G4VLL8_SCHMA Loading...

ESF1-like protein

AlphaFold DB , UniProt , Accession G4VLL8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 602 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	48	Very low	61.5	Low	227 Å²	227	134.5 Å²	134.5	100%	1.118	68%	0.678	S	S	*	*				0	126.6	0	-71.7	-179.1	177	0	0	106.8	N3	M1-N3 PolarHBondContact O-N 3.14Å
2	N	50.7	Low	62.3	Low	129 Å²	129	128.6 Å²	128.6	69%	0.69	65%	0.649	S	S	*	*			trans	-59.4	127.3	-161.6	-68.2	-20.6	0	0	0	112.1	K4 N5	N2-K4 PolarHBondContact O-N 3.21Å; N2-N5 PolarHBondContact O-N 3.2Å
3	N	57.7	Low	62.8	Low	131 Å²	131	127.5 Å²	127.5	70%	0.701	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-17.7	178.7	-68.8	-17.9	0	0	0	113.7	M1 N5 L6	M1-N3 PolarHBondContact O-N 3.14Å; N3-N5 VanDerWaalsContact C-N 3.31Å; N3-N5 PolarHBondContact O-N 3.28Å; N3-L6 PolarHBondContact O-N 2.74Å
4	K	59.4	Low	63.1	Low	163 Å²	163	129.6 Å²	129.6	71%	0.709	67%	0.668	S	S	*	*	H	α-helix	trans	-64	-29.6	173.7	-72.1	-177.5	174	-177.9	0	113.9	N2 L6	N2-K4 PolarHBondContact O-N 3.21Å; K4-L6 VanDerWaalsContact C-N 3.34Å
5	N	65.7	Low	63.2	Low	96 Å²	96	128.8 Å²	128.8	51%	0.513	67%	0.665	S	S	.	*	H	α-helix	trans	-77.7	-20.4	179.1	-72	15.1	0	0	0	112.7	N2 N3 I9	N2-N5 PolarHBondContact O-N 3.2Å; N3-N5 VanDerWaalsContact C-N 3.31Å; N3-N5 PolarHBondContact O-N 3.28Å; N5-I9 WeakPolarHBondContact O-CD1 3.43Å; N5-I9 WeakPolarHBondContact O-CG1 3.35Å; N5-I9 PolarHBondContact O-N 2.57Å
6	L	63.5	Low	63.2	Low	117 Å²	117	124.8 Å²	124.8	61%	0.613	66%	0.656	S	S	*	*	H	α-helix	trans	-78.5	-33.4	178.5	-87.1	150.6	0	0	0	112.1	N3 K4 S10	N3-L6 PolarHBondContact O-N 2.74Å; K4-L6 VanDerWaalsContact C-N 3.34Å; L6-S10 PolarHBondContact O-N 3.21Å
7	E	66.3	Low	62.9	Low	133 Å²	133	124.7 Å²	124.7	62%	0.621	67%	0.665	S	S	*	*	H	α-helix	trans	-70.5	-39.5	175.5	-72.2	175.8	169.8	0	0	111.2	I9 S10 H11	E7-I9 PolarHBondContact O-N 3.17Å; E7-S10 PolarHBondContact O-N 3.42Å; E7-S10 PolarHBondContact O-OG 2.99Å; E7-H11 PolarHBondContact O-CD2 3.37Å
8	E	66.2	Low	62.7	Low	145 Å²	145	121.7 Å²	121.7	68%	0.678	67%	0.668	S	S	*	*	H	α-helix	trans	-64.2	-37.1	175.1	-81.5	176.1	163.5	0	0	113	S10 H11	E8-S10 VanDerWaalsContact C-N 3.3Å; E8-S10 PolarHBondContact O-N 3.01Å; E8-H11 PolarHBondContact O-N 3.48Å
9	I	66.2	Low	62.7	Low	98 Å²	98	126 Å²	126	50%	0.503	68%	0.68	S	S	.	*	H	α-helix	trans	-68.6	-30.2	176	-66.1	164	0	0	0	111.6	N5 E7 H11 D12 L15	N5-I9 WeakPolarHBondContact O-CD1 3.43Å; N5-I9 WeakPolarHBondContact O-CG1 3.35Å; N5-I9 PolarHBondContact O-N 2.57Å; E7-I9 PolarHBondContact O-N 3.17Å; I9-H11 VanDerWaalsContact C-N 3.26Å; I9-H11 PolarHBondContact O-N 3.43Å; I9-D12 PolarHBondContact O-N 3.47Å; I9-L15 HydrophobicContact CG2-CD1 3.91Å
10	S	66.5	Low	62.4	Low	83 Å²	83	132 Å²	132	58%	0.58	69%	0.692	S	S	*	*	H	α-helix	trans	-73.5	-16.9	-179.1	78.2	0	0	0	0	114.3	L6 E7 E8	L6-S10 PolarHBondContact O-N 3.21Å; E7-S10 PolarHBondContact O-N 3.42Å; E7-S10 PolarHBondContact O-OG 2.99Å; E8-S10 VanDerWaalsContact C-N 3.3Å; E8-S10 PolarHBondContact O-N 3.01Å
11	H	66.2	Low	62.2	Low	158 Å²	158	135.5 Å²	135.5	73%	0.731	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	0.6	-179.9	-72.6	-56.5	0	0	0	113.8	E7 E8 I9 P13	E7-H11 PolarHBondContact O-CD2 3.37Å; E8-H11 PolarHBondContact O-N 3.48Å; I9-H11 VanDerWaalsContact C-N 3.26Å; I9-H11 PolarHBondContact O-N 3.43Å; H11-P13 WeakPolarHBondContact O-CD 3.11Å
12	D	71.8	Confident	62.5	Low	63 Å²	63	127.8 Å²	127.8	34%	0.337	68%	0.68	S	S	.	*			trans	-72.6	116	178.5	-165.5	-18.1	0	0	0	110.8	I9 L14 L15 A16	I9-D12 PolarHBondContact O-N 3.47Å; D12-L14 PolarHBondContact O-N 3.13Å; D12-L14 VanDerWaalsContact O-N 3.09Å; D12-L14 PolarHBondContact OD1-N 2.89Å; D12-L15 HydrophobicContact CB-CD1 4.38Å; D12-L15 PolarHBondContact O-N 3.34Å; D12-A16 PolarHBondContact O-N 2.88Å
13	P	68	Low	62.7	Low	115 Å²	115	126.6 Å²	126.6	75%	0.747	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-16.4	-179.2	25.8	-35.4	0	0	0	113.8	H11	H11-P13 WeakPolarHBondContact O-CD 3.11Å
14	L	66.6	Low	62.8	Low	156 Å²	156	129.9 Å²	129.9	82%	0.817	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-21.8	174.7	-68.9	169.3	0	0	0	113.4	D12	D12-L14 PolarHBondContact O-N 3.13Å; D12-L14 VanDerWaalsContact O-N 3.09Å; D12-L14 PolarHBondContact OD1-N 2.89Å
15	L	65.4	Low	62.9	Low	118 Å²	118	132 Å²	132	62%	0.618	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	0.7	-177.5	-70.4	165.7	0	0	0	113.2	I9 D12	I9-L15 HydrophobicContact CG2-CD1 3.91Å; D12-L15 HydrophobicContact CB-CD1 4.38Å; D12-L15 PolarHBondContact O-N 3.34Å
16	A	63.1	Low	62.7	Low	64 Å²	64	133.7 Å²	133.7	53%	0.529	72%	0.72	S	S	.	*	S	Bend	trans	-70.5	127.6	177.7	0	0	0	0	0	111.3	D12 G18	D12-A16 PolarHBondContact O-N 2.88Å; A16-G18 PolarHBondContact O-N 3.49Å
17	P	58.1	Low	62.7	Low	124 Å²	124	134.2 Å²	134.2	81%	0.805	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-64.1	123.5	177.7	25.8	-32	0	0	0	109.6	K19	P17-K19 PolarHBondContact O-N 3.31Å
18	G	60	Low	62.9	Low	70 Å²	70	131.5 Å²	131.5	72%	0.722	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-48.4	128.2	-177.8	0	0	0	0	0	112	A16 R20	A16-G18 PolarHBondContact O-N 3.49Å; G18-R20 PolarHBondContact O-N 3.39Å
19	K	61.2	Low	63.1	Low	204 Å²	204	130.4 Å²	130.4	89%	0.887	71%	0.709	S	S	*	*			trans	-50.8	108.8	-180	-68.9	-175	179.8	-179	0	109.7	P17 K21	P17-K19 PolarHBondContact O-N 3.31Å; K19-K21 PolarHBondContact O-N 3.38Å
20	R	56.9	Low	63.2	Low	246 Å²	246	134.2 Å²	134.2	93%	0.928	72%	0.722	S	S	*	*			trans	-60.2	111.9	171.5	-62.5	178.8	95.2	174.9	6.3	107.1	G18 G22	G18-R20 PolarHBondContact O-N 3.39Å; R20-G22 PolarHBondContact O-N 2.94Å; R20-G22 VanDerWaalsContact O-N 3.13Å
21	K	57.8	Low	63.4	Low	205 Å²	205	133.3 Å²	133.3	89%	0.891	71%	0.711	S	S	*	*			trans	-54.2	120.6	171	-73.7	-178.9	178.2	175.2	0	107.2	K19 A23	K19-K21 PolarHBondContact O-N 3.38Å; K21-A23 PolarHBondContact O-N 3.32Å
22	G	55.5	Low	63.4	Low	65 Å²	65	130.2 Å²	130.2	67%	0.67	70%	0.699	S	S	*	*			trans	-52.3	135.8	177.9	0	0	0	0	0	110.5	R20 K24	R20-G22 PolarHBondContact O-N 2.94Å; R20-G22 VanDerWaalsContact O-N 3.13Å; G22-K24 PolarHBondContact O-N 3.2Å
23	A	53.8	Low	63.3	Low	105 Å²	105	134.2 Å²	134.2	87%	0.868	71%	0.714	S	S	*	*			trans	-57	104.2	-179.6	0	0	0	0	0	109.9	K21 K25	K21-A23 PolarHBondContact O-N 3.32Å; A23-K25 PolarHBondContact O-N 3.38Å
24	K	59.9	Low	63.3	Low	199 Å²	199	134.6 Å²	134.6	87%	0.865	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-65.3	127.8	167.6	-67.6	-175.2	178.1	-175.8	0	106.9	G22 T26	G22-K24 PolarHBondContact O-N 3.2Å; K24-T26 PolarHBondContact O-N 2.97Å
25	K	62.3	Low	63.2	Low	208 Å²	208	133.1 Å²	133.1	90%	0.904	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-46.2	126.2	174.9	-70.1	173.5	177.9	176.8	0	109.2	A23 R27	A23-K25 PolarHBondContact O-N 3.38Å; K25-R27 PolarHBondContact O-N 3.4Å
26	T	61.7	Low	63.1	Low	131 Å²	131	132 Å²	132	80%	0.804	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-59.9	121	176.1	48.9	0	0	0	0	109	K24 T28	K24-T26 PolarHBondContact O-N 2.97Å; T26-T28 PolarHBondContact O-N 2.8Å
27	R	63.3	Low	63.2	Low	128 Å²	128	131.2 Å²	131.2	48%	0.483	70%	0.699	S	S	.	*	P	Polyproline II helix	trans	-55.9	128.5	170.1	-69.5	175	81.5	143.6	8.3	107.9	K25 D31 D35	K25-R27 PolarHBondContact O-N 3.4Å; R27-D31 HydrophobicContact CB-CB 4.29Å; R27-D31 VanDerWaalsContact CZ-O 3.32Å; R27-D31 PolarHBondContact NE-O 2.92Å; R27-D31 VanDerWaalsContact NE-O 3.09Å; R27-D31 PolarHBondContact NH2-O 2.9Å; R27-D35 IonicContact CZ-OD2 3.4Å; R27-D35 VanDerWaalsContact CZ-OD2 3.25Å; R27-D35 IonicContact NH1-OD2 3.28Å; R27-D35 PolarHBondContact NH1-OD2 2.83Å; R27-D35 IonicContact NH2-OD1 2.62Å; R27-D35 IonicContact NH2-OD2 3.07Å; R27-D35 PolarHBondContact NH2-OD2 2.85Å
28	T	70.8	Confident	63.4	Low	77 Å²	77	131.7 Å²	131.7	47%	0.472	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-72.1	160.5	171.9	64.6	0	0	0	0	109.4	T26 K30 D31 L32	T26-T28 PolarHBondContact O-N 2.8Å; T28-K30 PolarHBondContact O-N 2.98Å; T28-D31 PolarHBondContact N-OD2 3.32Å; T28-D31 PolarHBondContact O-N 2.8Å; T28-D31 PolarHBondContact OG1-OD1 3.46Å; T28-D31 PolarHBondContact OG1-OD2 2.81Å; T28-L32 PolarHBondContact O-N 2.76Å
29	V	69.8	Low	63.4	Low	121 Å²	121	134.1 Å²	134.1	73%	0.733	69%	0.694	S	S	*	*	S	Bend	trans	-56.1	-24.8	179	-179.8	0	0	0	0	112.1
30	K	67.6	Low	63.6	Low	179 Å²	179	130.8 Å²	130.8	78%	0.778	70%	0.697	S	S	*	*	S	Bend	trans	-71.2	-42.4	172.6	-101.9	173.1	172.3	169.8	0	112.9	T28 L32	T28-K30 PolarHBondContact O-N 2.98Å; K30-L32 PolarHBondContact O-N 2.74Å
31	D	70.7	Confident	64.2	Low	64 Å²	64	120.8 Å²	120.8	34%	0.342	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.7	-1.2	-177.1	-45.9	-38.8	0	0	0	113.2	R27 T28 F33	R27-D31 HydrophobicContact CB-CB 4.29Å; R27-D31 VanDerWaalsContact CZ-O 3.32Å; R27-D31 PolarHBondContact NE-O 2.92Å; R27-D31 VanDerWaalsContact NE-O 3.09Å; R27-D31 PolarHBondContact NH2-O 2.9Å; T28-D31 PolarHBondContact N-OD2 3.32Å; T28-D31 PolarHBondContact O-N 2.8Å; T28-D31 PolarHBondContact OG1-OD1 3.46Å; T28-D31 PolarHBondContact OG1-OD2 2.81Å; D31-F33 VanDerWaalsContact C-N 3.28Å; D31-F33 PolarHBondContact O-N 3.35Å
32	L	67	Low	64.9	Low	93 Å²	93	115.8 Å²	115.8	49%	0.487	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	-19.1	-178.5	-108.6	140.1	0	0	0	113	T28 K30	T28-L32 PolarHBondContact O-N 2.76Å; K30-L32 PolarHBondContact O-N 2.74Å
33	F	69.7	Low	65.9	Low	146 Å²	146	117.7 Å²	117.7	64%	0.64	64%	0.635	S	S	*	*	S	Bend	trans	-118.3	-3.3	-175.3	-61.1	-75.6	0	0	0	114.5	D31 D35 V36	D31-F33 VanDerWaalsContact C-N 3.28Å; D31-F33 PolarHBondContact O-N 3.35Å; F33-D35 VanDerWaalsContact C-N 3.26Å; F33-D35 PolarHBondContact O-N 2.87Å; F33-V36 PolarHBondContact O-N 3.15Å
34	D	67.4	Low	66.9	Low	124 Å²	124	117.1 Å²	117.1	66%	0.663	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-23.6	-178.3	-73.4	-17.2	0	0	0	113.4	V36	D34-V36 VanDerWaalsContact C-N 3.34Å
35	D	65.9	Low	67.8	Low	125 Å²	125	117.7 Å²	117.7	67%	0.668	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-5.9	174.5	-61.3	-25.8	0	0	0	112.8	R27 F33 G37	R27-D35 IonicContact CZ-OD2 3.4Å; R27-D35 VanDerWaalsContact CZ-OD2 3.25Å; R27-D35 IonicContact NH1-OD2 3.28Å; R27-D35 PolarHBondContact NH1-OD2 2.83Å; R27-D35 IonicContact NH2-OD1 2.62Å; R27-D35 IonicContact NH2-OD2 3.07Å; R27-D35 PolarHBondContact NH2-OD2 2.85Å; F33-D35 VanDerWaalsContact C-N 3.26Å; F33-D35 PolarHBondContact O-N 2.87Å; D35-G37 PolarHBondContact O-N 3.38Å
36	V	62.6	Low	68.5	Low	94 Å²	94	118 Å²	118	57%	0.57	62%	0.615	S	S	*	*			trans	-93.7	82.3	-179.5	-172	0	0	0	0	108	F33 D34	F33-V36 PolarHBondContact O-N 3.15Å; D34-V36 VanDerWaalsContact C-N 3.34Å
37	G	64.9	Low	69.3	Low	48 Å²	48	114 Å²	114	50%	0.495	60%	0.6	S	S	.	*			trans	-53.4	153.4	166.8	0	0	0	0	0	111	D35 E39	D35-G37 PolarHBondContact O-N 3.38Å; G37-E39 PolarHBondContact O-N 2.81Å
38	P	62.3	Low	70	Confident	134 Å²	134	116.8 Å²	116.8	87%	0.87	61%	0.611	S	S	*	*			trans	-59.5	112.5	-178.9	25.3	-33.1	0	0	0	109.4	S40	P38-S40 PolarHBondContact O-N 3.26Å
39	E	59.9	Low	70.3	Confident	120 Å²	120	116.9 Å²	116.9	56%	0.561	61%	0.612	S	S	*	*			trans	-59.9	122.4	176.8	-69.6	-164.7	133.7	0	0	109.1	G37 A41 K43	G37-E39 PolarHBondContact O-N 2.81Å; E39-A41 PolarHBondContact O-N 3.3Å; E39-A41 VanDerWaalsContact O-N 3.09Å; E39-K43 IonicContact OE1-NZ 3.62Å; E39-K43 PolarHBondContact OE1-NZ 2.62Å; E39-K43 IonicContact OE2-NZ 2.65Å
40	S	66.4	Low	70.3	Confident	135 Å²	135	115.8 Å²	115.8	94%	0.944	60%	0.595	S	S	*	*	S	Bend	trans	-66.6	-9.5	-176	54.2	0	0	0	0	114.1	P38	P38-S40 PolarHBondContact O-N 3.26Å
41	A	69	Low	70.2	Confident	35 Å²	35	116.9 Å²	116.9	29%	0.289	60%	0.6	S	S	.	*	S	Bend	trans	-141.8	136.9	179.6	0	0	0	0	0	111.3	E39 P49	E39-A41 PolarHBondContact O-N 3.3Å; E39-A41 VanDerWaalsContact O-N 3.09Å; A41-P49 HydrophobicContact CB-CB 4.25Å
42	F	71.8	Confident	70.1	Confident	100 Å²	100	119.9 Å²	119.9	44%	0.439	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-62.8	137.3	171.1	-73	-85.7	0	0	0	109.5	P49 W50 N53 P54	F42-P49 CarbonylContact O-C 3.59Å; F42-P49 WeakPolarHBondContact O-CA 3.36Å; F42-W50 HydrophobicContact CB-CB 4.02Å; F42-W50 WeakPolarHBondContact O-CA 3.25Å; F42-W50 WeakPolarHBondContact O-CB 3.3Å; F42-W50 PolarHBondContact O-N 3.12Å; F42-N53 HydrophobicContact CD2-CB 4.16Å; F42-N53 HydrophobicContact CE2-CB 3.65Å; F42-N53 HydrophobicContact CZ-CB 4.22Å; F42-N53 VanDerWaalsContact CZ-CG 3.4Å; F42-N53 WeakPolarHBondContact CZ-ND2 3.39Å; F42-N53 WeakPolarHBondContact CZ-OD1 3.3Å; F42-P54 HydrophobicContact CB-CG 4.17Å; F42-P54 VanDerWaalsContact CD1-CD 3.42Å; F42-P54 HydrophobicContact CD1-CG 3.67Å; F42-P54 HydrophobicContact CE1-CG 4.25Å; F42-P54 HydrophobicContact CG-CG 3.94Å
43	K	76.1	Confident	70.5	Confident	105 Å²	105	118.7 Å²	118.7	46%	0.457	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.8	144.8	176.4	-65.2	169.4	-173.2	166.7	0	110.7	E39 R48	E39-K43 IonicContact OE1-NZ 3.62Å; E39-K43 PolarHBondContact OE1-NZ 2.62Å; E39-K43 IonicContact OE2-NZ 2.65Å; K43-R48 CarbonylContact C-O 3.55Å; K43-R48 VanDerWaalsContact CA-O 3.24Å; K43-R48 WeakPolarHBondContact CA-O 3.39Å
44	D	76.3	Confident	70.5	Confident	93 Å²	93	113.1 Å²	113.1	50%	0.497	58%	0.583	S	S	.	*			trans	-74.2	171.4	170	-171	18.7	0	0	0	110.9	R46 G47 R48	D44-R46 PolarHBondContact O-N 3.33Å; D44-G47 PolarHBondContact O-N 3.37Å; D44-R48 PolarHBondContact N-O 3.46Å
45	K	78.6	Confident	70.9	Confident	211 Å²	211	117 Å²	117	92%	0.917	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-15.1	177.3	-63.7	-175.1	-179.8	-178.2	0	114.2
46	R	77.2	Confident	71.3	Confident	216 Å²	216	113.7 Å²	113.7	82%	0.815	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	12	176.9	-60.1	178.7	-178.8	-111.3	2.3	113.6	D44 R48	D44-R46 PolarHBondContact O-N 3.33Å; R46-R48 PolarHBondContact O-N 2.79Å
47	G	77.5	Confident	72	Confident	47 Å²	47	113.9 Å²	113.9	49%	0.485	57%	0.569	S	S	.	*	S	Bend	trans	72.6	6.1	-179.8	0	0	0	0	0	115	D44	D44-G47 PolarHBondContact O-N 3.37Å
48	R	78.6	Confident	72.6	Confident	186 Å²	186	115.1 Å²	115.1	70%	0.702	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-76.8	127.7	-180	-71.3	-176.4	178.1	-122.7	-0.3	110.4	K43 D44 R46	K43-R48 CarbonylContact C-O 3.55Å; K43-R48 VanDerWaalsContact CA-O 3.24Å; K43-R48 WeakPolarHBondContact CA-O 3.39Å; D44-R48 PolarHBondContact N-O 3.46Å; R46-R48 PolarHBondContact O-N 2.79Å
49	P	76	Confident	73.5	Confident	78 Å²	78	116.3 Å²	116.3	51%	0.506	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.2	136.7	178.6	25.7	-31.4	0	0	0	111.1	A41 F42	A41-P49 HydrophobicContact CB-CB 4.25Å; F42-P49 CarbonylContact O-C 3.59Å; F42-P49 WeakPolarHBondContact O-CA 3.36Å
50	W	71	Confident	74.4	Confident	99 Å²	99	116.7 Å²	116.7	38%	0.375	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.2	117	175.7	-166.3	-9.2	0	0	0	107.5	F42 K52 P54 Y57	F42-W50 HydrophobicContact CB-CB 4.02Å; F42-W50 WeakPolarHBondContact O-CA 3.25Å; F42-W50 WeakPolarHBondContact O-CB 3.3Å; F42-W50 PolarHBondContact O-N 3.12Å; W50-K52 VanDerWaalsContact CD1-O 3.23Å; W50-K52 VanDerWaalsContact CG-O 3.25Å; W50-K52 PolarHBondContact NE1-O 3.25Å; W50-K52 PolarHBondContact O-N 3.18Å; W50-K52 VanDerWaalsContact O-N 3.1Å; W50-P54 HydrophobicContact CD2-CB 4.43Å; W50-P54 HydrophobicContact CD2-CG 4.16Å; W50-P54 HydrophobicContact CE3-CB 3.73Å; W50-P54 HydrophobicContact CE3-CG 3.42Å; W50-P54 VanDerWaalsContact CE3-CG 3.42Å; W50-P54 VanDerWaalsContact CH2-CA 3.41Å; W50-P54 HydrophobicContact CH2-CB 3.42Å; W50-P54 VanDerWaalsContact CH2-CB 3.42Å; W50-P54 HydrophobicContact CH2-CG 4.12Å; W50-P54 HydrophobicContact CZ2-CB 4.15Å; W50-P54 HydrophobicContact CZ3-CB 3.19Å; W50-P54 HydrophobicContact CZ3-CG 3.42Å; W50-P54 VanDerWaalsContact CZ3-CG 3.42Å; W50-Y57 HydrophobicContact CZ2-CD1 4.09Å; W50-Y57 HydrophobicContact CZ2-CG 4.39Å
51	F	65.3	Low	75	Confident	201 Å²	201	114.2 Å²	114.2	88%	0.882	53%	0.533	S	S	*	.	S	Bend	trans	-66.2	-8.5	-178.5	-67.4	-82.9	0	0	0	114.7
52	K	68.4	Low	75.3	Confident	127 Å²	127	117.7 Å²	117.7	55%	0.552	55%	0.546	S	S	*	.	S	Bend	trans	-136.9	147.3	179.9	-68.5	-175.5	179	-177.3	0	109.6	W50 P54	W50-K52 VanDerWaalsContact CD1-O 3.23Å; W50-K52 VanDerWaalsContact CG-O 3.25Å; W50-K52 PolarHBondContact NE1-O 3.25Å; W50-K52 PolarHBondContact O-N 3.18Å; W50-K52 VanDerWaalsContact O-N 3.1Å; K52-P54 WeakPolarHBondContact O-CD 3.35Å
53	N	74.6	Confident	75.7	Confident	69 Å²	69	115.1 Å²	115.1	37%	0.369	54%	0.543	S	S	.	.			trans	-58.9	120.1	173.7	-171.2	-27.6	0	0	0	109.5	F42 R55 A56 Y57	F42-N53 HydrophobicContact CD2-CB 4.16Å; F42-N53 HydrophobicContact CE2-CB 3.65Å; F42-N53 HydrophobicContact CZ-CB 4.22Å; F42-N53 VanDerWaalsContact CZ-CG 3.4Å; F42-N53 WeakPolarHBondContact CZ-ND2 3.39Å; F42-N53 WeakPolarHBondContact CZ-OD1 3.3Å; N53-R55 PolarHBondContact O-N 3.44Å; N53-R55 VanDerWaalsContact O-N 3.07Å; N53-R55 PolarHBondContact OD1-N 3.38Å; N53-A56 HydrophobicContact CB-CB 4.14Å; N53-A56 WeakPolarHBondContact O-CB 3.36Å; N53-A56 PolarHBondContact O-N 3.45Å; N53-Y57 PolarHBondContact O-N 3.03Å; N53-Y57 VanDerWaalsContact O-N 3.1Å
54	P	71.5	Confident	75.7	Confident	28 Å²	28	113.3 Å²	113.3	18%	0.182	54%	0.544	C	S	.	.	H	α-helix	trans	-45.4	-45.3	-176.9	-22	16.8	0	0	0	113.3	F42 W50 K52 Y57 V58	F42-P54 HydrophobicContact CB-CG 4.17Å; F42-P54 VanDerWaalsContact CD1-CD 3.42Å; F42-P54 HydrophobicContact CD1-CG 3.67Å; F42-P54 HydrophobicContact CE1-CG 4.25Å; F42-P54 HydrophobicContact CG-CG 3.94Å; W50-P54 HydrophobicContact CD2-CB 4.43Å; W50-P54 HydrophobicContact CD2-CG 4.16Å; W50-P54 HydrophobicContact CE3-CB 3.73Å; W50-P54 HydrophobicContact CE3-CG 3.42Å; W50-P54 VanDerWaalsContact CE3-CG 3.42Å; W50-P54 VanDerWaalsContact CH2-CA 3.41Å; W50-P54 HydrophobicContact CH2-CB 3.42Å; W50-P54 VanDerWaalsContact CH2-CB 3.42Å; W50-P54 HydrophobicContact CH2-CG 4.12Å; W50-P54 HydrophobicContact CZ2-CB 4.15Å; W50-P54 HydrophobicContact CZ3-CB 3.19Å; W50-P54 HydrophobicContact CZ3-CG 3.42Å; W50-P54 VanDerWaalsContact CZ3-CG 3.42Å; K52-P54 WeakPolarHBondContact O-CD 3.35Å; P54-Y57 PolarHBondContact O-N 3.42Å; P54-V58 WeakPolarHBondContact O-CG2 3.33Å; P54-V58 PolarHBondContact O-N 3.07Å
55	R	75.5	Confident	75.6	Confident	206 Å²	206	115.4 Å²	115.4	78%	0.777	55%	0.548	S	S	*	.	H	α-helix	trans	-68.8	-37.4	-174.8	-72.5	178.3	155.2	160.1	-5.1	111.5	N53 K59	N53-R55 PolarHBondContact O-N 3.44Å; N53-R55 VanDerWaalsContact O-N 3.07Å; N53-R55 PolarHBondContact OD1-N 3.38Å; R55-K59 WeakPolarHBondContact O-CB 3.3Å; R55-K59 WeakPolarHBondContact O-CG 3.37Å; R55-K59 PolarHBondContact O-N 3.43Å
56	A	74.6	Confident	75.3	Confident	55 Å²	55	109.3 Å²	109.3	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-69.6	-41.9	177.2	0	0	0	0	0	111.2	N53 K59 Q60	N53-A56 HydrophobicContact CB-CB 4.14Å; N53-A56 WeakPolarHBondContact O-CB 3.36Å; N53-A56 PolarHBondContact O-N 3.45Å; A56-K59 PolarHBondContact O-N 2.78Å; A56-Q60 WeakPolarHBondContact O-CB 3.25Å; A56-Q60 PolarHBondContact O-N 3.06Å
57	Y	76.4	Confident	74.8	Confident	98 Å²	98	108.2 Å²	108.2	38%	0.384	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-46.1	176.7	179.9	-101.2	0	0	0	112.1	W50 N53 P54 Q60 K61	W50-Y57 HydrophobicContact CZ2-CD1 4.09Å; W50-Y57 HydrophobicContact CZ2-CG 4.39Å; N53-Y57 PolarHBondContact O-N 3.03Å; N53-Y57 VanDerWaalsContact O-N 3.1Å; P54-Y57 PolarHBondContact O-N 3.42Å; Y57-Q60 PolarHBondContact O-N 2.95Å; Y57-K61 PolarHBondContact O-N 3.41Å
58	V	77.6	Confident	74.3	Confident	75 Å²	75	112.1 Å²	112.1	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-44.7	177.5	172.4	0	0	0	0	111.4	P54 Q60 K61 L62	P54-V58 WeakPolarHBondContact O-CG2 3.33Å; P54-V58 PolarHBondContact O-N 3.07Å; V58-Q60 VanDerWaalsContact C-N 3.34Å; V58-Q60 PolarHBondContact O-N 3.05Å; V58-K61 PolarHBondContact O-N 3.37Å; V58-L62 HydrophobicContact CG1-CD1 3.71Å; V58-L62 PolarHBondContact O-N 2.79Å
59	K	80.2	Confident	73.5	Confident	158 Å²	158	107.4 Å²	107.4	69%	0.687	52%	0.517	S	S	*	.	H	α-helix	trans	-59.3	-42.8	175.1	-81	-174.9	176.5	-173.6	0	112.3	R55 A56 K61 L62 A63	R55-K59 WeakPolarHBondContact O-CB 3.3Å; R55-K59 WeakPolarHBondContact O-CG 3.37Å; R55-K59 PolarHBondContact O-N 3.43Å; A56-K59 PolarHBondContact O-N 2.78Å; K59-K61 PolarHBondContact O-N 3.27Å; K59-L62 PolarHBondContact O-N 2.68Å; K59-A63 WeakPolarHBondContact O-CB 3.36Å; K59-A63 PolarHBondContact O-N 3.12Å
60	Q	79.4	Confident	72.6	Confident	128 Å²	128	106.6 Å²	106.6	60%	0.598	51%	0.513	S	S	*	.	H	α-helix	trans	-64.6	-40.1	179	-166.8	177.5	23	0	0	111.9	A56 Y57 V58 A63 S64	A56-Q60 WeakPolarHBondContact O-CB 3.25Å; A56-Q60 PolarHBondContact O-N 3.06Å; Y57-Q60 PolarHBondContact O-N 2.95Å; V58-Q60 VanDerWaalsContact C-N 3.34Å; V58-Q60 PolarHBondContact O-N 3.05Å; Q60-A63 PolarHBondContact O-N 2.99Å; Q60-S64 PolarHBondContact O-N 2.85Å; Q60-S64 PolarHBondContact O-OG 3.43Å
61	K	78.7	Confident	71.8	Confident	84 Å²	84	105.5 Å²	105.5	37%	0.365	52%	0.521	S	S	.	.	H	α-helix	trans	-69.7	-37.3	176.9	-114.2	-149.7	178.5	-162.3	0	113.4	Y57 V58 K59 S64 K65 F105	Y57-K61 PolarHBondContact O-N 3.41Å; V58-K61 PolarHBondContact O-N 3.37Å; K59-K61 PolarHBondContact O-N 3.27Å; K61-S64 WeakPolarHBondContact CA-OG 3.16Å; K61-S64 PolarHBondContact O-N 3.04Å; K61-S64 PolarHBondContact O-OG 2.88Å; K61-K65 PolarHBondContact O-N 2.68Å; K61-F105 HydrophobicContact CD-CE2 4.26Å
62	L	76.7	Confident	71.2	Confident	107 Å²	107	102.7 Å²	102.7	56%	0.56	51%	0.51	S	S	*	.	H	α-helix	trans	-67.2	-39.5	173.7	-80.2	156.7	0	0	0	111.3	V58 K59 K65 T66	V58-L62 HydrophobicContact CG1-CD1 3.71Å; V58-L62 PolarHBondContact O-N 2.79Å; K59-L62 PolarHBondContact O-N 2.68Å; L62-K65 PolarHBondContact O-N 3.18Å; L62-T66 WeakPolarHBondContact O-CG2 3.42Å; L62-T66 PolarHBondContact O-N 2.74Å; L62-T66 PolarHBondContact O-OG1 3.15Å
63	A	78.9	Confident	70.5	Confident	47 Å²	47	105.3 Å²	105.3	39%	0.388	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-37.4	174.8	0	0	0	0	0	112.3	K59 Q60 T66 R67	K59-A63 WeakPolarHBondContact O-CB 3.36Å; K59-A63 PolarHBondContact O-N 3.12Å; Q60-A63 PolarHBondContact O-N 2.99Å; A63-T66 WeakPolarHBondContact CA-OG1 3.22Å; A63-T66 PolarHBondContact O-OG1 3.31Å; A63-R67 WeakPolarHBondContact O-CB 3.35Å; A63-R67 VanDerWaalsContact O-CG 3.32Å; A63-R67 WeakPolarHBondContact O-CG 3.38Å; A63-R67 PolarHBondContact O-N 2.76Å
64	S	75.7	Confident	68.9	Low	66 Å²	66	110.1 Å²	110.1	46%	0.462	54%	0.542	S	S	.	.	H	α-helix	trans	-73	-35.5	175.6	60.9	0	0	0	0	112.9	Q60 K61 R67 K68	Q60-S64 PolarHBondContact O-N 2.85Å; Q60-S64 PolarHBondContact O-OG 3.43Å; K61-S64 WeakPolarHBondContact CA-OG 3.16Å; K61-S64 PolarHBondContact O-N 3.04Å; K61-S64 PolarHBondContact O-OG 2.88Å; S64-R67 PolarHBondContact O-N 2.78Å; S64-K68 WeakPolarHBondContact O-CB 3.31Å; S64-K68 PolarHBondContact O-N 2.96Å
65	K	74.7	Confident	67.5	Low	137 Å²	137	114 Å²	114	60%	0.596	57%	0.57	S	S	*	*	H	α-helix	trans	-65.2	-45.9	174	-169.5	166.8	-178.4	174.1	0	111.6	K61 L62 R67 K68 D69	K61-K65 PolarHBondContact O-N 2.68Å; L62-K65 PolarHBondContact O-N 3.18Å; K65-R67 VanDerWaalsContact C-N 3.34Å; K65-R67 PolarHBondContact O-N 2.91Å; K65-K68 PolarHBondContact O-N 2.85Å; K65-D69 PolarHBondContact O-N 2.79Å
66	T	72.4	Confident	65.9	Low	84 Å²	84	112.1 Å²	112.1	52%	0.515	58%	0.575	S	S	.	*	H	α-helix	trans	-64.4	-35.7	175.7	47.8	0	0	0	0	112.8	L62 A63 S70	L62-T66 WeakPolarHBondContact O-CG2 3.42Å; L62-T66 PolarHBondContact O-N 2.74Å; L62-T66 PolarHBondContact O-OG1 3.15Å; A63-T66 WeakPolarHBondContact CA-OG1 3.22Å; A63-T66 PolarHBondContact O-OG1 3.31Å; T66-S70 WeakPolarHBondContact O-CB 3.13Å; T66-S70 PolarHBondContact O-N 3.43Å; T66-S70 PolarHBondContact O-OG 3.47Å
67	R	67.6	Low	64.3	Low	192 Å²	192	115.4 Å²	115.4	73%	0.725	60%	0.595	S	S	*	*	H	α-helix	trans	-66.2	-39.2	171.6	-79	-178.6	175.6	-170	-1.9	112.7	A63 S64 K65 S70 S71	A63-R67 WeakPolarHBondContact O-CB 3.35Å; A63-R67 VanDerWaalsContact O-CG 3.32Å; A63-R67 WeakPolarHBondContact O-CG 3.38Å; A63-R67 PolarHBondContact O-N 2.76Å; S64-R67 PolarHBondContact O-N 2.78Å; K65-R67 VanDerWaalsContact C-N 3.34Å; K65-R67 PolarHBondContact O-N 2.91Å; R67-S70 WeakPolarHBondContact CA-OG 3.34Å; R67-S70 PolarHBondContact O-N 2.87Å; R67-S70 PolarHBondContact O-OG 2.76Å; R67-S70 VanDerWaalsContact O-OG 3.12Å; R67-S71 WeakPolarHBondContact O-CB 3.49Å; R67-S71 PolarHBondContact O-N 2.96Å; R67-S71 PolarHBondContact O-OG 3.06Å
68	K	66.4	Low	62.4	Low	130 Å²	130	116 Å²	116	57%	0.565	61%	0.614	S	S	*	*	H	α-helix	trans	-67.1	-44.7	177.3	-160.1	178.3	178.4	-174.1	0	111.7	S64 K65 S70 S71 E72	S64-K68 WeakPolarHBondContact O-CB 3.31Å; S64-K68 PolarHBondContact O-N 2.96Å; K65-K68 PolarHBondContact O-N 2.85Å; K68-S70 VanDerWaalsContact C-N 3.29Å; K68-S70 PolarHBondContact O-N 2.85Å; K68-S71 WeakPolarHBondContact CA-OG 3.11Å; K68-S71 PolarHBondContact O-N 3.21Å; K68-S71 PolarHBondContact O-OG 3.15Å; K68-E72 PolarHBondContact O-N 2.91Å; K68-E72 VanDerWaalsContact O-N 3.15Å
69	D	61.2	Low	60.6	Low	87 Å²	87	118 Å²	118	47%	0.465	63%	0.631	S	S	.	*	H	α-helix	trans	-68.4	-25	177.7	-70	-14.6	0	0	0	113.1	K65	K65-D69 PolarHBondContact O-N 2.79Å
70	S	57.1	Low	58.5	Low	61 Å²	61	118.7 Å²	118.7	43%	0.427	64%	0.642	S	S	.	*	H	α-helix	trans	-86	-33.4	173.8	47.8	0	0	0	0	113	T66 R67 K68 E72 K73 Q74	T66-S70 WeakPolarHBondContact O-CB 3.13Å; T66-S70 PolarHBondContact O-N 3.43Å; T66-S70 PolarHBondContact O-OG 3.47Å; R67-S70 WeakPolarHBondContact CA-OG 3.34Å; R67-S70 PolarHBondContact O-N 2.87Å; R67-S70 PolarHBondContact O-OG 2.76Å; R67-S70 VanDerWaalsContact O-OG 3.12Å; K68-S70 VanDerWaalsContact C-N 3.29Å; K68-S70 PolarHBondContact O-N 2.85Å; S70-E72 VanDerWaalsContact C-N 3.3Å; S70-E72 PolarHBondContact O-N 3.38Å; S70-K73 PolarHBondContact O-N 3.04Å; S70-Q74 PolarHBondContact O-N 3.34Å
71	S	55.2	Low	56.6	Low	76 Å²	76	121.8 Å²	121.8	53%	0.531	66%	0.656	S	S	.	*	H	α-helix	trans	-69.6	-23.7	173.9	59.8	0	0	0	0	113.8	R67 K68 K73	R67-S71 WeakPolarHBondContact O-CB 3.49Å; R67-S71 PolarHBondContact O-N 2.96Å; R67-S71 PolarHBondContact O-OG 3.06Å; K68-S71 WeakPolarHBondContact CA-OG 3.11Å; K68-S71 PolarHBondContact O-N 3.21Å; K68-S71 PolarHBondContact O-OG 3.15Å; S71-K73 VanDerWaalsContact C-N 3.33Å
72	E	53.4	Low	54.6	Low	141 Å²	141	123.2 Å²	123.2	66%	0.659	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-6.2	173	-75	175.5	-170.1	0	0	113	K68 S70	K68-E72 PolarHBondContact O-N 2.91Å; K68-E72 VanDerWaalsContact O-N 3.15Å; S70-E72 VanDerWaalsContact C-N 3.3Å; S70-E72 PolarHBondContact O-N 3.38Å
73	K	52.5	Low	52.9	Low	183 Å²	183	123.6 Å²	123.6	80%	0.796	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	-4.2	-180	-79.4	-177.1	177.8	175	0	115.6	S70 S71	S70-K73 PolarHBondContact O-N 3.04Å; S71-K73 VanDerWaalsContact C-N 3.33Å
74	Q	41.8	Very low	50.9	Low	170 Å²	170	130.1 Å²	130.1	79%	0.794	71%	0.711	S	S	*	*			trans	-140.8	80.7	177.8	-73.5	-170.5	-30.6	0	0	111.3	S70	S70-Q74 PolarHBondContact O-N 3.34Å
75	S	41.9	Very low	49.3	Very low	109 Å²	109	134.8 Å²	134.8	76%	0.762	73%	0.73	S	S	*	*			trans	-124.1	66.2	163.1	65.9	0	0	0	0	109.4
76	D	42.2	Very low	47.5	Very low	166 Å²	166	136.4 Å²	136.4	89%	0.888	74%	0.74	S	S	*	*			trans	-152	106.6	160.7	-101.1	-21.4	0	0	0	107.2
77	S	39.4	Very low	45.8	Very low	124 Å²	124	136.4 Å²	136.4	87%	0.867	75%	0.748	S	S	*	*			trans	135	116.7	160.6	-167.6	0	0	0	0	113.1
78	S	37.3	Very low	44.1	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	75%	0.746	S	S	*	*			trans	-79.2	137.5	-179.2	52.8	0	0	0	0	114.1
79	S	39.3	Very low	42.9	Very low	117 Å²	117	134 Å²	134	82%	0.818	76%	0.758	S	S	*	*			trans	-172.9	129.1	133.5	60.8	0	0	0	0	111.5
80	N	37	Very low	41.5	Very low	172 Å²	172	135.5 Å²	135.5	92%	0.92	77%	0.77	S	S	*	*			trans	-52.7	135.2	167.9	-96.9	-10.1	0	0	0	112.4
81	E	39.2	Very low	40.4	Very low	192 Å²	192	140.4 Å²	140.4	90%	0.897	79%	0.786	S	S	*	*			trans	-152.9	129.1	139.4	-150.3	168.5	155.5	0	0	110.8
