N 3.29Å; K590-K593 PolarHBondContact O-N 3.03Å; A591-K593 VanDerWaalsContact C-N 3.29Å; A591-K593 PolarHBondContact O-N 3.44Å; K593-K596 PolarHBondContact O-N 2.94Å; K593-D597 WeakPolarHBondContact O-CB 3.37Å; K593-D597 VanDerWaalsContact O-CG 3.24Å; K593-D597 PolarHBondContact O-N 3.41Å
594	K	79.6	Confident	72.9	Confident	147 Å²	147	98 Å²	98	64%	0.639	46%	0.463	S	S	*	.	H	α-helix	trans	-63.1	-40.5	178	-79.7	-177.6	177.5	-175	0	112.5	K590 A591 D597 K598	K590-K594 WeakPolarHBondContact O-CB 3.31Å; K590-K594 WeakPolarHBondContact O-CG 3.46Å; K590-K594 PolarHBondContact O-N 3.14Å; A591-K594 PolarHBondContact O-N 3.4Å; A591-K594 VanDerWaalsContact O-N 3.16Å; K594-D597 PolarHBondContact O-N 2.9Å; K594-K598 WeakPolarHBondContact O-CG 3.32Å; K594-K598 PolarHBondContact O-N 3.07Å
595	E	69.8	Low	71.5	Confident	62 Å²	62	101.4 Å²	101.4	29%	0.29	49%	0.487	S	S	.	.	H	α-helix	trans	-72.7	-41.9	177.4	-72.1	-57.2	140.7	0	0	111.2	A591 D597 K598 S599	A591-E595 PolarHBondContact O-N 3.38Å; E595-D597 PolarHBondContact O-N 2.85Å; E595-K598 PolarHBondContact O-N 2.91Å; E595-K598 IonicContact OE1-NZ 3.37Å; E595-K598 PolarHBondContact OE1-NZ 2.89Å; E595-S599 WeakPolarHBondContact O-CB 3.2Å; E595-S599 PolarHBondContact O-N 3.48Å; E595-S599 PolarHBondContact O-OG 3.31Å
596	K	72.9	Confident	70.1	Confident	98 Å²	98	105.8 Å²	105.8	43%	0.426	51%	0.511	S	S	.	.	H	α-helix	trans	-54.7	-37.7	169.6	-77.3	178.1	-179.4	180	0	112.1	E592 K593 K600	E592-K596 VanDerWaalsContact O-CB 3.32Å; E592-K596 WeakPolarHBondContact O-CB 3.25Å; E592-K596 VanDerWaalsContact O-CG 3.27Å; E592-K596 WeakPolarHBondContact O-CG 3.32Å; E592-K596 PolarHBondContact O-N 3.06Å; K593-K596 PolarHBondContact O-N 2.94Å; K596-K600 VanDerWaalsContact O-CB 3.26Å; K596-K600 WeakPolarHBondContact O-CB 3.41Å; K596-K600 WeakPolarHBondContact O-CG 3.15Å; K596-K600 PolarHBondContact O-N 3.44Å
597	D	75.4	Confident	68.7	Low	81 Å²	81	107.5 Å²	107.5	43%	0.433	54%	0.537	S	S	.	.	H	α-helix	trans	-73.5	-35.7	176.6	-70.5	-20.3	0	0	0	112.9	K593 K594 E595 K601	K593-D597 WeakPolarHBondContact O-CB 3.37Å; K593-D597 VanDerWaalsContact O-CG 3.24Å; K593-D597 PolarHBondContact O-N 3.41Å; K594-D597 PolarHBondContact O-N 2.9Å; E595-D597 PolarHBondContact O-N 2.85Å; D597-K601 WeakPolarHBondContact O-CG 3.47Å; D597-K601 PolarHBondContact O-N 3.39Å
598	K	70.8	Confident	67	Low	120 Å²	120	110.7 Å²	110.7	52%	0.522	55%	0.554	S	S	.	*	H	α-helix	trans	-70	-46.2	173.5	-78.4	-177.2	-171.2	166	0	112.3	K594 E595 K600 K601 Q602	K594-K598 WeakPolarHBondContact O-CG 3.32Å; K594-K598 PolarHBondContact O-N 3.07Å; E595-K598 PolarHBondContact O-N 2.91Å; E595-K598 IonicContact OE1-NZ 3.37Å; E595-K598 PolarHBondContact OE1-NZ 2.89Å; K598-K600 VanDerWaalsContact C-N 3.32Å; K598-K600 PolarHBondContact O-N 2.97Å; K598-K601 WeakPolarHBondContact O-CA 3.41Å; K598-K601 WeakPolarHBondContact O-CB 3.01Å; K598-K601 PolarHBondContact O-N 3.25Å; K598-Q602 PolarHBondContact O-N 2.88Å
599	S	61.3	Low	65.6	Low	33 Å²	33	113.8 Å²	113.8	23%	0.231	58%	0.578	C	S	.	*	H	α-helix	trans	-64.7	-35.6	177.5	-52.2	0	0	0	0	111.3	E595 K601 Q602 A603	E595-S599 WeakPolarHBondContact O-CB 3.2Å; E595-S599 PolarHBondContact O-N 3.48Å; E595-S599 PolarHBondContact O-OG 3.31Å; S599-K601 VanDerWaalsContact C-N 3.32Å; S599-K601 PolarHBondContact O-N 2.89Å; S599-Q602 PolarHBondContact O-N 2.98Å; S599-A603 VanDerWaalsContact O-CB 3.27Å; S599-A603 WeakPolarHBondContact O-CB 3.22Å; S599-A603 PolarHBondContact O-N 3.15Å
600	K	66.1	Low	63.8	Low	123 Å²	123	114.2 Å²	114.2	54%	0.535	59%	0.587	S	S	.	*	H	α-helix	trans	-64.5	-32.3	169.8	-81.9	177.7	-179.9	-177.4	0	113.5	K596 K598 K604	K596-K600 VanDerWaalsContact O-CB 3.26Å; K596-K600 WeakPolarHBondContact O-CB 3.41Å; K596-K600 WeakPolarHBondContact O-CG 3.15Å; K596-K600 PolarHBondContact O-N 3.44Å; K598-K600 VanDerWaalsContact C-N 3.32Å; K598-K600 PolarHBondContact O-N 2.97Å; K600-K604 PolarHBondContact O-N 3.16Å
601	K	62.9	Low	62	Low	160 Å²	160	114.4 Å²	114.4	70%	0.696	60%	0.595	S	S	*	*	H	α-helix	trans	-73.4	-41.3	173.3	-75.7	179.7	178.2	-175.8	0	111.5	D597 K598 S599 K604 T605	D597-K601 WeakPolarHBondContact O-CG 3.47Å; D597-K601 PolarHBondContact O-N 3.39Å; K598-K601 WeakPolarHBondContact O-CA 3.41Å; K598-K601 WeakPolarHBondContact O-CB 3.01Å; K598-K601 PolarHBondContact O-N 3.25Å; S599-K601 VanDerWaalsContact C-N 3.32Å; S599-K601 PolarHBondContact O-N 2.89Å; K601-K604 PolarHBondContact O-N 3.04Å; K601-T605 PolarHBondContact O-OG1 3.38Å
602	Q	57.5	Low	60.5	Low	139 Å²	139	117 Å²	117	65%	0.65	60%	0.597	S	S	*	*	H	α-helix	trans	-65.5	-41.6	175.1	-96.3	173.8	-21.6	0	0	112.8	K598 S599 K604 T605 N606	K598-Q602 PolarHBondContact O-N 2.88Å; S599-Q602 PolarHBondContact O-N 2.98Å; Q602-K604 PolarHBondContact O-N 2.94Å; Q602-T605 PolarHBondContact O-N 3.37Å; Q602-N606 PolarHBondContact O-N 3.35Å
603	A	53.6	Low	59	Low	52 Å²	52	119.1 Å²	119.1	43%	0.43	61%	0.611	S	S	.	*	H	α-helix	trans	-65.9	-23.5	176.5	0	0	0	0	0	113.6	S599 T605	S599-A603 VanDerWaalsContact O-CB 3.27Å; S599-A603 WeakPolarHBondContact O-CB 3.22Å; S599-A603 PolarHBondContact O-N 3.15Å; A603-T605 VanDerWaalsContact C-N 3.29Å
604	K	56.5	Low	57.2	Low	193 Å²	193	117.6 Å²	117.6	84%	0.839	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-13.4	169.8	-82.4	-173.7	174.7	-172	0	113.7	K600 K601 Q602	K600-K604 PolarHBondContact O-N 3.16Å; K601-K604 PolarHBondContact O-N 3.04Å; Q602-K604 PolarHBondContact O-N 2.94Å
605	T	52.8	Low	55.3	Low	114 Å²	114	116 Å²	116	70%	0.699	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	-34.3	-175.1	-32	0	0	0	0	112.3	K601 Q602 A603	K601-T605 PolarHBondContact O-OG1 3.38Å; Q602-T605 PolarHBondContact O-N 3.37Å; A603-T605 VanDerWaalsContact C-N 3.29Å
606	N	50.5	Low	54	Low	125 Å²	125	116.7 Å²	116.7	67%	0.668	62%	0.615	S	S	*	*	S	Bend	trans	-121	99	176.2	-71.5	-1.8	0	0	0	109.2	Q602 E608	Q602-N606 PolarHBondContact O-N 3.35Å; N606-E608 PolarHBondContact O-N 2.96Å
607	G	52.4	Low	52.5	Low	79 Å²	79	114.8 Å²	114.8	81%	0.814	62%	0.623	S	S	*	*			trans	-66.3	64.2	-171.4	0	0	0	0	0	116.4
608	E	46.2	Very low	51	Low	173 Å²	173	117.6 Å²	117.6	81%	0.808	64%	0.637	S	S	*	*			trans	-134.9	133.9	170.1	-76.2	-173.3	157.1	0	0	110.5	N606	N606-E608 PolarHBondContact O-N 2.96Å
609	T	47.2	Very low	49.7	Very low	126 Å²	126	116.4 Å²	116.4	77%	0.773	64%	0.64	S	S	*	*			trans	-116	21.5	-160	-19.6	0	0	0	0	114.7
610	N	43.7	Very low	49.2	Very low	152 Å²	152	122.2 Å²	122.2	81%	0.813	66%	0.663	S	S	*	*			trans	-120.3	11.9	-167.2	-75.7	-3.1	0	0	0	117.8
611	N	46.3	Very low	48.5	Very low	142 Å²	142	125.8 Å²	125.8	76%	0.759	68%	0.679	S	S	*	*			trans	-116.9	37.4	175.5	-84.8	-13.4	0	0	0	113.6
612	F	46.4	Very low	48.5	Very low	104 Å²	104	125.1 Å²	125.1	46%	0.456	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-33	-169.9	-154.6	-97.1	0	0	0	114.6
613	D	45.8	Very low	49.1	Very low	138 Å²	138	120.5 Å²	120.5	74%	0.738	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-29.4	-173.2	-68.8	-29.9	0	0	0	113.8	F615	D613-F615 PolarHBondContact O-N 2.92Å
614	V	44.6	Very low	50.3	Low	109 Å²	109	126.2 Å²	126.2	66%	0.661	68%	0.675	S	S	*	*	H	α-helix	trans	-71.5	-31.6	-175.5	-176.1	0	0	0	0	112.3
615	F	37.9	Very low	51.8	Low	114 Å²	114	117.4 Å²	117.4	50%	0.5	64%	0.637	S	S	.	*	H	α-helix	trans	-77.4	-24.7	-177.1	-163.9	-100.2	0	0	0	113.5	D613 G617 L618	D613-F615 PolarHBondContact O-N 2.92Å; F615-G617 VanDerWaalsContact C-N 3.32Å; F615-G617 PolarHBondContact O-N 3.04Å; F615-L618 PolarHBondContact O-N 3.37Å
616	V	43.4	Very low	53.5	Low	76 Å²	76	113.7 Å²	113.7	46%	0.461	61%	0.612	S	S	.	*	H	α-helix	trans	-72.8	-25.6	-178.2	-179.6	0	0	0	0	111.9
617	G	41	Very low	55.5	Low	58 Å²	58	108 Å²	108	60%	0.598	58%	0.582	S	S	*	*	H	α-helix	trans	-72.7	-27.7	176.6	0	0	0	0	0	114.8	F615 V619	F615-G617 VanDerWaalsContact C-N 3.32Å; F615-G617 PolarHBondContact O-N 3.04Å; G617-V619 VanDerWaalsContact C-N 3.34Å; G617-V619 PolarHBondContact O-N 3.4Å
618	L	43.5	Very low	57.5	Low	139 Å²	139	104.3 Å²	104.3	73%	0.728	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	1.3	-168.3	-74.4	167	0	0	0	115.4	F615	F615-L618 PolarHBondContact O-N 3.37Å
619	V	43.9	Very low	59.8	Low	95 Å²	95	96 Å²	96	58%	0.576	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	32.3	-176.5	-161.5	0	0	0	0	111.8	G617 K621	G617-V619 VanDerWaalsContact C-N 3.34Å; G617-V619 PolarHBondContact O-N 3.4Å; V619-K621 PolarHBondContact O-N 3.42Å
620	Q	51	Low	62.1	Low	156 Å²	156	90.3 Å²	90.3	73%	0.729	47%	0.469	S	S	*	.			trans	-79.6	99.2	159.1	-78.3	-172.5	-3.3	0	0	108.2	E622	Q620-E622 PolarHBondContact O-N 3.35Å
621	K	51.7	Low	64.6	Low	198 Å²	198	83.2 Å²	83.2	86%	0.861	43%	0.431	S	S	*	.			trans	-60.1	107.7	167.4	-158.4	180	-173.8	-174.4	0	107	V619 L623	V619-K621 PolarHBondContact O-N 3.42Å; K621-L623 PolarHBondContact O-N 3.07Å