82	S	37.1	Very low	39.4	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	79%	0.794	S	S	*	*			trans	-78.4	138.1	-179	40.6	0	0	0	0	112.1
83	S	41	Very low	38.3	Very low	115 Å²	115	140.4 Å²	140.4	80%	0.804	80%	0.802	S	S	*	*			trans	-150	119.4	153.5	64.5	0	0	0	0	110.6
84	E	36.6	Very low	37.6	Very low	184 Å²	184	136 Å²	136	86%	0.86	80%	0.8	S	S	*	*			trans	-46.2	159.4	161.2	-76.1	160	120.6	0	0	112.7
85	L	41.7	Very low	37.2	Very low	164 Å²	164	133.6 Å²	133.6	86%	0.859	80%	0.802	S	S	*	*			trans	156	91.5	147.2	-80.8	178.2	0	0	0	106
86	E	37.3	Very low	36.9	Very low	171 Å²	171	134.2 Å²	134.2	80%	0.799	80%	0.801	S	S	*	*				81.3	131.6	85.4	-87.3	-63.8	165.2	0	0	114.4
87	A	37.2	Very low	36.9	Very low	83 Å²	83	132.8 Å²	132.8	69%	0.686	79%	0.794	S	S	*	*			trans	64.1	138.4	164.6	0	0	0	0	0	119.3
88	S	32	Very low	36.9	Very low	97 Å²	97	134.8 Å²	134.8	68%	0.678	80%	0.795	S	S	*	*			cis	177.8	160.7	-17.8	47.5	0	0	0	0	104.6
89	E	39.8	Very low	37.3	Very low	174 Å²	174	137 Å²	137	81%	0.813	79%	0.792	S	S	*	*			trans	84.6	81.2	159.7	-46.2	-161.7	-178.4	0	0	118.4
90	T	32.3	Very low	37.8	Very low	119 Å²	119	138.3 Å²	138.3	73%	0.73	79%	0.786	S	S	*	*				-13.4	123.4	116.5	50.2	0	0	0	0	113.4
91	E	34.2	Very low	38.6	Very low	164 Å²	164	139.5 Å²	139.5	77%	0.766	78%	0.783	S	S	*	*				163.6	127.5	93.9	-83.7	-65.6	131.4	0	0	101.1
92	S	35	Very low	39.5	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	76%	0.763	S	S	*	*				156.5	144.9	86.5	46.7	0	0	0	0	106.9	A94	S92-A94 PolarHBondContact O-N 2.9Å
93	S	30.3	Very low	41	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	75%	0.749	S	S	*	*			trans	-36	123.4	167.7	50	0	0	0	0	115.5
94	A	38.1	Very low	42.4	Very low	90 Å²	90	133.2 Å²	133.2	74%	0.744	74%	0.74	S	S	*	*			trans	-131.3	87.1	154	0	0	0	0	0	109.3	S92 T96	S92-A94 PolarHBondContact O-N 2.9Å; A94-T96 PolarHBondContact O-N 3.33Å
95	S	31.4	Very low	44.2	Very low	119 Å²	119	131 Å²	131	83%	0.832	73%	0.727	S	S	*	*			trans	-60.4	110.6	160.4	64.3	0	0	0	0	108.3
96	T	36.4	Very low	45.5	Very low	122 Å²	122	126.1 Å²	126.1	75%	0.748	70%	0.7	S	S	*	*			trans	-152	107.3	167.8	-41.8	0	0	0	0	110	A94	A94-T96 PolarHBondContact O-N 3.33Å
97	N	42.5	Very low	47.1	Very low	137 Å²	137	118.9 Å²	118.9	73%	0.733	67%	0.67	S	S	*	*			trans	54.3	105	167	-93.7	2.8	0	0	0	118.6	E99	N97-E99 PolarHBondContact O-N 3.31Å
98	D	40.1	Very low	48.8	Very low	166 Å²	166	118.5 Å²	118.5	89%	0.888	66%	0.656	S	S	*	*			trans	-60.6	69.9	154.7	-72.4	-40.9	0	0	0	111.2
99	E	45.3	Very low	50.7	Low	158 Å²	158	119.4 Å²	119.4	74%	0.738	65%	0.649	S	S	*	*			trans	-94.4	88.9	151.8	-72.5	-169	-176.4	0	0	107	N97 K101	N97-E99 PolarHBondContact O-N 3.31Å; E99-K101 PolarHBondContact O-N 2.82Å; E99-K101 VanDerWaalsContact O-N 3.1Å
100	E	49.6	Very low	52.1	Low	145 Å²	145	111.8 Å²	111.8	68%	0.678	61%	0.614	S	S	*	*			trans	-44.5	115.7	178	-67	173.4	162.2	0	0	111.1	I102	E100-I102 PolarHBondContact O-N 3.29Å
101	K	54.1	Low	53.9	Low	197 Å²	197	108.5 Å²	108.5	86%	0.857	59%	0.592	S	S	*	*			trans	-61.8	95.2	-174	-67.1	171.1	-179.3	169.5	0	111	E99 N103	E99-K101 PolarHBondContact O-N 2.82Å; E99-K101 VanDerWaalsContact O-N 3.1Å; K101-N103 PolarHBondContact O-N 3.01Å
102	I	57.7	Low	55.4	Low	93 Å²	93	106.4 Å²	106.4	48%	0.477	58%	0.582	S	S	.	*			trans	-61.2	119.1	155.1	-60	171.9	0	0	0	106	E100 V104 A107	E100-I102 PolarHBondContact O-N 3.29Å; I102-V104 PolarHBondContact O-N 3.34Å; I102-A107 HydrophobicContact CG2-CB 4.38Å
103	N	67.5	Low	56.6	Low	96 Å²	96	103.5 Å²	103.5	51%	0.513	57%	0.568	S	S	.	*			trans	-64.1	101.4	175.1	-92.2	-32.2	0	0	0	108.4	K101 F105 E106 A107	K101-N103 PolarHBondContact O-N 3.01Å; N103-F105 PolarHBondContact O-N 3.26Å; N103-E106 HydrophobicContact CB-CB 3.98Å; N103-E106 WeakPolarHBondContact O-CB 3.28Å; N103-E106 PolarHBondContact O-N 2.95Å; N103-A107 PolarHBondContact O-N 3.28Å; N103-A107 VanDerWaalsContact O-N 3.11Å
104	V	71.5	Confident	58	Low	101 Å²	101	97.9 Å²	97.9	61%	0.612	53%	0.529	S	S	*	.	H	α-helix	trans	-51	-34	-179.9	-179.9	0	0	0	0	111.9	I102 I108	I102-V104 PolarHBondContact O-N 3.34Å; V104-I108 HydrophobicContact CG1-CD1 3.85Å; V104-I108 HydrophobicContact CG1-CG1 4.47Å; V104-I108 WeakPolarHBondContact O-CD1 3.2Å; V104-I108 WeakPolarHBondContact O-CG1 3.34Å; V104-I108 PolarHBondContact O-N 3.45Å
105	F	73.7	Confident	59.3	Low	136 Å²	136	97.1 Å²	97.1	60%	0.596	51%	0.512	S	S	*	.	H	α-helix	trans	-64.7	-43.3	176.5	-76.3	-87.2	0	0	0	113.4	K61 N103 I108 E109	K61-F105 HydrophobicContact CD-CE2 4.26Å; N103-F105 PolarHBondContact O-N 3.26Å; F105-I108 PolarHBondContact O-N 3.03Å; F105-E109 WeakPolarHBondContact O-CB 3.39Å; F105-E109 PolarHBondContact O-N 3.18Å
106	E	70.4	Confident	61.2	Low	62 Å²	62	93.1 Å²	93.1	29%	0.29	48%	0.479	S	S	.	.	H	α-helix	trans	-68.4	-41	178.9	-178.2	173.4	-155.9	0	0	110.4	N103 I108 E109 D110 S225	N103-E106 HydrophobicContact CB-CB 3.98Å; N103-E106 WeakPolarHBondContact O-CB 3.28Å; N103-E106 PolarHBondContact O-N 2.95Å; E106-I108 VanDerWaalsContact C-N 3.28Å; E106-I108 PolarHBondContact O-N 3.01Å; E106-E109 PolarHBondContact O-N 3.44Å; E106-D110 WeakPolarHBondContact O-CB 3.33Å; E106-D110 PolarHBondContact O-N 2.89Å; E106-S225 WeakPolarHBondContact OE1-CB 3.4Å; E106-S225 PolarHBondContact OE1-OG 3.1Å
107	A	69.4	Low	63	Low	20 Å²	20	95.4 Å²	95.4	17%	0.165	48%	0.475	C	S	.	.	H	α-helix	trans	-61.6	-35.2	174	0	0	0	0	0	112.8	I102 N103 L111 T318	I102-A107 HydrophobicContact CG2-CB 4.38Å; N103-A107 PolarHBondContact O-N 3.28Å; N103-A107 VanDerWaalsContact O-N 3.11Å; A107-L111 WeakPolarHBondContact O-CG 3.36Å; A107-L111 PolarHBondContact O-N 3.46Å; A107-T318 HydrophobicContact CB-CG2 4.27Å
108	I	73.7	Confident	64.6	Low	75 Å²	75	94.4 Å²	94.4	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-71.7	-43.6	175.2	-68.6	163.1	0	0	0	110.9	V104 F105 E106 D110 L111 Q112	V104-I108 HydrophobicContact CG1-CD1 3.85Å; V104-I108 HydrophobicContact CG1-CG1 4.47Å; V104-I108 WeakPolarHBondContact O-CD1 3.2Å; V104-I108 WeakPolarHBondContact O-CG1 3.34Å; V104-I108 PolarHBondContact O-N 3.45Å; F105-I108 PolarHBondContact O-N 3.03Å; E106-I108 VanDerWaalsContact C-N 3.28Å; E106-I108 PolarHBondContact O-N 3.01Å; I108-D110 VanDerWaalsContact C-N 3.31Å; I108-D110 PolarHBondContact O-N 3.39Å; I108-L111 WeakPolarHBondContact O-CB 3.24Å; I108-L111 PolarHBondContact O-N 3Å; I108-L111 VanDerWaalsContact O-N 3.14Å; I108-Q112 HydrophobicContact CG2-CG 4.3Å; I108-Q112 WeakPolarHBondContact O-CG 3.3Å; I108-Q112 PolarHBondContact O-N 3.45Å
109	E	72.5	Confident	66.5	Low	116 Å²	116	87.2 Å²	87.2	54%	0.542	43%	0.427	S	S	.	.	H	α-helix	trans	-61.9	-41.7	177.2	-174.3	171.8	-159.4	0	0	111.1	F105 E106 L111 Q112 G113	F105-E109 WeakPolarHBondContact O-CB 3.39Å; F105-E109 PolarHBondContact O-N 3.18Å; E106-E109 PolarHBondContact O-N 3.44Å; E109-L111 VanDerWaalsContact C-N 3.25Å; E109-L111 PolarHBondContact O-N 2.94Å; E109-Q112 PolarHBondContact O-N 2.96Å; E109-G113 PolarHBondContact O-N 2.85Å
110	D	68.4	Low	68.1	Low	13 Å²	13	80.7 Å²	80.7	7%	0.07	40%	0.398	C	S	.	.	H	α-helix	trans	-63.5	-32.3	175.5	-64.7	-11.9	0	0	0	112	E106 I108 R229 R232	E106-D110 WeakPolarHBondContact O-CB 3.33Å; E106-D110 PolarHBondContact O-N 2.89Å; I108-D110 VanDerWaalsContact C-N 3.31Å; I108-D110 PolarHBondContact O-N 3.39Å; D110-R229 IonicContact OD1-CZ 2.8Å; D110-R229 IonicContact OD1-NE 3.24Å; D110-R229 PolarHBondContact OD1-NE 2.97Å; D110-R229 IonicContact OD1-NH2 2.9Å; D110-R229 PolarHBondContact OD1-NH2 3.4Å; D110-R232 VanDerWaalsContact CB-NH1 3.28Å; D110-R232 PolarHBondContact O-NH1 3.03Å
111	L	69.8	Low	69.4	Low	51 Å²	51	80.8 Å²	80.8	27%	0.267	40%	0.396	S	S	.	.	H	α-helix	trans	-75.8	-37.5	174.2	-73.7	169.1	0	0	0	111.9	A107 I108 E109 A114 T318	A107-L111 WeakPolarHBondContact O-CG 3.36Å; A107-L111 PolarHBondContact O-N 3.46Å; I108-L111 WeakPolarHBondContact O-CB 3.24Å; I108-L111 PolarHBondContact O-N 3Å; I108-L111 VanDerWaalsContact O-N 3.14Å; E109-L111 VanDerWaalsContact C-N 3.25Å; E109-L111 PolarHBondContact O-N 2.94Å; L111-A114 WeakPolarHBondContact O-CA 3.48Å; L111-A114 WeakPolarHBondContact O-CB 3.47Å; L111-A114 PolarHBondContact O-N 2.95Å; L111-T318 HydrophobicContact CD1-CG2 3.69Å; L111-T318 HydrophobicContact CD2-CG2 4.28Å; L111-T318 HydrophobicContact CG-CG2 4.11Å
112	Q	66.7	Low	70.4	Confident	119 Å²	119	77.9 Å²	77.9	56%	0.556	39%	0.39	S	S	*	.	H	α-helix	trans	-67.6	-35.6	177.6	-74	175.3	-17	0	0	112	I108 E109 A114 D115	I108-Q112 HydrophobicContact CG2-CG 4.3Å; I108-Q112 WeakPolarHBondContact O-CG 3.3Å; I108-Q112 PolarHBondContact O-N 3.45Å; E109-Q112 PolarHBondContact O-N 2.96Å; Q112-A114 PolarHBondContact O-N 2.93Å; Q112-D115 WeakPolarHBondContact O-CB 3.42Å
113	G	59.4	Low	71.3	Confident	40 Å²	40	76 Å²	76	41%	0.412	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-4.6	170	0	0	0	0	0	113.8	E109 D115	E109-G113 PolarHBondContact O-N 2.85Å; G113-D115 VanDerWaalsContact C-N 3.34Å
114	A	60.1	Low	71.7	Confident	0 Å²	0	77 Å²	77	0%	0	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	10.6	178	0	0	0	0	0	112.7	L111 Q112 W116 R232	L111-A114 WeakPolarHBondContact O-CA 3.48Å; L111-A114 WeakPolarHBondContact O-CB 3.47Å; L111-A114 PolarHBondContact O-N 2.95Å; Q112-A114 PolarHBondContact O-N 2.93Å; A114-W116 PolarHBondContact O-N 3.42Å; A114-R232 HydrophobicContact CB-CG 4.12Å; A114-R232 VanDerWaalsContact CB-NE 3.28Å
115	D	65.9	Low	71.7	Confident	74 Å²	74	77 Å²	77	40%	0.396	40%	0.396	S	S	.	.			trans	-68.6	131	-159.8	-81.9	-12	0	0	0	110.3	Q112 G113 Y117 E118	Q112-D115 WeakPolarHBondContact O-CB 3.42Å; G113-D115 VanDerWaalsContact C-N 3.34Å; D115-Y117 PolarHBondContact O-N 2.96Å; D115-E118 HydrophobicContact CB-CG 4.49Å; D115-E118 WeakPolarHBondContact O-CB 3.42Å; D115-E118 PolarHBondContact O-N 3.5Å
116	W	70.6	Confident	71.6	Confident	35 Å²	35	72.7 Å²	72.7	13%	0.133	39%	0.386	C	S	.	.	H	α-helix	trans	-49	-25.3	164.5	-150.7	85.9	0	0	0	111.6	A114 L119 T120 R272 D274 L315	A114-W116 PolarHBondContact O-N 3.42Å; W116-L119 PolarHBondContact O-N 3.38Å; W116-T120 HydrophobicContact CD2-CG2 4.35Å; W116-T120 HydrophobicContact CE3-CG2 3.67Å; W116-T120 HydrophobicContact CH2-CG2 3.77Å; W116-T120 HydrophobicContact CZ2-CG2 4.36Å; W116-T120 HydrophobicContact CZ3-CG2 3.39Å; W116-T120 PolarHBondContact O-N 3.28Å; W116-T120 PolarHBondContact O-OG1 2.96Å; W116-R272 HydrophobicContact CD2-CB 3.9Å; W116-R272 HydrophobicContact CD2-CG 4.46Å; W116-R272 VanDerWaalsContact CE2-CB 3.5Å; W116-R272 HydrophobicContact CE3-CB 4.1Å; W116-R272 HydrophobicContact CH2-CB 3.56Å; W116-R272 VanDerWaalsContact CZ2-C 3.44Å; W116-R272 HydrophobicContact CZ2-CB 3.4Å; W116-R272 WeakPolarHBondContact CZ2-O 3.18Å; W116-R272 HydrophobicContact CZ3-CB 3.9Å; W116-D274 HydrophobicContact CH2-CB 3.68Å; W116-D274 HydrophobicContact CZ2-CB 3.9Å; W116-L315 HydrophobicContact CG-CD2 4.48Å
117	Y	73.8	Confident	71.8	Confident	170 Å²	170	75.9 Å²	75.9	67%	0.667	41%	0.41	S	S	*	.	H	α-helix	trans	-62	-36.6	171.5	-157.7	-99	0	0	0	113.3	D115 T120 K121	D115-Y117 PolarHBondContact O-N 2.96Å; Y117-T120 WeakPolarHBondContact CA-OG1 3.18Å; Y117-T120 CarbonylContact O-C 3.6Å; Y117-T120 PolarHBondContact O-N 2.93Å; Y117-T120 PolarHBondContact O-OG1 3.33Å; Y117-K121 WeakPolarHBondContact O-CA 3.49Å; Y117-K121 VanDerWaalsContact O-CB 3.25Å; Y117-K121 WeakPolarHBondContact O-CB 3.42Å; Y117-K121 PolarHBondContact O-N 3.43Å
118	E	77	Confident	72.5	Confident	116 Å²	116	80.9 Å²	80.9	54%	0.542	43%	0.43	S	S	.	.	H	α-helix	trans	-68.3	-35.8	176.6	-64.8	-165.4	168.6	0	0	112.2	D115 T120	D115-E118 HydrophobicContact CB-CG 4.49Å; D115-E118 WeakPolarHBondContact O-CB 3.42Å; D115-E118 PolarHBondContact O-N 3.5Å; E118-T120 VanDerWaalsContact C-N 3.28Å; E118-T120 PolarHBondContact O-N 3.06Å
119	L	78.7	Confident	73.2	Confident	14 Å²	14	81 Å²	81	7%	0.073	43%	0.434	C	S	.	.	H	α-helix	trans	-67.4	-32.2	174.8	-70.6	104.3	0	0	0	112.1	W116 H137 L236 L239	W116-L119 PolarHBondContact O-N 3.38Å; L119-H137 HydrophobicContact CD2-CB 4.15Å; L119-H137 VanDerWaalsContact CD2-CD2 3.42Å; L119-H137 WeakPolarHBondContact CD2-CD2 3.48Å; L119-H137 PolarHBondContact O-CE1 3.37Å; L119-L236 HydrophobicContact CD1-CD1 4.35Å; L119-L236 HydrophobicContact CD1-CD2 4.1Å; L119-L239 HydrophobicContact CD2-CD1 4.39Å
120	T	80.5	Confident	74.1	Confident	21 Å²	21	75.8 Å²	75.8	13%	0.129	41%	0.411	C	S	.	.	H	α-helix	trans	-99.4	-7.4	-176.9	51.1	0	0	0	0	114.1	W116 Y117 E118 D122 S123 D274	W116-T120 HydrophobicContact CD2-CG2 4.35Å; W116-T120 HydrophobicContact CE3-CG2 3.67Å; W116-T120 HydrophobicContact CH2-CG2 3.77Å; W116-T120 HydrophobicContact CZ2-CG2 4.36Å; W116-T120 HydrophobicContact CZ3-CG2 3.39Å; W116-T120 PolarHBondContact O-N 3.28Å; W116-T120 PolarHBondContact O-OG1 2.96Å; Y117-T120 WeakPolarHBondContact CA-OG1 3.18Å; Y117-T120 CarbonylContact O-C 3.6Å; Y117-T120 PolarHBondContact O-N 2.93Å; Y117-T120 PolarHBondContact O-OG1 3.33Å; E118-T120 VanDerWaalsContact C-N 3.28Å; E118-T120 PolarHBondContact O-N 3.06Å; T120-D122 PolarHBondContact O-N 3.07Å; T120-D122 VanDerWaalsContact O-N 3.15Å; T120-S123 WeakPolarHBondContact O-CB 3.32Å; T120-S123 PolarHBondContact O-N 3.3Å; T120-S123 PolarHBondContact O-OG 3.05Å; T120-D274 HydrophobicContact CG2-CB 4.42Å
121	K	75.9	Confident	75.3	Confident	147 Å²	147	78.3 Å²	78.3	64%	0.639	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-36	-174.7	-172	178.4	177.4	-174.6	0	113.5	Y117 S123	Y117-K121 WeakPolarHBondContact O-CA 3.49Å; Y117-K121 VanDerWaalsContact O-CB 3.25Å; Y117-K121 WeakPolarHBondContact O-CB 3.42Å; Y117-K121 PolarHBondContact O-N 3.43Å; K121-S123 VanDerWaalsContact C-N 3.27Å
122	D	75.8	Confident	76.5	Confident	137 Å²	137	78.6 Å²	78.6	73%	0.733	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	8.8	-179.2	-59.4	-25.8	0	0	0	112.2	T120 V124	T120-D122 PolarHBondContact O-N 3.07Å; T120-D122 VanDerWaalsContact O-N 3.15Å; D122-V124 PolarHBondContact O-N 3.4Å
123	S	75	Confident	77.8	Confident	52 Å²	52	72.9 Å²	72.9	36%	0.364	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-68.2	117.2	175.5	74.5	0	0	0	0	109.6	T120 K121	T120-S123 WeakPolarHBondContact O-CB 3.32Å; T120-S123 PolarHBondContact O-N 3.3Å; T120-S123 PolarHBondContact O-OG 3.05Å; K121-S123 VanDerWaalsContact C-N 3.27Å
124	V	75.9	Confident	79.5	Confident	117 Å²	117	71.4 Å²	71.4	71%	0.709	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-76.3	124.6	169.6	-179.6	0	0	0	0	106.6	D122 A126	D122-V124 PolarHBondContact O-N 3.4Å; V124-A126 PolarHBondContact O-N 3.47Å
125	P	72.8	Confident	81.2	Confident	101 Å²	101	71.5 Å²	71.5	66%	0.656	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-58.9	134.1	174.8	25	-33	0	0	0	108.8	T127	P125-T127 PolarHBondContact O-N 3.19Å
126	A	71.3	Confident	82.5	Confident	47 Å²	47	69.9 Å²	69.9	39%	0.388	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-62.1	122.9	-174.2	0	0	0	0	0	111.3	V124 F277	V124-A126 PolarHBondContact O-N 3.47Å; A126-F277 HydrophobicContact CB-CB 4.24Å; A126-F277 HydrophobicContact CB-CD2 3.34Å; A126-F277 HydrophobicContact CB-CE2 4.07Å; A126-F277 HydrophobicContact CB-CG 4.21Å
127	T	74.7	Confident	83.5	Confident	129 Å²	129	69 Å²	69	79%	0.791	37%	0.365	S	S	*	.	S	Bend	trans	-91.7	-21.4	174.8	51.3	0	0	0	0	112.7	P125	P125-T127 PolarHBondContact O-N 3.19Å
128	Q	83.5	Confident	84.4	Confident	125 Å²	125	61 Å²	61	58%	0.584	33%	0.334	S	S	*	.	S	Bend	trans	-125.4	131.2	-176.3	-61.6	-174.6	19.5	0	0	108.8	F277	Q128-F277 WeakPolarHBondContact O-CB 3.43Å
129	T	88.8	Confident	85	Confident	77 Å²	77	56.2 Å²	56.2	47%	0.472	31%	0.312	S	S	.	.			trans	-93.3	139.1	173.4	52.5	0	0	0	0	109.2	F277	T129-F277 HydrophobicContact CG2-CE1 4.21Å; T129-F277 HydrophobicContact CG2-CE2 4.32Å; T129-F277 HydrophobicContact CG2-CZ 3.92Å
130	S	92.5	Very high	85.6	Confident	6 Å²	6	56.9 Å²	56.9	4%	0.042	31%	0.314	C	S	.	.			trans	-140.2	172.5	-176.9	66.2	0	0	0	0	110.6	R132 A254 F277 V278	S130-R132 PolarHBondContact O-N 3.41Å; S130-R132 PolarHBondContact OG-N 2.91Å; S130-R132 PolarHBondContact OG-O 3.03Å; S130-A254 VanDerWaalsContact O-CB 3.25Å; S130-A254 WeakPolarHBondContact O-CB 3.06Å; S130-F277 VanDerWaalsContact N-CD1 3.34Å; S130-V278 WeakPolarHBondContact CB-O 3.29Å; S130-V278 PolarHBondContact OG-N 2.76Å; S130-V278 PolarHBondContact OG-O 3.33Å
131	H	93.1	Very high	86	Confident	67 Å²	67	58.3 Å²	58.3	31%	0.31	32%	0.321	S	S	.	.	S	Bend	trans	-77.2	-8.4	176.4	-63.7	-85.6	0	0	0	112.4	F248 S250 V251 N280	H131-F248 WeakPolarHBondContact O-CD2 3.44Å; H131-F248 PolarHBondContact O-N 2.91Å; H131-S250 VanDerWaalsContact ND1-CA 3.3Å; H131-S250 WeakPolarHBondContact ND1-CA 3.37Å; H131-V251 WeakPolarHBondContact CE1-CG2 3.45Å; H131-V251 PolarHBondContact CE1-N 3.09Å; H131-V251 PolarHBondContact ND1-N 2.73Å; H131-V251 VanDerWaalsContact ND1-N 3.13Å; H131-V251 WeakPolarHBondContact NE2-CG2 3.24Å; H131-N280 PolarHBondContact CD2-ND2 3.44Å; H131-N280 PolarHBondContact N-OD1 3.37Å
132	R	94.6	Very high	86.5	Confident	56 Å²	56	52.8 Å²	52.8	21%	0.211	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130	-173.6	-63.5	-173	171.7	150.5	3.6	111.4	S130 I246 E247 V278 N280 Q282	S130-R132 PolarHBondContact O-N 3.41Å; S130-R132 PolarHBondContact OG-N 2.91Å; S130-R132 PolarHBondContact OG-O 3.03Å; R132-I246 CarbonylContact C-O 3.43Å; R132-I246 VanDerWaalsContact CA-O 3.3Å; R132-I246 WeakPolarHBondContact CA-O 3.46Å; R132-E247 HydrophobicContact CG-CG 4.17Å; R132-E247 IonicContact CZ-OE1 3.13Å; R132-E247 IonicContact NE-OE1 2.8Å; R132-E247 PolarHBondContact NE-OE1 3.34Å; R132-E247 IonicContact NH2-OE1 2.8Å; R132-E247 PolarHBondContact NH2-OE1 3.26Å; R132-V278 HydrophobicContact CB-CB 4.09Å; R132-V278 HydrophobicContact CB-CG1 4.4Å; R132-V278 PolarHBondContact O-N 2.85Å; R132-N280 PolarHBondContact NH1-O 2.91Å; R132-Q282 PolarHBondContact NH1-O 3.36Å
133	L	94.9	Very high	87	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.7	169.3	-64.5	178.2	0	0	0	110.6	I245 I246 F248 A254 I257 L275 R276 F277	L133-I245 WeakPolarHBondContact O-CA 3.38Å; L133-I246 PolarHBondContact N-O 3.25Å; L133-I246 PolarHBondContact O-N 3.35Å; L133-F248 HydrophobicContact CB-CE2 3.88Å; L133-F248 HydrophobicContact CD1-CE2 3.57Å; L133-F248 HydrophobicContact CD1-CZ 4.04Å; L133-F248 HydrophobicContact CG-CD2 4.38Å; L133-F248 HydrophobicContact CG-CE2 3.64Å; L133-A254 HydrophobicContact CG-CB 4.38Å; L133-I257 HydrophobicContact CD1-CG2 4.29Å; L133-L275 HydrophobicContact CD1-CD1 4.4Å; L133-R276 CarbonylContact C-O 3.5Å; L133-R276 WeakPolarHBondContact CA-O 3.16Å; L133-F277 HydrophobicContact CD2-CB 4.44Å; L133-F277 HydrophobicContact CD2-CD1 3.42Å; L133-F277 VanDerWaalsContact CD2-CD1 3.42Å; L133-F277 HydrophobicContact CD2-CD2 4.09Å; L133-F277 HydrophobicContact CD2-CE1 3.59Å; L133-F277 HydrophobicContact CD2-CE2 4.26Å; L133-F277 HydrophobicContact CD2-CG 3.73Å; L133-F277 HydrophobicContact CD2-CZ 4.03Å
134	A	94.7	Very high	87.7	Confident	9 Å²	9	47 Å²	47	7%	0.074	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.2	163.4	0	0	0	0	0	110.1	A244 L275 R276 V278	A134-A244 CarbonylContact C-O 3.53Å; A134-A244 WeakPolarHBondContact CA-O 3.42Å; A134-L275 CarbonylContact O-C 3.44Å; A134-L275 WeakPolarHBondContact O-CA 3.19Å; A134-R276 PolarHBondContact N-O 3.05Å; A134-R276 PolarHBondContact O-N 3.16Å; A134-V278 HydrophobicContact CB-CG2 3.57Å
135	L	95.1	Very high	88.5	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123.1	164.8	178.2	69.1	0	0	0	108.9	F138 W140 I148 A244 I246 L273 D274 L275	L135-F138 HydrophobicContact CD2-CB 4.29Å; L135-F138 HydrophobicContact CD2-CD1 4.3Å; L135-F138 HydrophobicContact CD2-CG 4.17Å; L135-F138 HydrophobicContact CG-CB 4.45Å; L135-W140 HydrophobicContact CG-CH2 4.48Å; L135-W140 WeakPolarHBondContact O-CH2 3.4Å; L135-I148 HydrophobicContact CD2-CD1 3.9Å; L135-I148 HydrophobicContact CD2-CG1 3.98Å; L135-I148 HydrophobicContact CD2-CG2 4.05Å; L135-A244 HydrophobicContact CB-CB 4.2Å; L135-A244 PolarHBondContact N-O 2.92Å; L135-A244 PolarHBondContact O-N 3.47Å; L135-I246 HydrophobicContact CB-CD1 4.12Å; L135-L273 HydrophobicContact CD1-CB 3.91Å; L135-L273 HydrophobicContact CD1-CD2 3.69Å; L135-L273 HydrophobicContact CD1-CG 4.4Å; L135-L273 HydrophobicContact CD2-CD2 4.18Å; L135-D274 WeakPolarHBondContact CA-O 3.46Å; L135-L275 HydrophobicContact CB-CD2 4.03Å; L135-L275 HydrophobicContact CD1-CD2 3.71Å; L135-L275 HydrophobicContact CD1-CG 4.42Å; L135-L275 HydrophobicContact CG-CD2 4.46Å
136	L	93.2	Very high	89.5	Confident	39 Å²	39	41 Å²	41	20%	0.204	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	164.3	-178.5	-64.4	162.7	0	0	0	110.6	F138 D274 R276	L136-F138 VanDerWaalsContact C-N 3.29Å; L136-F138 PolarHBondContact O-N 2.93Å; L136-D274 HydrophobicContact CB-CB 4.23Å; L136-D274 PolarHBondContact N-O 3.38Å; L136-R276 VanDerWaalsContact CD1-CD 3.48Å; L136-R276 HydrophobicContact CD1-CG 4.04Å
137	H	91.7	Very high	90.4	Very high	16 Å²	16	38.9 Å²	38.9	7%	0.074	20%	0.199	C	C	.	.	S	Bend	trans	56.8	35.1	169.3	-51.7	127.6	0	0	0	115.5	L119 D274	L119-H137 HydrophobicContact CD2-CB 4.15Å; L119-H137 VanDerWaalsContact CD2-CD2 3.42Å; L119-H137 WeakPolarHBondContact CD2-CD2 3.48Å; L119-H137 PolarHBondContact O-CE1 3.37Å; H137-D274 IonicContact CE1-OD2 3.37Å; H137-D274 PolarHBondContact CE1-OD2 2.67Å; H137-D274 VanDerWaalsContact CE1-OD2 3.31Å; H137-D274 IonicContact CG-OD2 3.75Å; H137-D274 IonicContact ND1-OD2 2.79Å; H137-D274 PolarHBondContact ND1-OD2 2.92Å
138	F	91.9	Very high	91.3	Very high	3 Å²	3	33 Å²	33	1%	0.013	16%	0.163	C	C	.	.			trans	-100.5	164.6	178.5	-153.1	-123.5	0	0	0	112	L135 L136 W140 A143 I148 L239 Y266 L273 F310	L135-F138 HydrophobicContact CD2-CB 4.29Å; L135-F138 HydrophobicContact CD2-CD1 4.3Å; L135-F138 HydrophobicContact CD2-CG 4.17Å; L135-F138 HydrophobicContact CG-CB 4.45Å; L136-F138 VanDerWaalsContact C-N 3.29Å; L136-F138 PolarHBondContact O-N 2.93Å; F138-W140 HydrophobicContact CB-CD2 4.42Å; F138-W140 HydrophobicContact CB-CH2 3.88Å; F138-W140 HydrophobicContact CB-CZ2 3.79Å; F138-W140 HydrophobicContact CB-CZ3 4.25Å; F138-W140 PolarHBondContact O-N 3.48Å; F138-W140 VanDerWaalsContact O-N 3.08Å; F138-W140 PolarHBondContact O-NE1 2.82Å; F138-W140 VanDerWaalsContact O-NE1 3.12Å; F138-A143 HydrophobicContact CD1-CB 3.27Å; F138-A143 HydrophobicContact CE1-CB 3.25Å; F138-A143 HydrophobicContact CZ-CB 4.49Å; F138-I148 HydrophobicContact CD1-CG1 4.49Å; F138-I148 HydrophobicContact CE1-CG1 4.36Å; F138-L239 WeakPolarHBondContact O-CD2 3.48Å; F138-Y266 HydrophobicContact CE2-CG 4.31Å; F138-Y266 HydrophobicContact CZ-CD1 4.06Å; F138-Y266 HydrophobicContact CZ-CD2 4.41Å; F138-Y266 AromaticContact CZ-CG 3.86Å; F138-Y266 HydrophobicContact CZ-CG 3.86Å; F138-L273 HydrophobicContact CD2-CD2 4.08Å; F138-L273 HydrophobicContact CE2-CD2 3.76Å; F138-L273 HydrophobicContact CZ-CD2 4.35Å; F138-F310 HydrophobicContact CE1-CZ 4.15Å; F138-F310 AromaticContact CZ-CZ 3.98Å; F138-F310 HydrophobicContact CZ-CZ 3.98Å
139	D	91	Very high	91.8	Very high	15 Å²	15	28.3 Å²	28.3	8%	0.08	14%	0.14	C	C	.	.			trans	-82.5	85.9	-179.8	-172	0.6	0	0	0	111.3	D141 N142 A143 F310 T312	D139-D141 PolarHBondContact O-N 3.28Å; D139-D141 PolarHBondContact OD1-N 3.19Å; D139-N142 PolarHBondContact O-N 2.89Å; D139-N142 PolarHBondContact OD2-ND2 2.65Å; D139-A143 WeakPolarHBondContact O-CB 3.35Å; D139-A143 PolarHBondContact O-N 3.01Å; D139-F310 HydrophobicContact CB-CD2 4.03Å; D139-F310 HydrophobicContact CB-CE2 3.53Å; D139-F310 HydrophobicContact CB-CZ 4.25Å; D139-F310 VanDerWaalsContact OD2-CD2 3.29Å; D139-F310 WeakPolarHBondContact OD2-CD2 3.22Å; D139-T312 PolarHBondContact OD2-OG1 3.31Å
140	W	91.3	Very high	91.9	Very high	29 Å²	29	26.9 Å²	26.9	11%	0.11	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.7	-175.2	-49.8	112.8	0	0	0	114.7	L135 F138 N142 I148 I167 L239 F242 A244	L135-W140 HydrophobicContact CG-CH2 4.48Å; L135-W140 WeakPolarHBondContact O-CH2 3.4Å; F138-W140 HydrophobicContact CB-CD2 4.42Å; F138-W140 HydrophobicContact CB-CH2 3.88Å; F138-W140 HydrophobicContact CB-CZ2 3.79Å; F138-W140 HydrophobicContact CB-CZ3 4.25Å; F138-W140 PolarHBondContact O-N 3.48Å; F138-W140 VanDerWaalsContact O-N 3.08Å; F138-W140 PolarHBondContact O-NE1 2.82Å; F138-W140 VanDerWaalsContact O-NE1 3.12Å; W140-N142 VanDerWaalsContact C-N 3.31Å; W140-I148 HydrophobicContact CZ3-CD1 3.98Å; W140-I167 HydrophobicContact CE3-CD1 4.15Å; W140-I167 HydrophobicContact CE3-CG2 4.01Å; W140-I167 HydrophobicContact CZ3-CD1 4.14Å; W140-I167 HydrophobicContact CZ3-CG1 4.27Å; W140-I167 HydrophobicContact CZ3-CG2 4.16Å; W140-L239 PolarHBondContact NE1-O 2.92Å; W140-F242 HydrophobicContact CB-CB 4.19Å; W140-F242 HydrophobicContact CB-CD2 3.65Å; W140-F242 HydrophobicContact CB-CE2 4.44Å; W140-F242 HydrophobicContact CB-CG 4.19Å; W140-F242 AromaticContact CD1-CD2 3.99Å; W140-F242 HydrophobicContact CD2-CB 3.63Å; W140-F242 VanDerWaalsContact CE2-O 3.23Å; W140-F242 HydrophobicContact CE3-CB 4.19Å; W140-F242 HydrophobicContact CG-CB 3.59Å; W140-F242 AromaticContact CG-CD2 3.85Å; W140-F242 HydrophobicContact CG-CD2 3.85Å; W140-F242 HydrophobicContact CG-CG 4.1Å; W140-F242 WeakPolarHBondContact CZ2-O 3.06Å; W140-F242 PolarHBondContact NE1-O 3.33Å; W140-A244 HydrophobicContact CH2-CB 3.85Å; W140-A244 HydrophobicContact CZ3-CB 3.92Å
141	D	87.8	Confident	91.9	Very high	51 Å²	51	27.9 Å²	27.9	27%	0.273	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-29.6	176.5	-68.4	-20.1	0	0	0	111.4	D139 R238	D139-D141 PolarHBondContact O-N 3.28Å; D139-D141 PolarHBondContact OD1-N 3.19Å; D141-R238 IonicContact OD1-CZ 3.24Å; D141-R238 VanDerWaalsContact OD1-CZ 3.26Å; D141-R238 IonicContact OD1-NE 3.5Å; D141-R238 PolarHBondContact OD1-NE 2.83Å; D141-R238 IonicContact OD1-NH2 3.43Å; D141-R238 PolarHBondContact OD1-NH2 2.72Å; D141-R238 IonicContact OD2-CZ 3.49Å; D141-R238 IonicContact OD2-NE 2.7Å; D141-R238 PolarHBondContact OD2-NE 2.88Å; D141-R238 VanDerWaalsContact OD2-NE 3.17Å; D141-R238 IonicContact OD2-NH1 2.66Å; D141-R238 IonicContact OD2-NH2 3.48Å; D141-R238 PolarHBondContact OD2-NH2 3.13Å
142	N	86.9	Confident	91.9	Very high	31 Å²	31	24.9 Å²	24.9	17%	0.166	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-27.4	-176.7	-60.6	-56.5	0	0	0	112.9	D139 W140 K144 F310	D139-N142 PolarHBondContact O-N 2.89Å; D139-N142 PolarHBondContact OD2-ND2 2.65Å; W140-N142 VanDerWaalsContact C-N 3.31Å; N142-K144 PolarHBondContact O-N 2.82Å; N142-F310 HydrophobicContact CB-CB 3.8Å; N142-F310 HydrophobicContact CB-CD1 3.51Å; N142-F310 HydrophobicContact CB-CD2 4.1Å; N142-F310 HydrophobicContact CB-CE1 4.05Å; N142-F310 HydrophobicContact CB-CG 3.53Å
143	A	86.3	Confident	91.8	Very high	5 Å²	5	24.5 Å²	24.5	4%	0.041	12%	0.121	C	C	.	.			trans	-83	111.7	-175.4	0	0	0	0	0	112.6	F138 D139	F138-A143 HydrophobicContact CD1-CB 3.27Å; F138-A143 HydrophobicContact CE1-CB 3.25Å; F138-A143 HydrophobicContact CZ-CB 4.49Å; D139-A143 WeakPolarHBondContact O-CB 3.35Å; D139-A143 PolarHBondContact O-N 3.01Å
144	K	89.9	Confident	91.6	Very high	61 Å²	61	28.8 Å²	28.8	27%	0.265	15%	0.151	S	C	.	.			trans	-84.6	158.8	169.1	-70.9	-178.5	-170.6	162.6	0	111.1	N142 E146 T147 I148 D330	N142-K144 PolarHBondContact O-N 2.82Å; K144-E146 HydrophobicContact CB-CB 4.3Å; K144-E146 PolarHBondContact O-N 2.74Å; K144-E146 VanDerWaalsContact O-N 3.17Å; K144-T147 WeakPolarHBondContact O-CB 3.3Å; K144-T147 PolarHBondContact O-N 2.8Å; K144-I148 PolarHBondContact O-N 2.9Å; K144-D330 VanDerWaalsContact CE-OD1 3.3Å; K144-D330 WeakPolarHBondContact CE-OD1 3.32Å; K144-D330 WeakPolarHBondContact CE-OD2 3.38Å; K144-D330 IonicContact NZ-OD1 2.89Å; K144-D330 PolarHBondContact NZ-OD1 3.27Å; K144-D330 IonicContact NZ-OD2 3.1Å; K144-D330 PolarHBondContact NZ-OD2 3.1Å; K144-D330 VanDerWaalsContact NZ-OD2 3.12Å