622	E	62.6	Low	66.8	Low	146 Å²	146	76.5 Å²	76.5	68%	0.682	40%	0.396	S	S	*	.			trans	-55.4	126.9	179.1	-86.1	-165.6	-148.4	0	0	109.6	R551 Q620	R551-E622 IonicContact CZ-OE2 3.75Å; R551-E622 IonicContact NH1-OE2 3.5Å; R551-E622 PolarHBondContact NH1-OE2 3.15Å; R551-E622 IonicContact NH2-OE2 3.91Å; R551-E622 PolarHBondContact NH2-OE2 3.32Å; Q620-E622 PolarHBondContact O-N 3.35Å
623	L	71.1	Confident	69	Low	42 Å²	42	74.6 Å²	74.6	22%	0.22	40%	0.395	C	S	.	.			trans	-68.7	146.7	173.2	-70.4	153.7	0	0	0	109.1	R551 V579 K621 F625 V656 I658	R551-L623 PolarHBondContact NH2-O 3.21Å; V579-L623 HydrophobicContact CG2-CD2 4.29Å; K621-L623 PolarHBondContact O-N 3.07Å; L623-F625 PolarHBondContact O-N 3.32Å; L623-V656 HydrophobicContact CD1-CG1 3.68Å; L623-I658 HydrophobicContact CD1-CD1 3.95Å; L623-I658 HydrophobicContact CD1-CG1 3.98Å
624	E	78	Confident	71.2	Confident	171 Å²	171	69.7 Å²	69.7	80%	0.799	37%	0.373	S	S	*	.	S	Bend	trans	-59	-23.1	-177.4	-69.3	-178.8	174.1	0	0	113
625	F	87.3	Confident	73.5	Confident	8 Å²	8	64.7 Å²	64.7	4%	0.035	34%	0.343	C	S	.	.			trans	-139.2	154.8	179.6	66.5	-86	0	0	0	110.4	R551 K553 V577 V579 L623 I628 I658	R551-F625 VanDerWaalsContact O-CA 3.29Å; R551-F625 WeakPolarHBondContact O-CA 3.26Å; R551-F625 WeakPolarHBondContact O-CB 3.4Å; K553-F625 HydrophobicContact CB-CD2 4.49Å; K553-F625 HydrophobicContact CG-CB 4.23Å; K553-F625 HydrophobicContact CG-CD1 4.01Å; K553-F625 HydrophobicContact CG-CD2 4Å; K553-F625 HydrophobicContact CG-CE1 4.45Å; K553-F625 HydrophobicContact CG-CE2 4.44Å; K553-F625 HydrophobicContact CG-CG 3.8Å; V577-F625 HydrophobicContact CG1-CE1 3.71Å; V577-F625 HydrophobicContact CG1-CE2 3.68Å; V577-F625 HydrophobicContact CG1-CZ 3.08Å; V579-F625 HydrophobicContact CB-CZ 4.16Å; V579-F625 HydrophobicContact CG2-CE1 3.66Å; V579-F625 HydrophobicContact CG2-CZ 3.71Å; L623-F625 PolarHBondContact O-N 3.32Å; F625-I628 HydrophobicContact CD2-CG1 4.32Å; F625-I628 HydrophobicContact CE2-CD1 4.07Å; F625-I628 HydrophobicContact CE2-CG1 3.71Å; F625-I658 HydrophobicContact CD2-CG2 4.38Å; F625-I658 HydrophobicContact CE2-CD1 3.58Å; F625-I658 HydrophobicContact CE2-CG1 4.03Å; F625-I658 HydrophobicContact CE2-CG2 3.84Å; F625-I658 HydrophobicContact CZ-CD1 3.62Å
626	H	89.3	Confident	76.1	Confident	36 Å²	36	62.3 Å²	62.3	17%	0.167	34%	0.339	C	S	.	.	S	Bend	trans	-109.6	-24.1	-177.8	62.1	76.2	0	0	0	113.2	R551 I658 S659 A701	R551-H626 VanDerWaalsContact CB-CD2 3.49Å; R551-H626 WeakPolarHBondContact CB-CD2 3.39Å; R551-H626 PolarHBondContact O-CD2 3.3Å; R551-H626 PolarHBondContact O-N 3.49Å; H626-I658 CarbonylContact O-C 3.55Å; H626-I658 WeakPolarHBondContact O-CA 3.43Å; H626-S659 PolarHBondContact O-N 3.37Å; H626-A701 PolarHBondContact CE1-O 3Å; H626-A701 VanDerWaalsContact CE1-O 3.25Å
627	T	92.4	Very high	78.5	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.037	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	140.6	-175.7	-61.3	0	0	0	0	112.5	V552 K553 V629 S659 L661 A701	V552-T627 WeakPolarHBondContact CA-O 3.11Å; K553-T627 PolarHBondContact N-O 3.09Å; T627-V629 HydrophobicContact CG2-CG2 4.32Å; T627-S659 CarbonylContact C-O 3.57Å; T627-S659 VanDerWaalsContact CA-O 3.29Å; T627-S659 WeakPolarHBondContact CA-O 3.3Å; T627-S659 WeakPolarHBondContact CG2-O 3.28Å; T627-L661 HydrophobicContact CG2-CD1 3.79Å; T627-L661 HydrophobicContact CG2-CG 3.8Å; T627-A701 HydrophobicContact CG2-CB 3.74Å
628	I	94.5	Very high	81	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.3	167.5	-60.5	168.4	0	0	0	108.2	K553 L573 V577 F625 L630 Y653 I658 S659 V660 L661	K553-I628 CarbonylContact O-C 3.58Å; K553-I628 VanDerWaalsContact O-CA 3.3Å; K553-I628 WeakPolarHBondContact O-CA 3.32Å; L573-I628 HydrophobicContact CD1-CG2 4.46Å; V577-I628 HydrophobicContact CG1-CD1 3.95Å; V577-I628 HydrophobicContact CG1-CG1 4.33Å; V577-I628 HydrophobicContact CG2-CD1 4.26Å; F625-I628 HydrophobicContact CD2-CG1 4.32Å; F625-I628 HydrophobicContact CE2-CD1 4.07Å; F625-I628 HydrophobicContact CE2-CG1 3.71Å; I628-L630 HydrophobicContact CG2-CD2 4Å; I628-L630 HydrophobicContact CG2-CG 4.41Å; I628-Y653 HydrophobicContact CD1-CD1 3.82Å; I628-Y653 HydrophobicContact CD1-CD2 4.15Å; I628-Y653 HydrophobicContact CD1-CE1 3.59Å; I628-Y653 HydrophobicContact CD1-CE2 3.91Å; I628-Y653 HydrophobicContact CD1-CG 4.1Å; I628-I658 HydrophobicContact CD1-CG2 3.78Å; I628-I658 HydrophobicContact CG1-CG2 3.74Å; I628-S659 PolarHBondContact N-O 3.03Å; I628-V660 HydrophobicContact CB-CG2 4.45Å; I628-V660 CarbonylContact O-C 3.32Å; I628-V660 WeakPolarHBondContact O-CA 3.47Å; I628-L661 PolarHBondContact O-N 3.35Å
629	V	95.1	Very high	83.4	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.1	170.7	-179.7	0	0	0	0	108.4	V552 K553 I554 F555 T627 L661 A663 V694 A697 V698	V552-V629 HydrophobicContact CG1-CG2 3.78Å; K553-V629 PolarHBondContact O-N 2.84Å; I554-V629 CarbonylContact C-O 3.56Å; I554-V629 WeakPolarHBondContact CA-O 3.25Å; I554-V629 HydrophobicContact CG1-CB 4.18Å; I554-V629 HydrophobicContact CG2-CB 4.33Å; I554-V629 HydrophobicContact CG2-CG1 4.43Å; F555-V629 PolarHBondContact N-O 2.82Å; T627-V629 HydrophobicContact CG2-CG2 4.32Å; V629-L661 WeakPolarHBondContact CA-O 3.25Å; V629-L661 HydrophobicContact CG2-CB 4.44Å; V629-A663 HydrophobicContact CG1-CB 3.83Å; V629-V694 HydrophobicContact CG1-CG1 4.42Å; V629-A697 HydrophobicContact CG1-CB 3.81Å; V629-A697 HydrophobicContact CG2-CB 4.09Å; V629-V698 HydrophobicContact CG2-CG2 4.37Å
630	L	95.3	Very high	85.7	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	108.4	174.5	-61.9	177.7	0	0	0	109.5	F555 L573 I628 C632 F646 L649 V660 L661 L662 A663	F555-L630 HydrophobicContact CB-CD2 4.2Å; F555-L630 HydrophobicContact CD1-CD2 3.91Å; L573-L630 HydrophobicContact CD1-CD2 4.09Å; L573-L630 HydrophobicContact CD2-CD2 4.42Å; I628-L630 HydrophobicContact CG2-CD2 4Å; I628-L630 HydrophobicContact CG2-CG 4.41Å; L630-C632 PolarHBondContact O-N 2.95Å; L630-F646 HydrophobicContact CD1-CE1 4.47Å; L630-L649 HydrophobicContact CD1-CD2 3.87Å; L630-V660 HydrophobicContact CD1-CG1 3.63Å; L630-V660 HydrophobicContact CG-CG1 3.93Å; L630-L661 PolarHBondContact N-O 2.82Å; L630-L662 HydrophobicContact CB-CD2 4.01Å; L630-L662 HydrophobicContact CD1-CD2 3.94Å; L630-A663 PolarHBondContact O-N 3.35Å
631	D	95.2	Very high	87.7	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	105.8	171.9	-178.8	3.3	0	0	0	109.7	L528 F555 R556 S633 V694	L528-D631 HydrophobicContact CD1-CB 4.31Å; F555-D631 PolarHBondContact O-N 3.34Å; R556-D631 HydrophobicContact CB-CB 4.06Å; R556-D631 HydrophobicContact CG-CB 4.38Å; R556-D631 IonicContact CZ-OD2 2.61Å; R556-D631 VanDerWaalsContact CZ-OD2 3.27Å; R556-D631 IonicContact NE-OD2 2.96Å; R556-D631 PolarHBondContact NE-OD2 3.47Å; R556-D631 IonicContact NH2-OD2 2.65Å; R556-D631 PolarHBondContact NH2-OD2 3.09Å; D631-S633 VanDerWaalsContact CG-OG 3.27Å; D631-S633 WeakPolarHBondContact OD1-CB 3.41Å; D631-S633 PolarHBondContact OD1-N 3.3Å; D631-S633 PolarHBondContact OD1-OG 3.23Å; D631-S633 PolarHBondContact OD2-OG 3.37Å; D631-V694 HydrophobicContact CB-CG2 4.2Å
632	C	93.6	Very high	89.7	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.007	23%	0.228	C	C	.	.			trans	-94.7	10.6	-177.6	-61.7	0	0	0	0	113.1	L630 A634 I635 A663 C664 C665	L630-C632 PolarHBondContact O-N 2.95Å; C632-A634 PolarHBondContact O-N 3.38Å; C632-I635 HydrophobicContact CB-CD1 4.12Å; C632-I635 HydrophobicContact CB-CG1 4.47Å; C632-I635 PolarHBondContact O-N 3.02Å; C632-I635 VanDerWaalsContact O-N 3.07Å; C632-A663 WeakPolarHBondContact CB-O 3.18Å; C632-A663 PolarHBondContact N-O 3.02Å; C632-C664 CarbonylContact C-O 3.57Å; C632-C665 HydrophobicContact CB-CB 4.39Å; C632-C665 WeakPolarHBondContact CB-SG 3.46Å
633	S	92.1	Very high	91.1	Very high	64 Å²	64	36.6 Å²	36.6	45%	0.448	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.2	179.9	54.1	0	0	0	0	113.3	D631 C664	D631-S633 VanDerWaalsContact CG-OG 3.27Å; D631-S633 WeakPolarHBondContact OD1-CB 3.41Å; D631-S633 PolarHBondContact OD1-N 3.3Å; D631-S633 PolarHBondContact OD1-OG 3.23Å; D631-S633 PolarHBondContact OD2-OG 3.37Å; S633-C664 WeakPolarHBondContact CA-O 3.46Å; S633-C664 PolarHBondContact N-O 3.16Å
634	A	91.8	Very high	92.1	Very high	34 Å²	34	37.1 Å²	37.1	28%	0.281	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	8.1	-178.6	0	0	0	0	0	114.1	Q558 C632 P636	Q558-A634 HydrophobicContact CB-CB 4.3Å; Q558-A634 HydrophobicContact CG-CB 4.34Å; C632-A634 PolarHBondContact O-N 3.38Å; A634-P636 WeakPolarHBondContact O-CD 3.27Å
635	I	93.5	Very high	92.8	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	18%	0.181	C	C	.	.			trans	-99.3	99.2	177.5	-54.7	-178.1	0	0	0	109	L561 C632 F637 I638 F646 V669	L561-I635 HydrophobicContact CB-CG2 4.45Å; C632-I635 HydrophobicContact CB-CD1 4.12Å; C632-I635 HydrophobicContact CB-CG1 4.47Å; C632-I635 PolarHBondContact O-N 3.02Å; C632-I635 VanDerWaalsContact O-N 3.07Å; I635-F637 WeakPolarHBondContact CG2-O 3.28Å; I635-I638 HydrophobicContact CG2-CD1 4.07Å; I635-I638 HydrophobicContact CG2-CG1 3.62Å; I635-F646 HydrophobicContact CD1-CZ 4.1Å; I635-V669 HydrophobicContact CG2-CG2 4.26Å; I635-V669 VanDerWaalsContact O-CG2 3.32Å; I635-V669 WeakPolarHBondContact O-CG2 3.16Å
636	P	91.9	Very high	92.9	Very high	65 Å²	65	29.5 Å²	29.5	42%	0.422	18%	0.18	S	C	.	.			trans	-72.3	-31.4	-176.7	26.9	-35.2	0	0	0	113.4	P560 A634 S668	P560-P636 HydrophobicContact CB-CG 3.96Å; P560-P636 HydrophobicContact CG-CG 4.39Å; A634-P636 WeakPolarHBondContact O-CD 3.27Å; P636-S668 PolarHBondContact O-OG 2.66Å
637	F	93.8	Very high	93	Very high	105 Å²	105	31.4 Å²	31.4	46%	0.461	19%	0.188	S	C	.	.			trans	-154.5	160.6	177.1	70.5	-93.5	0	0	0	111.3	P560 L561 I635	P560-F637 HydrophobicContact CB-CD1 3.77Å; P560-F637 HydrophobicContact CB-CD2 4.29Å; P560-F637 HydrophobicContact CB-CE1 3.41Å; P560-F637 VanDerWaalsContact CB-CE1 3.41Å; P560-F637 HydrophobicContact CB-CE2 3.96Å; P560-F637 HydrophobicContact CB-CG 4.2Å; P560-F637 HydrophobicContact CB-CZ 3.51Å; P560-F637 HydrophobicContact CG-CE1 3.9Å; P560-F637 HydrophobicContact CG-CZ 4.02Å; L561-F637 PolarHBondContact N-O 3.24Å; I635-F637 WeakPolarHBondContact CG2-O 3.28Å
638	I	93.7	Very high	92.9	Very high	16 Å²	16	33 Å²	33	8%	0.082	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-130.4	135.6	173.8	-60.3	-170.8	0	0	0	108.9	L561 I635 M643 F646 V669	L561-I638 HydrophobicContact CB-CG1 4.23Å; L561-I638 WeakPolarHBondContact O-CA 3.35Å; I635-I638 HydrophobicContact CG2-CD1 4.07Å; I635-I638 HydrophobicContact CG2-CG1 3.62Å; I638-M643 HydrophobicContact CG2-CB 4.14Å; I638-M643 VanDerWaalsContact CG2-N 3.31Å; I638-F646 HydrophobicContact CD1-CD2 3.99Å; I638-F646 HydrophobicContact CD1-CE2 3.53Å; I638-F646 HydrophobicContact CD1-CZ 4.03Å; I638-V669 HydrophobicContact CD1-CG1 3.53Å; I638-V669 HydrophobicContact CG1-CG1 3.93Å; I638-V669 HydrophobicContact CG1-CG2 4.21Å
639	D	93.8	Very high	92.8	Very high	39 Å²	39	33 Å²	33	21%	0.209	20%	0.202	C	C	.	.			trans	-90.4	178.4	173.3	80.7	-3	0	0	0	112.3	L561 Y562 F563 T641 G642 M643	L561-D639 PolarHBondContact O-N 3.02Å; Y562-D639 VanDerWaalsContact CA-CG 3.48Å; Y562-D639 WeakPolarHBondContact CA-OD1 3.2Å; Y562-D639 WeakPolarHBondContact CA-OD2 3.49Å; Y562-D639 WeakPolarHBondContact CB-OD2 3.42Å; F563-D639 PolarHBondContact N-OD2 2.91Å; D639-T641 PolarHBondContact O-N 2.63Å; D639-T641 WeakPolarHBondContact OD1-CA 3.47Å; D639-T641 WeakPolarHBondContact OD1-CB 3.27Å; D639-T641 PolarHBondContact OD1-N 3.24Å; D639-G642 PolarHBondContact O-N 3.34Å; D639-G642 PolarHBondContact OD1-N 3.31Å; D639-M643 WeakPolarHBondContact O-CB 3.45Å; D639-M643 PolarHBondContact O-N 2.99Å
640	S	92.5	Very high	92.6	Very high	87 Å²	87	34.1 Å²	34.1	61%	0.608	21%	0.209	S	C	*	.	H	α-helix	trans	-59.2	-31.7	178.4	55	0	0	0	0	113.3	A644	S640-A644 WeakPolarHBondContact O-CB 3.48Å; S640-A644 PolarHBondContact O-N 3.18Å; S640-A644 VanDerWaalsContact O-N 3.09Å
641	T	93.1	Very high	92.4	Very high	41 Å²	41	40 Å²	40	25%	0.252	23%	0.234	S	C	.	.	H	α-helix	trans	-76.5	-45.8	-178.9	-48.8	0	0	0	0	111	F563 K566 D639 M643 A644 T645	F563-T641 HydrophobicContact CB-CG2 4.18Å; K566-T641 HydrophobicContact CD-CG2 3.49Å; K566-T641 VanDerWaalsContact CD-CG2 3.49Å; D639-T641 PolarHBondContact O-N 2.63Å; D639-T641 WeakPolarHBondContact OD1-CA 3.47Å; D639-T641 WeakPolarHBondContact OD1-CB 3.27Å; D639-T641 PolarHBondContact OD1-N 3.24Å; T641-M643 VanDerWaalsContact C-N 3.28Å; T641-M643 PolarHBondContact O-N 3.26Å; T641-A644 PolarHBondContact O-N 3.43Å; T641-T645 PolarHBondContact O-N 2.91Å; T641-T645 PolarHBondContact O-OG1 2.88Å; T641-T645 VanDerWaalsContact O-OG1 3.04Å
642	G	92.5	Very high	92.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-37.7	175.2	0	0	0	0	0	111.8	D639 T645 F646	D639-G642 PolarHBondContact O-N 3.34Å; D639-G642 PolarHBondContact OD1-N 3.31Å; G642-T645 WeakPolarHBondContact O-CB 3.12Å; G642-T645 PolarHBondContact O-N 2.93Å; G642-F646 PolarHBondContact O-N 3.49Å
643	M	91.8	Very high	92	Very high	40 Å²	40	43.2 Å²	43.2	20%	0.197	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-46.4	172.8	178.2	-165.6	73.1	0	0	112.2	I638 D639 T641 T645 F646 K647 L673 G676	I638-M643 HydrophobicContact CG2-CB 4.14Å; I638-M643 VanDerWaalsContact CG2-N 3.31Å; D639-M643 WeakPolarHBondContact O-CB 3.45Å; D639-M643 PolarHBondContact O-N 2.99Å; T641-M643 VanDerWaalsContact C-N 3.28Å; T641-M643 PolarHBondContact O-N 3.26Å; M643-T645 VanDerWaalsContact C-N 3.25Å; M643-T645 PolarHBondContact O-N 3.29Å; M643-F646 PolarHBondContact O-N 3.02Å; M643-K647 PolarHBondContact O-N 3.26Å; M643-L673 HydrophobicContact CG-CD2 4.43Å; M643-G676 WeakPolarHBondContact SD-CA 3.3Å
644	A	92.2	Very high	91.8	Very high	53 Å²	53	46.7 Å²	46.7	44%	0.438	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-38.2	174.5	0	0	0	0	0	111.4	S640 T641 K647 A648	S640-A644 WeakPolarHBondContact O-CB 3.48Å; S640-A644 PolarHBondContact O-N 3.18Å; S640-A644 VanDerWaalsContact O-N 3.09Å; T641-A644 PolarHBondContact O-N 3.43Å; A644-K647 PolarHBondContact O-N 2.96Å; A644-A648 WeakPolarHBondContact O-CB 3.14Å; A644-A648 PolarHBondContact O-N 3.35Å
645	T	92.8	Very high	91.5	Very high	15 Å²	15	50.2 Å²	50.2	9%	0.092	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-43.7	173.5	-61.3	0	0	0	0	111.9	F569 L570 T641 G642 M643 A648 L649	F569-T645 HydrophobicContact CD1-CG2 4.36Å; L570-T645 HydrophobicContact CD1-CG2 3.93Å; L570-T645 HydrophobicContact CD2-CG2 3.75Å; L570-T645 HydrophobicContact CG-CG2 3.84Å; T641-T645 PolarHBondContact O-N 2.91Å; T641-T645 PolarHBondContact O-OG1 2.88Å; T641-T645 VanDerWaalsContact O-OG1 3.04Å; G642-T645 WeakPolarHBondContact O-CB 3.12Å; G642-T645 PolarHBondContact O-N 2.93Å; M643-T645 VanDerWaalsContact C-N 3.25Å; M643-T645 PolarHBondContact O-N 3.29Å; T645-A648 PolarHBondContact O-N 3.28Å; T645-L649 VanDerWaalsContact O-CB 3.22Å; T645-L649 WeakPolarHBondContact O-CB 3.48Å; T645-L649 PolarHBondContact O-N 2.9Å
646	F	91	Very high	91.1	Very high	3 Å²	3	50.1 Å²	50.1	1%	0.013	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-44.5	174.4	-90.2	14.9	0	0	0	112.6	L561 F569 L630 I635 I638 G642 M643 A648 L649 V650 L662 L673 F678	L561-F646 HydrophobicContact CD2-CD1 3.52Å; L561-F646 HydrophobicContact CD2-CE1 3.22Å; L561-F646 HydrophobicContact CD2-CG 4.37Å; L561-F646 HydrophobicContact CD2-CZ 3.85Å; F569-F646 HydrophobicContact CE1-CD1 4.23Å; F569-F646 AromaticContact CE1-CE1 3.9Å; F569-F646 HydrophobicContact CE1-CE1 3.9Å; F569-F646 HydrophobicContact CE2-CE1 4.23Å; F569-F646 HydrophobicContact CZ-CD1 4.31Å; F569-F646 AromaticContact CZ-CE1 3.59Å; F569-F646 HydrophobicContact CZ-CE1 3.59Å; L630-F646 HydrophobicContact CD1-CE1 4.47Å; I635-F646 HydrophobicContact CD1-CZ 4.1Å; I638-F646 HydrophobicContact CD1-CD2 3.99Å; I638-F646 HydrophobicContact CD1-CE2 3.53Å; I638-F646 HydrophobicContact CD1-CZ 4.03Å; G642-F646 PolarHBondContact O-N 3.49Å; M643-F646 PolarHBondContact O-N 3.02Å; F646-A648 PolarHBondContact O-N 3.48Å; F646-L649 WeakPolarHBondContact O-CB 3.23Å; F646-L649 PolarHBondContact O-N 3.13Å; F646-V650 WeakPolarHBondContact O-CG2 3.38Å; F646-V650 PolarHBondContact O-N 2.97Å; F646-L662 HydrophobicContact CD2-CD2 4.44Å; F646-L662 HydrophobicContact CE2-CD2 4.13Å; F646-L673 HydrophobicContact CD2-CD2 4.13Å; F646-F678 HydrophobicContact CB-CD2 4.39Å; F646-F678 HydrophobicContact CB-CE2 3.93Å
647	K	90.4	Very high	90.8	Very high	76 Å²	76	49.9 Å²	49.9	33%	0.33	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-46.7	176.3	-73.5	-170.1	178.1	-154.7	0	112.2	M643 A644 L649 K651 G676 E677 F678	M643-K647 PolarHBondContact O-N 3.26Å; A644-K647 PolarHBondContact O-N 2.96Å; K647-L649 VanDerWaalsContact C-N 3.31Å; K647-K651 PolarHBondContact O-N 3.08Å; K647-G676 WeakPolarHBondContact CE-O 3.18Å; K647-G676 PolarHBondContact NZ-O 3.41Å; K647-E677 WeakPolarHBondContact CE-O 3.35Å; K647-E677 PolarHBondContact NZ-O 2.86Å; K647-F678 HydrophobicContact CG-CD2 3.69Å; K647-F678 HydrophobicContact CG-CE2 4.4Å