145	P	93	Very high	91.5	Very high	6 Å²	6	32 Å²	32	4%	0.039	16%	0.164	C	C	.	.	H	α-helix	trans	-59	-28.5	170.6	27.4	-36.3	0	0	0	111.4	T147 I148 Y149 V165 I167 S295 C297	P145-T147 VanDerWaalsContact C-N 3.34Å; P145-T147 PolarHBondContact O-N 3.38Å; P145-I148 PolarHBondContact O-N 3.03Å; P145-Y149 WeakPolarHBondContact O-CB 3.33Å; P145-Y149 PolarHBondContact O-N 3.01Å; P145-V165 HydrophobicContact CB-CB 4.43Å; P145-V165 HydrophobicContact CB-CG1 4.02Å; P145-I167 HydrophobicContact CB-CD1 4.26Å; P145-I167 HydrophobicContact CB-CG1 4.27Å; P145-S295 VanDerWaalsContact CG-OG 3.31Å; P145-S295 WeakPolarHBondContact CG-OG 3.06Å; P145-C297 HydrophobicContact CB-CB 3.75Å; P145-C297 HydrophobicContact CG-CB 4.02Å
146	E	92.6	Very high	91.3	Very high	86 Å²	86	33.7 Å²	33.7	40%	0.402	17%	0.173	S	C	.	.	H	α-helix	trans	-59.6	-43.7	173.8	-64.2	177.7	-177.6	0	0	112.3	K144 Y149 M150 I300 Y305	K144-E146 HydrophobicContact CB-CB 4.3Å; K144-E146 PolarHBondContact O-N 2.74Å; K144-E146 VanDerWaalsContact O-N 3.17Å; E146-Y149 PolarHBondContact O-N 2.87Å; E146-M150 WeakPolarHBondContact O-CB 3.44Å; E146-M150 WeakPolarHBondContact O-CG 3.4Å; E146-M150 PolarHBondContact O-N 2.71Å; E146-I300 VanDerWaalsContact CA-CD1 3.48Å; E146-I300 HydrophobicContact CB-CD1 3.92Å; E146-I300 HydrophobicContact CG-CD1 4.38Å; E146-I300 WeakPolarHBondContact O-CD1 3.46Å; E146-Y305 HydrophobicContact CB-CD2 4.14Å; E146-Y305 HydrophobicContact CB-CE2 3.86Å
147	T	91.2	Very high	91.3	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-45	178.9	-54.7	0	0	0	0	111.5	K144 P145 M150 V151 Y266 Y305	K144-T147 WeakPolarHBondContact O-CB 3.3Å; K144-T147 PolarHBondContact O-N 2.8Å; P145-T147 VanDerWaalsContact C-N 3.34Å; P145-T147 PolarHBondContact O-N 3.38Å; T147-M150 PolarHBondContact O-N 3.46Å; T147-V151 VanDerWaalsContact O-CG2 3.25Å; T147-V151 WeakPolarHBondContact O-CG2 3.34Å; T147-V151 PolarHBondContact O-N 3Å; T147-Y266 HydrophobicContact CG2-CE1 4.46Å; T147-Y266 HydrophobicContact CG2-CE2 3.89Å; T147-Y266 VanDerWaalsContact CG2-OH 3.24Å; T147-Y266 WeakPolarHBondContact CG2-OH 3.3Å; T147-Y305 WeakPolarHBondContact CA-OH 3.49Å; T147-Y305 WeakPolarHBondContact CB-OH 3.34Å; T147-Y305 WeakPolarHBondContact CG2-OH 3.48Å; T147-Y305 PolarHBondContact OG1-OH 3.13Å
148	I	93.2	Very high	91.1	Very high	6 Å²	6	39 Å²	39	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-46.7	178.7	-63.2	165.5	0	0	0	110.2	L135 F138 W140 K144 P145 M150 V151 L152 V165 I167 A244 I246	L135-I148 HydrophobicContact CD2-CD1 3.9Å; L135-I148 HydrophobicContact CD2-CG1 3.98Å; L135-I148 HydrophobicContact CD2-CG2 4.05Å; F138-I148 HydrophobicContact CD1-CG1 4.49Å; F138-I148 HydrophobicContact CE1-CG1 4.36Å; W140-I148 HydrophobicContact CZ3-CD1 3.98Å; K144-I148 PolarHBondContact O-N 2.9Å; P145-I148 PolarHBondContact O-N 3.03Å; I148-M150 PolarHBondContact O-N 2.82Å; I148-V151 PolarHBondContact O-N 2.95Å; I148-L152 HydrophobicContact CG2-CD1 3.76Å; I148-L152 HydrophobicContact CG2-CG 4.38Å; I148-L152 VanDerWaalsContact O-CG 3.28Å; I148-L152 WeakPolarHBondContact O-CG 3.31Å; I148-L152 PolarHBondContact O-N 3.34Å; I148-V165 HydrophobicContact CB-CG1 4.18Å; I148-V165 HydrophobicContact CG2-CG1 3.99Å; I148-I167 HydrophobicContact CD1-CD1 4.17Å; I148-I167 HydrophobicContact CD1-CG1 4.43Å; I148-A244 HydrophobicContact CD1-CB 3.91Å; I148-I246 HydrophobicContact CG2-CD1 4.28Å; I148-I246 HydrophobicContact CG2-CG1 4.31Å
149	Y	94.1	Very high	90.9	Very high	26 Å²	26	50.1 Å²	50.1	10%	0.102	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-47.1	177.7	-177.7	-71	0	0	0	111.3	P145 E146 V151 L152 E153 I162 V165 R298 I300	P145-Y149 WeakPolarHBondContact O-CB 3.33Å; P145-Y149 PolarHBondContact O-N 3.01Å; E146-Y149 PolarHBondContact O-N 2.87Å; Y149-V151 VanDerWaalsContact C-N 3.33Å; Y149-V151 PolarHBondContact O-N 3.18Å; Y149-L152 PolarHBondContact O-N 2.84Å; Y149-E153 HydrophobicContact CD1-CB 4.46Å; Y149-E153 HydrophobicContact CE1-CB 4.4Å; Y149-E153 HydrophobicContact CE1-CG 4.48Å; Y149-E153 VanDerWaalsContact O-CB 3.28Å; Y149-E153 WeakPolarHBondContact O-CB 3.42Å; Y149-E153 PolarHBondContact O-N 2.85Å; Y149-I162 HydrophobicContact CD2-CB 4.11Å; Y149-I162 HydrophobicContact CD2-CD1 4.4Å; Y149-I162 HydrophobicContact CD2-CG2 3.82Å; Y149-I162 HydrophobicContact CE2-CB 3.71Å; Y149-I162 HydrophobicContact CE2-CG2 3.82Å; Y149-V165 HydrophobicContact CD2-CG2 3.99Å; Y149-V165 HydrophobicContact CG-CG2 4.49Å; Y149-R298 WeakPolarHBondContact CE2-O 3.44Å; Y149-I300 HydrophobicContact CD1-CB 4.4Å; Y149-I300 HydrophobicContact CD1-CD1 3.38Å; Y149-I300 HydrophobicContact CD1-CG1 3.79Å; Y149-I300 HydrophobicContact CE1-CD1 4.27Å; Y149-I300 HydrophobicContact CE1-CG1 4.23Å; Y149-I300 HydrophobicContact CG-CD1 3.62Å; Y149-I300 HydrophobicContact CG-CG1 4.14Å
150	M	91.9	Very high	90.9	Very high	46 Å²	46	50.1 Å²	50.1	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-38.6	179.6	-76.2	-56.1	-48	0	0	113	E146 T147 I148 I300 K302 Y305	E146-M150 WeakPolarHBondContact O-CB 3.44Å; E146-M150 WeakPolarHBondContact O-CG 3.4Å; E146-M150 PolarHBondContact O-N 2.71Å; T147-M150 PolarHBondContact O-N 3.46Å; I148-M150 PolarHBondContact O-N 2.82Å; M150-I300 HydrophobicContact CG-CD1 3.74Å; M150-I300 HydrophobicContact CG-CG2 4.18Å; M150-I300 HydrophobicContact SD-CB 4.1Å; M150-I300 HydrophobicContact SD-CD1 4.06Å; M150-I300 HydrophobicContact SD-CG2 3.74Å; M150-K302 HydrophobicContact CE-CG 4.46Å; M150-K302 HydrophobicContact SD-CG 4.41Å; M150-Y305 HydrophobicContact CB-CE1 4.09Å; M150-Y305 HydrophobicContact CG-CD1 3.73Å; M150-Y305 HydrophobicContact CG-CD2 4.27Å; M150-Y305 HydrophobicContact CG-CE1 3.73Å; M150-Y305 HydrophobicContact CG-CE2 4.29Å; M150-Y305 HydrophobicContact CG-CG 4Å
151	V	91.7	Very high	91	Very high	28 Å²	28	53.5 Å²	53.5	17%	0.17	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-53.2	176	171.8	0	0	0	0	109.9	T147 I148 Y149 E153 S154 F155 Y266 L273	T147-V151 VanDerWaalsContact O-CG2 3.25Å; T147-V151 WeakPolarHBondContact O-CG2 3.34Å; T147-V151 PolarHBondContact O-N 3Å; I148-V151 PolarHBondContact O-N 2.95Å; Y149-V151 VanDerWaalsContact C-N 3.33Å; Y149-V151 PolarHBondContact O-N 3.18Å; V151-E153 VanDerWaalsContact C-N 3.29Å; V151-E153 PolarHBondContact O-N 3.29Å; V151-S154 WeakPolarHBondContact O-CB 3.45Å; V151-S154 PolarHBondContact O-N 3.2Å; V151-S154 PolarHBondContact O-OG 2.86Å; V151-F155 HydrophobicContact CG1-CE2 4.29Å; V151-F155 VanDerWaalsContact O-CD2 3.26Å; V151-F155 WeakPolarHBondContact O-CD2 3.3Å; V151-Y266 HydrophobicContact CG2-CD2 3.5Å; V151-Y266 VanDerWaalsContact CG2-CD2 3.5Å; V151-Y266 HydrophobicContact CG2-CE2 3.28Å; V151-L273 HydrophobicContact CG1-CD1 4.34Å
152	L	93	Very high	91.3	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-32.4	-176.4	-63.4	175.1	0	0	0	112.1	I148 Y149 S154 F155 L156 I162 I246 I257 C261	I148-L152 HydrophobicContact CG2-CD1 3.76Å; I148-L152 HydrophobicContact CG2-CG 4.38Å; I148-L152 VanDerWaalsContact O-CG 3.28Å; I148-L152 WeakPolarHBondContact O-CG 3.31Å; I148-L152 PolarHBondContact O-N 3.34Å; Y149-L152 PolarHBondContact O-N 2.84Å; L152-S154 PolarHBondContact O-N 3.23Å; L152-F155 PolarHBondContact O-N 3.39Å; L152-L156 PolarHBondContact O-N 2.85Å; L152-I162 HydrophobicContact CB-CD1 3.55Å; L152-I246 HydrophobicContact CD1-CB 4.44Å; L152-I246 HydrophobicContact CD1-CD1 3.43Å; L152-I246 VanDerWaalsContact CD1-CD1 3.43Å; L152-I246 HydrophobicContact CD1-CG1 3.78Å; L152-I246 HydrophobicContact CD1-CG2 3.99Å; L152-I257 HydrophobicContact CD2-CG2 3.74Å; L152-C261 HydrophobicContact CD2-CB 4.46Å
153	E	92	Very high	91.7	Very high	48 Å²	48	54.4 Å²	54.4	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-34.8	176.3	-166.1	-176.6	-173.5	0	0	111.8	Y149 V151 F155 L156 K302	Y149-E153 HydrophobicContact CD1-CB 4.46Å; Y149-E153 HydrophobicContact CE1-CB 4.4Å; Y149-E153 HydrophobicContact CE1-CG 4.48Å; Y149-E153 VanDerWaalsContact O-CB 3.28Å; Y149-E153 WeakPolarHBondContact O-CB 3.42Å; Y149-E153 PolarHBondContact O-N 2.85Å; V151-E153 VanDerWaalsContact C-N 3.29Å; V151-E153 PolarHBondContact O-N 3.29Å; E153-F155 PolarHBondContact O-N 2.87Å; E153-L156 HydrophobicContact CB-CD1 4.21Å; E153-L156 HydrophobicContact CG-CD1 3.82Å; E153-L156 PolarHBondContact O-N 2.79Å; E153-K302 VanDerWaalsContact CD-CE 3.48Å; E153-K302 WeakPolarHBondContact OE1-CE 3.3Å; E153-K302 IonicContact OE1-NZ 2.81Å; E153-K302 PolarHBondContact OE1-NZ 3.12Å; E153-K302 WeakPolarHBondContact OE2-CE 3.38Å; E153-K302 IonicContact OE2-NZ 3.06Å
154	S	90.7	Very high	92.1	Very high	90 Å²	90	55.8 Å²	55.8	63%	0.629	29%	0.289	S	S	*	.	H	α-helix	trans	-68.7	-21.4	177.9	76	0	0	0	0	114.1	V151 L152	V151-S154 WeakPolarHBondContact O-CB 3.45Å; V151-S154 PolarHBondContact O-N 3.2Å; V151-S154 PolarHBondContact O-OG 2.86Å; L152-S154 PolarHBondContact O-N 3.23Å
155	F	92.8	Very high	92.4	Very high	77 Å²	77	52.9 Å²	52.9	34%	0.338	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	4.3	179.2	-64.9	-80.6	0	0	0	113.2	V151 L152 E153 C261 L264	V151-F155 HydrophobicContact CG1-CE2 4.29Å; V151-F155 VanDerWaalsContact O-CD2 3.26Å; V151-F155 WeakPolarHBondContact O-CD2 3.3Å; L152-F155 PolarHBondContact O-N 3.39Å; E153-F155 PolarHBondContact O-N 2.87Å; F155-C261 VanDerWaalsContact CB-SG 3.52Å; F155-C261 WeakPolarHBondContact CD2-SG 3.13Å; F155-C261 WeakPolarHBondContact CG-SG 3.5Å; F155-L264 HydrophobicContact CE1-CD1 3.9Å; F155-L264 HydrophobicContact CZ-CD1 3.8Å
156	L	92.5	Very high	92.5	Very high	37 Å²	37	52.7 Å²	52.7	19%	0.194	28%	0.275	C	S	.	.			trans	-65.3	137.5	178.9	-75.6	167.6	0	0	0	111.6	L152 E153 I162 I257	L152-L156 PolarHBondContact O-N 2.85Å; E153-L156 HydrophobicContact CB-CD1 4.21Å; E153-L156 HydrophobicContact CG-CD1 3.82Å; E153-L156 PolarHBondContact O-N 2.79Å; L156-I162 HydrophobicContact CD1-CD1 4.28Å; L156-I162 HydrophobicContact CD1-CG1 4.09Å; L156-I162 HydrophobicContact CD2-CG1 3.97Å; L156-I162 HydrophobicContact CG-CG1 4.39Å; L156-I257 HydrophobicContact CD2-CD1 3.57Å
157	P	91.8	Very high	92.7	Very high	50 Å²	50	49.2 Å²	49.2	33%	0.325	26%	0.259	S	S	.	.			trans	-64.9	157.5	167	30	-34.9	0	0	0	110.1	R159 G160 T253 A256	P157-R159 PolarHBondContact O-N 2.72Å; P157-G160 PolarHBondContact O-N 3.48Å; P157-T253 HydrophobicContact CG-CG2 3.83Å; P157-A256 HydrophobicContact CG-CB 4.34Å
158	A	88.1	Confident	92.9	Very high	116 Å²	116	50.9 Å²	50.9	96%	0.959	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-12.5	-170.7	0	0	0	0	0	116.7
159	R	87.5	Confident	93	Very high	237 Å²	237	50.8 Å²	50.8	89%	0.894	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-5.1	177.6	-68.7	-173.7	174.6	178	-1.2	114.2	P157	P157-R159 PolarHBondContact O-N 2.72Å
160	G	90.4	Very high	93	Very high	14 Å²	14	50.3 Å²	50.3	14%	0.144	27%	0.266	C	S	.	.			trans	-87	147.5	-175.6	0	0	0	0	0	112.3	P157 D249 T253	P157-G160 PolarHBondContact O-N 3.48Å; G160-D249 WeakPolarHBondContact CA-OD2 3.25Å; G160-T253 VanDerWaalsContact CA-CG2 3.42Å
161	H	93.2	Very high	93	Very high	100 Å²	100	55.3 Å²	55.3	46%	0.463	29%	0.289	S	S	.	.			trans	-136.7	154	168.9	65.9	-74.8	0	0	0	111.1	D249	H161-D249 WeakPolarHBondContact CE1-CB 3.41Å; H161-D249 IonicContact CE1-OD2 3.51Å; H161-D249 PolarHBondContact CE1-OD2 3.47Å; H161-D249 IonicContact CG-OD2 3.6Å; H161-D249 PolarHBondContact N-OD2 3.11Å; H161-D249 VanDerWaalsContact N-OD2 3.12Å; H161-D249 VanDerWaalsContact ND1-CB 3.34Å; H161-D249 WeakPolarHBondContact ND1-CB 2.89Å; H161-D249 VanDerWaalsContact ND1-CG 3.32Å; H161-D249 IonicContact ND1-OD2 2.7Å; H161-D249 PolarHBondContact ND1-OD2 3.19Å; H161-D249 PolarHBondContact O-N 2.77Å
162	I	95.4	Very high	93.1	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	122.8	175	-58.1	170.3	0	0	0	106.5	Y149 L152 L156 V165 I246 F248	Y149-I162 HydrophobicContact CD2-CB 4.11Å; Y149-I162 HydrophobicContact CD2-CD1 4.4Å; Y149-I162 HydrophobicContact CD2-CG2 3.82Å; Y149-I162 HydrophobicContact CE2-CB 3.71Å; Y149-I162 HydrophobicContact CE2-CG2 3.82Å; L152-I162 HydrophobicContact CB-CD1 3.55Å; L156-I162 HydrophobicContact CD1-CD1 4.28Å; L156-I162 HydrophobicContact CD1-CG1 4.09Å; L156-I162 HydrophobicContact CD2-CG1 3.97Å; L156-I162 HydrophobicContact CG-CG1 4.39Å; I162-V165 HydrophobicContact CG2-CG2 3.85Å; I162-I246 HydrophobicContact CG2-CG2 3.85Å; I162-F248 HydrophobicContact CD1-CE1 4.39Å; I162-F248 HydrophobicContact CG1-CD1 3.96Å; I162-F248 HydrophobicContact CG1-CE1 3.77Å
163	E	94.5	Very high	93.1	Very high	96 Å²	96	57.7 Å²	57.7	45%	0.449	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-45	178.4	-65.1	-170.1	162.1	0	0	110.5	E247	E163-E247 HydrophobicContact CB-CB 4.31Å; E163-E247 PolarHBondContact N-O 2.82Å
164	K	94.8	Very high	93.1	Very high	34 Å²	34	56.6 Å²	56.6	15%	0.148	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	141.6	-172.5	-175.6	170.3	153.9	162.4	0	112	T166 E247 E296 R298	K164-T166 HydrophobicContact CD-CG2 4.21Å; K164-T166 HydrophobicContact CG-CG2 4.09Å; K164-E247 HydrophobicContact CB-CB 4.47Å; K164-E247 PolarHBondContact N-O 3.46Å; K164-E247 PolarHBondContact O-N 3.39Å; K164-E296 HydrophobicContact CD-CG 4.09Å; K164-E296 WeakPolarHBondContact CD-OE1 3Å; K164-E296 WeakPolarHBondContact CE-OE1 3.42Å; K164-E296 VanDerWaalsContact CE-OE2 3.3Å; K164-E296 WeakPolarHBondContact CE-OE2 3.29Å; K164-E296 HydrophobicContact CG-CG 4.05Å; K164-E296 IonicContact NZ-OE1 2.89Å; K164-E296 PolarHBondContact NZ-OE1 3.34Å; K164-E296 IonicContact NZ-OE2 2.76Å; K164-E296 PolarHBondContact NZ-OE2 2.93Å; K164-R298 HydrophobicContact CB-CG 4.32Å; K164-R298 HydrophobicContact CD-CG 4.34Å; K164-R298 HydrophobicContact CG-CG 4.09Å
165	V	96.1	Very high	93.2	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.3	168.4	179.8	0	0	0	0	108.4	P145 I148 Y149 I162 I246 E296 C297	P145-V165 HydrophobicContact CB-CB 4.43Å; P145-V165 HydrophobicContact CB-CG1 4.02Å; I148-V165 HydrophobicContact CB-CG1 4.18Å; I148-V165 HydrophobicContact CG2-CG1 3.99Å; Y149-V165 HydrophobicContact CD2-CG2 3.99Å; Y149-V165 HydrophobicContact CG-CG2 4.49Å; I162-V165 HydrophobicContact CG2-CG2 3.85Å; V165-I246 HydrophobicContact CG1-CG1 4.28Å; V165-I246 HydrophobicContact CG2-CG1 4.15Å; V165-I246 HydrophobicContact CG2-CG2 4.03Å; V165-E296 CarbonylContact O-C 3.59Å; V165-E296 WeakPolarHBondContact O-CA 3.34Å; V165-C297 PolarHBondContact N-O 3.39Å; V165-C297 PolarHBondContact O-N 3.02Å
166	T	95.7	Very high	93.2	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128.6	-179.6	35.8	0	0	0	0	111.4	K164 Y168 A244 I245 S295 E296	K164-T166 HydrophobicContact CD-CG2 4.21Å; K164-T166 HydrophobicContact CG-CG2 4.09Å; T166-Y168 VanDerWaalsContact CB-CE2 3.45Å; T166-Y168 HydrophobicContact CG2-CE2 4.4Å; T166-Y168 WeakPolarHBondContact OG1-CE2 3.2Å; T166-A244 CarbonylContact O-C 3.5Å; T166-A244 WeakPolarHBondContact O-CA 3.47Å; T166-I245 PolarHBondContact N-O 3.39Å; T166-I245 PolarHBondContact O-N 3.32Å; T166-I245 PolarHBondContact OG1-O 2.83Å; T166-S295 CarbonylContact C-O 3.54Å; T166-S295 WeakPolarHBondContact CA-O 3.26Å; T166-E296 HydrophobicContact CG2-CB 3.92Å; T166-E296 HydrophobicContact CG2-CG 3.94Å
167	I	96.3	Very high	93.2	Very high	13 Å²	13	57.5 Å²	57.5	7%	0.067	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.4	173.5	-56.5	-179.1	0	0	0	108.3	W140 P145 I148 F242 A244 V294 S295	W140-I167 HydrophobicContact CE3-CD1 4.15Å; W140-I167 HydrophobicContact CE3-CG2 4.01Å; W140-I167 HydrophobicContact CZ3-CD1 4.14Å; W140-I167 HydrophobicContact CZ3-CG1 4.27Å; W140-I167 HydrophobicContact CZ3-CG2 4.16Å; P145-I167 HydrophobicContact CB-CD1 4.26Å; P145-I167 HydrophobicContact CB-CG1 4.27Å; I148-I167 HydrophobicContact CD1-CD1 4.17Å; I148-I167 HydrophobicContact CD1-CG1 4.43Å; I167-F242 HydrophobicContact CG2-CB 3.9Å; I167-F242 HydrophobicContact CG2-CD1 4.19Å; I167-F242 HydrophobicContact CG2-CG 4.35Å; I167-A244 HydrophobicContact CG1-CB 4.05Å; I167-V294 WeakPolarHBondContact O-CA 2.78Å; I167-S295 PolarHBondContact N-O 3.32Å; I167-S295 PolarHBondContact O-N 3.48Å
168	Y	95.3	Very high	93.2	Very high	39 Å²	39	56.8 Å²	56.8	15%	0.153	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.9	177.6	-66.7	-82.1	0	0	0	110.7	T166 F242 Y243 I245 F284 V286 V294	T166-Y168 VanDerWaalsContact CB-CE2 3.45Å; T166-Y168 HydrophobicContact CG2-CE2 4.4Å; T166-Y168 WeakPolarHBondContact OG1-CE2 3.2Å; Y168-F242 CarbonylContact O-C 3.59Å; Y168-F242 VanDerWaalsContact O-CA 3.26Å; Y168-F242 WeakPolarHBondContact O-CA 3.35Å; Y168-F242 WeakPolarHBondContact O-CB 3.34Å; Y168-Y243 VanDerWaalsContact CB-CZ 3.48Å; Y168-Y243 HydrophobicContact CD2-CE2 4.16Å; Y168-Y243 HydrophobicContact CG-CE2 4.36Å; Y168-Y243 PolarHBondContact N-O 2.78Å; Y168-Y243 WeakPolarHBondContact O-CD1 3.45Å; Y168-Y243 PolarHBondContact O-N 3.32Å; Y168-I245 HydrophobicContact CD2-CB 4.46Å; Y168-I245 HydrophobicContact CD2-CD1 3.61Å; Y168-I245 HydrophobicContact CD2-CG1 4.17Å; Y168-I245 HydrophobicContact CE2-CB 4.23Å; Y168-I245 HydrophobicContact CE2-CD1 3.58Å; Y168-I245 HydrophobicContact CE2-CG1 4.28Å; Y168-F284 HydrophobicContact CE1-CB 4.32Å; Y168-F284 HydrophobicContact CE2-CB 4.47Å; Y168-V286 HydrophobicContact CD1-CG2 3.68Å; Y168-V286 HydrophobicContact CE1-CG2 4.39Å; Y168-V294 HydrophobicContact CD1-CG1 4.02Å; Y168-V294 HydrophobicContact CD1-CG2 4Å; Y168-V294 HydrophobicContact CE1-CG1 3.88Å; Y168-V294 HydrophobicContact CE1-CG2 4.44Å
169	P	94.9	Very high	93.4	Very high	4 Å²	4	54.6 Å²	54.6	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	132.8	168.6	30.7	-33.8	0	0	0	109.8	I174 M177 F242 V286 L293	P169-I174 HydrophobicContact CB-CD1 4.23Å; P169-I174 HydrophobicContact CB-CG1 3.89Å; P169-I174 HydrophobicContact CG-CD1 4.14Å; P169-I174 HydrophobicContact CG-CG1 4.28Å; P169-M177 HydrophobicContact CB-CE 4.3Å; P169-F242 HydrophobicContact CB-CD1 3.9Å; P169-F242 HydrophobicContact CB-CE1 3.81Å; P169-V286 HydrophobicContact CG-CG1 3.87Å; P169-V286 HydrophobicContact CG-CG2 4.38Å; P169-L293 HydrophobicContact CB-CD1 4.5Å; P169-L293 HydrophobicContact CG-CB 4.47Å
170	S	93.8	Very high	93.6	Very high	17 Å²	17	44 Å²	44	12%	0.119	21%	0.214	C	C	.	.			trans	-74.1	152.4	174.6	78.9	0	0	0	0	110.7	F172 G173 I174 K240 Y241	S170-F172 PolarHBondContact O-N 3.2Å; S170-G173 CarbonylContact O-C 3.6Å; S170-G173 WeakPolarHBondContact O-CA 3Å; S170-G173 PolarHBondContact O-N 3.01Å; S170-G173 PolarHBondContact OG-N 2.86Å; S170-I174 WeakPolarHBondContact O-CG1 3.34Å; S170-I174 PolarHBondContact O-N 3.18Å; S170-K240 WeakPolarHBondContact CB-O 3.4Å; S170-K240 PolarHBondContact OG-O 3.47Å; S170-Y241 PolarHBondContact N-O 2.83Å; S170-Y241 PolarHBondContact OG-O 2.96Å
171	E	92.8	Very high	93.5	Very high	150 Å²	150	47.6 Å²	47.6	70%	0.701	24%	0.243	S	C	*	.	H	α-helix	trans	-56.7	-33.4	174	-64.2	-175.4	-175.8	0	0	112.3	K175	E171-K175 WeakPolarHBondContact O-CG 3.43Å; E171-K175 PolarHBondContact O-N 2.88Å; E171-K175 VanDerWaalsContact O-N 3.16Å
172	F	92.7	Very high	93.4	Very high	82 Å²	82	49.4 Å²	49.4	36%	0.36	26%	0.255	S	S	.	.	H	α-helix	trans	-65.4	-48.6	173.9	176.3	-99.3	0	0	0	110.9	S170 I174 K175 R176 K240 Y241	S170-F172 PolarHBondContact O-N 3.2Å; F172-I174 PolarHBondContact O-N 3.35Å; F172-K175 PolarHBondContact O-N 2.92Å; F172-R176 HydrophobicContact CD1-CG 4.21Å; F172-R176 HydrophobicContact CD2-CG 4.41Å; F172-R176 HydrophobicContact CE1-CG 3.83Å; F172-R176 HydrophobicContact CE2-CG 4.05Å; F172-R176 HydrophobicContact CG-CG 4.49Å; F172-R176 HydrophobicContact CZ-CG 3.74Å; F172-R176 WeakPolarHBondContact O-CB 3.43Å; F172-R176 VanDerWaalsContact O-CG 3.3Å; F172-R176 WeakPolarHBondContact O-CG 3.28Å; F172-R176 PolarHBondContact O-N 3.39Å; F172-K240 HydrophobicContact CD1-CB 4.03Å; F172-K240 HydrophobicContact CE1-CB 4.23Å; F172-Y241 HydrophobicContact CD1-CD1 4.23Å; F172-Y241 HydrophobicContact CD1-CE1 4.38Å; F172-Y241 HydrophobicContact CE1-CD1 4.14Å; F172-Y241 AromaticContact CE1-CE1 3.9Å; F172-Y241 HydrophobicContact CE1-CE1 3.9Å
173	G	93	Very high	93	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.8	-44.3	176.4	0	0	0	0	0	112.3	S170 K175 R176 M177	S170-G173 CarbonylContact O-C 3.6Å; S170-G173 WeakPolarHBondContact O-CA 3Å; S170-G173 PolarHBondContact O-N 3.01Å; S170-G173 PolarHBondContact OG-N 2.86Å; G173-K175 PolarHBondContact O-N 3.19Å; G173-R176 PolarHBondContact O-N 2.66Å; G173-M177 VanDerWaalsContact O-CB 3.3Å; G173-M177 WeakPolarHBondContact O-CB 3.28Å; G173-M177 WeakPolarHBondContact O-CE 3.16Å; G173-M177 VanDerWaalsContact O-CG 3.22Å; G173-M177 WeakPolarHBondContact O-CG 3.48Å; G173-M177 PolarHBondContact O-N 2.93Å
174	I	93	Very high	92.8	Very high	25 Å²	25	50.4 Å²	50.4	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-57.6	-50.9	177.7	-69.5	169.5	0	0	0	111	P169 S170 F172 R176 M177 A178 Y290	P169-I174 HydrophobicContact CB-CD1 4.23Å; P169-I174 HydrophobicContact CB-CG1 3.89Å; P169-I174 HydrophobicContact CG-CD1 4.14Å; P169-I174 HydrophobicContact CG-CG1 4.28Å; S170-I174 WeakPolarHBondContact O-CG1 3.34Å; S170-I174 PolarHBondContact O-N 3.18Å; F172-I174 PolarHBondContact O-N 3.35Å; I174-R176 PolarHBondContact O-N 3.14Å; I174-M177 HydrophobicContact CG1-CE 4.43Å; I174-M177 PolarHBondContact O-N 2.75Å; I174-A178 WeakPolarHBondContact O-CB 3.11Å; I174-A178 PolarHBondContact O-N 3.27Å; I174-Y290 HydrophobicContact CD1-CD2 4.38Å; I174-Y290 HydrophobicContact CG1-CD2 4.36Å; I174-Y290 HydrophobicContact CG1-CG 4.28Å; I174-Y290 HydrophobicContact CG2-CD2 3.84Å; I174-Y290 HydrophobicContact CG2-CE1 4.21Å; I174-Y290 HydrophobicContact CG2-CE2 3.41Å; I174-Y290 VanDerWaalsContact CG2-CE2 3.41Å; I174-Y290 HydrophobicContact CG2-CG 4.42Å
175	K	93.5	Very high	92.5	Very high	130 Å²	130	49.3 Å²	49.3	57%	0.565	26%	0.257	S	S	*	.	H	α-helix	trans	-60.8	-46.3	177.8	-72.1	170	-176.6	164.5	0	111.2	E171 F172 G173 A178 D179	E171-K175 WeakPolarHBondContact O-CG 3.43Å; E171-K175 PolarHBondContact O-N 2.88Å; E171-K175 VanDerWaalsContact O-N 3.16Å; F172-K175 PolarHBondContact O-N 2.92Å; G173-K175 PolarHBondContact O-N 3.19Å; K175-A178 PolarHBondContact O-N 3.36Å; K175-D179 PolarHBondContact O-N 3.06Å
176	R	93	Very high	91.9	Very high	50 Å²	50	53 Å²	53	19%	0.189	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-45.7	178.8	-73.4	-53.5	-159.4	114.1	-8.7	112.9	F172 G173 I174 A178 D179 E180 E187 Y241	F172-R176 HydrophobicContact CD1-CG 4.21Å; F172-R176 HydrophobicContact CD2-CG 4.41Å; F172-R176 HydrophobicContact CE1-CG 3.83Å; F172-R176 HydrophobicContact CE2-CG 4.05Å; F172-R176 HydrophobicContact CG-CG 4.49Å; F172-R176 HydrophobicContact CZ-CG 3.74Å; F172-R176 WeakPolarHBondContact O-CB 3.43Å; F172-R176 VanDerWaalsContact O-CG 3.3Å; F172-R176 WeakPolarHBondContact O-CG 3.28Å; F172-R176 PolarHBondContact O-N 3.39Å; G173-R176 PolarHBondContact O-N 2.66Å; I174-R176 PolarHBondContact O-N 3.14Å; R176-A178 VanDerWaalsContact C-N 3.29Å; R176-A178 PolarHBondContact O-N 3.04Å; R176-D179 PolarHBondContact O-N 3.39Å; R176-E180 VanDerWaalsContact O-CB 3.29Å; R176-E180 WeakPolarHBondContact O-CB 3.48Å; R176-E180 VanDerWaalsContact O-CG 3.25Å; R176-E180 WeakPolarHBondContact O-CG 3.44Å; R176-E180 PolarHBondContact O-N 3.1Å; R176-E187 IonicContact CZ-OE1 3.32Å; R176-E187 IonicContact NH1-OE1 3.19Å; R176-E187 PolarHBondContact NH1-OE1 2.65Å; R176-E187 IonicContact NH1-OE2 2.71Å; R176-E187 PolarHBondContact NH1-OE2 3.33Å; R176-E187 IonicContact NH2-OE1 2.85Å; R176-E187 PolarHBondContact NH2-OE1 3.31Å; R176-Y241 HydrophobicContact CB-CE1 3.78Å; R176-Y241 HydrophobicContact CB-CE2 4.24Å; R176-Y241 HydrophobicContact CG-CE1 3.93Å
177	M	90.9	Very high	91.2	Very high	43 Å²	43	54.9 Å²	54.9	21%	0.212	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-38.8	177	-73.4	-174.7	-66.7	0	0	111.3	P169 G173 I174 A181 Y241 F242 L293	P169-M177 HydrophobicContact CB-CE 4.3Å; G173-M177 VanDerWaalsContact O-CB 3.3Å; G173-M177 WeakPolarHBondContact O-CB 3.28Å; G173-M177 WeakPolarHBondContact O-CE 3.16Å; G173-M177 VanDerWaalsContact O-CG 3.22Å; G173-M177 WeakPolarHBondContact O-CG 3.48Å; G173-M177 PolarHBondContact O-N 2.93Å; I174-M177 HydrophobicContact CG1-CE 4.43Å; I174-M177 PolarHBondContact O-N 2.75Å; M177-A181 VanDerWaalsContact O-CB 3.29Å; M177-A181 WeakPolarHBondContact O-CB 3.48Å; M177-A181 PolarHBondContact O-N 3.28Å; M177-Y241 HydrophobicContact CG-CD2 4.04Å; M177-Y241 HydrophobicContact CG-CE2 4.24Å; M177-F242 HydrophobicContact CE-CZ 4.2Å; M177-F242 HydrophobicContact SD-CE2 4.48Å; M177-F242 HydrophobicContact SD-CZ 3.99Å; M177-L293 HydrophobicContact CE-CD1 3.73Å; M177-L293 HydrophobicContact SD-CD1 4.18Å
178	A	92.2	Very high	90.5	Very high	36 Å²	36	56 Å²	56	30%	0.298	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-44.7	174.6	0	0	0	0	0	112.1	I174 K175 R176 A181 L182	I174-A178 WeakPolarHBondContact O-CB 3.11Å; I174-A178 PolarHBondContact O-N 3.27Å; K175-A178 PolarHBondContact O-N 3.36Å; R176-A178 VanDerWaalsContact C-N 3.29Å; R176-A178 PolarHBondContact O-N 3.04Å; A178-A181 PolarHBondContact O-N 2.69Å; A178-L182 PolarHBondContact O-N 2.95Å
179	D	92.3	Very high	89.8	Confident	69 Å²	69	58.9 Å²	58.9	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-40.6	177.6	-71.2	-23.2	0	0	0	112.3	K175 R176 L182 H183 I186	K175-D179 PolarHBondContact O-N 3.06Å; R176-D179 PolarHBondContact O-N 3.39Å; D179-L182 PolarHBondContact O-N 3.41Å; D179-H183 PolarHBondContact O-N 3.41Å; D179-H183 PolarHBondContact O-ND1 3.03Å; D179-I186 HydrophobicContact CB-CD1 4.28Å
180	E	91.7	Very high	88.7	Confident	16 Å²	16	64.2 Å²	64.2	8%	0.075	34%	0.336	C	S	.	.	H	α-helix	trans	-67.6	-37.5	176.9	-77.4	178.1	-177.2	0	0	112.5	R176 L182 G184 Y234 Y241	R176-E180 VanDerWaalsContact O-CB 3.29Å; R176-E180 WeakPolarHBondContact O-CB 3.48Å; R176-E180 VanDerWaalsContact O-CG 3.25Å; R176-E180 WeakPolarHBondContact O-CG 3.44Å; R176-E180 PolarHBondContact O-N 3.1Å; E180-L182 PolarHBondContact O-N 2.91Å; E180-G184 WeakPolarHBondContact O-CA 3.48Å; E180-G184 PolarHBondContact O-N 3.34Å; E180-Y234 WeakPolarHBondContact OE1-CE2 3.33Å; E180-Y234 PolarHBondContact OE1-OH 2.98Å; E180-Y241 PolarHBondContact OE1-OH 3.19Å
181	A	88.8	Confident	87.5	Confident	89 Å²	89	65.3 Å²	65.3	74%	0.736	34%	0.344	S	S	*	.	H	α-helix	trans	-61.5	-33.5	175.7	0	0	0	0	0	111.8	M177 A178	M177-A181 VanDerWaalsContact O-CB 3.29Å; M177-A181 WeakPolarHBondContact O-CB 3.48Å; M177-A181 PolarHBondContact O-N 3.28Å; A178-A181 PolarHBondContact O-N 2.69Å
182	L	90.2	Very high	85.9	Confident	138 Å²	138	66.3 Å²	66.3	72%	0.723	35%	0.348	S	S	*	.	H	α-helix	trans	-85.4	-42	179.8	-68	175.4	0	0	0	113.2	A178 D179 E180	A178-L182 PolarHBondContact O-N 2.95Å; D179-L182 PolarHBondContact O-N 3.41Å; E180-L182 PolarHBondContact O-N 2.91Å
183	H	88.1	Confident	84.3	Confident	115 Å²	115	65 Å²	65	53%	0.532	35%	0.349	S	S	.	.	H	α-helix	trans	-126.6	-4.5	-166.7	-50.3	95.4	0	0	0	114.3	D179 R189	D179-H183 PolarHBondContact O-N 3.41Å; D179-H183 PolarHBondContact O-ND1 3.03Å; H183-R189 VanDerWaalsContact C-NH2 3.31Å; H183-R189 PolarHBondContact O-NE 3.42Å; H183-R189 PolarHBondContact O-NH2 3.46Å
184	G	88.7	Confident	82.7	Confident	7 Å²	7	67 Å²	67	7%	0.072	36%	0.36	C	S	.	.			trans	68.2	-178.8	-167.5	0	0	0	0	0	113.8	E180 I186 R189 W324	E180-G184 WeakPolarHBondContact O-CA 3.48Å; E180-G184 PolarHBondContact O-N 3.34Å; G184-I186 PolarHBondContact O-N 3.25Å; G184-I186 VanDerWaalsContact O-N 3.08Å; G184-R189 PolarHBondContact O-NH2 3.5Å; G184-W324 VanDerWaalsContact CA-CZ2 3.44Å