648	A	91.4	Very high	90.6	Very high	40 Å²	40	44.9 Å²	44.9	33%	0.331	26%	0.256	S	S	.	.	H	α-helix	trans	-61.1	-44.2	177.3	0	0	0	0	0	110.8	A644 T645 F646 V650 K651 E652	A644-A648 WeakPolarHBondContact O-CB 3.14Å; A644-A648 PolarHBondContact O-N 3.35Å; T645-A648 PolarHBondContact O-N 3.28Å; F646-A648 PolarHBondContact O-N 3.48Å; A648-V650 PolarHBondContact O-N 3.39Å; A648-K651 PolarHBondContact O-N 3.49Å; A648-E652 WeakPolarHBondContact O-CB 3.49Å; A648-E652 VanDerWaalsContact O-CG 3.25Å; A648-E652 WeakPolarHBondContact O-CG 3.18Å; A648-E652 PolarHBondContact O-N 2.84Å
649	L	92.4	Very high	90.4	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-58.4	-49.3	179.7	-174.6	72.3	0	0	0	112.9	F569 L570 L573 Y574 L630 T645 F646 K647 K651 E652 Y653	F569-L649 HydrophobicContact CE1-CD2 3.99Å; F569-L649 HydrophobicContact CZ-CD2 4.1Å; L570-L649 HydrophobicContact CD2-CD1 3.76Å; L573-L649 HydrophobicContact CD2-CD1 3.7Å; L573-L649 HydrophobicContact CD2-CD2 3.64Å; L573-L649 HydrophobicContact CD2-CG 4.24Å; Y574-L649 HydrophobicContact CE1-CD1 4.08Å; L630-L649 HydrophobicContact CD1-CD2 3.87Å; T645-L649 VanDerWaalsContact O-CB 3.22Å; T645-L649 WeakPolarHBondContact O-CB 3.48Å; T645-L649 PolarHBondContact O-N 2.9Å; F646-L649 WeakPolarHBondContact O-CB 3.23Å; F646-L649 PolarHBondContact O-N 3.13Å; K647-L649 VanDerWaalsContact C-N 3.31Å; L649-K651 VanDerWaalsContact C-N 3.33Å; L649-K651 PolarHBondContact O-N 2.87Å; L649-E652 PolarHBondContact O-N 2.75Å; L649-Y653 HydrophobicContact CD1-CD2 3.67Å; L649-Y653 HydrophobicContact CD1-CE2 3.5Å; L649-Y653 VanDerWaalsContact CD1-CE2 3.5Å; L649-Y653 HydrophobicContact CG-CD2 3.95Å; L649-Y653 HydrophobicContact CG-CE2 4.19Å; L649-Y653 WeakPolarHBondContact O-CD2 3.44Å; L649-Y653 PolarHBondContact O-N 3.46Å
650	V	90.7	Very high	90.4	Very high	23 Å²	23	45.2 Å²	45.2	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-48.4	179.1	174.2	0	0	0	0	109.8	F646 A648 E652 Y653 E654 V660 F678	F646-V650 WeakPolarHBondContact O-CG2 3.38Å; F646-V650 PolarHBondContact O-N 2.97Å; A648-V650 PolarHBondContact O-N 3.39Å; V650-E652 PolarHBondContact O-N 3.46Å; V650-Y653 PolarHBondContact O-N 3.49Å; V650-E654 VanDerWaalsContact O-CB 3.24Å; V650-E654 WeakPolarHBondContact O-CB 3.29Å; V650-E654 PolarHBondContact O-N 3.03Å; V650-V660 HydrophobicContact CG2-CB 4.15Å; V650-V660 HydrophobicContact CG2-CG1 4.27Å; V650-F678 HydrophobicContact CG2-CE2 3.84Å; V650-F678 HydrophobicContact CG2-CZ 3.63Å
651	K	89.6	Confident	90.4	Very high	129 Å²	129	41.5 Å²	41.5	56%	0.561	24%	0.235	S	C	*	.	H	α-helix	trans	-61.7	-45.2	179.8	-174.2	-178.8	176.3	-176.4	0	112.4	K647 A648 L649 E654 E655	K647-K651 PolarHBondContact O-N 3.08Å; A648-K651 PolarHBondContact O-N 3.49Å; L649-K651 VanDerWaalsContact C-N 3.33Å; L649-K651 PolarHBondContact O-N 2.87Å; K651-E654 PolarHBondContact O-N 3.5Å; K651-E655 WeakPolarHBondContact CE-OE1 3.49Å; K651-E655 WeakPolarHBondContact O-CG 3.34Å; K651-E655 PolarHBondContact O-N 2.66Å
652	E	90.6	Very high	90.4	Very high	72 Å²	72	39.7 Å²	39.7	34%	0.336	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-41.4	-179.3	-76.5	171.8	-166.4	0	0	112.3	Y574 P581 A648 L649 V650 V656	Y574-E652 PolarHBondContact OH-OE2 3.27Å; P581-E652 HydrophobicContact CB-CB 3.95Å; P581-E652 HydrophobicContact CG-CB 4.26Å; A648-E652 WeakPolarHBondContact O-CB 3.49Å; A648-E652 VanDerWaalsContact O-CG 3.25Å; A648-E652 WeakPolarHBondContact O-CG 3.18Å; A648-E652 PolarHBondContact O-N 2.84Å; L649-E652 PolarHBondContact O-N 2.75Å; V650-E652 PolarHBondContact O-N 3.46Å; E652-V656 WeakPolarHBondContact O-CG2 3.34Å; E652-V656 PolarHBondContact O-N 3.3Å
653	Y	90.2	Very high	90.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-73.2	-34.6	176.4	-87.6	-67.8	0	0	0	112.6	L573 Y574 V579 P581 I628 L649 V650 E655 V656 G657 I658 V660	L573-Y653 HydrophobicContact CD2-CE2 4.24Å; Y574-Y653 HydrophobicContact CD1-CE2 4.37Å; Y574-Y653 VanDerWaalsContact CD1-OH 3.27Å; Y574-Y653 WeakPolarHBondContact CD1-OH 3.35Å; Y574-Y653 HydrophobicContact CE1-CE2 4Å; V579-Y653 HydrophobicContact CB-CE1 4.45Å; V579-Y653 HydrophobicContact CG1-CE1 4.21Å; V579-Y653 PolarHBondContact O-OH 2.87Å; P581-Y653 HydrophobicContact CG-CD1 3.88Å; P581-Y653 HydrophobicContact CG-CD2 4.04Å; P581-Y653 HydrophobicContact CG-CE1 3.69Å; P581-Y653 HydrophobicContact CG-CE2 3.87Å; P581-Y653 HydrophobicContact CG-CG 4.05Å; I628-Y653 HydrophobicContact CD1-CD1 3.82Å; I628-Y653 HydrophobicContact CD1-CD2 4.15Å; I628-Y653 HydrophobicContact CD1-CE1 3.59Å; I628-Y653 HydrophobicContact CD1-CE2 3.91Å; I628-Y653 HydrophobicContact CD1-CG 4.1Å; L649-Y653 HydrophobicContact CD1-CD2 3.67Å; L649-Y653 HydrophobicContact CD1-CE2 3.5Å; L649-Y653 VanDerWaalsContact CD1-CE2 3.5Å; L649-Y653 HydrophobicContact CG-CD2 3.95Å; L649-Y653 HydrophobicContact CG-CE2 4.19Å; L649-Y653 WeakPolarHBondContact O-CD2 3.44Å; L649-Y653 PolarHBondContact O-N 3.46Å; V650-Y653 PolarHBondContact O-N 3.49Å; Y653-E655 VanDerWaalsContact C-N 3.34Å; Y653-E655 PolarHBondContact O-N 3.46Å; Y653-V656 WeakPolarHBondContact O-CA 3.33Å; Y653-V656 WeakPolarHBondContact O-CB 3.32Å; Y653-V656 PolarHBondContact O-N 3.47Å; Y653-G657 PolarHBondContact O-N 2.96Å; Y653-G657 VanDerWaalsContact O-N 3.16Å; Y653-I658 CarbonylContact C-O 3.5Å; Y653-I658 HydrophobicContact CD1-CB 3.99Å; Y653-I658 HydrophobicContact CD1-CD1 3.82Å; Y653-I658 HydrophobicContact CD1-CG2 4.06Å; Y653-I658 HydrophobicContact CE1-CD1 4.09Å; Y653-I658 PolarHBondContact O-N 3.12Å; Y653-I658 VanDerWaalsContact O-O 3.07Å; Y653-V660 HydrophobicContact CD2-CG2 4.04Å; Y653-V660 HydrophobicContact CG-CG2 4.06Å
654	E	87.8	Confident	90.5	Very high	136 Å²	136	39.7 Å²	39.7	64%	0.636	23%	0.228	S	C	*	.	H	α-helix	trans	-61.3	-42	174.5	-172.9	175.7	-162.4	0	0	111.4	V650 K651 V656 G657 I658	V650-E654 VanDerWaalsContact O-CB 3.24Å; V650-E654 WeakPolarHBondContact O-CB 3.29Å; V650-E654 PolarHBondContact O-N 3.03Å; K651-E654 PolarHBondContact O-N 3.5Å; E654-V656 PolarHBondContact O-N 2.9Å; E654-G657 PolarHBondContact O-N 3.27Å; E654-I658 PolarHBondContact N-O 3.09Å
655	E	86.4	Confident	90.5	Very high	109 Å²	109	38 Å²	38	51%	0.509	21%	0.212	S	C	.	.	H	α-helix	trans	-60.6	-26.3	173.4	-73.6	178.7	-164.7	0	0	113.1	L585 K651 Y653	L585-E655 HydrophobicContact CD1-CB 4.21Å; L585-E655 HydrophobicContact CD2-CB 4.22Å; K651-E655 WeakPolarHBondContact CE-OE1 3.49Å; K651-E655 WeakPolarHBondContact O-CG 3.34Å; K651-E655 PolarHBondContact O-N 2.66Å; Y653-E655 VanDerWaalsContact C-N 3.34Å; Y653-E655 PolarHBondContact O-N 3.46Å
656	V	85.2	Confident	90.3	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	23%	0.227	C	C	.	.	H	α-helix	trans	-84.1	-16.8	176.7	177.3	0	0	0	0	112	V579 P581 E584 L585 K588 L623 E652 Y653 E654 I658	V579-V656 HydrophobicContact CG1-CG1 4.44Å; P581-V656 HydrophobicContact CB-CG2 3.86Å; E584-V656 HydrophobicContact CB-CG1 4.36Å; L585-V656 HydrophobicContact CD1-CG2 4.28Å; L585-V656 HydrophobicContact CD2-CG2 4.25Å; L585-V656 HydrophobicContact CG-CG2 3.88Å; K588-V656 PolarHBondContact NZ-O 3.03Å; L623-V656 HydrophobicContact CD1-CG1 3.68Å; E652-V656 WeakPolarHBondContact O-CG2 3.34Å; E652-V656 PolarHBondContact O-N 3.3Å; Y653-V656 WeakPolarHBondContact O-CA 3.33Å; Y653-V656 WeakPolarHBondContact O-CB 3.32Å; Y653-V656 PolarHBondContact O-N 3.47Å; E654-V656 PolarHBondContact O-N 2.9Å; V656-I658 HydrophobicContact CG1-CD1 4.07Å
657	G	84.1	Confident	90.2	Very high	59 Å²	59	44.5 Å²	44.5	61%	0.608	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	96	17.1	-175.5	0	0	0	0	0	113.9	Y653 E654	Y653-G657 PolarHBondContact O-N 2.96Å; Y653-G657 VanDerWaalsContact O-N 3.16Å; E654-G657 PolarHBondContact O-N 3.27Å
658	I	90.1	Very high	90.1	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	25%	0.249	C	C	.	.			trans	-108.9	127.2	178.6	-65.6	163.5	0	0	0	109.3	V579 L623 F625 H626 I628 Y653 E654 V656	V579-I658 HydrophobicContact CG1-CD1 4.08Å; L623-I658 HydrophobicContact CD1-CD1 3.95Å; L623-I658 HydrophobicContact CD1-CG1 3.98Å; F625-I658 HydrophobicContact CD2-CG2 4.38Å; F625-I658 HydrophobicContact CE2-CD1 3.58Å; F625-I658 HydrophobicContact CE2-CG1 4.03Å; F625-I658 HydrophobicContact CE2-CG2 3.84Å; F625-I658 HydrophobicContact CZ-CD1 3.62Å; H626-I658 CarbonylContact O-C 3.55Å; H626-I658 WeakPolarHBondContact O-CA 3.43Å; I628-I658 HydrophobicContact CD1-CG2 3.78Å; I628-I658 HydrophobicContact CG1-CG2 3.74Å; Y653-I658 CarbonylContact C-O 3.5Å; Y653-I658 HydrophobicContact CD1-CB 3.99Å; Y653-I658 HydrophobicContact CD1-CD1 3.82Å; Y653-I658 HydrophobicContact CD1-CG2 4.06Å; Y653-I658 HydrophobicContact CE1-CD1 4.09Å; Y653-I658 PolarHBondContact O-N 3.12Å; Y653-I658 VanDerWaalsContact O-O 3.07Å; E654-I658 PolarHBondContact N-O 3.09Å; V656-I658 HydrophobicContact CG1-CD1 4.07Å