185	P	88.5	Confident	80.7	Confident	10 Å²	10	70.7 Å²	70.7	7%	0.065	38%	0.384	C	S	.	.			trans	-65.2	111	-173.6	25.7	-34.6	0	0	0	110.4	E187 L188 Y234 W324	P185-E187 VanDerWaalsContact C-N 3.28Å; P185-E187 PolarHBondContact O-N 3.01Å; P185-L188 HydrophobicContact CB-CB 4.4Å; P185-L188 HydrophobicContact CB-CD1 4.04Å; P185-L188 HydrophobicContact CB-CG 4.02Å; P185-L188 HydrophobicContact CG-CB 4.18Å; P185-L188 HydrophobicContact CG-CD1 3.71Å; P185-L188 HydrophobicContact CG-CG 4.06Å; P185-L188 PolarHBondContact O-N 3.38Å; P185-Y234 HydrophobicContact CB-CD2 4.08Å; P185-Y234 HydrophobicContact CB-CE1 4.37Å; P185-Y234 HydrophobicContact CB-CE2 3.58Å; P185-W324 VanDerWaalsContact CD-CE2 3.46Å; P185-W324 VanDerWaalsContact CD-CZ3 3.45Å; P185-W324 HydrophobicContact CG-CD2 3.81Å; P185-W324 HydrophobicContact CG-CE3 3.69Å; P185-W324 HydrophobicContact CG-CG 4.16Å; P185-W324 HydrophobicContact CG-CZ3 4.16Å
186	I	83.7	Confident	78.4	Confident	79 Å²	79	71.5 Å²	71.5	41%	0.405	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-62.4	-38.6	-173.5	-62.3	160.8	0	0	0	110.4	D179 G184 L188 R189	D179-I186 HydrophobicContact CB-CD1 4.28Å; G184-I186 PolarHBondContact O-N 3.25Å; G184-I186 VanDerWaalsContact O-N 3.08Å; I186-L188 PolarHBondContact O-N 2.97Å; I186-R189 WeakPolarHBondContact O-CB 3.26Å; I186-R189 PolarHBondContact O-N 3.33Å
187	E	81	Confident	76.1	Confident	41 Å²	41	74 Å²	74	19%	0.192	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-58.8	-30.6	179.3	-70.8	71.6	-158.2	0	0	113.2	R176 P185 R189 R230 Y234	R176-E187 IonicContact CZ-OE1 3.32Å; R176-E187 IonicContact NH1-OE1 3.19Å; R176-E187 PolarHBondContact NH1-OE1 2.65Å; R176-E187 IonicContact NH1-OE2 2.71Å; R176-E187 PolarHBondContact NH1-OE2 3.33Å; R176-E187 IonicContact NH2-OE1 2.85Å; R176-E187 PolarHBondContact NH2-OE1 3.31Å; P185-E187 VanDerWaalsContact C-N 3.28Å; P185-E187 PolarHBondContact O-N 3.01Å; E187-R189 VanDerWaalsContact C-N 3.33Å; E187-R230 WeakPolarHBondContact O-CD 3.47Å; E187-Y234 HydrophobicContact CB-CD2 4.39Å; E187-Y234 HydrophobicContact CG-CD2 4.47Å
188	L	82.6	Confident	73.9	Confident	36 Å²	36	75.6 Å²	75.6	19%	0.188	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-88.5	-5.1	-174.7	-56.8	-172.2	0	0	0	112.6	P185 I186 I231 Y234 I322	P185-L188 HydrophobicContact CB-CB 4.4Å; P185-L188 HydrophobicContact CB-CD1 4.04Å; P185-L188 HydrophobicContact CB-CG 4.02Å; P185-L188 HydrophobicContact CG-CB 4.18Å; P185-L188 HydrophobicContact CG-CD1 3.71Å; P185-L188 HydrophobicContact CG-CG 4.06Å; P185-L188 PolarHBondContact O-N 3.38Å; I186-L188 PolarHBondContact O-N 2.97Å; L188-I231 HydrophobicContact CD2-CB 4.25Å; L188-I231 HydrophobicContact CD2-CG1 3.48Å; L188-I231 VanDerWaalsContact CD2-CG1 3.48Å; L188-Y234 HydrophobicContact CD1-CD1 4.19Å; L188-Y234 HydrophobicContact CD1-CE1 4.48Å; L188-Y234 HydrophobicContact CD2-CG 4.5Å; L188-Y234 HydrophobicContact CG-CG 4.45Å; L188-I322 HydrophobicContact CD1-CD1 4Å; L188-I322 HydrophobicContact CD1-CG1 4.15Å; L188-I322 HydrophobicContact CD1-CG2 3.85Å
189	R	80.5	Confident	71.5	Confident	99 Å²	99	82 Å²	82	37%	0.374	45%	0.447	S	S	.	.	S	Bend	trans	-71	140.1	176.2	-61.3	-168.9	-162.7	130.3	29.1	110.3	H183 G184 I186 E187 S191	H183-R189 VanDerWaalsContact C-NH2 3.31Å; H183-R189 PolarHBondContact O-NE 3.42Å; H183-R189 PolarHBondContact O-NH2 3.46Å; G184-R189 PolarHBondContact O-NH2 3.5Å; I186-R189 WeakPolarHBondContact O-CB 3.26Å; I186-R189 PolarHBondContact O-N 3.33Å; E187-R189 VanDerWaalsContact C-N 3.33Å; R189-S191 PolarHBondContact O-N 2.99Å; R189-S191 VanDerWaalsContact O-N 3.11Å
190	P	71.8	Confident	69.6	Low	117 Å²	117	86.5 Å²	86.5	76%	0.76	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-61.7	118.4	169.9	26.1	-31.5	0	0	0	108.2
191	S	67.6	Low	67.3	Low	39 Å²	39	91 Å²	91	27%	0.273	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-78.5	153.4	172.1	68	0	0	0	0	109.4	R189 S193 D194 R230	R189-S191 PolarHBondContact O-N 2.99Å; R189-S191 VanDerWaalsContact O-N 3.11Å; S191-S193 PolarHBondContact O-N 2.82Å; S191-S193 VanDerWaalsContact O-N 3.12Å; S191-S193 PolarHBondContact OG-OG 3.08Å; S191-D194 PolarHBondContact N-OD2 3.15Å; S191-D194 WeakPolarHBondContact O-CB 3.07Å; S191-D194 PolarHBondContact O-N 3.07Å; S191-D194 PolarHBondContact OG-OD1 3.36Å; S191-D194 PolarHBondContact OG-OD2 2.84Å; S191-R230 PolarHBondContact OG-NH2 3.2Å
192	E	60.8	Low	64.9	Low	171 Å²	171	94.6 Å²	94.6	80%	0.799	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-54	-33.5	173.7	-61.8	179.8	172.1	0	0	111.7	D194 T195	E192-D194 PolarHBondContact O-N 3.21Å; E192-D194 VanDerWaalsContact O-N 3.08Å; E192-T195 PolarHBondContact O-N 3.32Å; E192-T195 PolarHBondContact O-OG1 3.12Å
193	S	57.7	Low	62.7	Low	54 Å²	54	92.8 Å²	92.8	38%	0.378	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-67.2	-6.5	175.5	70.8	0	0	0	0	115.6	S191 K226	S191-S193 PolarHBondContact O-N 2.82Å; S191-S193 VanDerWaalsContact O-N 3.12Å; S191-S193 PolarHBondContact OG-OG 3.08Å; S193-K226 PolarHBondContact O-NZ 3.2Å; S193-K226 PolarHBondContact OG-NZ 3.08Å
194	D	59.1	Low	60.2	Low	42 Å²	42	91.3 Å²	91.3	23%	0.225	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-88.7	-16.2	176.1	-56.2	-40.2	0	0	0	112.7	S191 E192 K226 R230	S191-D194 PolarHBondContact N-OD2 3.15Å; S191-D194 WeakPolarHBondContact O-CB 3.07Å; S191-D194 PolarHBondContact O-N 3.07Å; S191-D194 PolarHBondContact OG-OD1 3.36Å; S191-D194 PolarHBondContact OG-OD2 2.84Å; E192-D194 PolarHBondContact O-N 3.21Å; E192-D194 VanDerWaalsContact O-N 3.08Å; D194-K226 VanDerWaalsContact OD1-CD 3.24Å; D194-K226 WeakPolarHBondContact OD1-CD 3.2Å; D194-K226 VanDerWaalsContact OD1-CE 3.24Å; D194-K226 WeakPolarHBondContact OD1-CE 3.46Å; D194-K226 IonicContact OD1-NZ 4Å; D194-K226 PolarHBondContact OD1-NZ 3.27Å; D194-R230 IonicContact OD1-CZ 2.79Å; D194-R230 IonicContact OD1-NH1 2.69Å; D194-R230 PolarHBondContact OD1-NH1 2.62Å; D194-R230 IonicContact OD1-NH2 2.65Å; D194-R230 PolarHBondContact OD1-NH2 2.95Å; D194-R230 IonicContact OD2-CZ 2.72Å; D194-R230 IonicContact OD2-NH1 2.95Å; D194-R230 PolarHBondContact OD2-NH1 2.96Å; D194-R230 IonicContact OD2-NH2 3.25Å; D194-R230 PolarHBondContact OD2-NH2 2.8Å
195	T	51.7	Low	58.3	Low	104 Å²	104	96.9 Å²	96.9	64%	0.638	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-29.4	176.8	58.7	0	0	0	0	111.8	E192 C197 N198	E192-T195 PolarHBondContact O-N 3.32Å; E192-T195 PolarHBondContact O-OG1 3.12Å; T195-C197 VanDerWaalsContact C-N 3.35Å; T195-C197 PolarHBondContact O-N 3.08Å; T195-N198 PolarHBondContact O-N 3.21Å
196	E	45.5	Very low	56	Low	147 Å²	147	104.2 Å²	104.2	69%	0.687	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-68.9	-26.6	-175.6	-64.1	-176.6	168.1	0	0	114.1	N198	E196-N198 VanDerWaalsContact C-N 3.33Å; E196-N198 PolarHBondContact O-N 3.17Å
197	C	44.2	Very low	54.1	Low	101 Å²	101	105.7 Å²	105.7	68%	0.682	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-88.3	7.6	-177.3	50	0	0	0	0	114.7	T195	T195-C197 VanDerWaalsContact C-N 3.35Å; T195-C197 PolarHBondContact O-N 3.08Å
198	N	44.6	Very low	52.3	Low	77 Å²	77	108.5 Å²	108.5	41%	0.412	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-118.9	20.5	-173.8	-134.7	2.9	0	0	0	114.9	T195 E196 N200	T195-N198 PolarHBondContact O-N 3.21Å; E196-N198 VanDerWaalsContact C-N 3.33Å; E196-N198 PolarHBondContact O-N 3.17Å; N198-N200 PolarHBondContact O-N 2.99Å
199	E	42.8	Very low	50.3	Low	171 Å²	171	112.3 Å²	112.3	80%	0.799	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-15.4	178.9	-65.9	-168.6	152.8	0	0	114
200	N	51.2	Low	48.6	Very low	164 Å²	164	115.1 Å²	115.1	88%	0.877	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	0.4	-175.7	-70.1	-32.4	0	0	0	115.2	N198	N198-N200 PolarHBondContact O-N 2.99Å
201	N	45	Very low	48.2	Very low	109 Å²	109	114.2 Å²	114.2	58%	0.583	64%	0.637	S	S	*	*	S	Bend	trans	-113.3	122.6	171.5	-85.9	-32	0	0	0	109.8	L203	N201-L203 HydrophobicContact CB-CD1 4.1Å; N201-L203 PolarHBondContact O-N 2.54Å
202	N	37.9	Very low	48.1	Very low	165 Å²	165	116.3 Å²	116.3	88%	0.882	65%	0.645	S	S	*	*			trans	-70.2	51	176.9	-152.7	0.6	0	0	0	111.4	T204	N202-T204 PolarHBondContact O-N 3.06Å
203	L	43.5	Very low	48.8	Very low	101 Å²	101	112 Å²	112	53%	0.529	63%	0.627	S	S	.	*			trans	-77.3	93	168.9	-87.4	151.6	0	0	0	106.5	N201 V205 N207	N201-L203 HydrophobicContact CB-CD1 4.1Å; N201-L203 PolarHBondContact O-N 2.54Å; L203-V205 PolarHBondContact O-N 3.44Å; L203-N207 HydrophobicContact CD2-CB 4.4Å
204	T	36.2	Very low	49.8	Very low	84 Å²	84	110 Å²	110	52%	0.515	61%	0.612	S	S	.	*			trans	-45.6	132.3	167.3	40.1	0	0	0	0	110.6	N202 E206 N207	N202-T204 PolarHBondContact O-N 3.06Å; T204-E206 PolarHBondContact O-N 2.65Å; T204-N207 PolarHBondContact O-N 2.77Å
205	V	48.3	Very low	50.7	Low	123 Å²	123	111 Å²	111	75%	0.745	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-50.3	-21.3	-178.7	178.6	0	0	0	0	113.2	L203 N207 S208	L203-V205 PolarHBondContact O-N 3.44Å; V205-N207 VanDerWaalsContact C-N 3.3Å; V205-N207 PolarHBondContact O-N 3.37Å; V205-S208 PolarHBondContact O-N 3.24Å
206	E	39.8	Very low	52.2	Low	165 Å²	165	111.3 Å²	111.3	77%	0.771	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-70.9	-16.7	175.8	-61.4	-175.4	171.9	0	0	114.5	T204 T209	T204-E206 PolarHBondContact O-N 2.65Å; E206-T209 PolarHBondContact O-OG1 3.42Å
207	N	43.5	Very low	54	Low	110 Å²	110	110.5 Å²	110.5	59%	0.588	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-95.5	-12.5	176	-89	9.9	0	0	0	113.8	L203 T204 V205 T209	L203-N207 HydrophobicContact CD2-CB 4.4Å; T204-N207 PolarHBondContact O-N 2.77Å; V205-N207 VanDerWaalsContact C-N 3.3Å; V205-N207 PolarHBondContact O-N 3.37Å; N207-T209 VanDerWaalsContact C-N 3.27Å; N207-T209 PolarHBondContact O-N 3.46Å
208	S	44.9	Very low	55.8	Low	100 Å²	100	109.1 Å²	109.1	70%	0.699	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-7.9	178.2	93.1	0	0	0	0	113	V205	V205-S208 PolarHBondContact O-N 3.24Å
209	T	40.3	Very low	57.6	Low	116 Å²	116	105.8 Å²	105.8	71%	0.712	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-7.3	179.1	43	0	0	0	0	114.2	E206 N207 A211	E206-T209 PolarHBondContact O-OG1 3.42Å; N207-T209 VanDerWaalsContact C-N 3.27Å; N207-T209 PolarHBondContact O-N 3.46Å; T209-A211 PolarHBondContact O-N 3.48Å
210	M	45	Very low	59.4	Low	157 Å²	157	98.6 Å²	98.6	77%	0.773	55%	0.547	S	S	*	.	S	Bend	trans	-79.8	103.8	164	-79.3	-146.8	173.5	0	0	107.7	I212	M210-I212 PolarHBondContact O-N 2.79Å
211	A	62	Low	60.8	Low	98 Å²	98	96.4 Å²	96.4	81%	0.81	53%	0.526	S	S	*	.			trans	-47.7	114.1	168.1	0	0	0	0	0	108	T209 D213	T209-A211 PolarHBondContact O-N 3.48Å; A211-D213 PolarHBondContact O-N 2.66Å
212	I	66.6	Low	62.6	Low	84 Å²	84	96.2 Å²	96.2	43%	0.431	53%	0.525	S	S	.	.			trans	-64.6	112.5	177.8	-63.2	166.9	0	0	0	105.5	M210 V214 G219	M210-I212 PolarHBondContact O-N 2.79Å; I212-V214 VanDerWaalsContact C-N 3.34Å; I212-V214 HydrophobicContact CG2-CG2 4.33Å; I212-V214 WeakPolarHBondContact O-CG2 3.36Å; I212-V214 PolarHBondContact O-N 3.43Å; I212-G219 WeakPolarHBondContact CG2-O 3.47Å
213	D	74.8	Confident	64.7	Low	81 Å²	81	88.5 Å²	88.5	43%	0.433	49%	0.485	S	S	.	.			trans	-70.5	96.5	173.2	-171.9	-12.8	0	0	0	108.5	A211 D215 E216 G219	A211-D213 PolarHBondContact O-N 2.66Å; D213-D215 PolarHBondContact O-N 3.24Å; D213-D215 WeakPolarHBondContact OD1-CB 3.43Å; D213-D215 PolarHBondContact OD1-N 2.7Å; D213-E216 HydrophobicContact CB-CB 4.38Å; D213-E216 HydrophobicContact CB-CG 4.14Å; D213-E216 PolarHBondContact O-N 3.06Å; D213-E216 VanDerWaalsContact O-N 3.12Å; D213-E216 PolarHBondContact OD1-N 2.78Å; D213-G219 VanDerWaalsContact O-CA 3.29Å; D213-G219 WeakPolarHBondContact O-CA 3.48Å
214	V	78.8	Confident	66.6	Low	11 Å²	11	87.2 Å²	87.2	7%	0.067	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-20	-176.7	-170.7	0	0	0	0	111.5	I212 E216 W220 L227 I231 I322	I212-V214 VanDerWaalsContact C-N 3.34Å; I212-V214 HydrophobicContact CG2-CG2 4.33Å; I212-V214 WeakPolarHBondContact O-CG2 3.36Å; I212-V214 PolarHBondContact O-N 3.43Å; V214-E216 VanDerWaalsContact C-N 3.28Å; V214-W220 HydrophobicContact CG1-CD2 4.42Å; V214-W220 HydrophobicContact CG1-CE3 3.31Å; V214-W220 HydrophobicContact CG1-CZ3 3.69Å; V214-L227 HydrophobicContact CG2-CD2 4.15Å; V214-I231 HydrophobicContact CB-CD1 4.1Å; V214-I231 HydrophobicContact CG1-CD1 3.47Å; V214-I231 VanDerWaalsContact CG1-CD1 3.47Å; V214-I231 HydrophobicContact CG2-CD1 4.05Å; V214-I322 HydrophobicContact CB-CD1 4.25Å
215	D	79.1	Confident	68.9	Low	62 Å²	62	84.2 Å²	84.2	33%	0.332	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.5	172.9	-79.9	-23.8	0	0	0	111.3	D213 R319 G321 I322 K326	D213-D215 PolarHBondContact O-N 3.24Å; D213-D215 WeakPolarHBondContact OD1-CB 3.43Å; D213-D215 PolarHBondContact OD1-N 2.7Å; D215-R319 PolarHBondContact O-NH2 2.8Å; D215-G321 WeakPolarHBondContact OD1-CA 3.12Å; D215-I322 PolarHBondContact OD1-N 2.9Å; D215-I322 VanDerWaalsContact OD1-N 3.08Å; D215-K326 IonicContact OD1-NZ 3.92Å; D215-K326 PolarHBondContact OD1-NZ 3Å; D215-K326 VanDerWaalsContact OD2-CE 3.28Å; D215-K326 WeakPolarHBondContact OD2-CE 3.45Å; D215-K326 IonicContact OD2-NZ 3.64Å; D215-K326 PolarHBondContact OD2-NZ 2.73Å
216	E	82.4	Confident	70.6	Confident	112 Å²	112	81.8 Å²	81.8	52%	0.523	45%	0.446	S	S	.	.	S	Bend	trans	-76.2	144.4	170.3	-73.2	-169.5	174.2	0	0	112.9	D213 V214 S218 G219 W220	D213-E216 HydrophobicContact CB-CB 4.38Å; D213-E216 HydrophobicContact CB-CG 4.14Å; D213-E216 PolarHBondContact O-N 3.06Å; D213-E216 VanDerWaalsContact O-N 3.12Å; D213-E216 PolarHBondContact OD1-N 2.78Å; V214-E216 VanDerWaalsContact C-N 3.28Å; E216-S218 PolarHBondContact O-N 3.35Å; E216-G219 PolarHBondContact O-N 2.93Å; E216-W220 PolarHBondContact O-N 3.3Å
217	K	82.5	Confident	72.8	Confident	129 Å²	129	76 Å²	76	56%	0.561	42%	0.42	S	S	*	.	H	α-helix	trans	-61.1	-34.3	177.7	-173	175.1	-178.5	176	0	112.5	R221	K217-R221 WeakPolarHBondContact O-CG 3.36Å; K217-R221 PolarHBondContact O-N 3.33Å
218	S	82.4	Confident	74.8	Confident	72 Å²	72	72.3 Å²	72.3	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-69.6	-47.3	176.4	-173.6	0	0	0	0	110.7	E216 R221 N222	E216-S218 PolarHBondContact O-N 3.35Å; S218-R221 PolarHBondContact O-N 3.44Å; S218-N222 VanDerWaalsContact O-CG 3.27Å; S218-N222 PolarHBondContact O-N 2.82Å; S218-N222 PolarHBondContact O-ND2 3.06Å
219	G	82.1	Confident	76.7	Confident	7 Å²	7	71.8 Å²	71.8	7%	0.072	38%	0.381	C	S	.	.	H	α-helix	trans	-64.3	-41.7	177.8	0	0	0	0	0	112.8	I212 D213 E216 R221 N222 A223	I212-G219 WeakPolarHBondContact CG2-O 3.47Å; D213-G219 VanDerWaalsContact O-CA 3.29Å; D213-G219 WeakPolarHBondContact O-CA 3.48Å; E216-G219 PolarHBondContact O-N 2.93Å; G219-R221 VanDerWaalsContact C-N 3.31Å; G219-R221 PolarHBondContact O-N 3.06Å; G219-N222 CarbonylContact O-C 3.53Å; G219-N222 PolarHBondContact O-N 3.49Å; G219-N222 VanDerWaalsContact O-N 3.12Å; G219-A223 WeakPolarHBondContact O-CB 3.39Å; G219-A223 PolarHBondContact O-N 2.97Å
220	W	82.1	Confident	78.9	Confident	21 Å²	21	68.1 Å²	68.1	8%	0.08	35%	0.354	C	S	.	.	H	α-helix	trans	-56.7	-43.7	172.9	-178	-96.7	0	0	0	112.5	V214 E216 N222 A223 R228 I231 T318 R319 I320	V214-W220 HydrophobicContact CG1-CD2 4.42Å; V214-W220 HydrophobicContact CG1-CE3 3.31Å; V214-W220 HydrophobicContact CG1-CZ3 3.69Å; E216-W220 PolarHBondContact O-N 3.3Å; W220-N222 VanDerWaalsContact C-N 3.31Å; W220-N222 PolarHBondContact O-N 3.1Å; W220-A223 WeakPolarHBondContact O-CB 3.44Å; W220-A223 PolarHBondContact O-N 3.38Å; W220-R228 HydrophobicContact CD2-CG 4.42Å; W220-R228 HydrophobicContact CH2-CB 3.62Å; W220-R228 HydrophobicContact CH2-CG 3.6Å; W220-R228 HydrophobicContact CZ2-CB 3.76Å; W220-R228 HydrophobicContact CZ2-CG 3.51Å; W220-R228 HydrophobicContact CZ3-CB 4.42Å; W220-R228 HydrophobicContact CZ3-CG 4.12Å; W220-R228 VanDerWaalsContact O-CZ 3.28Å; W220-R228 PolarHBondContact O-NE 3.01Å; W220-R228 PolarHBondContact O-NH2 3.48Å; W220-I231 HydrophobicContact CZ3-CD1 4.32Å; W220-I231 HydrophobicContact CZ3-CG2 4.49Å; W220-T318 WeakPolarHBondContact CZ2-O 3.37Å; W220-T318 PolarHBondContact NE1-O 2.87Å; W220-R319 HydrophobicContact CB-CG 4.38Å; W220-R319 HydrophobicContact CD2-CB 4.34Å; W220-R319 HydrophobicContact CD2-CG 3.91Å; W220-R319 HydrophobicContact CE3-CG 4.38Å; W220-R319 HydrophobicContact CG-CB 4.35Å; W220-R319 HydrophobicContact CG-CG 3.81Å; W220-I320 HydrophobicContact CH2-CB 3.99Å; W220-I320 HydrophobicContact CH2-CG1 4.45Å; W220-I320 HydrophobicContact CZ3-CB 4.15Å; W220-I320 WeakPolarHBondContact CZ3-O 3.48Å
221	R	80.3	Confident	81	Confident	117 Å²	117	60.7 Å²	60.7	44%	0.442	32%	0.317	S	S	.	.	H	α-helix	trans	-66.1	-32.8	178.3	-77.2	178.7	172.8	-147.4	-3.3	112.9	K217 S218 G219 R228	K217-R221 WeakPolarHBondContact O-CG 3.36Å; K217-R221 PolarHBondContact O-N 3.33Å; S218-R221 PolarHBondContact O-N 3.44Å; G219-R221 VanDerWaalsContact C-N 3.31Å; G219-R221 PolarHBondContact O-N 3.06Å; R221-R228 VanDerWaalsContact C-NH2 3.26Å; R221-R228 PolarHBondContact O-NH2 3.44Å
222	N	81.5	Confident	82.2	Confident	105 Å²	105	56.5 Å²	56.5	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-86	-16.9	178.1	-63.3	-24.4	0	0	0	113.2	S218 G219 W220	S218-N222 VanDerWaalsContact O-CG 3.27Å; S218-N222 PolarHBondContact O-N 2.82Å; S218-N222 PolarHBondContact O-ND2 3.06Å; G219-N222 CarbonylContact O-C 3.53Å; G219-N222 PolarHBondContact O-N 3.49Å; G219-N222 VanDerWaalsContact O-N 3.12Å; W220-N222 VanDerWaalsContact C-N 3.31Å; W220-N222 PolarHBondContact O-N 3.1Å
223	A	82.8	Confident	83.3	Confident	4 Å²	4	57.9 Å²	57.9	3%	0.033	29%	0.285	C	S	.	.	S	Bend	trans	-61.6	136	176.9	0	0	0	0	0	110.9	G219 W220 L227 R228	G219-A223 WeakPolarHBondContact O-CB 3.39Å; G219-A223 PolarHBondContact O-N 2.97Å; W220-A223 WeakPolarHBondContact O-CB 3.44Å; W220-A223 PolarHBondContact O-N 3.38Å; A223-L227 HydrophobicContact CB-CD2 4.1Å; A223-R228 HydrophobicContact CB-CG 4.15Å; A223-R228 VanDerWaalsContact O-CZ 3.3Å; A223-R228 PolarHBondContact O-NE 3.46Å; A223-R228 PolarHBondContact O-NH2 2.94Å; A223-R228 VanDerWaalsContact O-NH2 3.12Å
224	S	84.2	Confident	84	Confident	74 Å²	74	54 Å²	54	52%	0.517	26%	0.264	S	S	.	.			trans	-59.5	144.6	172.9	178.8	0	0	0	0	110.5	K226 L227 R228	S224-K226 PolarHBondContact O-N 3.47Å; S224-L227 WeakPolarHBondContact O-CA 3.5Å; S224-L227 WeakPolarHBondContact O-CB 3.17Å; S224-L227 PolarHBondContact O-N 3.23Å; S224-R228 PolarHBondContact O-N 3.45Å
225	S	83.5	Confident	84.6	Confident	20 Å²	20	54.4 Å²	54.4	14%	0.14	27%	0.265	C	S	.	.	H	α-helix	trans	-50.6	-41	174.1	-177.4	0	0	0	0	112.7	E106 L227 R228 R229	E106-S225 WeakPolarHBondContact OE1-CB 3.4Å; E106-S225 PolarHBondContact OE1-OG 3.1Å; S225-L227 VanDerWaalsContact C-N 3.35Å; S225-L227 PolarHBondContact O-N 2.86Å; S225-R228 WeakPolarHBondContact O-CB 3.5Å; S225-R228 PolarHBondContact O-N 2.88Å; S225-R229 WeakPolarHBondContact O-CG 3.25Å; S225-R229 PolarHBondContact O-N 3.17Å
226	K	84.2	Confident	85.1	Confident	73 Å²	73	52.3 Å²	52.3	32%	0.317	25%	0.254	S	S	.	.	H	α-helix	trans	-62.2	-39.6	176.5	-165.9	174.7	179.9	-157	0	112.6	S193 D194 S224 R230	S193-K226 PolarHBondContact O-NZ 3.2Å; S193-K226 PolarHBondContact OG-NZ 3.08Å; D194-K226 VanDerWaalsContact OD1-CD 3.24Å; D194-K226 WeakPolarHBondContact OD1-CD 3.2Å; D194-K226 VanDerWaalsContact OD1-CE 3.24Å; D194-K226 WeakPolarHBondContact OD1-CE 3.46Å; D194-K226 IonicContact OD1-NZ 4Å; D194-K226 PolarHBondContact OD1-NZ 3.27Å; S224-K226 PolarHBondContact O-N 3.47Å; K226-R230 WeakPolarHBondContact O-CG 3.29Å; K226-R230 PolarHBondContact O-N 3.48Å
227	L	84.9	Confident	85.5	Confident	44 Å²	44	47.8 Å²	47.8	23%	0.23	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-42.9	175.3	178.6	60.6	0	0	0	111.1	V214 A223 S224 S225 R229 R230 I231	V214-L227 HydrophobicContact CG2-CD2 4.15Å; A223-L227 HydrophobicContact CB-CD2 4.1Å; S224-L227 WeakPolarHBondContact O-CA 3.5Å; S224-L227 WeakPolarHBondContact O-CB 3.17Å; S224-L227 PolarHBondContact O-N 3.23Å; S225-L227 VanDerWaalsContact C-N 3.35Å; S225-L227 PolarHBondContact O-N 2.86Å; L227-R229 VanDerWaalsContact C-N 3.32Å; L227-R229 PolarHBondContact O-N 3.28Å; L227-R230 PolarHBondContact O-N 3.21Å; L227-I231 HydrophobicContact CD1-CD1 4.13Å; L227-I231 HydrophobicContact CD1-CG1 4.3Å; L227-I231 HydrophobicContact CG-CD1 3.96Å; L227-I231 VanDerWaalsContact O-CG1 3.32Å; L227-I231 WeakPolarHBondContact O-CG1 3.22Å; L227-I231 PolarHBondContact O-N 3.4Å
228	R	85.9	Confident	85.9	Confident	32 Å²	32	43.7 Å²	43.7	12%	0.121	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-42.5	176.5	-64.5	179.8	-175.5	146.2	8.5	112	W220 R221 A223 S224 S225 I231 R232	W220-R228 HydrophobicContact CD2-CG 4.42Å; W220-R228 HydrophobicContact CH2-CB 3.62Å; W220-R228 HydrophobicContact CH2-CG 3.6Å; W220-R228 HydrophobicContact CZ2-CB 3.76Å; W220-R228 HydrophobicContact CZ2-CG 3.51Å; W220-R228 HydrophobicContact CZ3-CB 4.42Å; W220-R228 HydrophobicContact CZ3-CG 4.12Å; W220-R228 VanDerWaalsContact O-CZ 3.28Å; W220-R228 PolarHBondContact O-NE 3.01Å; W220-R228 PolarHBondContact O-NH2 3.48Å; R221-R228 VanDerWaalsContact C-NH2 3.26Å; R221-R228 PolarHBondContact O-NH2 3.44Å; A223-R228 HydrophobicContact CB-CG 4.15Å; A223-R228 VanDerWaalsContact O-CZ 3.3Å; A223-R228 PolarHBondContact O-NE 3.46Å; A223-R228 PolarHBondContact O-NH2 2.94Å; A223-R228 VanDerWaalsContact O-NH2 3.12Å; S224-R228 PolarHBondContact O-N 3.45Å; S225-R228 WeakPolarHBondContact O-CB 3.5Å; S225-R228 PolarHBondContact O-N 2.88Å; R228-I231 PolarHBondContact O-N 3.03Å; R228-R232 PolarHBondContact O-N 3.02Å
229	R	85	Confident	86.3	Confident	88 Å²	88	40.7 Å²	40.7	33%	0.332	20%	0.195	S	C	.	.	H	α-helix	trans	-63.1	-47.3	175.5	-70.9	174.8	-171.4	172.6	-1	112	D110 S225 L227 I231 R232 E233	D110-R229 IonicContact OD1-CZ 2.8Å; D110-R229 IonicContact OD1-NE 3.24Å; D110-R229 PolarHBondContact OD1-NE 2.97Å; D110-R229 IonicContact OD1-NH2 2.9Å; D110-R229 PolarHBondContact OD1-NH2 3.4Å; S225-R229 WeakPolarHBondContact O-CG 3.25Å; S225-R229 PolarHBondContact O-N 3.17Å; L227-R229 VanDerWaalsContact C-N 3.32Å; L227-R229 PolarHBondContact O-N 3.28Å; R229-I231 VanDerWaalsContact C-N 3.33Å; R229-I231 PolarHBondContact O-N 3.35Å; R229-R232 WeakPolarHBondContact O-CB 3.3Å; R229-R232 PolarHBondContact O-N 3.34Å; R229-R232 VanDerWaalsContact O-N 3.1Å; R229-E233 WeakPolarHBondContact O-CG 3.37Å; R229-E233 PolarHBondContact O-N 2.78Å
230	R	87.5	Confident	86.8	Confident	40 Å²	40	44.9 Å²	44.9	15%	0.151	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-39.5	176.3	-72.8	176.6	-179.7	167	1.5	113.5	E187 S191 D194 K226 L227 R232 E233 Y234	E187-R230 WeakPolarHBondContact O-CD 3.47Å; S191-R230 PolarHBondContact OG-NH2 3.2Å; D194-R230 IonicContact OD1-CZ 2.79Å; D194-R230 IonicContact OD1-NH1 2.69Å; D194-R230 PolarHBondContact OD1-NH1 2.62Å; D194-R230 IonicContact OD1-NH2 2.65Å; D194-R230 PolarHBondContact OD1-NH2 2.95Å; D194-R230 IonicContact OD2-CZ 2.72Å; D194-R230 IonicContact OD2-NH1 2.95Å; D194-R230 PolarHBondContact OD2-NH1 2.96Å; D194-R230 IonicContact OD2-NH2 3.25Å; D194-R230 PolarHBondContact OD2-NH2 2.8Å; K226-R230 WeakPolarHBondContact O-CG 3.29Å; K226-R230 PolarHBondContact O-N 3.48Å; L227-R230 PolarHBondContact O-N 3.21Å; R230-R232 VanDerWaalsContact C-N 3.31Å; R230-R232 PolarHBondContact O-N 3.24Å; R230-E233 PolarHBondContact O-N 3Å; R230-Y234 VanDerWaalsContact O-CB 3.24Å; R230-Y234 WeakPolarHBondContact O-CB 3.24Å; R230-Y234 PolarHBondContact O-N 3.07Å
231	I	88.5	Confident	87.4	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-43.6	174.8	-70.6	166.5	0	0	0	110.4	L188 V214 W220 L227 R228 R229 Y234 Q235 I320 I322	L188-I231 HydrophobicContact CD2-CB 4.25Å; L188-I231 HydrophobicContact CD2-CG1 3.48Å; L188-I231 VanDerWaalsContact CD2-CG1 3.48Å; V214-I231 HydrophobicContact CB-CD1 4.1Å; V214-I231 HydrophobicContact CG1-CD1 3.47Å; V214-I231 VanDerWaalsContact CG1-CD1 3.47Å; V214-I231 HydrophobicContact CG2-CD1 4.05Å; W220-I231 HydrophobicContact CZ3-CD1 4.32Å; W220-I231 HydrophobicContact CZ3-CG2 4.49Å; L227-I231 HydrophobicContact CD1-CD1 4.13Å; L227-I231 HydrophobicContact CD1-CG1 4.3Å; L227-I231 HydrophobicContact CG-CD1 3.96Å; L227-I231 VanDerWaalsContact O-CG1 3.32Å; L227-I231 WeakPolarHBondContact O-CG1 3.22Å; L227-I231 PolarHBondContact O-N 3.4Å; R228-I231 PolarHBondContact O-N 3.03Å; R229-I231 VanDerWaalsContact C-N 3.33Å; R229-I231 PolarHBondContact O-N 3.35Å; I231-Y234 PolarHBondContact O-N 3.42Å; I231-Q235 HydrophobicContact CG2-CG 4.49Å; I231-Q235 WeakPolarHBondContact O-CB 3.36Å; I231-Q235 VanDerWaalsContact O-CG 3.22Å; I231-Q235 WeakPolarHBondContact O-CG 3.24Å; I231-Q235 PolarHBondContact O-N 2.98Å; I231-I320 HydrophobicContact CG2-CB 4.24Å; I231-I320 HydrophobicContact CG2-CG2 3.83Å; I231-I322 HydrophobicContact CD1-CD1 4Å; I231-I322 HydrophobicContact CD1-CG1 4.22Å; I231-I322 HydrophobicContact CG1-CD1 4.21Å; I231-I322 HydrophobicContact CG1-CG1 4.15Å; I231-I322 HydrophobicContact CG2-CG1 3.84Å
232	R	87.8	Confident	88.1	Confident	9 Å²	9	40.2 Å²	40.2	3%	0.034	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-50.7	176.1	-177.3	176	-97.9	130.2	14.6	111.9	D110 A114 R228 R229 R230 Y234 Q235 L236 S317 I320	D110-R232 VanDerWaalsContact CB-NH1 3.28Å; D110-R232 PolarHBondContact O-NH1 3.03Å; A114-R232 HydrophobicContact CB-CG 4.12Å; A114-R232 VanDerWaalsContact CB-NE 3.28Å; R228-R232 PolarHBondContact O-N 3.02Å; R229-R232 WeakPolarHBondContact O-CB 3.3Å; R229-R232 PolarHBondContact O-N 3.34Å; R229-R232 VanDerWaalsContact O-N 3.1Å; R230-R232 VanDerWaalsContact C-N 3.31Å; R230-R232 PolarHBondContact O-N 3.24Å; R232-Y234 VanDerWaalsContact C-N 3.26Å; R232-Y234 PolarHBondContact O-N 3.22Å; R232-Q235 PolarHBondContact O-N 3.31Å; R232-Q235 VanDerWaalsContact O-N 3.1Å; R232-L236 HydrophobicContact CG-CD1 4.18Å; R232-L236 HydrophobicContact CG-CG 4.4Å; R232-L236 WeakPolarHBondContact O-CG 3.24Å; R232-L236 PolarHBondContact O-N 2.86Å; R232-S317 PolarHBondContact NH2-O 3.2Å; R232-I320 HydrophobicContact CB-CD1 3.46Å; R232-I320 VanDerWaalsContact CB-CD1 3.46Å; R232-I320 HydrophobicContact CG-CD1 3.54Å; R232-I320 VanDerWaalsContact CZ-CD1 3.43Å
233	E	88	Confident	88.7	Confident	114 Å²	114	37.1 Å²	37.1	53%	0.533	18%	0.175	S	C	.	.	H	α-helix	trans	-54.3	-45	176.9	-73.1	165.3	-166.1	0	0	111.2	R229 R230 L236 A237	R229-E233 WeakPolarHBondContact O-CG 3.37Å; R229-E233 PolarHBondContact O-N 2.78Å; R230-E233 PolarHBondContact O-N 3Å; E233-L236 PolarHBondContact O-N 3.23Å; E233-A237 VanDerWaalsContact O-CB 3.31Å; E233-A237 WeakPolarHBondContact O-CB 3.31Å; E233-A237 PolarHBondContact O-N 2.92Å
234	Y	90.6	Very high	89.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.3	-49.2	175.1	173.9	-107	0	0	0	112.1	E180 P185 E187 L188 R230 I231 R232 L236 A237 R238 W324	E180-Y234 WeakPolarHBondContact OE1-CE2 3.33Å; E180-Y234 PolarHBondContact OE1-OH 2.98Å; P185-Y234 HydrophobicContact CB-CD2 4.08Å; P185-Y234 HydrophobicContact CB-CE1 4.37Å; P185-Y234 HydrophobicContact CB-CE2 3.58Å; E187-Y234 HydrophobicContact CB-CD2 4.39Å; E187-Y234 HydrophobicContact CG-CD2 4.47Å; L188-Y234 HydrophobicContact CD1-CD1 4.19Å; L188-Y234 HydrophobicContact CD1-CE1 4.48Å; L188-Y234 HydrophobicContact CD2-CG 4.5Å; L188-Y234 HydrophobicContact CG-CG 4.45Å; R230-Y234 VanDerWaalsContact O-CB 3.24Å; R230-Y234 WeakPolarHBondContact O-CB 3.24Å; R230-Y234 PolarHBondContact O-N 3.07Å; I231-Y234 PolarHBondContact O-N 3.42Å; R232-Y234 VanDerWaalsContact C-N 3.26Å; R232-Y234 PolarHBondContact O-N 3.22Å; Y234-L236 PolarHBondContact O-N 2.95Å; Y234-A237 PolarHBondContact O-N 3.02Å; Y234-R238 PolarHBondContact O-N 3.03Å; Y234-W324 HydrophobicContact CE1-CB 4.12Å; Y234-W324 WeakPolarHBondContact OH-CB 3.37Å
235	Q	90.5	Very high	89.9	Confident	18 Å²	18	33.5 Å²	33.5	8%	0.084	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-39.1	179.1	-70.8	-66.7	-48.9	0	0	112.4	I231 R232 R238 L239 A314 I320 T323	I231-Q235 HydrophobicContact CG2-CG 4.49Å; I231-Q235 WeakPolarHBondContact O-CB 3.36Å; I231-Q235 VanDerWaalsContact O-CG 3.22Å; I231-Q235 WeakPolarHBondContact O-CG 3.24Å; I231-Q235 PolarHBondContact O-N 2.98Å; R232-Q235 PolarHBondContact O-N 3.31Å; R232-Q235 VanDerWaalsContact O-N 3.1Å; Q235-R238 WeakPolarHBondContact O-CB 3.31Å; Q235-R238 PolarHBondContact O-N 3.47Å; Q235-L239 PolarHBondContact O-N 3.03Å; Q235-A314 HydrophobicContact CB-CB 3.64Å; Q235-I320 HydrophobicContact CB-CG2 4.4Å; Q235-I320 HydrophobicContact CG-CG2 3.78Å; Q235-T323 VanDerWaalsContact CD-OG1 3.31Å; Q235-T323 PolarHBondContact NE2-OG1 3.49Å; Q235-T323 PolarHBondContact OE1-OG1 2.64Å