659	S	90.2	Very high	90	Very high	56 Å²	56	41.2 Å²	41.2	39%	0.392	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	141.8	174.7	-60.8	0	0	0	0	111.3	H626 T627 I628	H626-S659 PolarHBondContact O-N 3.37Å; T627-S659 CarbonylContact C-O 3.57Å; T627-S659 VanDerWaalsContact CA-O 3.29Å; T627-S659 WeakPolarHBondContact CA-O 3.3Å; T627-S659 WeakPolarHBondContact CG2-O 3.28Å; I628-S659 PolarHBondContact N-O 3.03Å
660	V	93.1	Very high	89.9	Confident	6 Å²	6	42 Å²	42	4%	0.036	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	119.9	176.9	-177.9	0	0	0	0	109.6	I628 L630 V650 Y653	I628-V660 HydrophobicContact CB-CG2 4.45Å; I628-V660 CarbonylContact O-C 3.32Å; I628-V660 WeakPolarHBondContact O-CA 3.47Å; L630-V660 HydrophobicContact CD1-CG1 3.63Å; L630-V660 HydrophobicContact CG-CG1 3.93Å; V650-V660 HydrophobicContact CG2-CB 4.15Å; V650-V660 HydrophobicContact CG2-CG1 4.27Å; Y653-V660 HydrophobicContact CD2-CG2 4.04Å; Y653-V660 HydrophobicContact CG-CG2 4.06Å
661	L	93.7	Very high	89.7	Confident	9 Å²	9	43.3 Å²	43.3	5%	0.047	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	146.2	179.8	-53.9	-178.4	0	0	0	110.6	T627 I628 V629 L630 S688 L689 F691 A697 A701	T627-L661 HydrophobicContact CG2-CD1 3.79Å; T627-L661 HydrophobicContact CG2-CG 3.8Å; I628-L661 PolarHBondContact O-N 3.35Å; V629-L661 WeakPolarHBondContact CA-O 3.25Å; V629-L661 HydrophobicContact CG2-CB 4.44Å; L630-L661 PolarHBondContact N-O 2.82Å; L661-S688 WeakPolarHBondContact CD2-O 3.45Å; L661-L689 HydrophobicContact CD2-CD2 4.47Å; L661-F691 HydrophobicContact CB-CD2 4.32Å; L661-F691 HydrophobicContact CB-CE2 4.2Å; L661-F691 HydrophobicContact CD1-CE2 3.89Å; L661-F691 HydrophobicContact CD2-CE2 4.1Å; L661-F691 HydrophobicContact CG-CE2 4.28Å; L661-A697 HydrophobicContact CD1-CB 4.42Å; L661-A701 HydrophobicContact CD1-CB 4.03Å
662	L	93.4	Very high	89.7	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	131	175.7	-58.7	-179.8	0	0	0	110.2	L630 F646 L673 F678 F679 L689 L690 F691	L630-L662 HydrophobicContact CB-CD2 4.01Å; L630-L662 HydrophobicContact CD1-CD2 3.94Å; F646-L662 HydrophobicContact CD2-CD2 4.44Å; F646-L662 HydrophobicContact CE2-CD2 4.13Å; L662-L673 HydrophobicContact CD1-CD1 3.71Å; L662-F678 HydrophobicContact CD1-CD1 4.31Å; L662-F678 HydrophobicContact CD1-CE1 3.53Å; L662-F678 HydrophobicContact CD1-CZ 3.91Å; L662-F678 HydrophobicContact CG-CE1 4.37Å; L662-F678 HydrophobicContact CG-CZ 4.49Å; L662-F679 HydrophobicContact CD1-CE1 4.47Å; L662-F679 HydrophobicContact CD1-CZ 4.43Å; L662-L689 PolarHBondContact N-O 3.25Å; L662-L690 HydrophobicContact CB-CD1 4.04Å; L662-F691 PolarHBondContact O-N 3.45Å
663	A	93.3	Very high	89.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	151.6	174.5	0	0	0	0	0	111.5	V629 L630 C632 C665 F691 V694 A697	V629-A663 HydrophobicContact CG1-CB 3.83Å; L630-A663 PolarHBondContact O-N 3.35Å; C632-A663 WeakPolarHBondContact CB-O 3.18Å; C632-A663 PolarHBondContact N-O 3.02Å; A663-C665 VanDerWaalsContact C-N 3.29Å; A663-C665 PolarHBondContact O-N 3.04Å; A663-C665 VanDerWaalsContact O-N 3.16Å; A663-F691 CarbonylContact C-O 3.3Å; A663-F691 WeakPolarHBondContact CA-O 3.39Å; A663-V694 HydrophobicContact CB-CB 4.48Å; A663-V694 HydrophobicContact CB-CG2 3.93Å; A663-A697 HydrophobicContact CB-CB 4.39Å
664	C	92.6	Very high	89.5	Confident	40 Å²	40	37.7 Å²	37.7	27%	0.27	22%	0.224	S	C	.	.	S	Bend	trans	56	33.1	169.4	-58.6	0	0	0	0	115.3	C632 S633 F691 Y692	C632-C664 CarbonylContact C-O 3.57Å; S633-C664 WeakPolarHBondContact CA-O 3.46Å; S633-C664 PolarHBondContact N-O 3.16Å; C664-F691 PolarHBondContact N-O 2.98Å; C664-Y692 PolarHBondContact SG-O 3.34Å
665	C	90.7	Very high	89.5	Confident	17 Å²	17	39.3 Å²	39.3	12%	0.115	23%	0.229	C	C	.	.			trans	-68.7	134.8	179.4	-67.6	0	0	0	0	112.1	C632 A663 I670 L690	C632-C665 HydrophobicContact CB-CB 4.39Å; C632-C665 WeakPolarHBondContact CB-SG 3.46Å; A663-C665 VanDerWaalsContact C-N 3.29Å; A663-C665 PolarHBondContact O-N 3.04Å; A663-C665 VanDerWaalsContact O-N 3.16Å; C665-I670 HydrophobicContact CB-CD1 4.14Å; C665-I670 HydrophobicContact CB-CG1 3.66Å; C665-L690 HydrophobicContact CB-CD1 3.85Å
666	N	89.9	Confident	89.4	Confident	77 Å²	77	34.7 Å²	34.7	41%	0.412	21%	0.211	S	C	.	.			trans	-67.8	153.3	170	-166.3	-5.7	0	0	0	111.1	S668 V669 I670	N666-S668 VanDerWaalsContact C-N 3.26Å; N666-S668 PolarHBondContact O-N 3.46Å; N666-V669 HydrophobicContact CB-CG2 4.46Å; N666-V669 WeakPolarHBondContact O-CB 3.31Å; N666-V669 PolarHBondContact O-N 3.3Å; N666-I670 WeakPolarHBondContact O-CG1 3.44Å; N666-I670 PolarHBondContact O-N 2.89Å
667	T	87.7	Confident	89.4	Confident	79 Å²	79	40 Å²	40	49%	0.485	24%	0.236	S	C	.	.	H	α-helix	trans	-53.2	-38.4	178.1	56.2	0	0	0	0	113.8	V669 I670 D671	T667-V669 VanDerWaalsContact C-N 3.35Å; T667-I670 PolarHBondContact O-N 3.3Å; T667-D671 WeakPolarHBondContact O-CB 3.2Å; T667-D671 VanDerWaalsContact O-CG 3.31Å; T667-D671 PolarHBondContact O-N 3.32Å
668	S	88.4	Confident	89.5	Confident	46 Å²	46	38.1 Å²	38.1	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-62.4	-40.4	175.1	49.3	0	0	0	0	112.6	P636 N666 A672	P636-S668 PolarHBondContact O-OG 2.66Å; N666-S668 VanDerWaalsContact C-N 3.26Å; N666-S668 PolarHBondContact O-N 3.46Å; S668-A672 PolarHBondContact O-N 3.2Å; S668-A672 VanDerWaalsContact O-N 3.11Å
669	V	90.3	Very high	89.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-71.7	-43.7	178.9	177.3	0	0	0	0	110.2	I635 I638 N666 T667 D671 A672 L673	I635-V669 HydrophobicContact CG2-CG2 4.26Å; I635-V669 VanDerWaalsContact O-CG2 3.32Å; I635-V669 WeakPolarHBondContact O-CG2 3.16Å; I638-V669 HydrophobicContact CD1-CG1 3.53Å; I638-V669 HydrophobicContact CG1-CG1 3.93Å; I638-V669 HydrophobicContact CG1-CG2 4.21Å; N666-V669 HydrophobicContact CB-CG2 4.46Å; N666-V669 WeakPolarHBondContact O-CB 3.31Å; N666-V669 PolarHBondContact O-N 3.3Å; T667-V669 VanDerWaalsContact C-N 3.35Å; V669-D671 VanDerWaalsContact C-N 3.32Å; V669-D671 PolarHBondContact O-N 3.22Å; V669-A672 PolarHBondContact O-N 3.32Å; V669-A672 VanDerWaalsContact O-N 3.16Å; V669-L673 HydrophobicContact CG1-CD1 3.99Å; V669-L673 HydrophobicContact CG1-CG 4.32Å; V669-L673 WeakPolarHBondContact O-CG 3.13Å; V669-L673 PolarHBondContact O-N 3.27Å
670	I	89.2	Confident	88.6	Confident	20 Å²	20	36.5 Å²	36.5	10%	0.103	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-46.2	175.1	-62.6	168.5	0	0	0	110.3	C665 N666 T667 A672 L673 Q674 L690	C665-I670 HydrophobicContact CB-CD1 4.14Å; C665-I670 HydrophobicContact CB-CG1 3.66Å; N666-I670 WeakPolarHBondContact O-CG1 3.44Å; N666-I670 PolarHBondContact O-N 2.89Å; T667-I670 PolarHBondContact O-N 3.3Å; I670-A672 VanDerWaalsContact C-N 3.31Å; I670-A672 PolarHBondContact O-N 3.46Å; I670-L673 PolarHBondContact O-N 3.34Å; I670-Q674 HydrophobicContact CG2-CG 4.26Å; I670-Q674 WeakPolarHBondContact O-CB 3.44Å; I670-Q674 VanDerWaalsContact O-CG 3.31Å; I670-Q674 WeakPolarHBondContact O-CG 3.48Å; I670-Q674 PolarHBondContact O-N 3.47Å; I670-L690 HydrophobicContact CD1-CD2 4.06Å; I670-L690 HydrophobicContact CG1-CD2 4.04Å; I670-L690 HydrophobicContact CG2-CD2 4.36Å
671	D	88.4	Confident	87.6	Confident	49 Å²	49	43.7 Å²	43.7	26%	0.262	23%	0.234	S	C	.	.	H	α-helix	trans	-59.5	-40.9	176.7	-77.3	-24.3	0	0	0	112.7	R22 T667 V669 K675	R22-D671 IonicContact CZ-OD1 3.8Å; R22-D671 IonicContact CZ-OD2 2.75Å; R22-D671 IonicContact NH1-OD1 2.64Å; R22-D671 PolarHBondContact NH1-OD1 3.07Å; R22-D671 IonicContact NH2-OD1 3.53Å; R22-D671 PolarHBondContact NH2-OD1 3.41Å; R22-D671 IonicContact NH2-OD2 2.65Å; R22-D671 PolarHBondContact NH2-OD2 2.95Å; T667-D671 WeakPolarHBondContact O-CB 3.2Å; T667-D671 VanDerWaalsContact O-CG 3.31Å; T667-D671 PolarHBondContact O-N 3.32Å; V669-D671 VanDerWaalsContact C-N 3.32Å; V669-D671 PolarHBondContact O-N 3.22Å; D671-K675 WeakPolarHBondContact O-CB 3.22Å; D671-K675 VanDerWaalsContact O-CG 3.27Å; D671-K675 WeakPolarHBondContact O-CG 3.31Å; D671-K675 PolarHBondContact O-N 3.46Å
672	A	89.1	Confident	86.2	Confident	28 Å²	28	50.6 Å²	50.6	23%	0.231	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-43.8	177.2	0	0	0	0	0	111.5	S668 V669 I670 G676	S668-A672 PolarHBondContact O-N 3.2Å; S668-A672 VanDerWaalsContact O-N 3.11Å; V669-A672 PolarHBondContact O-N 3.32Å; V669-A672 VanDerWaalsContact O-N 3.16Å; I670-A672 VanDerWaalsContact C-N 3.31Å; I670-A672 PolarHBondContact O-N 3.46Å; A672-G676 PolarHBondContact O-N 2.82Å
673	L	88.8	Confident	85.3	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-38.5	178.4	-68.4	174.5	0	0	0	112.6	M643 F646 L662 V669 I670 G676 E677 F678 F679	M643-L673 HydrophobicContact CG-CD2 4.43Å; F646-L673 HydrophobicContact CD2-CD2 4.13Å; L662-L673 HydrophobicContact CD1-CD1 3.71Å; V669-L673 HydrophobicContact CG1-CD1 3.99Å; V669-L673 HydrophobicContact CG1-CG 4.32Å; V669-L673 WeakPolarHBondContact O-CG 3.13Å; V669-L673 PolarHBondContact O-N 3.27Å; I670-L673 PolarHBondContact O-N 3.34Å; L673-G676 CarbonylContact O-C 3.57Å; L673-G676 WeakPolarHBondContact O-CA 3.44Å; L673-G676 PolarHBondContact O-N 3.49Å; L673-E677 PolarHBondContact O-N 3.46Å; L673-F678 HydrophobicContact CB-CB 4.01Å; L673-F678 HydrophobicContact CB-CG 4.47Å; L673-F678 HydrophobicContact CD2-CB 4.03Å; L673-F678 HydrophobicContact CD2-CD1 4.41Å; L673-F678 HydrophobicContact CD2-CD2 4.12Å; L673-F678 HydrophobicContact CD2-CG 3.94Å; L673-F678 WeakPolarHBondContact O-CB 3.36Å; L673-F678 PolarHBondContact O-N 2.89Å; L673-F679 HydrophobicContact CB-CE2 3.75Å; L673-F679 HydrophobicContact CB-CZ 4.27Å; L673-F679 HydrophobicContact CD1-CE2 4.47Å; L673-F679 HydrophobicContact CD1-CZ 4.17Å
674	Q	87.6	Confident	84.2	Confident	54 Å²	54	60.6 Å²	60.6	25%	0.252	32%	0.317	S	S	.	.	H	α-helix	trans	-66	-49.2	175.6	-74.2	-178.6	-27	0	0	111.8	I670 G676 E677 F679 I686	I670-Q674 HydrophobicContact CG2-CG 4.26Å; I670-Q674 WeakPolarHBondContact O-CB 3.44Å; I670-Q674 VanDerWaalsContact O-CG 3.31Å; I670-Q674 WeakPolarHBondContact O-CG 3.48Å; I670-Q674 PolarHBondContact O-N 3.47Å; Q674-G676 PolarHBondContact O-N 3.42Å; Q674-E677 PolarHBondContact O-N 2.98Å; Q674-F679 HydrophobicContact CG-CD2 4.11Å; Q674-F679 HydrophobicContact CG-CE2 4.25Å; Q674-I686 HydrophobicContact CG-CD1 4.42Å; Q674-I686 VanDerWaalsContact NE2-CD1 3.34Å
675	K	86.9	Confident	83.5	Confident	170 Å²	170	62.2 Å²	62.2	74%	0.739	32%	0.323	S	S	*	.	H	α-helix	trans	-59.8	-29.9	173.2	-73.6	174.5	-177.6	177.6	0	112.1	D671 E677	D671-K675 WeakPolarHBondContact O-CB 3.22Å; D671-K675 VanDerWaalsContact O-CG 3.27Å; D671-K675 WeakPolarHBondContact O-CG 3.31Å; D671-K675 PolarHBondContact O-N 3.46Å; K675-E677 VanDerWaalsContact C-N 3.28Å; K675-E677 PolarHBondContact O-N 2.87Å
676	G	83.8	Confident	83	Confident	12 Å²	12	63.7 Å²	63.7	12%	0.124	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-8.6	175.4	0	0	0	0	0	115.8	M643 K647 A672 L673 Q674 F678	M643-G676 WeakPolarHBondContact SD-CA 3.3Å; K647-G676 WeakPolarHBondContact CE-O 3.18Å; K647-G676 PolarHBondContact NZ-O 3.41Å; A672-G676 PolarHBondContact O-N 2.82Å; L673-G676 CarbonylContact O-C 3.57Å; L673-G676 WeakPolarHBondContact O-CA 3.44Å; L673-G676 PolarHBondContact O-N 3.49Å; Q674-G676 PolarHBondContact O-N 3.42Å; G676-F678 VanDerWaalsContact C-N 3.26Å; G676-F678 PolarHBondContact O-N 3.43Å
677	E	86.1	Confident	82.4	Confident	114 Å²	114	64.3 Å²	64.3	53%	0.533	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	40.9	-168.3	-55.4	-173.2	158.8	0	0	112.7	K647 L673 Q674 K675	K647-E677 WeakPolarHBondContact CE-O 3.35Å; K647-E677 PolarHBondContact NZ-O 2.86Å; L673-E677 PolarHBondContact O-N 3.46Å; Q674-E677 PolarHBondContact O-N 2.98Å; K675-E677 VanDerWaalsContact C-N 3.28Å; K675-E677 PolarHBondContact O-N 2.87Å
678	F	85.6	Confident	82.1	Confident	20 Å²	20	62.8 Å²	62.8	9%	0.088	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-37.5	174.7	179.1	-92.1	0	0	0	112	F646 K647 V650 L662 L673 G676 G680 L689	F646-F678 HydrophobicContact CB-CD2 4.39Å; F646-F678 HydrophobicContact CB-CE2 3.93Å; K647-F678 HydrophobicContact CG-CD2 3.69Å; K647-F678 HydrophobicContact CG-CE2 4.4Å; V650-F678 HydrophobicContact CG2-CE2 3.84Å; V650-F678 HydrophobicContact CG2-CZ 3.63Å; L662-F678 HydrophobicContact CD1-CD1 4.31Å; L662-F678 HydrophobicContact CD1-CE1 3.53Å; L662-F678 HydrophobicContact CD1-CZ 3.91Å; L662-F678 HydrophobicContact CG-CE1 4.37Å; L662-F678 HydrophobicContact CG-CZ 4.49Å; L673-F678 HydrophobicContact CB-CB 4.01Å; L673-F678 HydrophobicContact CB-CG 4.47Å; L673-F678 HydrophobicContact CD2-CB 4.03Å; L673-F678 HydrophobicContact CD2-CD1 4.41Å; L673-F678 HydrophobicContact CD2-CD2 4.12Å; L673-F678 HydrophobicContact CD2-CG 3.94Å; L673-F678 WeakPolarHBondContact O-CB 3.36Å; L673-F678 PolarHBondContact O-N 2.89Å; G676-F678 VanDerWaalsContact C-N 3.26Å; G676-F678 PolarHBondContact O-N 3.43Å; F678-G680 VanDerWaalsContact C-N 3.26Å; F678-G680 PolarHBondContact O-N 2.99Å; F678-L689 HydrophobicContact CE1-CD1 4.3Å
679	F	83.3	Confident	81.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	26.5	-179	-55.1	-69.8	0	0	0	113.6	L662 L673 Q674 N683 K684 D685 I686 L689 L690	L662-F679 HydrophobicContact CD1-CE1 4.47Å; L662-F679 HydrophobicContact CD1-CZ 4.43Å; L673-F679 HydrophobicContact CB-CE2 3.75Å; L673-F679 HydrophobicContact CB-CZ 4.27Å; L673-F679 HydrophobicContact CD1-CE2 4.47Å; L673-F679 HydrophobicContact CD1-CZ 4.17Å; Q674-F679 HydrophobicContact CG-CD2 4.11Å; Q674-F679 HydrophobicContact CG-CE2 4.25Å; F679-N683 HydrophobicContact CB-CB 4.35Å; F679-N683 CarbonylContact O-C 3.58Å; F679-N683 VanDerWaalsContact O-C 3.3Å; F679-N683 WeakPolarHBondContact O-CA 3.41Å; F679-K684 PolarHBondContact O-N 2.84Å; F679-K684 VanDerWaalsContact O-N 3.12Å; F679-D685 PolarHBondContact O-N 2.94Å; F679-I686 HydrophobicContact CB-CB 4.11Å; F679-I686 HydrophobicContact CD1-CB 4.16Å; F679-I686 HydrophobicContact CD1-CG1 4.04Å; F679-I686 HydrophobicContact CD2-CB 4.47Å; F679-I686 HydrophobicContact CD2-CD1 4.01Å; F679-I686 HydrophobicContact CD2-CG1 3.99Å; F679-I686 HydrophobicContact CE1-CG1 4.19Å; F679-I686 HydrophobicContact CE2-CD1 4.16Å; F679-I686 HydrophobicContact CE2-CG1 4.14Å; F679-I686 HydrophobicContact CG-CB 4.01Å; F679-I686 HydrophobicContact CG-CD1 4.4Å; F679-I686 HydrophobicContact CG-CG1 3.94Å; F679-I686 HydrophobicContact CZ-CG1 4.24Å; F679-L689 HydrophobicContact CD1-CB 4.16Å; F679-L689 HydrophobicContact CD1-CD1 4.34Å; F679-L689 HydrophobicContact CE1-CB 4.13Å; F679-L690 HydrophobicContact CE1-CB 3.89Å; F679-L690 HydrophobicContact CZ-CB 4.1Å; F679-L690 HydrophobicContact CZ-CD2 4.16Å
680	G	79.1	Confident	81.8	Confident	23 Å²	23	63.3 Å²	63.3	24%	0.237	33%	0.331	C	S	.	.			trans	73.2	175.7	-174	0	0	0	0	0	114.5	F678 N682 N683	F678-G680 VanDerWaalsContact C-N 3.26Å; F678-G680 PolarHBondContact O-N 2.99Å; G680-N682 PolarHBondContact O-N 3.32Å; G680-N683 PolarHBondContact O-N 2.92Å
681	K	71.7	Confident	81.9	Confident	157 Å²	157	63.6 Å²	63.6	68%	0.683	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-63.4	127.2	177.5	-72.6	-177.9	178.2	178.6	0	109.9	N683	K681-N683 VanDerWaalsContact C-N 3.31Å; K681-N683 PolarHBondContact O-N 2.89Å
682	N	64.8	Low	81.9	Confident	153 Å²	153	66.8 Å²	66.8	82%	0.818	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	64.1	23.7	-174.6	-59.3	-11.4	0	0	0	115.5	G680 K684	G680-N682 PolarHBondContact O-N 3.32Å; N682-K684 VanDerWaalsContact C-N 3.32Å; N682-K684 PolarHBondContact O-N 2.94Å
683	N	73.2	Confident	82	Confident	51 Å²	51	68.9 Å²	68.9	27%	0.273	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	59.8	34.4	176.9	-55.9	-45.2	0	0	0	114.7	F679 G680 K681 D685 I686	F679-N683 HydrophobicContact CB-CB 4.35Å; F679-N683 CarbonylContact O-C 3.58Å; F679-N683 VanDerWaalsContact O-C 3.3Å; F679-N683 WeakPolarHBondContact O-CA 3.41Å; G680-N683 PolarHBondContact O-N 2.92Å; K681-N683 VanDerWaalsContact C-N 3.31Å; K681-N683 PolarHBondContact O-N 2.89Å; N683-D685 PolarHBondContact O-N 3.39Å; N683-I686 HydrophobicContact CB-CB 4.31Å; N683-I686 HydrophobicContact CB-CD1 4.4Å; N683-I686 WeakPolarHBondContact O-CB 3.23Å; N683-I686 VanDerWaalsContact O-CG2 3.29Å; N683-I686 WeakPolarHBondContact O-CG2 3.23Å; N683-I686 PolarHBondContact O-N 3.05Å
684	K	71.9	Confident	82.2	Confident	162 Å²	162	69.4 Å²	69.4	70%	0.704	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-34.2	-178.9	-72.4	-178.6	178	-171.3	0	113	F679 N682 I686	F679-K684 PolarHBondContact O-N 2.84Å; F679-K684 VanDerWaalsContact O-N 3.12Å; N682-K684 VanDerWaalsContact C-N 3.32Å; N682-K684 PolarHBondContact O-N 2.94Å; K684-I686 VanDerWaalsContact C-N 3.33Å; K684-I686 PolarHBondContact O-N 3.32Å
685	D	77.8	Confident	82.4	Confident	74 Å²	74	68.4 Å²	68.4	40%	0.396	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	12.9	-172.9	-49.7	-40.2	0	0	0	112.4	F679 N683 S687 S688 L689	F679-D685 PolarHBondContact O-N 2.94Å; N683-D685 PolarHBondContact O-N 3.39Å; D685-S687 PolarHBondContact O-N 2.68Å; D685-S688 PolarHBondContact O-N 3.26Å; D685-S688 PolarHBondContact O-OG 3.09Å; D685-L689 HydrophobicContact CB-CD1 3.97Å; D685-L689 HydrophobicContact CB-CG 4.5Å; D685-L689 WeakPolarHBondContact O-CB 3.04Å; D685-L689 PolarHBondContact O-N 2.67Å; D685-L689 VanDerWaalsContact O-N 3.16Å