236	L	90	Very high	90.5	Very high	18 Å²	18	32.6 Å²	32.6	9%	0.094	14%	0.143	C	C	.	.	H	α-helix	trans	-67.9	-38.7	174.3	-64.3	-179.9	0	0	0	112.1	L119 R232 E233 Y234 R238 L239 A314 L315	L119-L236 HydrophobicContact CD1-CD1 4.35Å; L119-L236 HydrophobicContact CD1-CD2 4.1Å; R232-L236 HydrophobicContact CG-CD1 4.18Å; R232-L236 HydrophobicContact CG-CG 4.4Å; R232-L236 WeakPolarHBondContact O-CG 3.24Å; R232-L236 PolarHBondContact O-N 2.86Å; E233-L236 PolarHBondContact O-N 3.23Å; Y234-L236 PolarHBondContact O-N 2.95Å; L236-R238 VanDerWaalsContact C-N 3.26Å; L236-R238 PolarHBondContact O-N 3.1Å; L236-L239 HydrophobicContact CD2-CD1 4.22Å; L236-L239 WeakPolarHBondContact O-CB 3.22Å; L236-L239 PolarHBondContact O-N 3.24Å; L236-A314 HydrophobicContact CD2-CB 4.07Å; L236-L315 HydrophobicContact CD2-CD2 3.45Å; L236-L315 VanDerWaalsContact CD2-CD2 3.45Å; L236-L315 HydrophobicContact CD2-CG 4.28Å
237	A	90.5	Very high	91	Very high	17 Å²	17	31 Å²	31	14%	0.14	14%	0.137	C	C	.	.	H	α-helix	trans	-64.3	-34.1	175	0	0	0	0	0	111.7	E233 Y234 L239 K240 Y241	E233-A237 VanDerWaalsContact O-CB 3.31Å; E233-A237 WeakPolarHBondContact O-CB 3.31Å; E233-A237 PolarHBondContact O-N 2.92Å; Y234-A237 PolarHBondContact O-N 3.02Å; A237-L239 VanDerWaalsContact C-N 3.28Å; A237-L239 PolarHBondContact O-N 2.91Å; A237-K240 VanDerWaalsContact O-CB 3.3Å; A237-K240 WeakPolarHBondContact O-CB 3.35Å; A237-K240 PolarHBondContact O-N 3.11Å; A237-Y241 WeakPolarHBondContact O-CD1 3.45Å
238	R	91.2	Very high	91.5	Very high	43 Å²	43	29 Å²	29	16%	0.162	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-31.4	176.3	-167.6	177.4	172.1	158.7	5.8	113.3	D141 Y234 Q235 L236 K240 Y241 T323	D141-R238 IonicContact OD1-CZ 3.24Å; D141-R238 VanDerWaalsContact OD1-CZ 3.26Å; D141-R238 IonicContact OD1-NE 3.5Å; D141-R238 PolarHBondContact OD1-NE 2.83Å; D141-R238 IonicContact OD1-NH2 3.43Å; D141-R238 PolarHBondContact OD1-NH2 2.72Å; D141-R238 IonicContact OD2-CZ 3.49Å; D141-R238 IonicContact OD2-NE 2.7Å; D141-R238 PolarHBondContact OD2-NE 2.88Å; D141-R238 VanDerWaalsContact OD2-NE 3.17Å; D141-R238 IonicContact OD2-NH1 2.66Å; D141-R238 IonicContact OD2-NH2 3.48Å; D141-R238 PolarHBondContact OD2-NH2 3.13Å; Y234-R238 PolarHBondContact O-N 3.03Å; Q235-R238 WeakPolarHBondContact O-CB 3.31Å; Q235-R238 PolarHBondContact O-N 3.47Å; L236-R238 VanDerWaalsContact C-N 3.26Å; L236-R238 PolarHBondContact O-N 3.1Å; R238-K240 PolarHBondContact O-N 2.66Å; R238-Y241 HydrophobicContact CB-CE1 4.46Å; R238-Y241 HydrophobicContact CG-CD2 3.97Å; R238-Y241 HydrophobicContact CG-CE2 4.01Å; R238-Y241 HydrophobicContact CG-CG 4.27Å; R238-Y241 VanDerWaalsContact O-CB 3.31Å; R238-Y241 WeakPolarHBondContact O-CB 3.36Å; R238-Y241 PolarHBondContact O-N 2.83Å; R238-T323 VanDerWaalsContact NH1-CB 3.34Å; R238-T323 PolarHBondContact NH1-O 2.93Å; R238-T323 PolarHBondContact NH1-OG1 3.09Å
239	L	91.8	Very high	91.9	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.047	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.6	173.1	-57.7	176.5	0	0	0	113	L119 F138 W140 Q235 L236 A237 T312 L315	L119-L239 HydrophobicContact CD2-CD1 4.39Å; F138-L239 WeakPolarHBondContact O-CD2 3.48Å; W140-L239 PolarHBondContact NE1-O 2.92Å; Q235-L239 PolarHBondContact O-N 3.03Å; L236-L239 HydrophobicContact CD2-CD1 4.22Å; L236-L239 WeakPolarHBondContact O-CB 3.22Å; L236-L239 PolarHBondContact O-N 3.24Å; A237-L239 VanDerWaalsContact C-N 3.28Å; A237-L239 PolarHBondContact O-N 2.91Å; L239-T312 HydrophobicContact CD2-CG2 4.16Å; L239-L315 HydrophobicContact CD1-CD1 4.35Å; L239-L315 HydrophobicContact CD1-CD2 4.37Å; L239-L315 HydrophobicContact CD1-CG 4.47Å
240	K	92.3	Very high	92.3	Very high	95 Å²	95	27 Å²	27	41%	0.413	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-0.8	177	-56.1	178.6	178.7	-179.4	0	113.3	S170 F172 A237 R238 F242	S170-K240 WeakPolarHBondContact CB-O 3.4Å; S170-K240 PolarHBondContact OG-O 3.47Å; F172-K240 HydrophobicContact CD1-CB 4.03Å; F172-K240 HydrophobicContact CE1-CB 4.23Å; A237-K240 VanDerWaalsContact O-CB 3.3Å; A237-K240 WeakPolarHBondContact O-CB 3.35Å; A237-K240 PolarHBondContact O-N 3.11Å; R238-K240 PolarHBondContact O-N 2.66Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.93Å
241	Y	93.5	Very high	92.7	Very high	6 Å²	6	26.9 Å²	26.9	2%	0.024	13%	0.131	C	C	.	.	S	Bend	trans	-71.1	-30.4	-173.1	-77	18.5	0	0	0	112.5	S170 F172 R176 M177 E180 A237 R238	S170-Y241 PolarHBondContact N-O 2.83Å; S170-Y241 PolarHBondContact OG-O 2.96Å; F172-Y241 HydrophobicContact CD1-CD1 4.23Å; F172-Y241 HydrophobicContact CD1-CE1 4.38Å; F172-Y241 HydrophobicContact CE1-CD1 4.14Å; F172-Y241 AromaticContact CE1-CE1 3.9Å; F172-Y241 HydrophobicContact CE1-CE1 3.9Å; R176-Y241 HydrophobicContact CB-CE1 3.78Å; R176-Y241 HydrophobicContact CB-CE2 4.24Å; R176-Y241 HydrophobicContact CG-CE1 3.93Å; M177-Y241 HydrophobicContact CG-CD2 4.04Å; M177-Y241 HydrophobicContact CG-CE2 4.24Å; E180-Y241 PolarHBondContact OE1-OH 3.19Å; A237-Y241 WeakPolarHBondContact O-CD1 3.45Å; R238-Y241 HydrophobicContact CB-CE1 4.46Å; R238-Y241 HydrophobicContact CG-CD2 3.97Å; R238-Y241 HydrophobicContact CG-CE2 4.01Å; R238-Y241 HydrophobicContact CG-CG 4.27Å; R238-Y241 VanDerWaalsContact O-CB 3.31Å; R238-Y241 WeakPolarHBondContact O-CB 3.36Å; R238-Y241 PolarHBondContact O-N 2.83Å
242	F	95	Very high	92.9	Very high	34 Å²	34	34.1 Å²	34.1	15%	0.149	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	166.7	176.8	-55.8	-95.3	0	0	0	109.9	W140 I167 Y168 P169 M177 K240 L293	W140-F242 HydrophobicContact CB-CB 4.19Å; W140-F242 HydrophobicContact CB-CD2 3.65Å; W140-F242 HydrophobicContact CB-CE2 4.44Å; W140-F242 HydrophobicContact CB-CG 4.19Å; W140-F242 AromaticContact CD1-CD2 3.99Å; W140-F242 HydrophobicContact CD2-CB 3.63Å; W140-F242 VanDerWaalsContact CE2-O 3.23Å; W140-F242 HydrophobicContact CE3-CB 4.19Å; W140-F242 HydrophobicContact CG-CB 3.59Å; W140-F242 AromaticContact CG-CD2 3.85Å; W140-F242 HydrophobicContact CG-CD2 3.85Å; W140-F242 HydrophobicContact CG-CG 4.1Å; W140-F242 WeakPolarHBondContact CZ2-O 3.06Å; W140-F242 PolarHBondContact NE1-O 3.33Å; I167-F242 HydrophobicContact CG2-CB 3.9Å; I167-F242 HydrophobicContact CG2-CD1 4.19Å; I167-F242 HydrophobicContact CG2-CG 4.35Å; Y168-F242 CarbonylContact O-C 3.59Å; Y168-F242 VanDerWaalsContact O-CA 3.26Å; Y168-F242 WeakPolarHBondContact O-CA 3.35Å; Y168-F242 WeakPolarHBondContact O-CB 3.34Å; P169-F242 HydrophobicContact CB-CD1 3.9Å; P169-F242 HydrophobicContact CB-CE1 3.81Å; M177-F242 HydrophobicContact CE-CZ 4.2Å; M177-F242 HydrophobicContact SD-CE2 4.48Å; M177-F242 HydrophobicContact SD-CZ 3.99Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.93Å; F242-L293 HydrophobicContact CE1-CB 4.18Å; F242-L293 HydrophobicContact CE1-CD1 4.35Å
243	Y	95.2	Very high	93.3	Very high	40 Å²	40	34.1 Å²	34.1	16%	0.157	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	149.5	169.4	61.6	-81.6	0	0	0	107.8	Y168 I245 F284	Y168-Y243 VanDerWaalsContact CB-CZ 3.48Å; Y168-Y243 HydrophobicContact CD2-CE2 4.16Å; Y168-Y243 HydrophobicContact CG-CE2 4.36Å; Y168-Y243 PolarHBondContact N-O 2.78Å; Y168-Y243 WeakPolarHBondContact O-CD1 3.45Å; Y168-Y243 PolarHBondContact O-N 3.32Å; Y243-I245 HydrophobicContact CD2-CD1 4.29Å; Y243-I245 HydrophobicContact CD2-CG1 4.05Å; Y243-I245 HydrophobicContact CE2-CD1 3.65Å; Y243-I245 HydrophobicContact CE2-CG1 3.93Å; Y243-F284 AromaticContact CE2-CD1 3.97Å; Y243-F284 HydrophobicContact CE2-CD1 3.97Å; Y243-F284 HydrophobicContact CE2-CE1 4.12Å; Y243-F284 VanDerWaalsContact OH-CD1 3.3Å; Y243-F284 WeakPolarHBondContact OH-CD1 3.48Å
244	A	95.9	Very high	93.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	143.1	174.2	0	0	0	0	0	110.2	A134 L135 W140 I148 T166 I167	A134-A244 CarbonylContact C-O 3.53Å; A134-A244 WeakPolarHBondContact CA-O 3.42Å; L135-A244 HydrophobicContact CB-CB 4.2Å; L135-A244 PolarHBondContact N-O 2.92Å; L135-A244 PolarHBondContact O-N 3.47Å; W140-A244 HydrophobicContact CH2-CB 3.85Å; W140-A244 HydrophobicContact CZ3-CB 3.92Å; I148-A244 HydrophobicContact CD1-CB 3.91Å; T166-A244 CarbonylContact O-C 3.5Å; T166-A244 WeakPolarHBondContact O-CA 3.47Å; I167-A244 HydrophobicContact CG1-CB 4.05Å
245	I	95.8	Very high	93.7	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.015	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.8	169.2	-64.6	164.3	0	0	0	107.5	L133 T166 Y168 Y243 E247 F284	L133-I245 WeakPolarHBondContact O-CA 3.38Å; T166-I245 PolarHBondContact N-O 3.39Å; T166-I245 PolarHBondContact O-N 3.32Å; T166-I245 PolarHBondContact OG1-O 2.83Å; Y168-I245 HydrophobicContact CD2-CB 4.46Å; Y168-I245 HydrophobicContact CD2-CD1 3.61Å; Y168-I245 HydrophobicContact CD2-CG1 4.17Å; Y168-I245 HydrophobicContact CE2-CB 4.23Å; Y168-I245 HydrophobicContact CE2-CD1 3.58Å; Y168-I245 HydrophobicContact CE2-CG1 4.28Å; Y243-I245 HydrophobicContact CD2-CD1 4.29Å; Y243-I245 HydrophobicContact CD2-CG1 4.05Å; Y243-I245 HydrophobicContact CE2-CD1 3.65Å; Y243-I245 HydrophobicContact CE2-CG1 3.93Å; I245-E247 HydrophobicContact CG2-CG 4.44Å; I245-F284 HydrophobicContact CD1-CB 4.37Å; I245-F284 HydrophobicContact CD1-CD1 3.61Å; I245-F284 HydrophobicContact CD1-CD2 3.18Å; I245-F284 HydrophobicContact CD1-CE1 3.58Å; I245-F284 HydrophobicContact CD1-CE2 3.17Å; I245-F284 HydrophobicContact CD1-CG 3.4Å; I245-F284 VanDerWaalsContact CD1-CG 3.4Å; I245-F284 HydrophobicContact CD1-CZ 3.38Å; I245-F284 HydrophobicContact CG1-CE2 4.32Å; I245-F284 HydrophobicContact CG1-CZ 4.34Å
246	I	96.1	Very high	93.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.9	178.5	-53.7	135.6	0	0	0	107.2	R132 L133 L135 I148 L152 I162 V165 F248 L275	R132-I246 CarbonylContact C-O 3.43Å; R132-I246 VanDerWaalsContact CA-O 3.3Å; R132-I246 WeakPolarHBondContact CA-O 3.46Å; L133-I246 PolarHBondContact N-O 3.25Å; L133-I246 PolarHBondContact O-N 3.35Å; L135-I246 HydrophobicContact CB-CD1 4.12Å; I148-I246 HydrophobicContact CG2-CD1 4.28Å; I148-I246 HydrophobicContact CG2-CG1 4.31Å; L152-I246 HydrophobicContact CD1-CB 4.44Å; L152-I246 HydrophobicContact CD1-CD1 3.43Å; L152-I246 VanDerWaalsContact CD1-CD1 3.43Å; L152-I246 HydrophobicContact CD1-CG1 3.78Å; L152-I246 HydrophobicContact CD1-CG2 3.99Å; I162-I246 HydrophobicContact CG2-CG2 3.85Å; V165-I246 HydrophobicContact CG1-CG1 4.28Å; V165-I246 HydrophobicContact CG2-CG1 4.15Å; V165-I246 HydrophobicContact CG2-CG2 4.03Å; I246-F248 HydrophobicContact CB-CE2 3.98Å; I246-F248 HydrophobicContact CB-CZ 3.95Å; I246-F248 HydrophobicContact CG2-CD1 4.25Å; I246-F248 HydrophobicContact CG2-CD2 4.27Å; I246-F248 HydrophobicContact CG2-CE1 3.54Å; I246-F248 HydrophobicContact CG2-CE2 3.59Å; I246-F248 HydrophobicContact CG2-CZ 3.2Å; I246-L275 HydrophobicContact CD1-CD2 4.25Å
247	E	95.4	Very high	94.1	Very high	39 Å²	39	33.1 Å²	33.1	18%	0.182	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.4	175.3	-55	-170.6	126.2	0	0	108.9	R132 E163 K164 I245	R132-E247 HydrophobicContact CG-CG 4.17Å; R132-E247 IonicContact CZ-OE1 3.13Å; R132-E247 IonicContact NE-OE1 2.8Å; R132-E247 PolarHBondContact NE-OE1 3.34Å; R132-E247 IonicContact NH2-OE1 2.8Å; R132-E247 PolarHBondContact NH2-OE1 3.26Å; E163-E247 HydrophobicContact CB-CB 4.31Å; E163-E247 PolarHBondContact N-O 2.82Å; K164-E247 HydrophobicContact CB-CB 4.47Å; K164-E247 PolarHBondContact N-O 3.46Å; K164-E247 PolarHBondContact O-N 3.39Å; I245-E247 HydrophobicContact CG2-CG 4.44Å
248	F	95.4	Very high	94.3	Very high	4 Å²	4	35 Å²	35	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	158.1	176.4	-56.9	-79.4	0	0	0	110.8	H131 L133 I162 I246 S250 A254 I257	H131-F248 WeakPolarHBondContact O-CD2 3.44Å; H131-F248 PolarHBondContact O-N 2.91Å; L133-F248 HydrophobicContact CB-CE2 3.88Å; L133-F248 HydrophobicContact CD1-CE2 3.57Å; L133-F248 HydrophobicContact CD1-CZ 4.04Å; L133-F248 HydrophobicContact CG-CD2 4.38Å; L133-F248 HydrophobicContact CG-CE2 3.64Å; I162-F248 HydrophobicContact CD1-CE1 4.39Å; I162-F248 HydrophobicContact CG1-CD1 3.96Å; I162-F248 HydrophobicContact CG1-CE1 3.77Å; I246-F248 HydrophobicContact CB-CE2 3.98Å; I246-F248 HydrophobicContact CB-CZ 3.95Å; I246-F248 HydrophobicContact CG2-CD1 4.25Å; I246-F248 HydrophobicContact CG2-CD2 4.27Å; I246-F248 HydrophobicContact CG2-CE1 3.54Å; I246-F248 HydrophobicContact CG2-CE2 3.59Å; I246-F248 HydrophobicContact CG2-CZ 3.2Å; F248-S250 VanDerWaalsContact C-N 3.34Å; F248-S250 PolarHBondContact O-N 2.89Å; F248-A254 HydrophobicContact CB-CB 4.32Å; F248-A254 HydrophobicContact CD2-CB 3.55Å; F248-A254 HydrophobicContact CE2-CB 4.15Å; F248-A254 HydrophobicContact CG-CB 4.14Å; F248-I257 HydrophobicContact CD1-CD1 3.59Å; F248-I257 HydrophobicContact CE1-CD1 3.06Å; F248-I257 HydrophobicContact CE1-CG1 4.42Å; F248-I257 HydrophobicContact CZ-CB 4.45Å; F248-I257 HydrophobicContact CZ-CD1 3.6Å; F248-I257 HydrophobicContact CZ-CG2 4.13Å
249	D	94.1	Very high	94.4	Very high	41 Å²	41	38 Å²	38	22%	0.219	19%	0.194	C	C	.	.	S	Bend	trans	-64	-33.4	176.4	61.6	-18.8	0	0	0	114.5	G160 H161 T253	G160-D249 WeakPolarHBondContact CA-OD2 3.25Å; H161-D249 WeakPolarHBondContact CE1-CB 3.41Å; H161-D249 IonicContact CE1-OD2 3.51Å; H161-D249 PolarHBondContact CE1-OD2 3.47Å; H161-D249 IonicContact CG-OD2 3.6Å; H161-D249 PolarHBondContact N-OD2 3.11Å; H161-D249 VanDerWaalsContact N-OD2 3.12Å; H161-D249 VanDerWaalsContact ND1-CB 3.34Å; H161-D249 WeakPolarHBondContact ND1-CB 2.89Å; H161-D249 VanDerWaalsContact ND1-CG 3.32Å; H161-D249 IonicContact ND1-OD2 2.7Å; H161-D249 PolarHBondContact ND1-OD2 3.19Å; H161-D249 PolarHBondContact O-N 2.77Å; D249-T253 WeakPolarHBondContact OD1-CB 3.33Å; D249-T253 VanDerWaalsContact OD1-CG2 3.31Å; D249-T253 WeakPolarHBondContact OD1-CG2 3.49Å; D249-T253 PolarHBondContact OD1-OG1 3.25Å
250	S	93.8	Very high	94.4	Very high	36 Å²	36	39.8 Å²	39.8	25%	0.252	21%	0.21	S	C	.	.			trans	-139.2	154.5	-173	-176.4	0	0	0	0	111.7	H131 F248 E252 T253 A254	H131-S250 VanDerWaalsContact ND1-CA 3.3Å; H131-S250 WeakPolarHBondContact ND1-CA 3.37Å; F248-S250 VanDerWaalsContact C-N 3.34Å; F248-S250 PolarHBondContact O-N 2.89Å; S250-E252 VanDerWaalsContact C-N 3.26Å; S250-E252 PolarHBondContact OG-N 2.8Å; S250-T253 PolarHBondContact N-OG1 3.19Å; S250-T253 PolarHBondContact O-N 3.06Å; S250-T253 PolarHBondContact O-OG1 3.42Å; S250-A254 PolarHBondContact O-N 3.41Å
251	V	94.4	Very high	94.4	Very high	37 Å²	37	35.2 Å²	35.2	22%	0.224	19%	0.19	C	C	.	.	H	α-helix	trans	-67.9	-34.5	172.7	-174.5	0	0	0	0	109.9	H131 T253 A254 E255	H131-V251 WeakPolarHBondContact CE1-CG2 3.45Å; H131-V251 PolarHBondContact CE1-N 3.09Å; H131-V251 PolarHBondContact ND1-N 2.73Å; H131-V251 VanDerWaalsContact ND1-N 3.13Å; H131-V251 WeakPolarHBondContact NE2-CG2 3.24Å; V251-T253 VanDerWaalsContact C-N 3.28Å; V251-T253 PolarHBondContact O-N 2.72Å; V251-A254 PolarHBondContact O-N 2.82Å; V251-E255 WeakPolarHBondContact O-CB 3.45Å; V251-E255 PolarHBondContact O-N 2.86Å
252	E	94.2	Very high	94.4	Very high	153 Å²	153	38 Å²	38	72%	0.715	21%	0.205	S	C	*	.	H	α-helix	trans	-64.2	-34.9	179.2	-62.3	-178	173.5	0	0	111.8	S250 A256	S250-E252 VanDerWaalsContact C-N 3.26Å; S250-E252 PolarHBondContact OG-N 2.8Å; E252-A256 WeakPolarHBondContact O-CB 3.25Å; E252-A256 PolarHBondContact O-N 3.17Å
253	T	94.9	Very high	94.1	Very high	10 Å²	10	38.1 Å²	38.1	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-75.8	-41.7	-179.6	55.6	0	0	0	0	110.3	P157 G160 D249 S250 V251 E255 A256 I257	P157-T253 HydrophobicContact CG-CG2 3.83Å; G160-T253 VanDerWaalsContact CA-CG2 3.42Å; D249-T253 WeakPolarHBondContact OD1-CB 3.33Å; D249-T253 VanDerWaalsContact OD1-CG2 3.31Å; D249-T253 WeakPolarHBondContact OD1-CG2 3.49Å; D249-T253 PolarHBondContact OD1-OG1 3.25Å; S250-T253 PolarHBondContact N-OG1 3.19Å; S250-T253 PolarHBondContact O-N 3.06Å; S250-T253 PolarHBondContact O-OG1 3.42Å; V251-T253 VanDerWaalsContact C-N 3.28Å; V251-T253 PolarHBondContact O-N 2.72Å; T253-E255 PolarHBondContact O-N 3.44Å; T253-A256 PolarHBondContact O-N 2.96Å; T253-I257 WeakPolarHBondContact O-CD1 3.09Å; T253-I257 VanDerWaalsContact O-CG1 3.24Å; T253-I257 WeakPolarHBondContact O-CG1 3.21Å; T253-I257 PolarHBondContact O-N 3.12Å
254	A	94.7	Very high	93.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-44.7	170.3	0	0	0	0	0	112	S130 L133 F248 S250 V251 I257 Y258 F277	S130-A254 VanDerWaalsContact O-CB 3.25Å; S130-A254 WeakPolarHBondContact O-CB 3.06Å; L133-A254 HydrophobicContact CG-CB 4.38Å; F248-A254 HydrophobicContact CB-CB 4.32Å; F248-A254 HydrophobicContact CD2-CB 3.55Å; F248-A254 HydrophobicContact CE2-CB 4.15Å; F248-A254 HydrophobicContact CG-CB 4.14Å; S250-A254 PolarHBondContact O-N 3.41Å; V251-A254 PolarHBondContact O-N 2.82Å; A254-I257 PolarHBondContact O-N 2.97Å; A254-Y258 WeakPolarHBondContact O-CB 3.35Å; A254-Y258 PolarHBondContact O-N 2.89Å; A254-F277 HydrophobicContact CB-CE1 4.26Å
255	E	93.9	Very high	93.7	Very high	93 Å²	93	43.5 Å²	43.5	44%	0.435	24%	0.244	S	C	.	.	H	α-helix	trans	-65.3	-43.9	178.1	-174.1	177	-170.1	0	0	112.5	V251 T253 I257 Y258 T259 F277	V251-E255 WeakPolarHBondContact O-CB 3.45Å; V251-E255 PolarHBondContact O-N 2.86Å; T253-E255 PolarHBondContact O-N 3.44Å; E255-I257 VanDerWaalsContact C-N 3.29Å; E255-I257 PolarHBondContact O-N 3.42Å; E255-Y258 PolarHBondContact O-N 3.01Å; E255-T259 VanDerWaalsContact O-CG2 3.3Å; E255-T259 WeakPolarHBondContact O-CG2 3.35Å; E255-T259 PolarHBondContact O-N 3.12Å; E255-T259 PolarHBondContact O-OG1 3.38Å; E255-F277 HydrophobicContact CB-CZ 4.48Å
256	A	94	Very high	93.4	Very high	35 Å²	35	43.9 Å²	43.9	29%	0.289	25%	0.246	S	C	.	.	H	α-helix	trans	-58.4	-43.3	175.8	0	0	0	0	0	111.6	P157 E252 T253 T259 A260	P157-A256 HydrophobicContact CG-CB 4.34Å; E252-A256 WeakPolarHBondContact O-CB 3.25Å; E252-A256 PolarHBondContact O-N 3.17Å; T253-A256 PolarHBondContact O-N 2.96Å; A256-T259 PolarHBondContact O-OG1 2.91Å; A256-A260 VanDerWaalsContact O-CB 3.28Å; A256-A260 WeakPolarHBondContact O-CB 3.5Å; A256-A260 PolarHBondContact O-N 2.9Å
257	I	94.9	Very high	93	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70.5	-42.5	179	-67.7	164.7	0	0	0	111.2	L133 L152 L156 F248 T253 A254 E255 T259 A260 C261 L275	L133-I257 HydrophobicContact CD1-CG2 4.29Å; L152-I257 HydrophobicContact CD2-CG2 3.74Å; L156-I257 HydrophobicContact CD2-CD1 3.57Å; F248-I257 HydrophobicContact CD1-CD1 3.59Å; F248-I257 HydrophobicContact CE1-CD1 3.06Å; F248-I257 HydrophobicContact CE1-CG1 4.42Å; F248-I257 HydrophobicContact CZ-CB 4.45Å; F248-I257 HydrophobicContact CZ-CD1 3.6Å; F248-I257 HydrophobicContact CZ-CG2 4.13Å; T253-I257 WeakPolarHBondContact O-CD1 3.09Å; T253-I257 VanDerWaalsContact O-CG1 3.24Å; T253-I257 WeakPolarHBondContact O-CG1 3.21Å; T253-I257 PolarHBondContact O-N 3.12Å; A254-I257 PolarHBondContact O-N 2.97Å; E255-I257 VanDerWaalsContact C-N 3.29Å; E255-I257 PolarHBondContact O-N 3.42Å; I257-T259 VanDerWaalsContact C-N 3.34Å; I257-T259 PolarHBondContact O-N 2.89Å; I257-A260 PolarHBondContact O-N 2.93Å; I257-C261 HydrophobicContact CG2-CB 4.31Å; I257-C261 WeakPolarHBondContact O-CB 3.47Å; I257-C261 PolarHBondContact O-N 2.99Å; I257-L275 HydrophobicContact CG2-CD1 4.34Å
258	Y	94.1	Very high	92.5	Very high	57 Å²	57	50.8 Å²	50.8	22%	0.224	29%	0.287	C	S	.	.	H	α-helix	trans	-56.1	-49.9	175.2	175.8	-107.1	0	0	0	111	A254 E255 A260 D262 L275 F277	A254-Y258 WeakPolarHBondContact O-CB 3.35Å; A254-Y258 PolarHBondContact O-N 2.89Å; E255-Y258 PolarHBondContact O-N 3.01Å; Y258-A260 VanDerWaalsContact C-N 3.32Å; Y258-A260 PolarHBondContact O-N 3.44Å; Y258-D262 HydrophobicContact CD2-CB 4.11Å; Y258-D262 HydrophobicContact CE2-CB 3.95Å; Y258-D262 WeakPolarHBondContact O-CB 3.28Å; Y258-D262 PolarHBondContact O-N 3.16Å; Y258-D262 VanDerWaalsContact O-N 3.07Å; Y258-L275 HydrophobicContact CD2-CB 3.84Å; Y258-L275 HydrophobicContact CE2-CB 4.31Å; Y258-L275 WeakPolarHBondContact CE2-O 3.24Å; Y258-F277 HydrophobicContact CD1-CD2 4.48Å; Y258-F277 AromaticContact CD1-CE2 3.47Å; Y258-F277 HydrophobicContact CD1-CE2 3.47Å; Y258-F277 VanDerWaalsContact CD1-CE2 3.47Å; Y258-F277 HydrophobicContact CD1-CZ 4.04Å; Y258-F277 HydrophobicContact CD2-CD2 4.47Å; Y258-F277 HydrophobicContact CD2-CE2 4.03Å; Y258-F277 AromaticContact CE1-CE2 3.93Å; Y258-F277 HydrophobicContact CE1-CE2 3.93Å; Y258-F277 HydrophobicContact CE2-CE2 4.48Å; Y258-F277 HydrophobicContact CG-CD2 4.37Å; Y258-F277 AromaticContact CG-CE2 3.52Å; Y258-F277 HydrophobicContact CG-CE2 3.52Å; Y258-F277 AromaticContact CG-CZ 3.92Å; Y258-F277 HydrophobicContact CG-CZ 3.92Å
259	T	92.8	Very high	92.1	Very high	105 Å²	105	50.7 Å²	50.7	64%	0.644	29%	0.287	S	S	*	.	H	α-helix	trans	-66.9	-30.2	-179.7	62	0	0	0	0	114	E255 A256 I257	E255-T259 VanDerWaalsContact O-CG2 3.3Å; E255-T259 WeakPolarHBondContact O-CG2 3.35Å; E255-T259 PolarHBondContact O-N 3.12Å; E255-T259 PolarHBondContact O-OG1 3.38Å; A256-T259 PolarHBondContact O-OG1 2.91Å; I257-T259 VanDerWaalsContact C-N 3.34Å; I257-T259 PolarHBondContact O-N 2.89Å
260	A	92.8	Very high	91.6	Very high	47 Å²	47	49.5 Å²	49.5	39%	0.388	28%	0.284	S	S	.	.	H	α-helix	trans	-85.9	-39.6	-179	0	0	0	0	0	113	A256 I257 Y258 L264	A256-A260 VanDerWaalsContact O-CB 3.28Å; A256-A260 WeakPolarHBondContact O-CB 3.5Å; A256-A260 PolarHBondContact O-N 2.9Å; I257-A260 PolarHBondContact O-N 2.93Å; Y258-A260 VanDerWaalsContact C-N 3.32Å; Y258-A260 PolarHBondContact O-N 3.44Å; A260-L264 VanDerWaalsContact O-CD1 3.3Å; A260-L264 WeakPolarHBondContact O-CD1 3.23Å
261	C	92.7	Very high	91.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-102.9	-21.8	-167.3	-62.2	0	0	0	0	114.1	L152 F155 I257 G263 L264 L273 L275	L152-C261 HydrophobicContact CD2-CB 4.46Å; F155-C261 VanDerWaalsContact CB-SG 3.52Å; F155-C261 WeakPolarHBondContact CD2-SG 3.13Å; F155-C261 WeakPolarHBondContact CG-SG 3.5Å; I257-C261 HydrophobicContact CG2-CB 4.31Å; I257-C261 WeakPolarHBondContact O-CB 3.47Å; I257-C261 PolarHBondContact O-N 2.99Å; C261-G263 PolarHBondContact O-N 2.95Å; C261-L264 WeakPolarHBondContact O-CB 3.26Å; C261-L264 PolarHBondContact O-N 3.13Å; C261-L273 HydrophobicContact CB-CD1 4.1Å; C261-L275 HydrophobicContact CB-CD1 3.63Å
262	D	92.1	Very high	91.1	Very high	64 Å²	64	50.9 Å²	50.9	34%	0.342	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	126.8	-179.8	-169.2	37.7	0	0	0	110.8	Y258 L264 L275	Y258-D262 HydrophobicContact CD2-CB 4.11Å; Y258-D262 HydrophobicContact CE2-CB 3.95Å; Y258-D262 WeakPolarHBondContact O-CB 3.28Å; Y258-D262 PolarHBondContact O-N 3.16Å; Y258-D262 VanDerWaalsContact O-N 3.07Å; D262-L264 VanDerWaalsContact C-N 3.28Å; D262-L264 PolarHBondContact O-N 3.2Å; D262-L275 HydrophobicContact CB-CB 4.35Å; D262-L275 PolarHBondContact OD1-N 2.81Å
263	G	89.3	Confident	91	Very high	36 Å²	36	44.1 Å²	44.1	37%	0.371	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	0.2	-174.1	0	0	0	0	0	115.9	C261 R272 L273	C261-G263 PolarHBondContact O-N 2.95Å; G263-R272 WeakPolarHBondContact O-CG 3.4Å; G263-L273 PolarHBondContact N-O 3.33Å
264	L	91.5	Very high	90.9	Very high	66 Å²	66	43.9 Å²	43.9	35%	0.346	25%	0.247	S	C	.	.			trans	-77.6	134.9	179.9	-143.6	160.8	0	0	0	110.3	F155 A260 C261 D262 R272 L273	F155-L264 HydrophobicContact CE1-CD1 3.9Å; F155-L264 HydrophobicContact CZ-CD1 3.8Å; A260-L264 VanDerWaalsContact O-CD1 3.3Å; A260-L264 WeakPolarHBondContact O-CD1 3.23Å; C261-L264 WeakPolarHBondContact O-CB 3.26Å; C261-L264 PolarHBondContact O-N 3.13Å; D262-L264 VanDerWaalsContact C-N 3.28Å; D262-L264 PolarHBondContact O-N 3.2Å; L264-R272 CarbonylContact O-C 3.49Å; L264-R272 WeakPolarHBondContact O-CA 3.49Å; L264-L273 PolarHBondContact O-N 2.76Å
265	E	91.1	Very high	90.9	Very high	87 Å²	87	44 Å²	44	41%	0.407	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-76.1	132.2	178	-69.2	177.2	-171.9	0	0	111	E267 R272	E265-E267 PolarHBondContact O-N 3.23Å; E265-R272 HydrophobicContact CB-CG 4.45Å; E265-R272 HydrophobicContact CG-CG 3.36Å; E265-R272 IonicContact OE1-CZ 3.31Å; E265-R272 IonicContact OE1-NE 3.97Å; E265-R272 PolarHBondContact OE1-NE 3.12Å; E265-R272 IonicContact OE1-NH2 2.76Å; E265-R272 PolarHBondContact OE1-NH2 3.24Å
266	Y	89.9	Confident	90.8	Very high	12 Å²	12	42.5 Å²	42.5	5%	0.047	24%	0.238	C	C	.	.			trans	-74.7	110.6	172.1	174.8	-106.2	0	0	0	109.8	F138 T147 V151 S268 S269 S271 F310	F138-Y266 HydrophobicContact CE2-CG 4.31Å; F138-Y266 HydrophobicContact CZ-CD1 4.06Å; F138-Y266 HydrophobicContact CZ-CD2 4.41Å; F138-Y266 AromaticContact CZ-CG 3.86Å; F138-Y266 HydrophobicContact CZ-CG 3.86Å; T147-Y266 HydrophobicContact CG2-CE1 4.46Å; T147-Y266 HydrophobicContact CG2-CE2 3.89Å; T147-Y266 VanDerWaalsContact CG2-OH 3.24Å; T147-Y266 WeakPolarHBondContact CG2-OH 3.3Å; V151-Y266 HydrophobicContact CG2-CD2 3.5Å; V151-Y266 VanDerWaalsContact CG2-CD2 3.5Å; V151-Y266 HydrophobicContact CG2-CE2 3.28Å; Y266-S268 PolarHBondContact O-N 3.28Å; Y266-S269 VanDerWaalsContact O-CB 3.28Å; Y266-S269 WeakPolarHBondContact O-CB 3.22Å; Y266-S269 PolarHBondContact O-N 3.21Å; Y266-S269 PolarHBondContact O-OG 3.33Å; Y266-S271 PolarHBondContact N-O 3.5Å; Y266-F310 AromaticContact CD1-CE1 3.9Å; Y266-F310 HydrophobicContact CD1-CE1 3.9Å; Y266-F310 HydrophobicContact CD1-CE2 4.28Å; Y266-F310 AromaticContact CD1-CZ 3.6Å; Y266-F310 HydrophobicContact CD1-CZ 3.6Å; Y266-F310 HydrophobicContact CE1-CD1 4.14Å; Y266-F310 AromaticContact CE1-CE1 3.38Å; Y266-F310 HydrophobicContact CE1-CE1 3.38Å; Y266-F310 AromaticContact CE1-CZ 3.61Å; Y266-F310 HydrophobicContact CE1-CZ 3.61Å
267	E	86.8	Confident	90.8	Very high	102 Å²	102	42.4 Å²	42.4	48%	0.477	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.5	-122.1	-177.3	-60.9	-167.7	158.7	0	0	112.5	E265	E265-E267 PolarHBondContact O-N 3.23Å
268	S	86.3	Confident	90.7	Very high	82 Å²	82	43 Å²	43	57%	0.573	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.8	25.3	174.2	63.8	0	0	0	0	112.1	Y266 G270	Y266-S268 PolarHBondContact O-N 3.28Å; S268-G270 VanDerWaalsContact C-N 3.3Å; S268-G270 PolarHBondContact O-N 2.72Å
269	S	85.7	Confident	90.6	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.007	25%	0.246	C	C	.	.	S	Bend	trans	-75.6	-19.6	-176.6	67.5	0	0	0	0	113.7	Y266 S271 F310 T312	Y266-S269 VanDerWaalsContact O-CB 3.28Å; Y266-S269 WeakPolarHBondContact O-CB 3.22Å; Y266-S269 PolarHBondContact O-N 3.21Å; Y266-S269 PolarHBondContact O-OG 3.33Å; S269-S271 PolarHBondContact O-N 2.77Å; S269-S271 PolarHBondContact OG-N 3.08Å; S269-F310 VanDerWaalsContact CA-O 3.23Å; S269-F310 WeakPolarHBondContact CA-O 3.13Å; S269-F310 WeakPolarHBondContact CB-O 3.4Å; S269-T312 PolarHBondContact O-N 3.19Å
270	G	84.5	Confident	90.4	Very high	16 Å²	16	42.7 Å²	42.7	17%	0.165	23%	0.233	C	C	.	.			trans	74.6	-2.1	-171.6	0	0	0	0	0	114.5	S268	S268-G270 VanDerWaalsContact C-N 3.3Å; S268-G270 PolarHBondContact O-N 2.72Å
271	S	86.8	Confident	90.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-87.9	120	172.3	-76.6	0	0	0	0	110.3	Y266 S269 T312 L315	Y266-S271 PolarHBondContact N-O 3.5Å; S269-S271 PolarHBondContact O-N 2.77Å; S269-S271 PolarHBondContact OG-N 3.08Å; S271-T312 VanDerWaalsContact OG-CB 3.25Å; S271-T312 WeakPolarHBondContact OG-CB 3.33Å; S271-T312 PolarHBondContact OG-OG1 3.21Å; S271-L315 WeakPolarHBondContact OG-CD1 3.38Å
272	R	90.6	Very high	90.1	Very high	103 Å²	103	52.3 Å²	52.3	39%	0.389	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-84.4	153.3	170.6	-66.3	171.7	-175.7	173.6	1.7	110.1	W116 G263 L264 E265	W116-R272 HydrophobicContact CD2-CB 3.9Å; W116-R272 HydrophobicContact CD2-CG 4.46Å; W116-R272 VanDerWaalsContact CE2-CB 3.5Å; W116-R272 HydrophobicContact CE3-CB 4.1Å; W116-R272 HydrophobicContact CH2-CB 3.56Å; W116-R272 VanDerWaalsContact CZ2-C 3.44Å; W116-R272 HydrophobicContact CZ2-CB 3.4Å; W116-R272 WeakPolarHBondContact CZ2-O 3.18Å; W116-R272 HydrophobicContact CZ3-CB 3.9Å; G263-R272 WeakPolarHBondContact O-CG 3.4Å; L264-R272 CarbonylContact O-C 3.49Å; L264-R272 WeakPolarHBondContact O-CA 3.49Å; E265-R272 HydrophobicContact CB-CG 4.45Å; E265-R272 HydrophobicContact CG-CG 3.36Å; E265-R272 IonicContact OE1-CZ 3.31Å; E265-R272 IonicContact OE1-NE 3.97Å; E265-R272 PolarHBondContact OE1-NE 3.12Å; E265-R272 IonicContact OE1-NH2 2.76Å; E265-R272 PolarHBondContact OE1-NH2 3.24Å
273	L	92.3	Very high	89.9	Confident	10 Å²	10	56.8 Å²	56.8	5%	0.052	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-80.6	123	173	-58.8	174	0	0	0	109	L135 F138 V151 C261 G263 L264 L275	L135-L273 HydrophobicContact CD1-CB 3.91Å; L135-L273 HydrophobicContact CD1-CD2 3.69Å; L135-L273 HydrophobicContact CD1-CG 4.4Å; L135-L273 HydrophobicContact CD2-CD2 4.18Å; F138-L273 HydrophobicContact CD2-CD2 4.08Å; F138-L273 HydrophobicContact CE2-CD2 3.76Å; F138-L273 HydrophobicContact CZ-CD2 4.35Å; V151-L273 HydrophobicContact CG1-CD1 4.34Å; C261-L273 HydrophobicContact CB-CD1 4.1Å; G263-L273 PolarHBondContact N-O 3.33Å; L264-L273 PolarHBondContact O-N 2.76Å; L273-L275 HydrophobicContact CB-CG 4.49Å
274	D	92.9	Very high	89.8	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.027	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	98.4	168.8	179.5	-2.1	0	0	0	107.5	W116 T120 L135 L136 H137 R276	W116-D274 HydrophobicContact CH2-CB 3.68Å; W116-D274 HydrophobicContact CZ2-CB 3.9Å; T120-D274 HydrophobicContact CG2-CB 4.42Å; L135-D274 WeakPolarHBondContact CA-O 3.46Å; L136-D274 HydrophobicContact CB-CB 4.23Å; L136-D274 PolarHBondContact N-O 3.38Å; H137-D274 IonicContact CE1-OD2 3.37Å; H137-D274 PolarHBondContact CE1-OD2 2.67Å; H137-D274 VanDerWaalsContact CE1-OD2 3.31Å; H137-D274 IonicContact CG-OD2 3.75Å; H137-D274 IonicContact ND1-OD2 2.79Å; H137-D274 PolarHBondContact ND1-OD2 2.92Å; D274-R276 IonicContact OD1-CZ 3.73Å; D274-R276 IonicContact OD1-NE 2.98Å; D274-R276 PolarHBondContact OD1-NE 3.45Å; D274-R276 IonicContact OD1-NH2 3.56Å; D274-R276 IonicContact OD2-CZ 3.58Å; D274-R276 IonicContact OD2-NE 3.56Å; D274-R276 IonicContact OD2-NH2 2.81Å; D274-R276 PolarHBondContact OD2-NH2 3.12Å
275	L	93.5	Very high	89.5	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	138.8	-179.7	-65.4	175.8	0	0	0	110	L133 A134 L135 I246 I257 Y258 C261 D262 L273	L133-L275 HydrophobicContact CD1-CD1 4.4Å; A134-L275 CarbonylContact O-C 3.44Å; A134-L275 WeakPolarHBondContact O-CA 3.19Å; L135-L275 HydrophobicContact CB-CD2 4.03Å; L135-L275 HydrophobicContact CD1-CD2 3.71Å; L135-L275 HydrophobicContact CD1-CG 4.42Å; L135-L275 HydrophobicContact CG-CD2 4.46Å; I246-L275 HydrophobicContact CD1-CD2 4.25Å; I257-L275 HydrophobicContact CG2-CD1 4.34Å; Y258-L275 HydrophobicContact CD2-CB 3.84Å; Y258-L275 HydrophobicContact CE2-CB 4.31Å; Y258-L275 WeakPolarHBondContact CE2-O 3.24Å; C261-L275 HydrophobicContact CB-CD1 3.63Å; D262-L275 HydrophobicContact CB-CB 4.35Å; D262-L275 PolarHBondContact OD1-N 2.81Å; L273-L275 HydrophobicContact CB-CG 4.49Å
276	R	92.9	Very high	89.4	Confident	63 Å²	63	60 Å²	60	24%	0.238	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	143.9	176.4	-57.8	-170.6	-166.7	-179.8	5.1	111.2	L133 A134 L136 D274	L133-R276 CarbonylContact C-O 3.5Å; L133-R276 WeakPolarHBondContact CA-O 3.16Å; A134-R276 PolarHBondContact N-O 3.05Å; A134-R276 PolarHBondContact O-N 3.16Å; L136-R276 VanDerWaalsContact CD1-CD 3.48Å; L136-R276 HydrophobicContact CD1-CG 4.04Å; D274-R276 IonicContact OD1-CZ 3.73Å; D274-R276 IonicContact OD1-NE 2.98Å; D274-R276 PolarHBondContact OD1-NE 3.45Å; D274-R276 IonicContact OD1-NH2 3.56Å; D274-R276 IonicContact OD2-CZ 3.58Å; D274-R276 IonicContact OD2-NE 3.56Å; D274-R276 IonicContact OD2-NH2 2.81Å; D274-R276 PolarHBondContact OD2-NH2 3.12Å
277	F	94.2	Very high	89.4	Confident	33 Å²	33	62.2 Å²	62.2	15%	0.145	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	142.8	176	-71.9	-85.2	0	0	0	111.9	A126 Q128 T129 S130 L133 A254 E255 Y258	A126-F277 HydrophobicContact CB-CB 4.24Å; A126-F277 HydrophobicContact CB-CD2 3.34Å; A126-F277 HydrophobicContact CB-CE2 4.07Å; A126-F277 HydrophobicContact CB-CG 4.21Å; Q128-F277 WeakPolarHBondContact O-CB 3.43Å; T129-F277 HydrophobicContact CG2-CE1 4.21Å; T129-F277 HydrophobicContact CG2-CE2 4.32Å; T129-F277 HydrophobicContact CG2-CZ 3.92Å; S130-F277 VanDerWaalsContact N-CD1 3.34Å; L133-F277 HydrophobicContact CD2-CB 4.44Å; L133-F277 HydrophobicContact CD2-CD1 3.42Å; L133-F277 VanDerWaalsContact CD2-CD1 3.42Å; L133-F277 HydrophobicContact CD2-CD2 4.09Å; L133-F277 HydrophobicContact CD2-CE1 3.59Å; L133-F277 HydrophobicContact CD2-CE2 4.26Å; L133-F277 HydrophobicContact CD2-CG 3.73Å; L133-F277 HydrophobicContact CD2-CZ 4.03Å; A254-F277 HydrophobicContact CB-CE1 4.26Å; E255-F277 HydrophobicContact CB-CZ 4.48Å; Y258-F277 HydrophobicContact CD1-CD2 4.48Å; Y258-F277 AromaticContact CD1-CE2 3.47Å; Y258-F277 HydrophobicContact CD1-CE2 3.47Å; Y258-F277 VanDerWaalsContact CD1-CE2 3.47Å; Y258-F277 HydrophobicContact CD1-CZ 4.04Å; Y258-F277 HydrophobicContact CD2-CD2 4.47Å; Y258-F277 HydrophobicContact CD2-CE2 4.03Å; Y258-F277 AromaticContact CE1-CE2 3.93Å; Y258-F277 HydrophobicContact CE1-CE2 3.93Å; Y258-F277 HydrophobicContact CE2-CE2 4.48Å; Y258-F277 HydrophobicContact CG-CD2 4.37Å; Y258-F277 AromaticContact CG-CE2 3.52Å; Y258-F277 HydrophobicContact CG-CE2 3.52Å; Y258-F277 AromaticContact CG-CZ 3.92Å; Y258-F277 HydrophobicContact CG-CZ 3.92Å
278	V	92.4	Very high	89.4	Confident	13 Å²	13	63 Å²	63	8%	0.079	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.7	-179.8	169.9	0	0	0	0	109.1	S130 R132 A134 Q282 F284	S130-V278 WeakPolarHBondContact CB-O 3.29Å; S130-V278 PolarHBondContact OG-N 2.76Å; S130-V278 PolarHBondContact OG-O 3.33Å; R132-V278 HydrophobicContact CB-CB 4.09Å; R132-V278 HydrophobicContact CB-CG1 4.4Å; R132-V278 PolarHBondContact O-N 2.85Å; A134-V278 HydrophobicContact CB-CG2 3.57Å; V278-Q282 HydrophobicContact CG1-CB 4.24Å; V278-F284 HydrophobicContact CG1-CE2 4.02Å; V278-F284 HydrophobicContact CG1-CZ 3.56Å
279	D	92	Very high	89.5	Confident	85 Å²	85	66.1 Å²	66.1	46%	0.455	33%	0.334	S	S	.	.			trans	-63.5	141.6	179	-64.5	-18.3	0	0	0	111.6	D281 Q282	D279-D281 PolarHBondContact O-N 2.79Å; D279-Q282 HydrophobicContact CB-CB 4.48Å; D279-Q282 WeakPolarHBondContact O-CB 3.36Å; D279-Q282 PolarHBondContact O-N 3.1Å; D279-Q282 VanDerWaalsContact O-N 3.14Å
280	N	88.6	Confident	89.7	Confident	69 Å²	69	68.3 Å²	68.3	37%	0.369	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.9	-178.1	-55.5	-37.6	0	0	0	112.5	H131 R132	H131-N280 PolarHBondContact CD2-ND2 3.44Å; H131-N280 PolarHBondContact N-OD1 3.37Å; R132-N280 PolarHBondContact NH1-O 2.91Å
281	D	88.9	Confident	89.9	Confident	154 Å²	154	70.1 Å²	70.1	82%	0.824	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-10.6	-179.8	-62.2	-29.3	0	0	0	112.8	D279 Q283	D279-D281 PolarHBondContact O-N 2.79Å; D281-Q283 PolarHBondContact O-N 3.28Å
282	Q	89.2	Confident	89.8	Confident	96 Å²	96	77 Å²	77	45%	0.449	39%	0.388	S	S	.	.			trans	-69.1	122.5	-178.6	-170.7	171.2	-5.1	0	0	110.3	R132 V278 D279 F284	R132-Q282 PolarHBondContact NH1-O 3.36Å; V278-Q282 HydrophobicContact CG1-CB 4.24Å; D279-Q282 HydrophobicContact CB-CB 4.48Å; D279-Q282 WeakPolarHBondContact O-CB 3.36Å; D279-Q282 PolarHBondContact O-N 3.1Å; D279-Q282 VanDerWaalsContact O-N 3.14Å; Q282-F284 HydrophobicContact CB-CE2 4.32Å; Q282-F284 HydrophobicContact CB-CZ 4.12Å; Q282-F284 HydrophobicContact CG-CE1 4.04Å; Q282-F284 HydrophobicContact CG-CE2 4.21Å; Q282-F284 HydrophobicContact CG-CZ 3.68Å; Q282-F284 WeakPolarHBondContact O-CE2 3.32Å
283	Q	87.9	Confident	89.7	Confident	158 Å²	158	74.5 Å²	74.5	74%	0.738	38%	0.382	S	S	*	.			trans	-96.5	141.4	176.8	-64.4	-175.7	-7.2	0	0	110.3	D281	D281-Q283 PolarHBondContact O-N 3.28Å
284	F	87.8	Confident	89.7	Confident	48 Å²	48	76.2 Å²	76.2	21%	0.211	39%	0.393	C	S	.	.			trans	-112.9	95.6	-179.7	-60.4	-77.6	0	0	0	108.8	Y168 Y243 I245 V278 Q282	Y168-F284 HydrophobicContact CE1-CB 4.32Å; Y168-F284 HydrophobicContact CE2-CB 4.47Å; Y243-F284 AromaticContact CE2-CD1 3.97Å; Y243-F284 HydrophobicContact CE2-CD1 3.97Å; Y243-F284 HydrophobicContact CE2-CE1 4.12Å; Y243-F284 VanDerWaalsContact OH-CD1 3.3Å; Y243-F284 WeakPolarHBondContact OH-CD1 3.48Å; I245-F284 HydrophobicContact CD1-CB 4.37Å; I245-F284 HydrophobicContact CD1-CD1 3.61Å; I245-F284 HydrophobicContact CD1-CD2 3.18Å; I245-F284 HydrophobicContact CD1-CE1 3.58Å; I245-F284 HydrophobicContact CD1-CE2 3.17Å; I245-F284 HydrophobicContact CD1-CG 3.4Å; I245-F284 VanDerWaalsContact CD1-CG 3.4Å; I245-F284 HydrophobicContact CD1-CZ 3.38Å; I245-F284 HydrophobicContact CG1-CE2 4.32Å; I245-F284 HydrophobicContact CG1-CZ 4.34Å; V278-F284 HydrophobicContact CG1-CE2 4.02Å; V278-F284 HydrophobicContact CG1-CZ 3.56Å; Q282-F284 HydrophobicContact CB-CE2 4.32Å; Q282-F284 HydrophobicContact CB-CZ 4.12Å; Q282-F284 HydrophobicContact CG-CE1 4.04Å; Q282-F284 HydrophobicContact CG-CE2 4.21Å; Q282-F284 HydrophobicContact CG-CZ 3.68Å; Q282-F284 WeakPolarHBondContact O-CE2 3.32Å
285	E	86	Confident	89.6	Confident	173 Å²	173	78.6 Å²	78.6	81%	0.808	41%	0.409	S	S	*	.			trans	-88.8	123	176.9	-64.4	-175.8	-179.2	0	0	109.7
286	V	88.6	Confident	89.6	Confident	36 Å²	36	82.6 Å²	82.6	22%	0.218	43%	0.428	C	S	.	.			trans	-110.7	132.8	172.3	-179.8	0	0	0	0	108.3	Y168 P169 V294	Y168-V286 HydrophobicContact CD1-CG2 3.68Å; Y168-V286 HydrophobicContact CE1-CG2 4.39Å; P169-V286 HydrophobicContact CG-CG1 3.87Å; P169-V286 HydrophobicContact CG-CG2 4.38Å; V286-V294 HydrophobicContact CB-CG2 4.41Å; V286-V294 HydrophobicContact CG1-CG2 4.28Å; V286-V294 HydrophobicContact CG2-CG2 4.09Å
287	P	89.2	Confident	89.6	Confident	58 Å²	58	80 Å²	80	38%	0.377	42%	0.419	S	S	.	.			trans	-56.4	142.1	174.6	-21.7	31.1	0	0	0	111	E289 Y290 A291	P287-E289 PolarHBondContact O-N 3.45Å; P287-Y290 HydrophobicContact CB-CD2 4.17Å; P287-Y290 HydrophobicContact CG-CD2 4.36Å; P287-Y290 PolarHBondContact O-N 3.02Å; P287-A291 PolarHBondContact O-N 3.09Å
288	P	88.1	Confident	89.5	Confident	118 Å²	118	85.9 Å²	85.9	77%	0.766	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-59	-27	-172.9	23.6	-34.3	0	0	0	113.2	Y290 A291	P288-Y290 VanDerWaalsContact C-N 3.27Å; P288-Y290 PolarHBondContact O-N 3.38Å; P288-A291 WeakPolarHBondContact O-CB 3.4Å; P288-A291 PolarHBondContact O-N 3.43Å
289	E	88.1	Confident	89.3	Confident	147 Å²	147	93.2 Å²	93.2	69%	0.687	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-60.7	-35	175.7	-62	177	-174.4	0	0	112.5	P287 H292	P287-E289 PolarHBondContact O-N 3.45Å; E289-H292 PolarHBondContact O-CE1 3.29Å; E289-H292 PolarHBondContact O-ND1 3.21Å
290	Y	88.7	Confident	89.1	Confident	48 Å²	48	90 Å²	90	19%	0.188	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-101.8	5.1	-177.6	-60.4	-78.7	0	0	0	113.2	I174 P287 P288 H292 L293	I174-Y290 HydrophobicContact CD1-CD2 4.38Å; I174-Y290 HydrophobicContact CG1-CD2 4.36Å; I174-Y290 HydrophobicContact CG1-CG 4.28Å; I174-Y290 HydrophobicContact CG2-CD2 3.84Å; I174-Y290 HydrophobicContact CG2-CE1 4.21Å; I174-Y290 HydrophobicContact CG2-CE2 3.41Å; I174-Y290 VanDerWaalsContact CG2-CE2 3.41Å; I174-Y290 HydrophobicContact CG2-CG 4.42Å; P287-Y290 HydrophobicContact CB-CD2 4.17Å; P287-Y290 HydrophobicContact CG-CD2 4.36Å; P287-Y290 PolarHBondContact O-N 3.02Å; P288-Y290 VanDerWaalsContact C-N 3.27Å; P288-Y290 PolarHBondContact O-N 3.38Å; Y290-H292 PolarHBondContact O-N 3.5Å; Y290-H292 VanDerWaalsContact O-N 3.15Å; Y290-L293 HydrophobicContact CD1-CD1 3.81Å; Y290-L293 WeakPolarHBondContact O-CB 3.49Å; Y290-L293 PolarHBondContact O-N 3.32Å
291	A	88.4	Confident	89	Confident	53 Å²	53	91.8 Å²	91.8	44%	0.438	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-59.3	-28	179.6	0	0	0	0	0	112.9	P287 P288 L293 V294	P287-A291 PolarHBondContact O-N 3.09Å; P288-A291 WeakPolarHBondContact O-CB 3.4Å; P288-A291 PolarHBondContact O-N 3.43Å; A291-L293 PolarHBondContact O-N 2.73Å; A291-V294 WeakPolarHBondContact O-CB 3.3Å; A291-V294 PolarHBondContact O-N 3.34Å
292	H	85.8	Confident	88.9	Confident	145 Å²	145	90.7 Å²	90.7	67%	0.671	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-68	-18.2	176.5	68.5	-84.1	0	0	0	114	E289 Y290 V294	E289-H292 PolarHBondContact O-CE1 3.29Å; E289-H292 PolarHBondContact O-ND1 3.21Å; Y290-H292 PolarHBondContact O-N 3.5Å; Y290-H292 VanDerWaalsContact O-N 3.15Å; H292-V294 VanDerWaalsContact C-N 3.34Å
293	L	87.8	Confident	88.8	Confident	51 Å²	51	92.5 Å²	92.5	27%	0.267	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-84.4	-11.3	176.2	-59.5	179	0	0	0	112.6	P169 M177 F242 Y290 A291 S295	P169-L293 HydrophobicContact CB-CD1 4.5Å; P169-L293 HydrophobicContact CG-CB 4.47Å; M177-L293 HydrophobicContact CE-CD1 3.73Å; M177-L293 HydrophobicContact SD-CD1 4.18Å; F242-L293 HydrophobicContact CE1-CB 4.18Å; F242-L293 HydrophobicContact CE1-CD1 4.35Å; Y290-L293 HydrophobicContact CD1-CD1 3.81Å; Y290-L293 WeakPolarHBondContact O-CB 3.49Å; Y290-L293 PolarHBondContact O-N 3.32Å; A291-L293 PolarHBondContact O-N 2.73Å; L293-S295 PolarHBondContact O-N 3.43Å
294	V	91.7	Very high	88.6	Confident	46 Å²	46	93.2 Å²	93.2	28%	0.279	47%	0.473	S	S	.	.			trans	-79.5	118.6	179.2	-179.1	0	0	0	0	109	I167 Y168 V286 A291 H292	I167-V294 WeakPolarHBondContact O-CA 2.78Å; Y168-V294 HydrophobicContact CD1-CG1 4.02Å; Y168-V294 HydrophobicContact CD1-CG2 4Å; Y168-V294 HydrophobicContact CE1-CG1 3.88Å; Y168-V294 HydrophobicContact CE1-CG2 4.44Å; V286-V294 HydrophobicContact CB-CG2 4.41Å; V286-V294 HydrophobicContact CG1-CG2 4.28Å; V286-V294 HydrophobicContact CG2-CG2 4.09Å; A291-V294 WeakPolarHBondContact O-CB 3.3Å; A291-V294 PolarHBondContact O-N 3.34Å; H292-V294 VanDerWaalsContact C-N 3.34Å
295	S	91.6	Very high	88.4	Confident	54 Å²	54	93 Å²	93	38%	0.378	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.1	177.7	-166.3	0	0	0	0	110.3	P145 T166 I167 L293	P145-S295 VanDerWaalsContact CG-OG 3.31Å; P145-S295 WeakPolarHBondContact CG-OG 3.06Å; T166-S295 CarbonylContact C-O 3.54Å; T166-S295 WeakPolarHBondContact CA-O 3.26Å; I167-S295 PolarHBondContact N-O 3.32Å; I167-S295 PolarHBondContact O-N 3.48Å; L293-S295 PolarHBondContact O-N 3.43Å
296	E	93.8	Very high	88.3	Confident	86 Å²	86	88.3 Å²	88.3	40%	0.402	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.1	-177.2	174.2	173.3	172.3	0	0	111	K164 V165 T166 R298	K164-E296 HydrophobicContact CD-CG 4.09Å; K164-E296 WeakPolarHBondContact CD-OE1 3Å; K164-E296 WeakPolarHBondContact CE-OE1 3.42Å; K164-E296 VanDerWaalsContact CE-OE2 3.3Å; K164-E296 WeakPolarHBondContact CE-OE2 3.29Å; K164-E296 HydrophobicContact CG-CG 4.05Å; K164-E296 IonicContact NZ-OE1 2.89Å; K164-E296 PolarHBondContact NZ-OE1 3.34Å; K164-E296 IonicContact NZ-OE2 2.76Å; K164-E296 PolarHBondContact NZ-OE2 2.93Å; V165-E296 CarbonylContact O-C 3.59Å; V165-E296 WeakPolarHBondContact O-CA 3.34Å; T166-E296 HydrophobicContact CG2-CB 3.92Å; T166-E296 HydrophobicContact CG2-CG 3.94Å; E296-R298 IonicContact OE1-CZ 2.67Å; E296-R298 VanDerWaalsContact OE1-CZ 3.24Å; E296-R298 IonicContact OE1-NE 2.74Å; E296-R298 PolarHBondContact OE1-NE 2.98Å; E296-R298 IonicContact OE1-NH2 3.07Å; E296-R298 PolarHBondContact OE1-NH2 3.41Å
297	C	93.1	Very high	88.1	Confident	9 Å²	9	90.1 Å²	90.1	6%	0.061	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	129	169.4	-171.7	0	0	0	0	110	P145 V165 I300	P145-C297 HydrophobicContact CB-CB 3.75Å; P145-C297 HydrophobicContact CG-CB 4.02Å; V165-C297 PolarHBondContact N-O 3.39Å; V165-C297 PolarHBondContact O-N 3.02Å; C297-I300 WeakPolarHBondContact SG-CG1 3.49Å
298	R	92.5	Very high	87.8	Confident	156 Å²	156	88.8 Å²	88.8	59%	0.589	46%	0.463	S	S	*	.	S	Bend	trans	-112.3	-33.6	174.5	-64.7	-171.9	-169.5	-177.2	2.1	113.2	Y149 K164 E296	Y149-R298 WeakPolarHBondContact CE2-O 3.44Å; K164-R298 HydrophobicContact CB-CG 4.32Å; K164-R298 HydrophobicContact CD-CG 4.34Å; K164-R298 HydrophobicContact CG-CG 4.09Å; E296-R298 IonicContact OE1-CZ 2.67Å; E296-R298 VanDerWaalsContact OE1-CZ 3.24Å; E296-R298 IonicContact OE1-NE 2.74Å; E296-R298 PolarHBondContact OE1-NE 2.98Å; E296-R298 IonicContact OE1-NH2 3.07Å; E296-R298 PolarHBondContact OE1-NH2 3.41Å
299	E	88.3	Confident	87.6	Confident	167 Å²	167	93.3 Å²	93.3	78%	0.78	47%	0.465	S	S	*	.			trans	-145	142.8	-177.4	-173.2	175.3	-174.9	0	0	109.3
300	I	86.5	Confident	87.6	Confident	19 Å²	19	87.1 Å²	87.1	10%	0.097	44%	0.436	C	S	.	.			trans	-121.5	130.3	-178.7	-58.9	-174.8	0	0	0	110.8	E146 Y149 M150 C297 K302 Y305	E146-I300 VanDerWaalsContact CA-CD1 3.48Å; E146-I300 HydrophobicContact CB-CD1 3.92Å; E146-I300 HydrophobicContact CG-CD1 4.38Å; E146-I300 WeakPolarHBondContact O-CD1 3.46Å; Y149-I300 HydrophobicContact CD1-CB 4.4Å; Y149-I300 HydrophobicContact CD1-CD1 3.38Å; Y149-I300 HydrophobicContact CD1-CG1 3.79Å; Y149-I300 HydrophobicContact CE1-CD1 4.27Å; Y149-I300 HydrophobicContact CE1-CG1 4.23Å; Y149-I300 HydrophobicContact CG-CD1 3.62Å; Y149-I300 HydrophobicContact CG-CG1 4.14Å; M150-I300 HydrophobicContact CG-CD1 3.74Å; M150-I300 HydrophobicContact CG-CG2 4.18Å; M150-I300 HydrophobicContact SD-CB 4.1Å; M150-I300 HydrophobicContact SD-CD1 4.06Å; M150-I300 HydrophobicContact SD-CG2 3.74Å; C297-I300 WeakPolarHBondContact SG-CG1 3.49Å; I300-K302 PolarHBondContact O-N 2.91Å; I300-Y305 HydrophobicContact CG2-CD2 4.4Å; I300-Y305 HydrophobicContact CG2-CG 4.34Å
301	N	86.4	Confident	87.6	Confident	106 Å²	106	90.6 Å²	90.6	57%	0.567	45%	0.454	S	S	*	.			trans	-74.6	91.8	167.6	-69.8	-51.1	0	0	0	109.8	T303 K304 Y305	N301-T303 PolarHBondContact O-N 3.44Å; N301-K304 HydrophobicContact CB-CB 4.24Å; N301-K304 HydrophobicContact CB-CD 4.46Å; N301-K304 HydrophobicContact CB-CG 4.39Å; N301-K304 PolarHBondContact O-N 3.27Å; N301-Y305 PolarHBondContact O-N 3.07Å; N301-Y305 VanDerWaalsContact O-N 3.12Å
302	K	87.1	Confident	87.5	Confident	130 Å²	130	88.6 Å²	88.6	57%	0.565	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-27.5	179.2	-63	-178.4	-179.1	-177.7	0	114.1	M150 E153 I300	M150-K302 HydrophobicContact CE-CG 4.46Å; M150-K302 HydrophobicContact SD-CG 4.41Å; E153-K302 VanDerWaalsContact CD-CE 3.48Å; E153-K302 WeakPolarHBondContact OE1-CE 3.3Å; E153-K302 IonicContact OE1-NZ 2.81Å; E153-K302 PolarHBondContact OE1-NZ 3.12Å; E153-K302 WeakPolarHBondContact OE2-CE 3.38Å; E153-K302 IonicContact OE2-NZ 3.06Å; I300-K302 PolarHBondContact O-N 2.91Å
303	T	86.6	Confident	87.5	Confident	135 Å²	135	83.6 Å²	83.6	83%	0.828	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-26	179.3	52.6	0	0	0	0	113.9	N301	N301-T303 PolarHBondContact O-N 3.44Å
304	K	83.6	Confident	87.5	Confident	173 Å²	173	81.3 Å²	81.3	75%	0.752	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-19	-178.2	-65.8	-174.3	178	-175.9	0	112.8	N301 A306	N301-K304 HydrophobicContact CB-CB 4.24Å; N301-K304 HydrophobicContact CB-CD 4.46Å; N301-K304 HydrophobicContact CB-CG 4.39Å; N301-K304 PolarHBondContact O-N 3.27Å; K304-A306 PolarHBondContact O-N 3.41Å
305	Y	85.3	Confident	87.2	Confident	44 Å²	44	80.2 Å²	80.2	17%	0.173	40%	0.399	C	S	.	.			trans	-69.9	123.5	-176.7	-179.5	-99.4	0	0	0	111.4	E146 T147 M150 I300 N301 P307	E146-Y305 HydrophobicContact CB-CD2 4.14Å; E146-Y305 HydrophobicContact CB-CE2 3.86Å; T147-Y305 WeakPolarHBondContact CA-OH 3.49Å; T147-Y305 WeakPolarHBondContact CB-OH 3.34Å; T147-Y305 WeakPolarHBondContact CG2-OH 3.48Å; T147-Y305 PolarHBondContact OG1-OH 3.13Å; M150-Y305 HydrophobicContact CB-CE1 4.09Å; M150-Y305 HydrophobicContact CG-CD1 3.73Å; M150-Y305 HydrophobicContact CG-CD2 4.27Å; M150-Y305 HydrophobicContact CG-CE1 3.73Å; M150-Y305 HydrophobicContact CG-CE2 4.29Å; M150-Y305 HydrophobicContact CG-CG 4Å; I300-Y305 HydrophobicContact CG2-CD2 4.4Å; I300-Y305 HydrophobicContact CG2-CG 4.34Å; N301-Y305 PolarHBondContact O-N 3.07Å; N301-Y305 VanDerWaalsContact O-N 3.12Å; Y305-P307 HydrophobicContact CE1-CB 4Å
306	A	84.1	Confident	86.8	Confident	74 Å²	74	81.9 Å²	81.9	61%	0.612	40%	0.4	S	S	*	.			trans	-115.3	116	173.7	0	0	0	0	0	109.1	K304 I308	K304-A306 PolarHBondContact O-N 3.41Å; A306-I308 PolarHBondContact O-N 3.43Å
307	P	83.1	Confident	86.3	Confident	74 Å²	74	79.3 Å²	79.3	48%	0.481	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-67.4	132.5	-179	26.9	-33.2	0	0	0	110.8	Y305	Y305-P307 HydrophobicContact CE1-CB 4Å
308	I	83.1	Confident	85.9	Confident	29 Å²	29	82.5 Å²	82.5	15%	0.149	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-88.7	121.2	174	-58.2	171.7	0	0	0	107.8	A306 F310 D330	A306-I308 PolarHBondContact O-N 3.43Å; I308-F310 WeakPolarHBondContact O-CD1 3.12Å; I308-D330 WeakPolarHBondContact CD1-OD1 3.4Å
309	R	85	Confident	85.5	Confident	214 Å²	214	79.8 Å²	79.8	81%	0.808	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-82.3	122.6	171.1	-65.9	-177.5	-179.7	167.9	1.8	108.8
310	F	87.4	Confident	85.4	Confident	16 Å²	16	71.9 Å²	71.9	7%	0.07	36%	0.364	C	S	.	.			trans	-136.8	157.8	175.5	63.4	-94.8	0	0	0	110.4	F138 D139 N142 Y266 S269 I308	F138-F310 HydrophobicContact CE1-CZ 4.15Å; F138-F310 AromaticContact CZ-CZ 3.98Å; F138-F310 HydrophobicContact CZ-CZ 3.98Å; D139-F310 HydrophobicContact CB-CD2 4.03Å; D139-F310 HydrophobicContact CB-CE2 3.53Å; D139-F310 HydrophobicContact CB-CZ 4.25Å; D139-F310 VanDerWaalsContact OD2-CD2 3.29Å; D139-F310 WeakPolarHBondContact OD2-CD2 3.22Å; N142-F310 HydrophobicContact CB-CB 3.8Å; N142-F310 HydrophobicContact CB-CD1 3.51Å; N142-F310 HydrophobicContact CB-CD2 4.1Å; N142-F310 HydrophobicContact CB-CE1 4.05Å; N142-F310 HydrophobicContact CB-CG 3.53Å; Y266-F310 AromaticContact CD1-CE1 3.9Å; Y266-F310 HydrophobicContact CD1-CE1 3.9Å; Y266-F310 HydrophobicContact CD1-CE2 4.28Å; Y266-F310 AromaticContact CD1-CZ 3.6Å; Y266-F310 HydrophobicContact CD1-CZ 3.6Å; Y266-F310 HydrophobicContact CE1-CD1 4.14Å; Y266-F310 AromaticContact CE1-CE1 3.38Å; Y266-F310 HydrophobicContact CE1-CE1 3.38Å; Y266-F310 AromaticContact CE1-CZ 3.61Å; Y266-F310 HydrophobicContact CE1-CZ 3.61Å; S269-F310 VanDerWaalsContact CA-O 3.23Å; S269-F310 WeakPolarHBondContact CA-O 3.13Å; S269-F310 WeakPolarHBondContact CB-O 3.4Å; I308-F310 WeakPolarHBondContact O-CD1 3.12Å
311	E	87.6	Confident	85.3	Confident	122 Å²	122	71.9 Å²	71.9	57%	0.57	37%	0.369	S	S	*	.			trans	-126.5	125.1	177.8	-68	-176.3	-176.6	0	0	110	S313	E311-S313 PolarHBondContact O-N 3.33Å; E311-S313 VanDerWaalsContact O-N 3.13Å
312	T	87.6	Confident	85.4	Confident	10 Å²	10	68.6 Å²	68.6	6%	0.061	35%	0.351	C	S	.	.			trans	-89.5	78.6	177.1	-47	0	0	0	0	109.1	D139 L239 S269 S271 A314 L315 H316	D139-T312 PolarHBondContact OD2-OG1 3.31Å; L239-T312 HydrophobicContact CD2-CG2 4.16Å; S269-T312 PolarHBondContact O-N 3.19Å; S271-T312 VanDerWaalsContact OG-CB 3.25Å; S271-T312 WeakPolarHBondContact OG-CB 3.33Å; S271-T312 PolarHBondContact OG-OG1 3.21Å; T312-A314 PolarHBondContact O-N 3.38Å; T312-L315 HydrophobicContact CG2-CD1 3.96Å; T312-L315 HydrophobicContact CG2-CG 4.15Å; T312-L315 PolarHBondContact O-N 2.83Å; T312-L315 VanDerWaalsContact O-N 3.07Å; T312-H316 PolarHBondContact O-CD2 2.69Å
313	S	86.3	Confident	85.3	Confident	40 Å²	40	63.9 Å²	63.9	28%	0.28	33%	0.333	S	S	.	.	H	α-helix	trans	-51.8	-28.9	-174.1	-71.1	0	0	0	0	114.3	E311 L315 S317	E311-S313 PolarHBondContact O-N 3.33Å; E311-S313 VanDerWaalsContact O-N 3.13Å; S313-L315 PolarHBondContact O-N 3.38Å; S313-S317 WeakPolarHBondContact O-CA 3.28Å; S313-S317 VanDerWaalsContact O-CB 3.26Å; S313-S317 WeakPolarHBondContact O-CB 3.02Å; S313-S317 PolarHBondContact O-N 3.17Å
314	A	86.9	Confident	85.3	Confident	4 Å²	4	62.7 Å²	62.7	3%	0.033	31%	0.314	C	S	.	.	H	α-helix	trans	-58.3	-31.4	-179.7	0	0	0	0	0	113.9	Q235 L236 T312 I320	Q235-A314 HydrophobicContact CB-CB 3.64Å; L236-A314 HydrophobicContact CD2-CB 4.07Å; T312-A314 PolarHBondContact O-N 3.38Å; A314-I320 HydrophobicContact CB-CD1 4.47Å; A314-I320 HydrophobicContact CB-CG2 4.44Å
315	L	84.8	Confident	85.3	Confident	23 Å²	23	61.3 Å²	61.3	12%	0.12	31%	0.314	C	S	.	.	H	α-helix	trans	-87.7	-28.3	-171.4	-69.1	175.7	0	0	0	114.6	W116 L236 L239 S271 T312 S313	W116-L315 HydrophobicContact CG-CD2 4.48Å; L236-L315 HydrophobicContact CD2-CD2 3.45Å; L236-L315 VanDerWaalsContact CD2-CD2 3.45Å; L236-L315 HydrophobicContact CD2-CG 4.28Å; L239-L315 HydrophobicContact CD1-CD1 4.35Å; L239-L315 HydrophobicContact CD1-CD2 4.37Å; L239-L315 HydrophobicContact CD1-CG 4.47Å; S271-L315 WeakPolarHBondContact OG-CD1 3.38Å; T312-L315 HydrophobicContact CG2-CD1 3.96Å; T312-L315 HydrophobicContact CG2-CG 4.15Å; T312-L315 PolarHBondContact O-N 2.83Å; T312-L315 VanDerWaalsContact O-N 3.07Å; S313-L315 PolarHBondContact O-N 3.38Å
316	H	82.9	Confident	85.2	Confident	89 Å²	89	63.7 Å²	63.7	41%	0.412	33%	0.325	S	S	.	.	H	α-helix	trans	-136.7	-12.1	-171.8	68.2	88.4	0	0	0	114.6	T312	T312-H316 PolarHBondContact O-CD2 2.69Å
317	S	84.7	Confident	85.2	Confident	31 Å²	31	64 Å²	64	22%	0.217	32%	0.32	C	S	.	.			trans	-100.7	144.5	-178.7	-179.4	0	0	0	0	112	R232 S313 R319	R232-S317 PolarHBondContact NH2-O 3.2Å; S313-S317 WeakPolarHBondContact O-CA 3.28Å; S313-S317 VanDerWaalsContact O-CB 3.26Å; S313-S317 WeakPolarHBondContact O-CB 3.02Å; S313-S317 PolarHBondContact O-N 3.17Å; S317-R319 VanDerWaalsContact C-N 3.3Å; S317-R319 WeakPolarHBondContact CB-O 3.43Å; S317-R319 PolarHBondContact OG-N 3.37Å; S317-R319 VanDerWaalsContact OG-N 3.16Å; S317-R319 PolarHBondContact OG-O 2.91Å
318	T	83.9	Confident	85.3	Confident	76 Å²	76	63.1 Å²	63.1	47%	0.466	31%	0.314	S	S	.	.	S	Bend	trans	-73.1	-23.8	171.3	53.5	0	0	0	0	112.8	A107 L111 W220	A107-T318 HydrophobicContact CB-CG2 4.27Å; L111-T318 HydrophobicContact CD1-CG2 3.69Å; L111-T318 HydrophobicContact CD2-CG2 4.28Å; L111-T318 HydrophobicContact CG-CG2 4.11Å; W220-T318 WeakPolarHBondContact CZ2-O 3.37Å; W220-T318 PolarHBondContact NE1-O 2.87Å
319	R	85.2	Confident	85.4	Confident	99 Å²	99	63 Å²	63	37%	0.374	32%	0.318	S	S	.	.	S	Bend	trans	-106.7	126	176	176.1	179.7	176.3	-159.4	-0.8	108.8	D215 W220 S317	D215-R319 PolarHBondContact O-NH2 2.8Å; W220-R319 HydrophobicContact CB-CG 4.38Å; W220-R319 HydrophobicContact CD2-CB 4.34Å; W220-R319 HydrophobicContact CD2-CG 3.91Å; W220-R319 HydrophobicContact CE3-CG 4.38Å; W220-R319 HydrophobicContact CG-CB 4.35Å; W220-R319 HydrophobicContact CG-CG 3.81Å; S317-R319 VanDerWaalsContact C-N 3.3Å; S317-R319 WeakPolarHBondContact CB-O 3.43Å; S317-R319 PolarHBondContact OG-N 3.37Å; S317-R319 VanDerWaalsContact OG-N 3.16Å; S317-R319 PolarHBondContact OG-O 2.91Å
320	I	86.2	Confident	85.3	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	29%	0.288	C	S	.	.			trans	-122.2	125.4	-177	-60.8	170.4	0	0	0	108	W220 I231 R232 Q235 A314	W220-I320 HydrophobicContact CH2-CB 3.99Å; W220-I320 HydrophobicContact CH2-CG1 4.45Å; W220-I320 HydrophobicContact CZ3-CB 4.15Å; W220-I320 WeakPolarHBondContact CZ3-O 3.48Å; I231-I320 HydrophobicContact CG2-CB 4.24Å; I231-I320 HydrophobicContact CG2-CG2 3.83Å; R232-I320 HydrophobicContact CB-CD1 3.46Å; R232-I320 VanDerWaalsContact CB-CD1 3.46Å; R232-I320 HydrophobicContact CG-CD1 3.54Å; R232-I320 VanDerWaalsContact CZ-CD1 3.43Å; Q235-I320 HydrophobicContact CB-CG2 4.4Å; Q235-I320 HydrophobicContact CG-CG2 3.78Å; A314-I320 HydrophobicContact CB-CD1 4.47Å; A314-I320 HydrophobicContact CB-CG2 4.44Å
321	G	84.5	Confident	85.2	Confident	20 Å²	20	55.9 Å²	55.9	21%	0.206	29%	0.293	C	S	.	.			trans	-86.7	151.3	169.8	0	0	0	0	0	110.7	D215	D215-G321 WeakPolarHBondContact OD1-CA 3.12Å