686	I	80	Confident	82.6	Confident	48 Å²	48	62.1 Å²	62.1	25%	0.246	33%	0.329	C	S	.	.	H	α-helix	trans	-67.8	-38.1	-174.6	-159	164.2	0	0	0	112	Q674 F679 N683 K684 S688 L690	Q674-I686 HydrophobicContact CG-CD1 4.42Å; Q674-I686 VanDerWaalsContact NE2-CD1 3.34Å; F679-I686 HydrophobicContact CB-CB 4.11Å; F679-I686 HydrophobicContact CD1-CB 4.16Å; F679-I686 HydrophobicContact CD1-CG1 4.04Å; F679-I686 HydrophobicContact CD2-CB 4.47Å; F679-I686 HydrophobicContact CD2-CD1 4.01Å; F679-I686 HydrophobicContact CD2-CG1 3.99Å; F679-I686 HydrophobicContact CE1-CG1 4.19Å; F679-I686 HydrophobicContact CE2-CD1 4.16Å; F679-I686 HydrophobicContact CE2-CG1 4.14Å; F679-I686 HydrophobicContact CG-CB 4.01Å; F679-I686 HydrophobicContact CG-CD1 4.4Å; F679-I686 HydrophobicContact CG-CG1 3.94Å; F679-I686 HydrophobicContact CZ-CG1 4.24Å; N683-I686 HydrophobicContact CB-CB 4.31Å; N683-I686 HydrophobicContact CB-CD1 4.4Å; N683-I686 WeakPolarHBondContact O-CB 3.23Å; N683-I686 VanDerWaalsContact O-CG2 3.29Å; N683-I686 WeakPolarHBondContact O-CG2 3.23Å; N683-I686 PolarHBondContact O-N 3.05Å; K684-I686 VanDerWaalsContact C-N 3.33Å; K684-I686 PolarHBondContact O-N 3.32Å; I686-S688 VanDerWaalsContact C-N 3.33Å; I686-L690 HydrophobicContact CD1-CD2 4.41Å; I686-L690 HydrophobicContact CG1-CB 4.31Å; I686-L690 HydrophobicContact CG1-CD2 4.08Å; I686-L690 VanDerWaalsContact O-CB 3.3Å; I686-L690 WeakPolarHBondContact O-CB 3.48Å; I686-L690 PolarHBondContact O-N 3.29Å
687	S	76	Confident	82.9	Confident	90 Å²	90	61.5 Å²	61.5	63%	0.629	32%	0.323	S	S	*	.	H	α-helix	trans	-74.6	-22.4	-179.4	50.7	0	0	0	0	113.5	D685	D685-S687 PolarHBondContact O-N 2.68Å
688	S	81.8	Confident	83.2	Confident	47 Å²	47	56.5 Å²	56.5	33%	0.329	30%	0.3	S	S	.	.	H	α-helix	trans	-88.4	-28.5	178.5	53.9	0	0	0	0	112.6	L661 D685 I686 F691	L661-S688 WeakPolarHBondContact CD2-O 3.45Å; D685-S688 PolarHBondContact O-N 3.26Å; D685-S688 PolarHBondContact O-OG 3.09Å; I686-S688 VanDerWaalsContact C-N 3.33Å; S688-F691 WeakPolarHBondContact O-CE2 3.28Å
689	L	84.3	Confident	83.4	Confident	33 Å²	33	59 Å²	59	17%	0.173	31%	0.314	C	S	.	.	H	α-helix	trans	-105.9	-22.8	-173.9	-65.5	173.1	0	0	0	114.7	L661 L662 F678 F679 D685	L661-L689 HydrophobicContact CD2-CD2 4.47Å; L662-L689 PolarHBondContact N-O 3.25Å; F678-L689 HydrophobicContact CE1-CD1 4.3Å; F679-L689 HydrophobicContact CD1-CB 4.16Å; F679-L689 HydrophobicContact CD1-CD1 4.34Å; F679-L689 HydrophobicContact CE1-CB 4.13Å; D685-L689 HydrophobicContact CB-CD1 3.97Å; D685-L689 HydrophobicContact CB-CG 4.5Å; D685-L689 WeakPolarHBondContact O-CB 3.04Å; D685-L689 PolarHBondContact O-N 2.67Å; D685-L689 VanDerWaalsContact O-N 3.16Å
690	L	89.3	Confident	83.7	Confident	24 Å²	24	62.6 Å²	62.6	13%	0.126	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.5	-173.3	-178.6	68.3	0	0	0	112.5	L662 C665 I670 F679 I686	L662-L690 HydrophobicContact CB-CD1 4.04Å; C665-L690 HydrophobicContact CB-CD1 3.85Å; I670-L690 HydrophobicContact CD1-CD2 4.06Å; I670-L690 HydrophobicContact CG1-CD2 4.04Å; I670-L690 HydrophobicContact CG2-CD2 4.36Å; F679-L690 HydrophobicContact CE1-CB 3.89Å; F679-L690 HydrophobicContact CZ-CB 4.1Å; F679-L690 HydrophobicContact CZ-CD2 4.16Å; I686-L690 HydrophobicContact CD1-CD2 4.41Å; I686-L690 HydrophobicContact CG1-CB 4.31Å; I686-L690 HydrophobicContact CG1-CD2 4.08Å; I686-L690 VanDerWaalsContact O-CB 3.3Å; I686-L690 WeakPolarHBondContact O-CB 3.48Å; I686-L690 PolarHBondContact O-N 3.29Å
691	F	91.3	Very high	84.2	Confident	26 Å²	26	61.6 Å²	61.6	11%	0.114	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.6	178.6	-60.2	-88	0	0	0	111.9	L661 L662 A663 C664 S688 A696 A697 H700	L661-F691 HydrophobicContact CB-CD2 4.32Å; L661-F691 HydrophobicContact CB-CE2 4.2Å; L661-F691 HydrophobicContact CD1-CE2 3.89Å; L661-F691 HydrophobicContact CD2-CE2 4.1Å; L661-F691 HydrophobicContact CG-CE2 4.28Å; L662-F691 PolarHBondContact O-N 3.45Å; A663-F691 CarbonylContact C-O 3.3Å; A663-F691 WeakPolarHBondContact CA-O 3.39Å; C664-F691 PolarHBondContact N-O 2.98Å; S688-F691 WeakPolarHBondContact O-CE2 3.28Å; F691-A696 HydrophobicContact CD1-CB 4.27Å; F691-A697 HydrophobicContact CB-CB 3.87Å; F691-A697 HydrophobicContact CD2-CB 3.65Å; F691-A697 HydrophobicContact CE2-CB 4.41Å; F691-A697 HydrophobicContact CG-CB 3.75Å; F691-H700 HydrophobicContact CE1-CB 3.65Å; F691-H700 AromaticContact CE1-CD2 3.96Å; F691-H700 AromaticContact CE1-CG 3.73Å; F691-H700 HydrophobicContact CZ-CB 3.68Å; F691-H700 AromaticContact CZ-CD2 3.79Å; F691-H700 AromaticContact CZ-CG 3.4Å; F691-H700 AromaticContact CZ-ND1 3.57Å
692	Y	87.8	Confident	85.1	Confident	116 Å²	116	56 Å²	56	46%	0.455	30%	0.298	S	S	.	.	S	Bend	trans	-76.6	-29.6	-180	-68.2	-69.9	0	0	0	113.4	L20 C664	L20-Y692 HydrophobicContact CB-CD2 4.4Å; L20-Y692 HydrophobicContact CB-CE1 4.14Å; L20-Y692 HydrophobicContact CB-CE2 3.89Å; L20-Y692 HydrophobicContact CD1-CD1 3.98Å; L20-Y692 HydrophobicContact CD1-CD2 4.11Å; L20-Y692 HydrophobicContact CD1-CE1 4.31Å; L20-Y692 HydrophobicContact CD1-CE2 4.42Å; L20-Y692 HydrophobicContact CD1-CG 3.88Å; L20-Y692 PolarHBondContact O-OH 3.5Å; C664-Y692 PolarHBondContact SG-O 3.34Å
693	T	91.2	Very high	86.2	Confident	72 Å²	72	56.4 Å²	56.4	44%	0.442	29%	0.288	S	S	.	.	S	Bend	trans	-128.1	152	178	66.5	0	0	0	0	110.2	H695 A696 A697	T693-H695 VanDerWaalsContact C-N 3.27Å; T693-H695 PolarHBondContact O-N 3.25Å; T693-A696 PolarHBondContact O-N 3.18Å; T693-A696 VanDerWaalsContact OG1-CB 3.32Å; T693-A696 WeakPolarHBondContact OG1-CB 3.4Å; T693-A696 PolarHBondContact OG1-N 3.11Å; T693-A696 VanDerWaalsContact OG1-N 3.16Å; T693-A697 PolarHBondContact O-N 3.21Å
694	V	92.6	Very high	86.7	Confident	12 Å²	12	55.7 Å²	55.7	7%	0.073	29%	0.289	C	S	.	.	H	α-helix	trans	-60.3	-41	173.6	177	0	0	0	0	110.4	Y537 I554 V629 D631 A663 A696 A697 V698	Y537-V694 HydrophobicContact CD1-CG1 4.16Å; Y537-V694 HydrophobicContact CD2-CB 4.21Å; Y537-V694 HydrophobicContact CD2-CG1 4.01Å; Y537-V694 HydrophobicContact CE1-CG1 4.33Å; Y537-V694 HydrophobicContact CE2-CB 4.5Å; Y537-V694 HydrophobicContact CE2-CG1 4.21Å; Y537-V694 HydrophobicContact CG-CG1 3.98Å; I554-V694 HydrophobicContact CD1-CG1 3.72Å; I554-V694 HydrophobicContact CG1-CG1 4.31Å; I554-V694 HydrophobicContact CG2-CG1 3.81Å; V629-V694 HydrophobicContact CG1-CG1 4.42Å; D631-V694 HydrophobicContact CB-CG2 4.2Å; A663-V694 HydrophobicContact CB-CB 4.48Å; A663-V694 HydrophobicContact CB-CG2 3.93Å; V694-A696 PolarHBondContact O-N 3.2Å; V694-A697 WeakPolarHBondContact O-CB 3.5Å; V694-A697 PolarHBondContact O-N 2.9Å; V694-V698 HydrophobicContact CG1-CG2 4.34Å; V694-V698 WeakPolarHBondContact O-CG2 3.35Å; V694-V698 PolarHBondContact O-N 3.27Å
695	H	92.2	Very high	87.2	Confident	32 Å²	32	49.1 Å²	49.1	15%	0.148	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-44.7	179.2	-168.2	63.4	0	0	0	112.6	R530 D535 Y537 T693 A697 V698 L699	R530-H695 PolarHBondContact NH2-CE1 3.15Å; D535-H695 HydrophobicContact CB-CB 4.28Å; D535-H695 IonicContact OD1-CD2 2.85Å; D535-H695 IonicContact OD1-CE1 3.73Å; D535-H695 PolarHBondContact OD1-CE1 3.4Å; D535-H695 VanDerWaalsContact OD1-CE1 3.26Å; D535-H695 IonicContact OD1-CG 2.77Å; D535-H695 IonicContact OD1-ND1 3.91Å; D535-H695 PolarHBondContact OD1-ND1 2.89Å; D535-H695 IonicContact OD1-NE2 3.46Å; D535-H695 PolarHBondContact OD1-NE2 3.32Å; D535-H695 IonicContact OD2-CD2 3.13Å; D535-H695 PolarHBondContact OD2-CD2 3.43Å; D535-H695 IonicContact OD2-CG 2.64Å; D535-H695 IonicContact OD2-NE2 3.87Å; Y537-H695 HydrophobicContact CE2-CB 3.96Å; Y537-H695 PolarHBondContact OH-ND1 3.3Å; T693-H695 VanDerWaalsContact C-N 3.27Å; T693-H695 PolarHBondContact O-N 3.25Å; H695-A697 VanDerWaalsContact C-N 3.31Å; H695-A697 PolarHBondContact O-N 3.44Å; H695-V698 PolarHBondContact O-N 2.96Å; H695-L699 WeakPolarHBondContact NE2-CD1 3.44Å; H695-L699 WeakPolarHBondContact O-CG 3.47Å; H695-L699 PolarHBondContact O-N 3.19Å
696	A	90.6	Very high	87.4	Confident	38 Å²	38	52 Å²	52	31%	0.314	28%	0.276	S	S	.	.	H	α-helix	trans	-61.9	-39.1	177.6	0	0	0	0	0	112.3	F691 T693 V694 H700	F691-A696 HydrophobicContact CD1-CB 4.27Å; T693-A696 PolarHBondContact O-N 3.18Å; T693-A696 VanDerWaalsContact OG1-CB 3.32Å; T693-A696 WeakPolarHBondContact OG1-CB 3.4Å; T693-A696 PolarHBondContact OG1-N 3.11Å; T693-A696 VanDerWaalsContact OG1-N 3.16Å; V694-A696 PolarHBondContact O-N 3.2Å; A696-H700 WeakPolarHBondContact O-CB 3.48Å; A696-H700 PolarHBondContact O-N 2.97Å
697	A	91.2	Very high	87.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-41.7	175.5	0	0	0	0	0	112.1	V629 L661 A663 F691 T693 V694 H695 H700 A701	V629-A697 HydrophobicContact CG1-CB 3.81Å; V629-A697 HydrophobicContact CG2-CB 4.09Å; L661-A697 HydrophobicContact CD1-CB 4.42Å; A663-A697 HydrophobicContact CB-CB 4.39Å; F691-A697 HydrophobicContact CB-CB 3.87Å; F691-A697 HydrophobicContact CD2-CB 3.65Å; F691-A697 HydrophobicContact CE2-CB 4.41Å; F691-A697 HydrophobicContact CG-CB 3.75Å; T693-A697 PolarHBondContact O-N 3.21Å; V694-A697 WeakPolarHBondContact O-CB 3.5Å; V694-A697 PolarHBondContact O-N 2.9Å; H695-A697 VanDerWaalsContact C-N 3.31Å; H695-A697 PolarHBondContact O-N 3.44Å; A697-H700 PolarHBondContact O-N 3.16Å; A697-A701 WeakPolarHBondContact O-CB 3.32Å; A697-A701 PolarHBondContact O-N 3.05Å
698	V	91.3	Very high	87.3	Confident	8 Å²	8	57.9 Å²	57.9	5%	0.048	29%	0.29	C	S	.	.	H	α-helix	trans	-66.3	-44.3	178.2	175.5	0	0	0	0	111.2	Y537 P549 V552 I554 V629 V694 H695 H700 A701 N702	Y537-V698 HydrophobicContact CE1-CG2 4.38Å; P549-V698 HydrophobicContact CB-CG1 4.37Å; V552-V698 HydrophobicContact CG1-CG2 4.29Å; I554-V698 HydrophobicContact CD1-CG2 3.8Å; I554-V698 HydrophobicContact CG1-CG2 4.25Å; V629-V698 HydrophobicContact CG2-CG2 4.37Å; V694-V698 HydrophobicContact CG1-CG2 4.34Å; V694-V698 WeakPolarHBondContact O-CG2 3.35Å; V694-V698 PolarHBondContact O-N 3.27Å; H695-V698 PolarHBondContact O-N 2.96Å; V698-H700 VanDerWaalsContact C-N 3.34Å; V698-H700 PolarHBondContact O-N 3.32Å; V698-A701 WeakPolarHBondContact O-CB 3.26Å; V698-A701 PolarHBondContact O-N 2.73Å; V698-N702 PolarHBondContact O-N 3.31Å
699	L	90.4	Very high	86.8	Confident	73 Å²	73	61.8 Å²	61.8	38%	0.382	30%	0.301	S	S	.	.	H	α-helix	trans	-60	-44.4	175.9	-72.2	178.8	0	0	0	111.8	H695 N702 R703	H695-L699 WeakPolarHBondContact NE2-CD1 3.44Å; H695-L699 WeakPolarHBondContact O-CG 3.47Å; H695-L699 PolarHBondContact O-N 3.19Å; L699-N702 PolarHBondContact O-N 2.98Å; L699-R703 WeakPolarHBondContact O-CG 3.45Å; L699-R703 PolarHBondContact O-N 2.53Å
700	H	90.1	Very high	86.1	Confident	75 Å²	75	62.8 Å²	62.8	35%	0.347	31%	0.314	S	S	.	.	H	α-helix	trans	-62.7	-43.8	175.9	-179.5	-85.3	0	0	0	111.7	F691 A696 A697 V698 N702 R703 A704	F691-H700 HydrophobicContact CE1-CB 3.65Å; F691-H700 AromaticContact CE1-CD2 3.96Å; F691-H700 AromaticContact CE1-CG 3.73Å; F691-H700 HydrophobicContact CZ-CB 3.68Å; F691-H700 AromaticContact CZ-CD2 3.79Å; F691-H700 AromaticContact CZ-CG 3.4Å; F691-H700 AromaticContact CZ-ND1 3.57Å; A696-H700 WeakPolarHBondContact O-CB 3.48Å; A696-H700 PolarHBondContact O-N 2.97Å; A697-H700 PolarHBondContact O-N 3.16Å; V698-H700 VanDerWaalsContact C-N 3.34Å; V698-H700 PolarHBondContact O-N 3.32Å; H700-N702 VanDerWaalsContact C-N 3.34Å; H700-N702 PolarHBondContact O-N 3.04Å; H700-R703 PolarHBondContact O-N 3.37Å; H700-A704 WeakPolarHBondContact O-CB 3.42Å; H700-A704 PolarHBondContact O-N 3.01Å
701	A	89.3	Confident	84.8	Confident	2 Å²	2	68.1 Å²	68.1	2%	0.017	34%	0.339	C	S	.	.	H	α-helix	trans	-59.7	-43.2	178.1	0	0	0	0	0	112.4	V552 H626 T627 L661 A697 V698 A705	V552-A701 HydrophobicContact CG2-CB 4.06Å; H626-A701 PolarHBondContact CE1-O 3Å; H626-A701 VanDerWaalsContact CE1-O 3.25Å; T627-A701 HydrophobicContact CG2-CB 3.74Å; L661-A701 HydrophobicContact CD1-CB 4.03Å; A697-A701 WeakPolarHBondContact O-CB 3.32Å; A697-A701 PolarHBondContact O-N 3.05Å; V698-A701 WeakPolarHBondContact O-CB 3.26Å; V698-A701 PolarHBondContact O-N 2.73Å; A701-A705 PolarHBondContact O-N 3.35Å
702	N	89.3	Confident	83.2	Confident	41 Å²	41	73 Å²	73	22%	0.219	37%	0.366	C	S	.	.	H	α-helix	trans	-69.4	-42.9	179.7	-71.8	-7.2	0	0	0	111.9	V552 V698 L699 H700 A704 A705 E706	V552-N702 WeakPolarHBondContact CG2-OD1 3.43Å; V698-N702 PolarHBondContact O-N 3.31Å; L699-N702 PolarHBondContact O-N 2.98Å; H700-N702 VanDerWaalsContact C-N 3.34Å; H700-N702 PolarHBondContact O-N 3.04Å; N702-A704 PolarHBondContact O-N 3.13Å; N702-A705 PolarHBondContact O-N 2.94Å; N702-E706 WeakPolarHBondContact O-CG 3.31Å; N702-E706 PolarHBondContact O-N 2.98Å
703	R	87.7	Confident	81.6	Confident	161 Å²	161	72 Å²	72	61%	0.608	38%	0.375	S	S	*	.	H	α-helix	trans	-60	-46.6	175.3	-73.9	-179.6	-173.7	176.9	1.6	112.2	L699 H700 A705 E706 E707	L699-R703 WeakPolarHBondContact O-CG 3.45Å; L699-R703 PolarHBondContact O-N 2.53Å; H700-R703 PolarHBondContact O-N 3.37Å; R703-A705 PolarHBondContact O-N 3.42Å; R703-E706 PolarHBondContact O-N 3.42Å; R703-E706 VanDerWaalsContact O-N 3.13Å; R703-E707 WeakPolarHBondContact O-CG 3.42Å; R703-E707 PolarHBondContact O-N 2.94Å
704	A	84.8	Confident	79.6	Confident	35 Å²	35	74.7 Å²	74.7	29%	0.289	39%	0.392	S	S	.	.	H	α-helix	trans	-62.3	-30.7	178.1	0	0	0	0	0	112.7	H700 N702 K708	H700-A704 WeakPolarHBondContact O-CB 3.42Å; H700-A704 PolarHBondContact O-N 3.01Å; N702-A704 PolarHBondContact O-N 3.13Å; A704-K708 PolarHBondContact O-N 3.38Å
705	A	82.6	Confident	77.1	Confident	25 Å²	25	82.7 Å²	82.7	21%	0.207	44%	0.44	C	S	.	.	H	α-helix	trans	-75.9	-35.5	174.8	0	0	0	0	0	112.8	A701 N702 R703 K709	A701-A705 PolarHBondContact O-N 3.35Å; N702-A705 PolarHBondContact O-N 2.94Å; R703-A705 PolarHBondContact O-N 3.42Å; A705-K709 PolarHBondContact O-N 3.34Å; A705-K709 VanDerWaalsContact O-N 3.13Å
706	E	82.2	Confident	76.3	Confident	134 Å²	134	85.2 Å²	85.2	63%	0.626	46%	0.455	S	S	*	.	H	α-helix	trans	-66.2	-43.5	173.3	-73.5	173.9	179.4	0	0	111.6	N702 R703 K709 A710	N702-E706 WeakPolarHBondContact O-CG 3.31Å; N702-E706 PolarHBondContact O-N 2.98Å; R703-E706 PolarHBondContact O-N 3.42Å; R703-E706 VanDerWaalsContact O-N 3.13Å; E706-K709 PolarHBondContact O-N 3.05Å; E706-A710 PolarHBondContact O-N 3Å
707	E	80.6	Confident	75.6	Confident	127 Å²	127	87.7 Å²	87.7	59%	0.593	46%	0.462	S	S	*	.	H	α-helix	trans	-60.5	-46.5	175.8	-73.3	170.8	-177.1	0	0	111.7	R703 K709 A710 E711	R703-E707 WeakPolarHBondContact O-CG 3.42Å; R703-E707 PolarHBondContact O-N 2.94Å; E707-K709 VanDerWaalsContact C-N 3.34Å; E707-K709 PolarHBondContact O-N 3.42Å; E707-A710 WeakPolarHBondContact O-CB 3.45Å; E707-A710 PolarHBondContact O-N 3.19Å; E707-A710 VanDerWaalsContact O-N 3.13Å; E707-E711 PolarHBondContact O-N 3.15Å
708	K	73.5	Confident	74.7	Confident	134 Å²	134	92.6 Å²	92.6	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-59.9	-41.5	174.9	-86.9	-175.2	173.2	-177.8	0	113.2	A704 A710 E711 D712	A704-K708 PolarHBondContact O-N 3.38Å; K708-A710 VanDerWaalsContact C-N 3.29Å; K708-A710 PolarHBondContact O-N 3.34Å; K708-E711 PolarHBondContact O-N 3.49Å; K708-D712 WeakPolarHBondContact O-CB 3.32Å; K708-D712 PolarHBondContact O-N 2.96Å
709	K	71.4	Confident	73.7	Confident	129 Å²	129	97.5 Å²	97.5	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-35.6	176	-83.9	-176	171.5	-171	0	112.4	A705 E706 E707 S713	A705-K709 PolarHBondContact O-N 3.34Å; A705-K709 VanDerWaalsContact O-N 3.13Å; E706-K709 PolarHBondContact O-N 3.05Å; E707-K709 VanDerWaalsContact C-N 3.34Å; E707-K709 PolarHBondContact O-N 3.42Å; K709-S713 WeakPolarHBondContact O-CB 3.41Å; K709-S713 PolarHBondContact O-N 3.41Å; K709-S713 PolarHBondContact O-OG 3.08Å
710	A	68.9	Low	72.7	Confident	54 Å²	54	99.1 Å²	99.1	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-69.6	-38.1	176.5	0	0	0	0	0	111.8	E706 E707 K708 S713 V714	E706-A710 PolarHBondContact O-N 3Å; E707-A710 WeakPolarHBondContact O-CB 3.45Å; E707-A710 PolarHBondContact O-N 3.19Å; E707-A710 VanDerWaalsContact O-N 3.13Å; K708-A710 VanDerWaalsContact C-N 3.29Å; K708-A710 PolarHBondContact O-N 3.34Å; A710-S713 PolarHBondContact O-OG 3.42Å; A710-V714 VanDerWaalsContact O-CG2 3.26Å; A710-V714 WeakPolarHBondContact O-CG2 3.38Å; A710-V714 PolarHBondContact O-N 2.76Å
711	E	62.8	Low	71.5	Confident	137 Å²	137	100.7 Å²	100.7	64%	0.64	53%	0.533	S	S	*	.	H	α-helix	trans	-66.7	-44	174.3	-72.5	-179	160.9	0	0	112.2	E707 K708 S713 V714	E707-E711 PolarHBondContact O-N 3.15Å; K708-E711 PolarHBondContact O-N 3.49Å; E711-S713 PolarHBondContact O-N 2.64Å; E711-V714 PolarHBondContact O-N 3.04Å
712	D	57.7	Low	70.2	Confident	129 Å²	129	107.7 Å²	107.7	69%	0.69	57%	0.57	S	S	*	*	H	α-helix	trans	-69.9	-16.1	179.5	-75.3	-20.4	0	0	0	113.8	K708	K708-D712 WeakPolarHBondContact O-CB 3.32Å; K708-D712 PolarHBondContact O-N 2.96Å
713	S	53.2	Low	68.8	Low	93 Å²	93	112.8 Å²	112.8	65%	0.65	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-4.2	177	43.3	0	0	0	0	114	K709 A710 E711	K709-S713 WeakPolarHBondContact O-CB 3.41Å; K709-S713 PolarHBondContact O-N 3.41Å; K709-S713 PolarHBondContact O-OG 3.08Å; A710-S713 PolarHBondContact O-OG 3.42Å; E711-S713 PolarHBondContact O-N 2.64Å
714	V	49.4	Very low	67.2	Low	130 Å²	130	108.8 Å²	108.8	79%	0.788	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-11.4	175	174.9	0	0	0	0	111.9	A710 E711	A710-V714 VanDerWaalsContact O-CG2 3.26Å; A710-V714 WeakPolarHBondContact O-CG2 3.38Å; A710-V714 PolarHBondContact O-N 2.76Å; E711-V714 PolarHBondContact O-N 3.04Å
715	V	39.4	Very low	65.6	Low	179 Å²	179	115.5 Å²	115.5	100%	1.085	62%	0.624	S	S	*	*			trans	-96.5	0	171	-175.8	0	0	0	0	109.8

Retrieved 715 of 715 residues in 193.7 ms (Link to these results)

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