322	I	86.6	Confident	85.1	Confident	37 Å²	37	52.5 Å²	52.5	19%	0.19	28%	0.28	C	S	.	.			trans	-83.5	128.4	177.2	-63.9	159.4	0	0	0	108.4	L188 V214 D215 I231 W324 K326	L188-I322 HydrophobicContact CD1-CD1 4Å; L188-I322 HydrophobicContact CD1-CG1 4.15Å; L188-I322 HydrophobicContact CD1-CG2 3.85Å; V214-I322 HydrophobicContact CB-CD1 4.25Å; D215-I322 PolarHBondContact OD1-N 2.9Å; D215-I322 VanDerWaalsContact OD1-N 3.08Å; I231-I322 HydrophobicContact CD1-CD1 4Å; I231-I322 HydrophobicContact CD1-CG1 4.22Å; I231-I322 HydrophobicContact CG1-CD1 4.21Å; I231-I322 HydrophobicContact CG1-CG1 4.15Å; I231-I322 HydrophobicContact CG2-CG1 3.84Å; I322-W324 HydrophobicContact CG2-CB 4.11Å; I322-K326 WeakPolarHBondContact O-CD 3.2Å; I322-K326 WeakPolarHBondContact O-CE 3.43Å; I322-K326 WeakPolarHBondContact O-CG 3.32Å; I322-K326 PolarHBondContact O-NZ 3.44Å
323	T	86.7	Confident	85	Confident	31 Å²	31	54.6 Å²	54.6	19%	0.19	29%	0.292	C	S	.	.			trans	-96.3	-8	-178.3	55.7	0	0	0	0	114.4	Q235 R238 D325 K326	Q235-T323 VanDerWaalsContact CD-OG1 3.31Å; Q235-T323 PolarHBondContact NE2-OG1 3.49Å; Q235-T323 PolarHBondContact OE1-OG1 2.64Å; R238-T323 VanDerWaalsContact NH1-CB 3.34Å; R238-T323 PolarHBondContact NH1-O 2.93Å; R238-T323 PolarHBondContact NH1-OG1 3.09Å; T323-D325 PolarHBondContact O-N 3.49Å; T323-K326 HydrophobicContact CG2-CD 4.41Å; T323-K326 PolarHBondContact O-N 3.38Å
324	W	85.2	Confident	84.8	Confident	110 Å²	110	54.1 Å²	54.1	42%	0.417	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-46.6	-169.9	176.5	58	0	0	0	113.5	G184 P185 Y234 I322	G184-W324 VanDerWaalsContact CA-CZ2 3.44Å; P185-W324 VanDerWaalsContact CD-CE2 3.46Å; P185-W324 VanDerWaalsContact CD-CZ3 3.45Å; P185-W324 HydrophobicContact CG-CD2 3.81Å; P185-W324 HydrophobicContact CG-CE3 3.69Å; P185-W324 HydrophobicContact CG-CG 4.16Å; P185-W324 HydrophobicContact CG-CZ3 4.16Å; Y234-W324 HydrophobicContact CE1-CB 4.12Å; Y234-W324 WeakPolarHBondContact OH-CB 3.37Å; I322-W324 HydrophobicContact CG2-CB 4.11Å
325	D	83.4	Confident	84.8	Confident	144 Å²	144	57 Å²	57	77%	0.77	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	16.9	-179.6	-162.4	23.2	0	0	0	112.2	T323	T323-D325 PolarHBondContact O-N 3.49Å
326	K	84.3	Confident	84.8	Confident	93 Å²	93	63.6 Å²	63.6	40%	0.404	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-77.7	133.4	179.1	-79.1	-171.4	170.5	128.6	0	110.1	D215 I322 T323	D215-K326 IonicContact OD1-NZ 3.92Å; D215-K326 PolarHBondContact OD1-NZ 3Å; D215-K326 VanDerWaalsContact OD2-CE 3.28Å; D215-K326 WeakPolarHBondContact OD2-CE 3.45Å; D215-K326 IonicContact OD2-NZ 3.64Å; D215-K326 PolarHBondContact OD2-NZ 2.73Å; I322-K326 WeakPolarHBondContact O-CD 3.2Å; I322-K326 WeakPolarHBondContact O-CE 3.43Å; I322-K326 WeakPolarHBondContact O-CG 3.32Å; I322-K326 PolarHBondContact O-NZ 3.44Å; T323-K326 HydrophobicContact CG2-CD 4.41Å; T323-K326 PolarHBondContact O-N 3.38Å
327	T	84.4	Confident	84.9	Confident	82 Å²	82	62 Å²	62	50%	0.503	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-61.7	128.7	170.9	53.6	0	0	0	0	109.4	A329	T327-A329 PolarHBondContact O-N 3.26Å
328	P	84.7	Confident	84.9	Confident	55 Å²	55	62 Å²	62	36%	0.357	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-60.8	140	-178	22.9	-32.2	0	0	0	110.9	D330 R331 T332	P328-D330 PolarHBondContact O-N 2.93Å; P328-R331 HydrophobicContact CG-CB 3.94Å; P328-R331 WeakPolarHBondContact O-CB 3.26Å; P328-R331 PolarHBondContact O-N 3.29Å; P328-T332 PolarHBondContact O-N 3.03Å
329	A	84.4	Confident	84.9	Confident	27 Å²	27	66.7 Å²	66.7	22%	0.223	33%	0.327	C	S	.	.	H	α-helix	trans	-57.4	-39.2	-176.2	0	0	0	0	0	111.6	T327 R331 T332 N333	T327-A329 PolarHBondContact O-N 3.26Å; A329-R331 VanDerWaalsContact C-N 3.31Å; A329-R331 PolarHBondContact O-N 2.84Å; A329-T332 PolarHBondContact O-N 3.49Å; A329-T332 VanDerWaalsContact O-N 3.1Å; A329-T332 PolarHBondContact O-OG1 2.93Å; A329-N333 WeakPolarHBondContact O-CB 3.16Å; A329-N333 PolarHBondContact O-N 3.2Å; A329-N333 PolarHBondContact O-ND2 3.05Å
330	D	82.8	Confident	84.9	Confident	32 Å²	32	68.8 Å²	68.8	17%	0.171	34%	0.335	C	S	.	.	H	α-helix	trans	-51.6	-46.3	174.1	-76.9	-38.9	0	0	0	113.5	K144 I308 P328 N333 W334 Y359	K144-D330 VanDerWaalsContact CE-OD1 3.3Å; K144-D330 WeakPolarHBondContact CE-OD1 3.32Å; K144-D330 WeakPolarHBondContact CE-OD2 3.38Å; K144-D330 IonicContact NZ-OD1 2.89Å; K144-D330 PolarHBondContact NZ-OD1 3.27Å; K144-D330 IonicContact NZ-OD2 3.1Å; K144-D330 PolarHBondContact NZ-OD2 3.1Å; K144-D330 VanDerWaalsContact NZ-OD2 3.12Å; I308-D330 WeakPolarHBondContact CD1-OD1 3.4Å; P328-D330 PolarHBondContact O-N 2.93Å; D330-N333 PolarHBondContact O-N 3.47Å; D330-W334 WeakPolarHBondContact O-CB 3.33Å; D330-W334 PolarHBondContact O-N 3Å; D330-Y359 HydrophobicContact CB-CE1 4.27Å
331	R	85.1	Confident	84.7	Confident	47 Å²	47	74.2 Å²	74.2	18%	0.177	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-43.4	179.1	-178.5	-178.3	-173	-167.1	1.5	110.6	P328 A329 L335 Y359	P328-R331 HydrophobicContact CG-CB 3.94Å; P328-R331 WeakPolarHBondContact O-CB 3.26Å; P328-R331 PolarHBondContact O-N 3.29Å; A329-R331 VanDerWaalsContact C-N 3.31Å; A329-R331 PolarHBondContact O-N 2.84Å; R331-L335 HydrophobicContact CG-CD1 3.94Å; R331-L335 HydrophobicContact CG-CG 4.42Å; R331-L335 VanDerWaalsContact O-CB 3.26Å; R331-L335 WeakPolarHBondContact O-CB 3.26Å; R331-L335 VanDerWaalsContact O-CG 3.26Å; R331-L335 WeakPolarHBondContact O-CG 3.13Å; R331-L335 PolarHBondContact O-N 3.32Å; R331-Y359 HydrophobicContact CB-CD1 3.75Å; R331-Y359 HydrophobicContact CB-CE1 4.2Å; R331-Y359 HydrophobicContact CG-CD1 3.94Å; R331-Y359 HydrophobicContact CG-CG 4.46Å; R331-Y359 PolarHBondContact NE-O 2.99Å; R331-Y359 VanDerWaalsContact NE-O 3.07Å; R331-Y359 PolarHBondContact NH2-O 2.7Å
332	T	86.4	Confident	84.6	Confident	51 Å²	51	80.1 Å²	80.1	31%	0.313	40%	0.4	S	S	.	.	H	α-helix	trans	-67.8	-39.5	-179	64.5	0	0	0	0	112	P328 A329 R336	P328-T332 PolarHBondContact O-N 3.03Å; A329-T332 PolarHBondContact O-N 3.49Å; A329-T332 VanDerWaalsContact O-N 3.1Å; A329-T332 PolarHBondContact O-OG1 2.93Å; T332-R336 VanDerWaalsContact O-CB 3.27Å; T332-R336 WeakPolarHBondContact O-CB 3.35Å; T332-R336 PolarHBondContact O-N 3.21Å
333	N	84.9	Confident	84.3	Confident	55 Å²	55	80.6 Å²	80.6	29%	0.294	40%	0.404	S	S	.	.	H	α-helix	trans	-68.1	-47.2	176	-71.4	-22.7	0	0	0	110.6	A329 D330 L335 R336 D337	A329-N333 WeakPolarHBondContact O-CB 3.16Å; A329-N333 PolarHBondContact O-N 3.2Å; A329-N333 PolarHBondContact O-ND2 3.05Å; D330-N333 PolarHBondContact O-N 3.47Å; N333-L335 PolarHBondContact O-N 3.44Å; N333-R336 PolarHBondContact O-N 3.2Å; N333-D337 WeakPolarHBondContact O-CB 3.33Å; N333-D337 PolarHBondContact O-N 3.25Å
334	W	83.6	Confident	84	Confident	29 Å²	29	84.5 Å²	84.5	11%	0.11	42%	0.424	C	S	.	.	H	α-helix	trans	-58.2	-49.1	175.5	178.6	86.8	0	0	0	111.1	D330 R336 D337 Q338 L356 Y359	D330-W334 WeakPolarHBondContact O-CB 3.33Å; D330-W334 PolarHBondContact O-N 3Å; W334-R336 VanDerWaalsContact C-N 3.35Å; W334-R336 PolarHBondContact O-N 3.24Å; W334-D337 PolarHBondContact O-N 2.82Å; W334-D337 VanDerWaalsContact O-N 3.17Å; W334-Q338 HydrophobicContact CD2-CG 4.12Å; W334-Q338 HydrophobicContact CE3-CG 4.25Å; W334-Q338 HydrophobicContact CH2-CG 3.85Å; W334-Q338 HydrophobicContact CZ2-CG 3.78Å; W334-Q338 HydrophobicContact CZ3-CG 4.12Å; W334-Q338 WeakPolarHBondContact O-CG 3.26Å; W334-Q338 PolarHBondContact O-N 2.8Å; W334-L356 HydrophobicContact CH2-CB 4.49Å; W334-L356 HydrophobicContact CH2-CD1 3.55Å; W334-L356 HydrophobicContact CZ2-CB 4.47Å; W334-L356 HydrophobicContact CZ2-CD1 4.28Å; W334-L356 HydrophobicContact CZ3-CD1 4.47Å; W334-Y359 HydrophobicContact CB-CD2 4.24Å; W334-Y359 HydrophobicContact CB-CE2 3.89Å; W334-Y359 AromaticContact CD1-CD2 3.95Å; W334-Y359 AromaticContact CD1-CE2 3.53Å; W334-Y359 AromaticContact CD2-CD2 3.27Å; W334-Y359 HydrophobicContact CD2-CD2 3.27Å; W334-Y359 AromaticContact CD2-CE2 3.66Å; W334-Y359 HydrophobicContact CD2-CE2 3.66Å; W334-Y359 AromaticContact CD2-CG 3.96Å; W334-Y359 HydrophobicContact CD2-CG 3.96Å; W334-Y359 AromaticContact CE2-CD2 3.61Å; W334-Y359 AromaticContact CE2-CE2 4Å; W334-Y359 AromaticContact CE3-CD2 3.56Å; W334-Y359 HydrophobicContact CE3-CD2 3.56Å; W334-Y359 HydrophobicContact CE3-CE2 4.33Å; W334-Y359 AromaticContact CE3-CG 3.77Å; W334-Y359 HydrophobicContact CE3-CG 3.77Å; W334-Y359 AromaticContact CG-CD2 3.57Å; W334-Y359 HydrophobicContact CG-CD2 3.57Å; W334-Y359 AromaticContact CG-CE2 3.39Å; W334-Y359 HydrophobicContact CG-CE2 3.39Å; W334-Y359 HydrophobicContact CG-CG 4.36Å; W334-Y359 HydrophobicContact CH2-CD2 4.48Å; W334-Y359 HydrophobicContact CZ2-CD2 4.21Å; W334-Y359 HydrophobicContact CZ3-CD2 4.17Å; W334-Y359 HydrophobicContact CZ3-CG 4.31Å; W334-Y359 AromaticContact NE1-CD2 3.94Å; W334-Y359 AromaticContact NE1-CE2 3.84Å
335	L	86	Confident	83.5	Confident	65 Å²	65	83.7 Å²	83.7	34%	0.34	43%	0.433	S	S	.	.	H	α-helix	trans	-58.6	-45.1	175.7	-79.5	169.5	0	0	0	111.6	R331 N333 D337 Q338 F339	R331-L335 HydrophobicContact CG-CD1 3.94Å; R331-L335 HydrophobicContact CG-CG 4.42Å; R331-L335 VanDerWaalsContact O-CB 3.26Å; R331-L335 WeakPolarHBondContact O-CB 3.26Å; R331-L335 VanDerWaalsContact O-CG 3.26Å; R331-L335 WeakPolarHBondContact O-CG 3.13Å; R331-L335 PolarHBondContact O-N 3.32Å; N333-L335 PolarHBondContact O-N 3.44Å; L335-D337 VanDerWaalsContact C-N 3.28Å; L335-D337 PolarHBondContact O-N 2.84Å; L335-Q338 WeakPolarHBondContact O-CB 3.44Å; L335-Q338 PolarHBondContact O-N 3.2Å; L335-F339 WeakPolarHBondContact O-CD2 3.29Å; L335-F339 PolarHBondContact O-N 2.75Å
336	R	85.5	Confident	83.2	Confident	161 Å²	161	84.7 Å²	84.7	61%	0.608	43%	0.43	S	S	*	.	H	α-helix	trans	-60.7	-40.3	177.5	-176.7	-177.9	-70.3	155.3	-4.5	111.5	T332 N333 W334 Q338 F339 R340	T332-R336 VanDerWaalsContact O-CB 3.27Å; T332-R336 WeakPolarHBondContact O-CB 3.35Å; T332-R336 PolarHBondContact O-N 3.21Å; N333-R336 PolarHBondContact O-N 3.2Å; W334-R336 VanDerWaalsContact C-N 3.35Å; W334-R336 PolarHBondContact O-N 3.24Å; R336-Q338 VanDerWaalsContact C-N 3.3Å; R336-Q338 PolarHBondContact O-N 3.46Å; R336-F339 PolarHBondContact O-N 3.3Å; R336-R340 PolarHBondContact O-N 3.18Å
337	D	84.7	Confident	82.9	Confident	56 Å²	56	82.3 Å²	82.3	30%	0.299	42%	0.424	S	S	.	.	H	α-helix	trans	-66.7	-33.7	178.7	-68	-11.5	0	0	0	111.6	N333 W334 L335 F339 R340 V343	N333-D337 WeakPolarHBondContact O-CB 3.33Å; N333-D337 PolarHBondContact O-N 3.25Å; W334-D337 PolarHBondContact O-N 2.82Å; W334-D337 VanDerWaalsContact O-N 3.17Å; L335-D337 VanDerWaalsContact C-N 3.28Å; L335-D337 PolarHBondContact O-N 2.84Å; D337-F339 VanDerWaalsContact C-N 3.26Å; D337-F339 PolarHBondContact O-N 2.8Å; D337-R340 PolarHBondContact O-N 3.12Å; D337-R340 IonicContact OD1-CZ 3.59Å; D337-R340 IonicContact OD1-NE 3.03Å; D337-R340 PolarHBondContact OD1-NE 2.62Å; D337-R340 VanDerWaalsContact OD1-NE 3.09Å; D337-R340 IonicContact OD1-NH2 3.65Å; D337-R340 PolarHBondContact OD1-NH2 3.35Å; D337-V343 WeakPolarHBondContact O-CG2 3.16Å
338	Q	83.5	Confident	82.4	Confident	31 Å²	31	79 Å²	79	15%	0.145	40%	0.403	C	S	.	.	H	α-helix	trans	-65.3	-24.5	173.2	-64.1	-47	-49.1	0	0	114.4	W334 L335 R336 T348	W334-Q338 HydrophobicContact CD2-CG 4.12Å; W334-Q338 HydrophobicContact CE3-CG 4.25Å; W334-Q338 HydrophobicContact CH2-CG 3.85Å; W334-Q338 HydrophobicContact CZ2-CG 3.78Å; W334-Q338 HydrophobicContact CZ3-CG 4.12Å; W334-Q338 WeakPolarHBondContact O-CG 3.26Å; W334-Q338 PolarHBondContact O-N 2.8Å; L335-Q338 WeakPolarHBondContact O-CB 3.44Å; L335-Q338 PolarHBondContact O-N 3.2Å; R336-Q338 VanDerWaalsContact C-N 3.3Å; R336-Q338 PolarHBondContact O-N 3.46Å; Q338-T348 PolarHBondContact OE1-OG1 3.36Å
339	F	83.9	Confident	81.9	Confident	175 Å²	175	81.9 Å²	81.9	77%	0.768	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	7.4	179	-70.3	-71.9	0	0	0	113.5	L335 R336 D337	L335-F339 WeakPolarHBondContact O-CD2 3.29Å; L335-F339 PolarHBondContact O-N 2.75Å; R336-F339 PolarHBondContact O-N 3.3Å; D337-F339 VanDerWaalsContact C-N 3.26Å; D337-F339 PolarHBondContact O-N 2.8Å
340	R	85.3	Confident	81.5	Confident	143 Å²	143	85.4 Å²	85.4	54%	0.54	43%	0.434	S	S	.	.	S	Bend	trans	-68.5	147	171.6	-68.5	-177.3	-174.9	-174.7	6.7	110.1	R336 D337 D342 V343	R336-R340 PolarHBondContact O-N 3.18Å; D337-R340 PolarHBondContact O-N 3.12Å; D337-R340 IonicContact OD1-CZ 3.59Å; D337-R340 IonicContact OD1-NE 3.03Å; D337-R340 PolarHBondContact OD1-NE 2.62Å; D337-R340 VanDerWaalsContact OD1-NE 3.09Å; D337-R340 IonicContact OD1-NH2 3.65Å; D337-R340 PolarHBondContact OD1-NH2 3.35Å; R340-D342 PolarHBondContact O-N 3.47Å; R340-V343 HydrophobicContact CB-CG2 4.41Å; R340-V343 PolarHBondContact O-N 3.37Å
341	S	82.4	Confident	81.2	Confident	115 Å²	115	90.8 Å²	90.8	80%	0.804	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.4	179.5	49.6	0	0	0	0	113.9
342	D	83.2	Confident	80.8	Confident	144 Å²	144	91.4 Å²	91.4	77%	0.77	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-9.7	-170.4	-52.6	-14	0	0	0	112.6	R340	R340-D342 PolarHBondContact O-N 3.47Å
343	V	80	Confident	80.5	Confident	47 Å²	47	97.1 Å²	97.1	29%	0.285	48%	0.481	S	S	.	.	S	Bend	trans	-103.4	115.1	-176.2	-178.6	0	0	0	0	109.4	D337 R340 P345 T348	D337-V343 WeakPolarHBondContact O-CG2 3.16Å; R340-V343 HydrophobicContact CB-CG2 4.41Å; R340-V343 PolarHBondContact O-N 3.37Å; V343-P345 WeakPolarHBondContact O-CD 3.32Å; V343-T348 HydrophobicContact CG1-CG2 4.29Å
344	D	79.7	Confident	80.2	Confident	113 Å²	113	100.4 Å²	100.4	60%	0.604	50%	0.498	S	S	*	.			trans	-69.3	116.4	174	-78.4	-31.6	0	0	0	109.9	K346 T347	D344-K346 PolarHBondContact O-N 2.78Å; D344-T347 HydrophobicContact CB-CG2 3.89Å; D344-T347 PolarHBondContact O-N 2.81Å; D344-T347 PolarHBondContact O-OG1 2.83Å
345	P	75.7	Confident	80	Confident	93 Å²	93	103 Å²	103	60%	0.604	51%	0.512	S	S	*	.	H	α-helix	trans	-63.7	-16.8	-176.6	26.4	-35.9	0	0	0	113	V343 T348 L349	V343-P345 WeakPolarHBondContact O-CD 3.32Å; P345-T348 PolarHBondContact O-OG1 2.77Å; P345-L349 PolarHBondContact O-N 3.26Å
346	K	77.1	Confident	79.7	Confident	165 Å²	165	101 Å²	101	72%	0.717	50%	0.501	S	S	*	.	H	α-helix	trans	-69.3	-40.7	175.5	-68.4	179.9	-178.7	173.2	0	111.6	D344 T348 L349 T350	D344-K346 PolarHBondContact O-N 2.78Å; K346-T348 PolarHBondContact O-N 3.48Å; K346-L349 PolarHBondContact O-N 3.38Å; K346-T350 PolarHBondContact O-N 2.9Å; K346-T350 PolarHBondContact O-OG1 3.42Å
347	T	78.4	Confident	79.4	Confident	43 Å²	43	96.3 Å²	96.3	26%	0.264	49%	0.493	S	S	.	.	H	α-helix	trans	-60.8	-37.6	-176.9	60.8	0	0	0	0	111.2	D344 T350 E351 N352	D344-T347 HydrophobicContact CB-CG2 3.89Å; D344-T347 PolarHBondContact O-N 2.81Å; D344-T347 PolarHBondContact O-OG1 2.83Å; T347-T350 PolarHBondContact O-N 3.2Å; T347-E351 WeakPolarHBondContact O-CA 3.38Å; T347-E351 VanDerWaalsContact O-CB 3.28Å; T347-E351 WeakPolarHBondContact O-CB 3.28Å; T347-E351 PolarHBondContact O-N 3.19Å; T347-N352 PolarHBondContact O-N 3Å
348	T	73.8	Confident	79.2	Confident	13 Å²	13	100.8 Å²	100.8	8%	0.08	51%	0.51	C	S	.	.	H	α-helix	trans	-81	-25.3	-177	59.3	0	0	0	0	113.3	Q338 V343 P345 K346 N352	Q338-T348 PolarHBondContact OE1-OG1 3.36Å; V343-T348 HydrophobicContact CG1-CG2 4.29Å; P345-T348 PolarHBondContact O-OG1 2.77Å; K346-T348 PolarHBondContact O-N 3.48Å; T348-N352 CarbonylContact O-C 3.46Å
349	L	73.7	Confident	79	Confident	114 Å²	114	101.7 Å²	101.7	60%	0.597	51%	0.512	S	S	*	.	H	α-helix	trans	-73.9	-35	169.8	-170.7	64.7	0	0	0	112.6	P345 K346 L356	P345-L349 PolarHBondContact O-N 3.26Å; K346-L349 PolarHBondContact O-N 3.38Å; L349-L356 HydrophobicContact CD1-CD2 3.89Å
350	T	76.2	Confident	78.5	Confident	102 Å²	102	98.5 Å²	98.5	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-95.2	-51.3	-175.2	55.9	0	0	0	0	113.8	K346 T347	K346-T350 PolarHBondContact O-N 2.9Å; K346-T350 PolarHBondContact O-OG1 3.42Å; T347-T350 PolarHBondContact O-N 3.2Å
351	E	76.6	Confident	77.4	Confident	145 Å²	145	95.7 Å²	95.7	68%	0.678	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-44.3	-170.3	-56.9	179.4	171.1	0	0	111.2	T347 R353	T347-E351 WeakPolarHBondContact O-CA 3.38Å; T347-E351 VanDerWaalsContact O-CB 3.28Å; T347-E351 WeakPolarHBondContact O-CB 3.28Å; T347-E351 PolarHBondContact O-N 3.19Å; E351-R353 VanDerWaalsContact C-N 3.35Å; E351-R353 PolarHBondContact O-N 3.48Å
352	N	76.5	Confident	76	Confident	59 Å²	59	95.4 Å²	95.4	32%	0.316	50%	0.499	S	S	.	.			trans	-99	38.6	-175.7	-59.9	-22.9	0	0	0	112.8	T347 T348 D354 E355 L356	T347-N352 PolarHBondContact O-N 3Å; T348-N352 CarbonylContact O-C 3.46Å; N352-D354 PolarHBondContact O-N 3.4Å; N352-E355 HydrophobicContact CB-CB 4.29Å; N352-E355 HydrophobicContact CB-CG 4.38Å; N352-E355 PolarHBondContact O-N 3.46Å; N352-E355 VanDerWaalsContact O-N 3.17Å; N352-L356 WeakPolarHBondContact O-CB 3.43Å; N352-L356 PolarHBondContact O-N 3.17Å
353	R	80.4	Confident	73.9	Confident	172 Å²	172	93.2 Å²	93.2	65%	0.649	50%	0.495	S	S	*	.	H	α-helix	trans	-57.4	-34.3	-179.9	-177.1	178.3	167.4	86.8	2	112.3	E351 L356 S357	E351-R353 VanDerWaalsContact C-N 3.35Å; E351-R353 PolarHBondContact O-N 3.48Å; R353-L356 PolarHBondContact O-N 3.36Å; R353-S357 WeakPolarHBondContact O-CB 3.32Å; R353-S357 PolarHBondContact O-N 2.68Å
354	D	78.5	Confident	71.9	Confident	123 Å²	123	97.1 Å²	97.1	66%	0.658	53%	0.525	S	S	*	.	H	α-helix	trans	-69.4	-41.7	179.7	-65.1	-17.8	0	0	0	111.7	N352 S357 K358	N352-D354 PolarHBondContact O-N 3.4Å; D354-S357 PolarHBondContact O-N 3.09Å; D354-S357 PolarHBondContact O-OG 2.85Å; D354-K358 WeakPolarHBondContact O-CG 3.1Å; D354-K358 PolarHBondContact O-N 3.27Å
355	E	79.2	Confident	69.7	Low	85 Å²	85	97 Å²	97	40%	0.397	53%	0.532	S	S	.	.	H	α-helix	trans	-66	-44	173.8	-60.6	-176.3	171	0	0	111.1	N352 S357 K358 Y359	N352-E355 HydrophobicContact CB-CB 4.29Å; N352-E355 HydrophobicContact CB-CG 4.38Å; N352-E355 PolarHBondContact O-N 3.46Å; N352-E355 VanDerWaalsContact O-N 3.17Å; E355-S357 VanDerWaalsContact C-N 3.29Å; E355-S357 PolarHBondContact O-N 3.31Å; E355-K358 WeakPolarHBondContact O-CB 3.41Å; E355-K358 PolarHBondContact O-N 3.14Å; E355-Y359 WeakPolarHBondContact O-CD2 3.27Å; E355-Y359 PolarHBondContact O-N 3.37Å
356	L	79.9	Confident	67.6	Low	22 Å²	22	96.6 Å²	96.6	12%	0.115	55%	0.545	C	S	.	.	H	α-helix	trans	-56.5	-44.9	174.9	177.9	67.9	0	0	0	110.7	W334 L349 N352 R353 K358 Y359 L360	W334-L356 HydrophobicContact CH2-CB 4.49Å; W334-L356 HydrophobicContact CH2-CD1 3.55Å; W334-L356 HydrophobicContact CZ2-CB 4.47Å; W334-L356 HydrophobicContact CZ2-CD1 4.28Å; W334-L356 HydrophobicContact CZ3-CD1 4.47Å; L349-L356 HydrophobicContact CD1-CD2 3.89Å; N352-L356 WeakPolarHBondContact O-CB 3.43Å; N352-L356 PolarHBondContact O-N 3.17Å; R353-L356 PolarHBondContact O-N 3.36Å; L356-K358 VanDerWaalsContact C-N 3.29Å; L356-K358 PolarHBondContact O-N 3.24Å; L356-Y359 PolarHBondContact O-N 3.28Å; L356-Y359 VanDerWaalsContact O-N 3.13Å; L356-L360 HydrophobicContact CD1-CD1 3.7Å; L356-L360 HydrophobicContact CD1-CD2 3.96Å; L356-L360 HydrophobicContact CD1-CG 3.59Å; L356-L360 HydrophobicContact CD2-CD1 3.86Å; L356-L360 HydrophobicContact CG-CD1 3.43Å; L356-L360 VanDerWaalsContact CG-CD1 3.43Å; L356-L360 HydrophobicContact CG-CG 3.74Å; L356-L360 VanDerWaalsContact O-CB 3.32Å; L356-L360 WeakPolarHBondContact O-CB 3.43Å; L356-L360 VanDerWaalsContact O-CG 3.26Å; L356-L360 WeakPolarHBondContact O-CG 3.42Å; L356-L360 PolarHBondContact O-N 3.42Å
357	S	79.1	Confident	65.5	Low	63 Å²	63	92.4 Å²	92.4	44%	0.441	54%	0.541	S	S	.	.	H	α-helix	trans	-59.8	-37.3	-179.9	76.8	0	0	0	0	113	R353 D354 E355 Y359 A361	R353-S357 WeakPolarHBondContact O-CB 3.32Å; R353-S357 PolarHBondContact O-N 2.68Å; D354-S357 PolarHBondContact O-N 3.09Å; D354-S357 PolarHBondContact O-OG 2.85Å; E355-S357 VanDerWaalsContact C-N 3.29Å; E355-S357 PolarHBondContact O-N 3.31Å; S357-Y359 VanDerWaalsContact C-N 3.31Å; S357-Y359 PolarHBondContact O-N 2.99Å; S357-A361 PolarHBondContact O-N 3.05Å
358	K	79.4	Confident	63.2	Low	149 Å²	149	96.3 Å²	96.3	65%	0.648	57%	0.57	S	S	*	*	H	α-helix	trans	-61.6	-39.5	176.9	-66.1	171.3	-174.1	177.9	0	111.7	D354 E355 L356	D354-K358 WeakPolarHBondContact O-CG 3.1Å; D354-K358 PolarHBondContact O-N 3.27Å; E355-K358 WeakPolarHBondContact O-CB 3.41Å; E355-K358 PolarHBondContact O-N 3.14Å; L356-K358 VanDerWaalsContact C-N 3.29Å; L356-K358 PolarHBondContact O-N 3.24Å
359	Y	80	Confident	61.5	Low	51 Å²	51	101.6 Å²	101.6	20%	0.2	60%	0.603	C	S	.	*	H	α-helix	trans	-94.6	-17.4	-175.9	-61.3	-61.7	0	0	0	114.4	D330 R331 W334 E355 L356 S357	D330-Y359 HydrophobicContact CB-CE1 4.27Å; R331-Y359 HydrophobicContact CB-CD1 3.75Å; R331-Y359 HydrophobicContact CB-CE1 4.2Å; R331-Y359 HydrophobicContact CG-CD1 3.94Å; R331-Y359 HydrophobicContact CG-CG 4.46Å; R331-Y359 PolarHBondContact NE-O 2.99Å; R331-Y359 VanDerWaalsContact NE-O 3.07Å; R331-Y359 PolarHBondContact NH2-O 2.7Å; W334-Y359 HydrophobicContact CB-CD2 4.24Å; W334-Y359 HydrophobicContact CB-CE2 3.89Å; W334-Y359 AromaticContact CD1-CD2 3.95Å; W334-Y359 AromaticContact CD1-CE2 3.53Å; W334-Y359 AromaticContact CD2-CD2 3.27Å; W334-Y359 HydrophobicContact CD2-CD2 3.27Å; W334-Y359 AromaticContact CD2-CE2 3.66Å; W334-Y359 HydrophobicContact CD2-CE2 3.66Å; W334-Y359 AromaticContact CD2-CG 3.96Å; W334-Y359 HydrophobicContact CD2-CG 3.96Å; W334-Y359 AromaticContact CE2-CD2 3.61Å; W334-Y359 AromaticContact CE2-CE2 4Å; W334-Y359 AromaticContact CE3-CD2 3.56Å; W334-Y359 HydrophobicContact CE3-CD2 3.56Å; W334-Y359 HydrophobicContact CE3-CE2 4.33Å; W334-Y359 AromaticContact CE3-CG 3.77Å; W334-Y359 HydrophobicContact CE3-CG 3.77Å; W334-Y359 AromaticContact CG-CD2 3.57Å; W334-Y359 HydrophobicContact CG-CD2 3.57Å; W334-Y359 AromaticContact CG-CE2 3.39Å; W334-Y359 HydrophobicContact CG-CE2 3.39Å; W334-Y359 HydrophobicContact CG-CG 4.36Å; W334-Y359 HydrophobicContact CH2-CD2 4.48Å; W334-Y359 HydrophobicContact CZ2-CD2 4.21Å; W334-Y359 HydrophobicContact CZ3-CD2 4.17Å; W334-Y359 HydrophobicContact CZ3-CG 4.31Å; W334-Y359 AromaticContact NE1-CD2 3.94Å; W334-Y359 AromaticContact NE1-CE2 3.84Å; E355-Y359 WeakPolarHBondContact O-CD2 3.27Å; E355-Y359 PolarHBondContact O-N 3.37Å; L356-Y359 PolarHBondContact O-N 3.28Å; L356-Y359 VanDerWaalsContact O-N 3.13Å; S357-Y359 VanDerWaalsContact C-N 3.31Å; S357-Y359 PolarHBondContact O-N 2.99Å
360	L	72.4	Confident	59.6	Low	107 Å²	107	100.5 Å²	100.5	56%	0.56	61%	0.61	S	S	*	*	H	α-helix	trans	-79.1	-28.6	177.1	-78.7	-174.5	0	0	0	113.6	L356 L362	L356-L360 HydrophobicContact CD1-CD1 3.7Å; L356-L360 HydrophobicContact CD1-CD2 3.96Å; L356-L360 HydrophobicContact CD1-CG 3.59Å; L356-L360 HydrophobicContact CD2-CD1 3.86Å; L356-L360 HydrophobicContact CG-CD1 3.43Å; L356-L360 VanDerWaalsContact CG-CD1 3.43Å; L356-L360 HydrophobicContact CG-CG 3.74Å; L356-L360 VanDerWaalsContact O-CB 3.32Å; L356-L360 WeakPolarHBondContact O-CB 3.43Å; L356-L360 VanDerWaalsContact O-CG 3.26Å; L356-L360 WeakPolarHBondContact O-CG 3.42Å; L356-L360 PolarHBondContact O-N 3.42Å; L360-L362 PolarHBondContact O-N 2.89Å
361	A	62.8	Low	57.6	Low	85 Å²	85	99.6 Å²	99.6	70%	0.702	61%	0.613	S	S	*	*	S	Bend	trans	-64.7	-4.2	-169.2	0	0	0	0	0	115.8	S357 S363	S357-A361 PolarHBondContact O-N 3.05Å; A361-S363 PolarHBondContact O-N 3.43Å
362	L	53.8	Low	55.6	Low	108 Å²	108	98.2 Å²	98.2	57%	0.565	62%	0.619	S	S	*	*	S	Bend	trans	-95.2	35.3	-175	-76.1	165	0	0	0	114.2	L360	L360-L362 PolarHBondContact O-N 2.89Å
363	S	39.3	Very low	53.5	Low	98 Å²	98	100.5 Å²	100.5	69%	0.685	64%	0.64	S	S	*	*			trans	-148.6	51.8	-177.1	-168.2	0	0	0	0	115.3	A361	A361-S363 PolarHBondContact O-N 3.43Å
364	S	36.6	Very low	51.5	Low	130 Å²	130	97.7 Å²	97.7	91%	0.909	64%	0.638	S	S	*	*			trans	-94.7	2.9	170	-173.7	0	0	0	0	114.3
365	S	33.7	Very low	49.5	Very low	110 Å²	110	97.3 Å²	97.3	77%	0.769	64%	0.642	S	S	*	*	S	Bend	trans	-136.2	77	179.4	-177.4	0	0	0	0	112.9	A367	S365-A367 VanDerWaalsContact C-N 3.29Å; S365-A367 PolarHBondContact O-N 2.64Å
366	G	31.7	Very low	47.4	Very low	84 Å²	84	101.4 Å²	101.4	87%	0.866	66%	0.661	S	S	*	*				49.8	13.5	126.8	0	0	0	0	0	123
367	A	34.2	Very low	45.5	Very low	78 Å²	78	105.6 Å²	105.6	65%	0.645	69%	0.692	S	S	*	*			trans	-121.7	116.8	175.1	0	0	0	0	0	110.7	S365 T369	S365-A367 VanDerWaalsContact C-N 3.29Å; S365-A367 PolarHBondContact O-N 2.64Å; A367-T369 VanDerWaalsContact C-N 3.32Å; A367-T369 PolarHBondContact O-N 3.2Å
368	S	29.1	Very low	43.8	Very low	125 Å²	125	110.6 Å²	110.6	87%	0.874	71%	0.709	S	S	*	*			trans	-58.4	83.2	177.1	-48.5	0	0	0	0	112	A370	S368-A370 PolarHBondContact O-N 3.24Å; S368-A370 VanDerWaalsContact O-N 3.08Å
369	T	38.5	Very low	42	Very low	124 Å²	124	108.8 Å²	108.8	76%	0.761	71%	0.712	S	S	*	*			trans	-80.3	83	157.3	60.6	0	0	0	0	106.4	A367 A371	A367-T369 VanDerWaalsContact C-N 3.32Å; A367-T369 PolarHBondContact O-N 3.2Å; T369-A371 PolarHBondContact O-N 3.13Å
370	A	32.6	Very low	40	Very low	90 Å²	90	111.5 Å²	111.5	74%	0.744	74%	0.736	S	S	*	*			trans	-51.4	103.7	153.3	0	0	0	0	0	105.1	S368 S372	S368-A370 PolarHBondContact O-N 3.24Å; S368-A370 VanDerWaalsContact O-N 3.08Å; A370-S372 PolarHBondContact O-N 3.26Å
371	A	34.6	Very low	38.4	Very low	84 Å²	84	110 Å²	110	69%	0.694	74%	0.739	S	S	*	*			trans	-45.5	118.6	161.8	0	0	0	0	0	104.5	T369 S373	T369-A371 PolarHBondContact O-N 3.13Å; A371-S373 PolarHBondContact O-N 3.12Å
372	S	35	Very low	37.4	Very low	115 Å²	115	110.7 Å²	110.7	80%	0.804	74%	0.737	S	S	*	*			trans	-62.8	83.9	165.3	55.5	0	0	0	0	105.3	A370 D374	A370-S372 PolarHBondContact O-N 3.26Å; S372-D374 PolarHBondContact O-N 3.47Å
373	S	33.2	Very low	36.5	Very low	108 Å²	108	110.1 Å²	110.1	76%	0.755	74%	0.738	S	S	*	*			trans	-64.6	78.5	159.2	53.1	0	0	0	0	104.8	A371 P375	A371-S373 PolarHBondContact O-N 3.12Å; S373-P375 VanDerWaalsContact C-CD 3.41Å; S373-P375 WeakPolarHBondContact O-CD 3.47Å
374	D	36.9	Very low	36.7	Very low	112 Å²	112	111.4 Å²	111.4	60%	0.599	74%	0.741	S	S	*	*			trans	-90.6	98.2	156.8	-168.8	8.4	0	0	0	106.4	S372 E376	S372-D374 PolarHBondContact O-N 3.47Å; D374-E376 PolarHBondContact O-N 3.36Å; D374-E376 WeakPolarHBondContact OD1-CB 2.84Å; D374-E376 PolarHBondContact OD1-N 3.39Å
375	P	38.4	Very low	36.7	Very low	116 Å²	116	110.1 Å²	110.1	75%	0.753	73%	0.729	S	S	*	*			trans	-78.4	36.9	169.2	35.3	-36.6	0	0	0	111.9	S373	S373-P375 VanDerWaalsContact C-CD 3.41Å; S373-P375 WeakPolarHBondContact O-CD 3.47Å
376	E	35.3	Very low	37	Very low	170 Å²	170	115.8 Å²	115.8	79%	0.794	73%	0.734	S	S	*	*			trans	-100.9	63.2	168.7	-73.6	-157.4	164.4	0	0	111.8	D374	D374-E376 PolarHBondContact O-N 3.36Å; D374-E376 WeakPolarHBondContact OD1-CB 2.84Å; D374-E376 PolarHBondContact OD1-N 3.39Å
377	S	39	Very low	37.4	Very low	110 Å²	110	118.7 Å²	118.7	77%	0.769	73%	0.728	S	S	*	*			trans	-149.4	51.5	154.5	81.5	0	0	0	0	111.5
378	E	42.5	Very low	37.6	Very low	169 Å²	169	123.1 Å²	123.1	79%	0.79	74%	0.735	S	S	*	*			trans	-75	139.4	155.1	-80.6	-170.9	153.6	0	0	108.7
379	P	43	Very low	38.2	Very low	110 Å²	110	128.1 Å²	128.1	71%	0.714	74%	0.735	S	S	*	*			trans	-58.7	146.6	166.9	29.2	-33.1	0	0	0	108.1	A381	P379-A381 PolarHBondContact O-N 3.05Å
380	P	37.8	Very low	38.4	Very low	109 Å²	109	131.2 Å²	131.2	71%	0.708	74%	0.74	S	S	*	*			trans	-62.6	106.4	-175.9	26.7	-32.7	0	0	0	109.1
381	A	39.3	Very low	39.1	Very low	74 Å²	74	137.6 Å²	137.6	61%	0.612	75%	0.745	S	S	*	*			trans	-57.8	141.7	161.9	0	0	0	0	0	107.9	P379 T383	P379-A381 PolarHBondContact O-N 3.05Å; A381-T383 PolarHBondContact O-N 3.4Å; A381-T383 VanDerWaalsContact O-N 3.1Å
382	P	40.4	Very low	39.7	Very low	101 Å²	101	139 Å²	139	66%	0.656	75%	0.747	S	S	*	*			trans	-57.9	123.2	-177.4	25.1	-32.6	0	0	0	108.9	V384 T580	P382-V384 PolarHBondContact O-N 3.44Å; P382-T580 HydrophobicContact CB-CG2 4.45Å
383	T	36.2	Very low	40.5	Very low	96 Å²	96	143.2 Å²	143.2	59%	0.589	75%	0.751	S	S	*	*			trans	-54.8	100.1	-178.5	3.1	0	0	0	0	110.1	A381 Q579	A381-T383 PolarHBondContact O-N 3.4Å; A381-T383 VanDerWaalsContact O-N 3.1Å; T383-Q579 PolarHBondContact OG1-O 2.99Å
384	V	42.6	Very low	41.6	Very low	125 Å²	125	147.1 Å²	147.1	76%	0.758	75%	0.754	S	S	*	*			trans	-63.7	130.2	159	-176.8	0	0	0	0	106.3	P382 R386	P382-V384 PolarHBondContact O-N 3.44Å; V384-R386 PolarHBondContact O-N 2.98Å
385	P	37.6	Very low	42.9	Very low	102 Å²	102	147 Å²	147	66%	0.662	75%	0.753	S	S	*	*			trans	-60.1	119	-174.8	23.3	-32.2	0	0	0	109.5	I387	P385-I387 PolarHBondContact O-N 3.08Å
386	R	38.1	Very low	44.5	Very low	229 Å²	229	144.9 Å²	144.9	86%	0.864	74%	0.74	S	S	*	*			trans	-68.8	94.6	-179.1	-168.4	176	-168.5	152	5.5	108.9	V384 H388	V384-R386 PolarHBondContact O-N 2.98Å; R386-H388 PolarHBondContact O-N 3.49Å
387	I	42.1	Very low	46.2	Very low	146 Å²	146	142 Å²	142	75%	0.749	74%	0.735	S	S	*	*			trans	-54	115.8	165.2	-62.1	169.7	0	0	0	107.1	P385 R389	P385-I387 PolarHBondContact O-N 3.08Å; I387-R389 HydrophobicContact CG2-CG 4.47Å; I387-R389 PolarHBondContact O-N 2.85Å
388	H	38	Very low	47.8	Very low	170 Å²	170	139.8 Å²	139.8	79%	0.787	72%	0.724	S	S	*	*			trans	-63.1	84.7	172.8	-82.6	-32.3	0	0	0	110	R386 H390	R386-H388 PolarHBondContact O-N 3.49Å; H388-H390 PolarHBondContact O-N 3.24Å
389	R	41.4	Very low	49.1	Very low	230 Å²	230	136.6 Å²	136.6	87%	0.868	71%	0.709	S	S	*	*			trans	-75	112.9	161.4	-76.7	-176	155.5	-173.5	-6.9	107.9	I387 R391	I387-R389 HydrophobicContact CG2-CG 4.47Å; I387-R389 PolarHBondContact O-N 2.85Å; R389-R391 PolarHBondContact O-N 3.3Å
390	H	41.5	Very low	50.4	Low	189 Å²	189	135 Å²	135	88%	0.875	70%	0.697	S	S	*	*			trans	-42.2	108	177.7	-81	-95.6	0	0	0	111.7	H388 P392	H388-H390 PolarHBondContact O-N 3.24Å; H390-P392 WeakPolarHBondContact O-CD 3.34Å
391	R	48.5	Very low	52	Low	225 Å²	225	138.6 Å²	138.6	85%	0.849	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-73.1	120.9	167.1	-157.6	176.9	-167.6	-177.6	6.3	107.1	R389	R389-R391 PolarHBondContact O-N 3.3Å
392	P	47.2	Very low	53.6	Low	114 Å²	114	139.7 Å²	139.7	74%	0.74	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61.3	142.6	-178.8	23.7	-31.8	0	0	0	110.2	H390 K394	H390-P392 WeakPolarHBondContact O-CD 3.34Å; P392-K394 PolarHBondContact O-N 2.98Å
393	K	52.2	Low	55	Low	203 Å²	203	138.3 Å²	138.3	88%	0.883	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-60.5	125.6	177.7	-69.6	175.8	-178.9	172.1	0	108.6	L395	K393-L395 PolarHBondContact O-N 2.94Å
394	K	56.2	Low	56.6	Low	189 Å²	189	140.9 Å²	140.9	82%	0.822	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-60.2	119.9	173.6	-71	-176.8	176.6	-174.7	0	109.3	P392	P392-K394 PolarHBondContact O-N 2.98Å
395	L	64.3	Low	57.8	Low	110 Å²	110	140.7 Å²	140.7	58%	0.576	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-65	139.3	173.1	-68.5	161.6	0	0	0	109.8	K393 E399 V400	K393-L395 PolarHBondContact O-N 2.94Å; L395-E399 HydrophobicContact CD2-CG 4.45Å; L395-E399 VanDerWaalsContact CD2-OE2 3.23Å; L395-E399 WeakPolarHBondContact CD2-OE2 3.49Å; L395-V400 HydrophobicContact CB-CG2 4.17Å
396	P	72.3	Confident	58.5	Low	72 Å²	72	139.1 Å²	139.1	47%	0.468	70%	0.695	S	S	.	*	P	Polyproline II helix	trans	-59.2	146.2	175.5	24.6	-33.2	0	0	0	110.9	A398 E399 V400	P396-A398 PolarHBondContact O-N 2.67Å; P396-E399 VanDerWaalsContact CD-OE2 3.3Å; P396-E399 WeakPolarHBondContact CD-OE2 3.23Å; P396-E399 HydrophobicContact CG-CB 4.19Å; P396-E399 WeakPolarHBondContact O-CB 3.47Å; P396-E399 PolarHBondContact O-N 3.3Å; P396-V400 PolarHBondContact O-N 3.01Å
397	P	70.7	Confident	59.4	Low	108 Å²	108	134 Å²	134	70%	0.701	68%	0.684	S	S	*	*	H	α-helix	trans	-62	-10.9	-173.6	20.8	-31.3	0	0	0	115	R401	P397-R401 WeakPolarHBondContact O-CB 3.42Å; P397-R401 PolarHBondContact O-N 2.97Å
398	A	71.2	Confident	59.4	Low	65 Å²	65	132.3 Å²	132.3	54%	0.537	69%	0.685	S	S	.	*	H	α-helix	trans	-76.5	-35.3	172.5	0	0	0	0	0	112.6	P396 R401 L402	P396-A398 PolarHBondContact O-N 2.67Å; A398-R401 WeakPolarHBondContact O-CB 3.25Å; A398-R401 PolarHBondContact O-N 3.19Å; A398-L402 PolarHBondContact O-N 2.68Å
399	E	70.6	Confident	59.7	Low	102 Å²	102	129.8 Å²	129.8	48%	0.477	69%	0.687	S	S	.	*	H	α-helix	trans	-79	-36.5	-178.3	-154.5	163.9	-157	0	0	110.5	L395 P396 R401 L402 A403	L395-E399 HydrophobicContact CD2-CG 4.45Å; L395-E399 VanDerWaalsContact CD2-OE2 3.23Å; L395-E399 WeakPolarHBondContact CD2-OE2 3.49Å; P396-E399 VanDerWaalsContact CD-OE2 3.3Å; P396-E399 WeakPolarHBondContact CD-OE2 3.23Å; P396-E399 HydrophobicContact CG-CB 4.19Å; P396-E399 WeakPolarHBondContact O-CB 3.47Å; P396-E399 PolarHBondContact O-N 3.3Å; E399-R401 VanDerWaalsContact C-N 3.27Å; E399-R401 PolarHBondContact O-N 3.36Å; E399-L402 PolarHBondContact O-N 2.82Å; E399-A403 WeakPolarHBondContact O-CB 3.33Å; E399-A403 PolarHBondContact O-N 3.49Å
400	V	70.5	Confident	59.3	Low	77 Å²	77	124.5 Å²	124.5	47%	0.467	68%	0.68	S	S	.	*	H	α-helix	trans	-62.4	-35.4	167.4	-177.4	0	0	0	0	111.3	L395 P396 L404	L395-V400 HydrophobicContact CB-CG2 4.17Å; P396-V400 PolarHBondContact O-N 3.01Å; V400-L404 WeakPolarHBondContact O-CB 3.11Å; V400-L404 PolarHBondContact O-N 3.21Å
401	R	70.4	Confident	59.1	Low	183 Å²	183	122 Å²	122	69%	0.691	67%	0.673	S	S	*	*	H	α-helix	trans	-69.6	-41	175.7	-108.9	179.3	177.2	150.9	0.3	112.7	P397 A398 E399 L404 L405	P397-R401 WeakPolarHBondContact O-CB 3.42Å; P397-R401 PolarHBondContact O-N 2.97Å; A398-R401 WeakPolarHBondContact O-CB 3.25Å; A398-R401 PolarHBondContact O-N 3.19Å; E399-R401 VanDerWaalsContact C-N 3.27Å; E399-R401 PolarHBondContact O-N 3.36Å; R401-L404 PolarHBondContact O-N 3.07Å; R401-L405 VanDerWaalsContact O-CB 3.32Å; R401-L405 WeakPolarHBondContact O-CB 3.44Å; R401-L405 WeakPolarHBondContact O-CD1 3.21Å; R401-L405 PolarHBondContact O-N 3.28Å
402	L	73.8	Confident	58.5	Low	97 Å²	97	120 Å²	120	51%	0.508	67%	0.67	S	S	.	*	H	α-helix	trans	-68.1	-38.9	176.8	-83.7	160.4	0	0	0	111.9	A398 E399 L405 G406 L407	A398-L402 PolarHBondContact O-N 2.68Å; E399-L402 PolarHBondContact O-N 2.82Å; L402-L405 PolarHBondContact O-N 3.18Å; L402-G406 PolarHBondContact O-N 3.1Å; L402-L407 HydrophobicContact CD2-CB 4.47Å; L402-L407 PolarHBondContact O-N 3.07Å
403	A	70.2	Confident	58	Low	72 Å²	72	121.1 Å²	121.1	60%	0.595	68%	0.675	S	S	*	*	H	α-helix	trans	-65.8	-42.1	173.2	0	0	0	0	0	112.4	E399 L405 G406	E399-A403 WeakPolarHBondContact O-CB 3.33Å; E399-A403 PolarHBondContact O-N 3.49Å; A403-L405 VanDerWaalsContact C-N 3.27Å; A403-L405 PolarHBondContact O-N 2.76Å; A403-G406 PolarHBondContact O-N 2.81Å
404	L	68.5	Low	57.1	Low	151 Å²	151	117.8 Å²	117.8	79%	0.791	67%	0.667	S	S	*	*	H	α-helix	trans	-68.7	-25.7	176.4	-170.2	67.7	0	0	0	112.8	V400 R401	V400-L404 WeakPolarHBondContact O-CB 3.11Å; V400-L404 PolarHBondContact O-N 3.21Å; R401-L404 PolarHBondContact O-N 3.07Å
405	L	67.8	Low	56.2	Low	121 Å²	121	117.4 Å²	117.4	63%	0.634	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-4.9	175.7	-89.6	151.6	0	0	0	113.5	R401 L402 A403 L407	R401-L405 VanDerWaalsContact O-CB 3.32Å; R401-L405 WeakPolarHBondContact O-CB 3.44Å; R401-L405 WeakPolarHBondContact O-CD1 3.21Å; R401-L405 PolarHBondContact O-N 3.28Å; L402-L405 PolarHBondContact O-N 3.18Å; A403-L405 VanDerWaalsContact C-N 3.27Å; A403-L405 PolarHBondContact O-N 2.76Å; L405-L407 HydrophobicContact CB-CD1 4.19Å; L405-L407 VanDerWaalsContact O-CD1 3.25Å; L405-L407 WeakPolarHBondContact O-CD1 3.29Å; L405-L407 PolarHBondContact O-N 2.83Å
406	G	52.8	Low	54.8	Low	69 Å²	69	119.3 Å²	119.3	71%	0.711	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.1	17.8	177.5	0	0	0	0	0	114.7	L402 A403	L402-G406 PolarHBondContact O-N 3.1Å; A403-G406 PolarHBondContact O-N 2.81Å
407	L	57.3	Low	53.1	Low	122 Å²	122	119.8 Å²	119.8	64%	0.639	70%	0.699	S	S	*	*			trans	-101.9	76.6	177.2	-85.1	91.7	0	0	0	110.4	L402 L405	L402-L407 HydrophobicContact CD2-CB 4.47Å; L402-L407 PolarHBondContact O-N 3.07Å; L405-L407 HydrophobicContact CB-CD1 4.19Å; L405-L407 VanDerWaalsContact O-CD1 3.25Å; L405-L407 WeakPolarHBondContact O-CD1 3.29Å; L405-L407 PolarHBondContact O-N 2.83Å
408	S	43.1	Very low	51.2	Low	109 Å²	109	124 Å²	124	76%	0.762	71%	0.709	S	S	*	*			trans	-137.9	96.7	155.3	61.7	0	0	0	0	109.2
409	S	42.6	Very low	49.4	Very low	118 Å²	118	125.9 Å²	125.9	83%	0.825	72%	0.719	S	S	*	*			trans	-61	132.9	170.4	-59.8	0	0	0	0	110.5
410	T	34	Very low	47.4	Very low	119 Å²	119	126 Å²	126	73%	0.73	73%	0.73	S	S	*	*			trans	-41.2	129.2	157.9	50.5	0	0	0	0	112.1
411	D	37.6	Very low	45.6	Very low	135 Å²	135	129.7 Å²	129.7	72%	0.722	75%	0.748	S	S	*	*				169.5	118	123.2	-85.2	-30.7	0	0	0	112
412	K	35.9	Very low	43.7	Very low	183 Å²	183	128.8 Å²	128.8	80%	0.796	75%	0.752	S	S	*	*			trans	36.6	127.9	134	-52.3	179.8	-176.7	179.1	0	118.5
413	V	36.8	Very low	41.8	Very low	138 Å²	138	131 Å²	131	84%	0.836	76%	0.764	S	S	*	*				-165.7	143.5	99.5	-158.7	0	0	0	0	109.5
414	D	32.4	Very low	40	Very low	134 Å²	134	136.1 Å²	136.1	72%	0.717	78%	0.775	S	S	*	*			trans	-65.1	154.4	-173.2	-45.8	-74	0	0	0	116.1
415	M	37.5	Very low	38.1	Very low	181 Å²	181	133.5 Å²	133.5	89%	0.892	78%	0.776	S	S	*	*			trans	-162.4	129.6	143.8	-110.4	-69.4	173.8	0	0	111.2
416	D	34.7	Very low	36.5	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	79%	0.79	S	S	*	*			trans	-83.6	155.5	-161.4	-45.8	-60	0	0	0	113.4
417	G	36.7	Very low	35.3	Very low	83 Å²	83	142.6 Å²	142.6	86%	0.856	80%	0.796	S	S	*	*			trans	174.7	72.8	176.5	0	0	0	0	0	114.5
418	E	31.2	Very low	34.2	Very low	195 Å²	195	146.4 Å²	146.4	91%	0.911	81%	0.811	S	S	*	*			trans	-54.1	131.7	178.3	-161.7	166.7	-153.7	0	0	114.9
419	S	32.5	Very low	33.6	Very low	105 Å²	105	149.9 Å²	149.9	73%	0.734	82%	0.815	S	S	*	*				176.7	106.8	121.6	-115.1	0	0	0	0	112.7
420	S	29.8	Very low	33.2	Very low	104 Å²	104	153.3 Å²	153.3	73%	0.727	82%	0.818	S	S	*	*			trans	9.6	123.1	140.8	58.8	0	0	0	0	119.4
421	N	32	Very low	33.1	Very low	156 Å²	156	156 Å²	156	83%	0.834	82%	0.822	S	S	*	*				-160.1	139.6	101.7	-143.3	3.2	0	0	0	112.3
422	Q	30.7	Very low	32.7	Very low	164 Å²	164	157.1 Å²	157.1	77%	0.766	83%	0.827	S	S	*	*			trans	-79.4	149.9	-176.3	-67.5	161.3	-37.6	0	0	111.2
423	N	34.3	Very low	32.5	Very low	143 Å²	143	155.3 Å²	155.3	77%	0.765	83%	0.825	S	S	*	*				176.6	105.6	119.8	-80.4	-6.9	0	0	0	111.1
424	E	31.7	Very low	32.2	Very low	180 Å²	180	155.9 Å²	155.9	84%	0.841	82%	0.823	S	S	*	*			trans	16	119.5	136.3	-63.1	161.4	178.6	0	0	116.6
425	A	29.1	Very low	32.3	Very low	96 Å²	96	157.3 Å²	157.3	79%	0.793	83%	0.83	S	S	*	*			cis	69.8	99.9	45.6	0	0	0	0	0	114.4
426	E	34.4	Very low	31.9	Very low	202 Å²	202	153.2 Å²	153.2	94%	0.944	83%	0.825	S	S	*	*			trans	-135.3	128.7	145.4	-74.2	-173.4	166.8	0	0	108.5
427	E	28	Very low	31.8	Very low	178 Å²	178	150.6 Å²	150.6	83%	0.832	82%	0.819	S	S	*	*			trans	-89.1	140.6	-179.4	-65	165.5	148.9	0	0	109.4
428	E	34.4	Very low	31.7	Very low	202 Å²	202	154.7 Å²	154.7	94%	0.944	82%	0.815	S	S	*	*			trans	-138.7	121.1	149.3	-72.8	-169.5	165.6	0	0	109.1
429	E	29	Very low	32.1	Very low	182 Å²	182	151.4 Å²	151.4	85%	0.85	81%	0.808	S	S	*	*			trans	-80.5	134.9	175.7	-55.8	173.6	140.9	0	0	109.3
430	E	34.5	Very low	32.2	Very low	190 Å²	190	151.3 Å²	151.3	89%	0.888	81%	0.805	S	S	*	*			trans	-144.6	102.1	152.1	-77.6	-155.7	167.4	0	0	111.8
431	E	32.8	Very low	32.2	Very low	176 Å²	176	153.5 Å²	153.5	82%	0.822	81%	0.809	S	S	*	*			trans	40.4	113.5	132.3	-64.2	-172.7	155.5	0	0	121.4
432	I	28.7	Very low	32.2	Very low	159 Å²	159	154.3 Å²	154.3	82%	0.815	81%	0.813	S	S	*	*			trans	-86.9	117.4	163	-63.4	165.7	0	0	0	107.9	D434	I432-D434 PolarHBondContact O-N 3.39Å
433	L	31.6	Very low	32.4	Very low	144 Å²	144	150.7 Å²	150.7	75%	0.754	81%	0.811	S	S	*	*			trans	-89.1	99.7	175.8	-129.1	107.8	0	0	0	110.4
434	D	29.6	Very low	32.4	Very low	150 Å²	150	149.3 Å²	149.3	80%	0.802	81%	0.813	S	S	*	*			trans	-84.8	114.7	165	-88.9	-25.6	0	0	0	109.3	I432	I432-D434 PolarHBondContact O-N 3.39Å
435	L	34.5	Very low	32.7	Very low	164 Å²	164	149.9 Å²	149.9	86%	0.859	82%	0.815	S	S	*	*			trans	-129.2	93.4	172.6	-155.8	74.5	0	0	0	111.2
436	A	29.2	Very low	32.8	Very low	96 Å²	96	152.1 Å²	152.1	79%	0.793	82%	0.82	S	S	*	*			trans	-140.1	111.5	158.9	0	0	0	0	0	109
437	S	33	Very low	32.9	Very low	94 Å²	94	150.6 Å²	150.6	66%	0.657	81%	0.812	S	S	*	*			trans	175.6	143.3	137.7	52.1	0	0	0	0	113.1
438	H	35.4	Very low	33.3	Very low	168 Å²	168	150.4 Å²	150.4	78%	0.778	81%	0.812	S	S	*	*			trans	81.2	129.4	160.4	-55.6	-51.6	0	0	0	116.4
439	T	38.3	Very low	33.4	Very low	126 Å²	126	150.3 Å²	150.3	77%	0.773	80%	0.804	S	S	*	*			cis	-172	177.5	23.6	6.3	0	0	0	0	109.5
440	P	34.4	Very low	33.8	Very low	103 Å²	103	146.5 Å²	146.5	67%	0.669	79%	0.79	S	S	*	*				-125.9	179.8	-122.3	37.1	-15.7	0	0	0	116.8
441	N	29.7	Very low	33.9	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	79%	0.79	S	S	*	*			trans	65.4	113.4	151.8	-70.3	-6.5	0	0	0	120.1
442	D	34	Very low	34.3	Very low	173 Å²	173	146.2 Å²	146.2	93%	0.925	79%	0.785	S	S	*	*				-153.3	152.7	117.1	-111.2	-24.1	0	0	0	111.8
443	A	33.7	Very low	34.8	Very low	88 Å²	88	144.6 Å²	144.6	73%	0.727	78%	0.784	S	S	*	*			trans	-97.4	173.2	-148	0	0	0	0	0	117
444	S	35.5	Very low	35	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	79%	0.789	S	S	*	*			trans	91.3	127.8	167.7	75.8	0	0	0	0	115.5
445	E	36.6	Very low	35.5	Very low	191 Å²	191	145.3 Å²	145.3	89%	0.893	79%	0.789	S	S	*	*			cis	-139.6	138.9	10.7	-66.9	175.2	140.2	0	0	109.6
446	T	30.6	Very low	35.6	Very low	144 Å²	144	147.3 Å²	147.3	88%	0.883	79%	0.79	S	S	*	*			trans	-104.1	112.9	-173.5	-7.5	0	0	0	0	110.7
447	E	38.4	Very low	35.9	Very low	169 Å²	169	151.3 Å²	151.3	79%	0.79	79%	0.79	S	S	*	*			trans	-91.3	111.3	155.4	-75.4	-167.2	172.5	0	0	108.7	Y449	E447-Y449 PolarHBondContact O-N 2.95Å
448	E	35.3	Very low	36.1	Very low	175 Å²	175	156.2 Å²	156.2	82%	0.818	80%	0.799	S	S	*	*			trans	-77.8	106.6	-177.1	-175.9	176.7	-171.8	0	0	110.6
449	Y	36.4	Very low	36.1	Very low	199 Å²	199	155.3 Å²	155.3	78%	0.78	80%	0.8	S	S	*	*			trans	-104	113.9	165.3	-83.2	-88.7	0	0	0	110.6	E447 L451	E447-Y449 PolarHBondContact O-N 2.95Å; Y449-L451 PolarHBondContact O-N 3.21Å; Y449-L451 VanDerWaalsContact O-N 3.09Å
450	D	38.5	Very low	35.9	Very low	103 Å²	103	154.7 Å²	154.7	55%	0.551	80%	0.801	S	S	*	*			trans	-71.6	88.5	-177.3	-136.5	15.1	0	0	0	111.1	R452	D450-R452 PolarHBondContact O-N 2.73Å; D450-R452 VanDerWaalsContact O-N 3.07Å; D450-R452 IonicContact OD2-CZ 3.06Å; D450-R452 IonicContact OD2-NE 3.09Å; D450-R452 PolarHBondContact OD2-NE 3.22Å; D450-R452 VanDerWaalsContact OD2-NE 3.14Å; D450-R452 IonicContact OD2-NH2 2.68Å; D450-R452 PolarHBondContact OD2-NH2 3.29Å
451	L	35.9	Very low	36.2	Very low	169 Å²	169	158.6 Å²	158.6	89%	0.885	81%	0.81	S	S	*	*			trans	-78.2	84.9	173.5	-68.9	177.3	0	0	0	110.8	Y449	Y449-L451 PolarHBondContact O-N 3.21Å; Y449-L451 VanDerWaalsContact O-N 3.09Å
452	R	40.9	Very low	36.4	Very low	191 Å²	191	158.2 Å²	158.2	72%	0.721	81%	0.814	S	S	*	*			trans	-82.2	139.6	168.9	-60.8	-177.8	-152.2	178.1	8.2	110.9	D450 V454	D450-R452 PolarHBondContact O-N 2.73Å; D450-R452 VanDerWaalsContact O-N 3.07Å; D450-R452 IonicContact OD2-CZ 3.06Å; D450-R452 IonicContact OD2-NE 3.09Å; D450-R452 PolarHBondContact OD2-NE 3.22Å; D450-R452 VanDerWaalsContact OD2-NE 3.14Å; D450-R452 IonicContact OD2-NH2 2.68Å; D450-R452 PolarHBondContact OD2-NH2 3.29Å; R452-V454 PolarHBondContact O-N 3.16Å
453	P	38.4	Very low	36.6	Very low	124 Å²	124	156.4 Å²	156.4	81%	0.805	81%	0.809	S	S	*	*			trans	-59.4	122.4	173.5	-22.8	33	0	0	0	111.5	E455	P453-E455 PolarHBondContact O-N 3.33Å
454	V	36.9	Very low	36.7	Very low	142 Å²	142	160.1 Å²	160.1	86%	0.861	81%	0.813	S	S	*	*			trans	-65	106.1	176.8	176.2	0	0	0	0	109.7	R452 K456	R452-V454 PolarHBondContact O-N 3.16Å; V454-K456 PolarHBondContact O-N 3.27Å
455	E	39.3	Very low	36.9	Very low	168 Å²	168	160.7 Å²	160.7	79%	0.785	81%	0.814	S	S	*	*			trans	-64.5	127.7	166.4	-66.7	-172.7	156	0	0	110	P453 K457	P453-E455 PolarHBondContact O-N 3.33Å; E455-K457 PolarHBondContact O-N 3.19Å
456	K	36.8	Very low	36.9	Very low	205 Å²	205	159 Å²	159	89%	0.891	81%	0.809	S	S	*	*			trans	-63.9	93	171.5	-71.8	176.6	177.7	171.1	0	109.8	V454 K458	V454-K456 PolarHBondContact O-N 3.27Å; K456-K458 PolarHBondContact O-N 3.11Å
457	K	36.9	Very low	37.2	Very low	181 Å²	181	157.5 Å²	157.5	79%	0.787	80%	0.804	S	S	*	*			trans	-66	119.5	166.8	-74.7	-177.5	178.6	174.9	0	109.5	E455 D459	E455-K457 PolarHBondContact O-N 3.19Å; K457-D459 PolarHBondContact O-N 2.93Å
458	K	35.6	Very low	37.1	Very low	196 Å²	196	161.2 Å²	161.2	85%	0.852	81%	0.811	S	S	*	*			trans	-83.7	99.2	165.9	-70.6	171.7	-178.8	165.7	0	106.9	K456 S460	K456-K458 PolarHBondContact O-N 3.11Å; K458-S460 PolarHBondContact O-N 3.12Å; K458-S460 VanDerWaalsContact O-N 3.12Å
459	D	36.2	Very low	37.1	Very low	150 Å²	150	161.8 Å²	161.8	80%	0.802	81%	0.814	S	S	*	*			trans	-75.9	101.1	170.2	-71.9	-24.5	0	0	0	109.4	K457	K457-D459 PolarHBondContact O-N 2.93Å
460	S	34.7	Very low	37.2	Very low	113 Å²	113	162 Å²	162	79%	0.79	82%	0.819	S	S	*	*			trans	-88.2	92.3	161.3	57.8	0	0	0	0	108.1	K458	K458-S460 PolarHBondContact O-N 3.12Å; K458-S460 VanDerWaalsContact O-N 3.12Å
461	Q	40.1	Very low	37	Very low	185 Å²	185	163.7 Å²	163.7	86%	0.864	83%	0.833	S	S	*	*			trans	-100.8	114.6	166.7	-134.1	175.3	9.2	0	0	109.9
462	T	33.6	Very low	37	Very low	142 Å²	142	166.6 Å²	166.6	87%	0.871	83%	0.832	S	S	*	*			trans	-67.9	117.9	177.2	-11.9	0	0	0	0	109.9
463	V	38.3	Very low	36.9	Very low	135 Å²	135	169.2 Å²	169.2	82%	0.818	84%	0.842	S	S	*	*			trans	-135.5	134.4	162.5	-173.1	0	0	0	0	108.9
464	M	36.5	Very low	36.9	Very low	165 Å²	165	174.7 Å²	174.7	81%	0.813	85%	0.846	S	S	*	*			trans	-68.1	150.7	-164.7	-54.4	-137	78.6	0	0	114	I466	M464-I466 PolarHBondContact O-N 2.62Å
465	P	38.8	Very low	36.9	Very low	127 Å²	127	174.5 Å²	174.5	83%	0.825	85%	0.845	S	S	*	*			trans	-84	109.8	171.8	32.6	-28.2	0	0	0	110.2
466	I	36.8	Very low	36.8	Very low	157 Å²	157	174.2 Å²	174.2	81%	0.805	85%	0.848	S	S	*	*			trans	-76.9	137.5	163.7	-66.5	170.7	0	0	0	108.7	M464	M464-I466 PolarHBondContact O-N 2.62Å
467	S	36	Very low	36.9	Very low	111 Å²	111	169.6 Å²	169.6	78%	0.776	84%	0.839	S	S	*	*			trans	-49.6	126.9	-173.3	50.3	0	0	0	0	114.7
468	R	37.6	Very low	36.7	Very low	247 Å²	247	170 Å²	170	93%	0.932	84%	0.844	S	S	*	*			trans	-94.6	111.2	161.7	-86.8	-177.2	171.8	143.2	-0.7	110.1
469	E	35.9	Very low	36.7	Very low	188 Å²	188	165.5 Å²	165.5	88%	0.879	84%	0.844	S	S	*	*			trans	-67.4	136.4	171	-164.2	157.5	-171.6	0	0	110.9
470	K	37.8	Very low	36.7	Very low	202 Å²	202	169.3 Å²	169.3	88%	0.878	85%	0.847	S	S	*	*			trans	-85.3	109.5	-175.8	-71.9	172	178.2	172.7	0	109.6
471	V	34.4	Very low	36.9	Very low	139 Å²	139	171 Å²	171	84%	0.842	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-100.5	119.7	162.6	-178.5	0	0	0	0	109.7
472	R	35.1	Very low	36.7	Very low	231 Å²	231	166.8 Å²	166.8	87%	0.872	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-71.8	121.3	179.6	-67.9	168.7	150.1	175.2	-8.3	110.1
473	R	38.5	Very low	37	Very low	245 Å²	245	166.7 Å²	166.7	93%	0.925	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-81.4	120.3	159.8	-79.3	-177.6	77.3	103.8	-4.4	108.6
474	R	39.7	Very low	37.1	Very low	239 Å²	239	166.1 Å²	166.1	90%	0.902	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-67.3	133.1	172.5	-66.8	-179.6	176.6	176.9	-1.6	109.4
475	V	36.7	Very low	37.1	Very low	138 Å²	138	164 Å²	164	84%	0.836	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-89.3	132	166.5	175.9	0	0	0	0	106.5
476	L	37.9	Very low	37.2	Very low	162 Å²	162	164.5 Å²	164.5	85%	0.848	81%	0.812	S	S	*	*			trans	-107.3	139.1	168.3	-101.7	140.9	0	0	0	108.2
477	P	38.7	Very low	37.3	Very low	109 Å²	109	163.4 Å²	163.4	71%	0.708	81%	0.808	S	S	*	*			trans	-91.5	167.4	-164.2	4.3	17.6	0	0	0	113.7
478	E	32.8	Very low	37.6	Very low	188 Å²	188	164.4 Å²	164.4	88%	0.879	80%	0.804	S	S	*	*			trans	-45.9	149	-178	-67.9	134.8	152.3	0	0	116.8
479	A	35	Very low	37.7	Very low	103 Å²	103	160.5 Å²	160.5	85%	0.851	80%	0.797	S	S	*	*			trans	-120.3	125.1	151	0	0	0	0	0	108.7
480	R	35.6	Very low	37.7	Very low	230 Å²	230	158.3 Å²	158.3	87%	0.868	79%	0.791	S	S	*	*			trans	-65.7	154.8	166.4	-79.6	167.8	144.5	126.9	-7.8	110.4
481	D	39.4	Very low	37.8	Very low	149 Å²	149	158.4 Å²	158.4	80%	0.797	79%	0.792	S	S	*	*			trans	177.3	103	135.7	-80.1	-17.7	0	0	0	105.2
482	S	35.5	Very low	37.9	Very low	95 Å²	95	160.5 Å²	160.5	66%	0.664	79%	0.792	S	S	*	*				64.3	137	84	65.6	0	0	0	0	115.2
483	D	40.5	Very low	37.8	Very low	141 Å²	141	157.8 Å²	157.8	75%	0.754	79%	0.791	S	S	*	*			trans	90.5	130.1	176.6	-51.9	-10.7	0	0	0	114
484	D	40.4	Very low	37.6	Very low	122 Å²	122	154.9 Å²	154.9	65%	0.652	79%	0.788	S	S	*	*			cis	-167.9	144.5	2.3	-117	-28.9	0	0	0	107.2
485	N	36.6	Very low	37.3	Very low	120 Å²	120	151.3 Å²	151.3	64%	0.642	78%	0.782	S	S	*	*			trans	50.4	110.6	141.2	-58.9	-30.3	0	0	0	121.2
486	D	39.6	Very low	37.3	Very low	138 Å²	138	151.9 Å²	151.9	74%	0.738	78%	0.78	S	S	*	*				158.4	132.6	94.5	-84.6	-28.4	0	0	0	112.6
487	D	40.2	Very low	37.1	Very low	135 Å²	135	151 Å²	151	72%	0.722	78%	0.776	S	S	*	*			trans	78.5	121.9	145	-63.8	-20.9	0	0	0	124
488	D	41.2	Very low	37	Very low	131 Å²	131	151.4 Å²	151.4	70%	0.701	78%	0.782	S	S	*	*			trans	101.2	97.3	138.9	-61.1	-24.5	0	0	0	122.2
489	E	39.8	Very low	37.1	Very low	166 Å²	166	147.9 Å²	147.9	78%	0.776	78%	0.775	S	S	*	*				72.8	104.4	123.6	-63.8	-172.2	168.5	0	0	121
490	D	36.8	Very low	37.1	Very low	142 Å²	142	149.9 Å²	149.9	76%	0.759	77%	0.771	S	S	*	*				56.3	107.4	125.4	-58.6	-12.6	0	0	0	120.6
491	K	40	Very low	37.2	Very low	204 Å²	204	146.8 Å²	146.8	89%	0.887	77%	0.766	S	S	*	*				-175.1	114.9	113	-98.4	166.3	-172.8	176.7	0	114.3
492	E	36.5	Very low	37	Very low	182 Å²	182	144.2 Å²	144.2	85%	0.85	76%	0.76	S	S	*	*			trans	-9	119.4	152.4	-61.6	173.7	167.9	0	0	116.6
493	M	32.2	Very low	37.2	Very low	174 Å²	174	148.5 Å²	148.5	86%	0.857	77%	0.77	S	S	*	*				64.5	108.1	88.6	-73.1	-80.2	-81.8	0	0	114.8
494	E	35.4	Very low	37	Very low	184 Å²	184	149.2 Å²	149.2	86%	0.86	77%	0.773	S	S	*	*				-165.1	101	129.3	-109.2	-178.8	-169.2	0	0	110.6
495	E	32.9	Very low	36.9	Very low	165 Å²	165	151.3 Å²	151.3	77%	0.771	78%	0.784	S	S	*	*			trans	-76.5	133.4	155.8	-76.9	-176.2	143.3	0	0	108.7
496	N	37.1	Very low	37	Very low	149 Å²	149	157 Å²	157	80%	0.797	80%	0.798	S	S	*	*			trans	-135.6	99.5	156.1	-96.3	-38.6	0	0	0	109.1
497	N	33.8	Very low	37.1	Very low	143 Å²	143	155.4 Å²	155.4	77%	0.765	80%	0.799	S	S	*	*			trans	-80.1	136.1	160.4	-88	-39.2	0	0	0	109.3
498	S	36	Very low	37	Very low	118 Å²	118	155.4 Å²	155.4	83%	0.825	80%	0.799	S	S	*	*			trans	-143.7	112.7	150.8	72.5	0	0	0	0	110.1
499	P	34.8	Very low	36.9	Very low	114 Å²	114	154.9 Å²	154.9	74%	0.74	80%	0.796	S	S	*	*			trans	-99.8	136.4	169	14.7	3.3	0	0	0	111.2
500	L	34.6	Very low	37.1	Very low	146 Å²	146	157 Å²	157	76%	0.764	80%	0.803	S	S	*	*			trans	-160.4	121.5	161.6	-152.7	70.4	0	0	0	111.8
501	E	37.1	Very low	37.4	Very low	164 Å²	164	153.8 Å²	153.8	77%	0.766	80%	0.795	S	S	*	*			trans	38.8	146.5	135.9	-55.2	174.3	172.7	0	0	119.3
502	S	37.1	Very low	37.6	Very low	96 Å²	96	149 Å²	149	67%	0.671	78%	0.783	S	S	*	*			cis	178.9	164.2	-3	44.7	0	0	0	0	104.1
503	E	38.7	Very low	38.1	Very low	185 Å²	185	149.2 Å²	149.2	86%	0.864	78%	0.781	S	S	*	*			trans	129.3	113.7	152.1	-64.8	-104.7	139.3	0	0	112.6
504	D	36.8	Very low	38.7	Very low	156 Å²	156	144.9 Å²	144.9	83%	0.834	77%	0.768	S	S	*	*			trans	-59	135.8	175.8	-64.8	-53.1	0	0	0	111.5
505	N	37.5	Very low	39.3	Very low	165 Å²	165	138.8 Å²	138.8	88%	0.882	75%	0.745	S	S	*	*			trans	-146.7	109	149	-111.9	-32.3	0	0	0	111.3	S507	N505-S507 PolarHBondContact O-N 2.8Å
506	Y	38.4	Very low	40.2	Very low	239 Å²	239	137.2 Å²	137.2	94%	0.937	74%	0.738	S	S	*	*			trans	-77.4	105.4	172.9	-134.3	-94.7	0	0	0	108
507	S	43	Very low	40.9	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	73%	0.734	S	S	*	*			trans	-155	124.9	153.4	74.3	0	0	0	0	112.4	N505	N505-S507 PolarHBondContact O-N 2.8Å
508	D	38.4	Very low	41.9	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	72%	0.722	S	S	*	*			trans	60.8	104.9	137.1	-95.3	15.2	0	0	0	122.2
509	N	37.8	Very low	43.4	Very low	120 Å²	120	133.8 Å²	133.8	64%	0.642	70%	0.703	S	S	*	*				84.2	112.4	113.6	-68.8	-23.5	0	0	0	120.9	A511	N509-A511 PolarHBondContact O-N 3.1Å
510	K	44.3	Very low	45.1	Very low	211 Å²	211	131.5 Å²	131.5	92%	0.917	69%	0.689	S	S	*	*			trans	72.5	11.8	132.6	-97.8	173.5	177.7	169.7	0	121.1
511	A	43	Very low	46.9	Very low	73 Å²	73	131.6 Å²	131.6	60%	0.603	68%	0.684	S	S	*	*			trans	-99.7	-5.1	175.5	0	0	0	0	0	116.6	N509 S514	N509-A511 PolarHBondContact O-N 3.1Å; A511-S514 PolarHBondContact O-OG 2.95Å
512	V	45.3	Very low	48.7	Very low	103 Å²	103	132.1 Å²	132.1	62%	0.624	68%	0.679	S	S	*	*	H	α-helix	trans	-88.7	-11.5	-162.9	-166.6	0	0	0	0	115.1	S515	V512-S515 PolarHBondContact O-OG 3.14Å
513	K	45.5	Very low	50.7	Low	188 Å²	188	134.6 Å²	134.6	82%	0.817	68%	0.677	S	S	*	*	H	α-helix	trans	-84.4	-16.2	-177.7	-78.9	-179	178.2	175.3	0	115
514	S	44.5	Very low	52.6	Low	82 Å²	82	132.8 Å²	132.8	57%	0.573	67%	0.666	S	S	*	*	H	α-helix	trans	-84.8	-29.2	177.6	57.3	0	0	0	0	112.8	A511	A511-S514 PolarHBondContact O-OG 2.95Å
515	S	48	Very low	54.6	Low	56 Å²	56	132.4 Å²	132.4	39%	0.392	66%	0.657	S	S	.	*	H	α-helix	trans	-71.3	-39.2	178.6	73.1	0	0	0	0	112.6	V512 K517 N518 D519	V512-S515 PolarHBondContact O-OG 3.14Å; S515-K517 VanDerWaalsContact C-N 3.34Å; S515-K517 PolarHBondContact O-N 2.89Å; S515-N518 PolarHBondContact O-N 2.98Å; S515-D519 PolarHBondContact O-N 3.17Å
516	Q	53.6	Low	56.8	Low	133 Å²	133	129.5 Å²	129.5	62%	0.621	64%	0.641	S	S	*	*	H	α-helix	trans	-64.6	-31.5	-179.7	-71.1	-172	-30	0	0	114	S520	Q516-S520 PolarHBondContact O-N 3.42Å
517	K	51.8	Low	59	Low	163 Å²	163	125.2 Å²	125.2	71%	0.709	63%	0.627	S	S	*	*	H	α-helix	trans	-71.4	-32.5	173.4	-85.8	-175.7	176.8	178.6	0	112.1	S515 K521	S515-K517 VanDerWaalsContact C-N 3.34Å; S515-K517 PolarHBondContact O-N 2.89Å; K517-K521 PolarHBondContact O-N 3.03Å
518	N	54.2	Low	60.8	Low	96 Å²	96	126.3 Å²	126.3	51%	0.513	62%	0.62	S	S	.	*	H	α-helix	trans	-73.2	-35.9	176.3	-73.1	-17.8	0	0	0	111.7	S515 K521 R522	S515-N518 PolarHBondContact O-N 2.98Å; N518-K521 PolarHBondContact O-N 3.41Å; N518-R522 WeakPolarHBondContact O-CG 3.5Å; N518-R522 PolarHBondContact O-N 2.94Å
519	D	68	Low	63	Low	78 Å²	78	129 Å²	129	42%	0.417	62%	0.621	S	S	.	*	H	α-helix	trans	-68.5	-36.7	176.3	-72.1	-26.3	0	0	0	113.1	S515 R522 K523	S515-D519 PolarHBondContact O-N 3.17Å; D519-R522 PolarHBondContact O-N 3.07Å; D519-K523 WeakPolarHBondContact O-CB 3.35Å; D519-K523 WeakPolarHBondContact O-CG 3.44Å; D519-K523 PolarHBondContact O-N 3.04Å
520	S	69.5	Low	65.5	Low	66 Å²	66	127.1 Å²	127.1	46%	0.462	61%	0.613	S	S	.	*	H	α-helix	trans	-66	-40.4	174.2	-173.7	0	0	0	0	112.2	Q516 K523 K524	Q516-S520 PolarHBondContact O-N 3.42Å; S520-K523 PolarHBondContact O-N 3.34Å; S520-K524 PolarHBondContact O-N 2.9Å
521	K	71.8	Confident	67.6	Low	149 Å²	149	124 Å²	124	65%	0.648	60%	0.6	S	S	*	*	H	α-helix	trans	-66.1	-40.1	173.3	-75.6	-177.4	179.1	178.4	0	112.2	K517 N518 K524 K525	K517-K521 PolarHBondContact O-N 3.03Å; N518-K521 PolarHBondContact O-N 3.41Å; K521-K524 PolarHBondContact O-N 2.87Å; K521-K525 PolarHBondContact O-N 3.38Å; K521-K525 VanDerWaalsContact O-N 3.09Å
522	R	74.9	Confident	69.6	Low	175 Å²	175	125.1 Å²	125.1	66%	0.66	60%	0.595	S	S	*	*	H	α-helix	trans	-63.6	-44.9	173.7	-76.4	178.3	105.1	-178	5.2	111.5	N518 D519 K524 K525 I526	N518-R522 WeakPolarHBondContact O-CG 3.5Å; N518-R522 PolarHBondContact O-N 2.94Å; D519-R522 PolarHBondContact O-N 3.07Å; R522-K524 PolarHBondContact O-N 3.05Å; R522-K525 PolarHBondContact O-N 3.38Å; R522-I526 VanDerWaalsContact O-CG1 3.32Å; R522-I526 WeakPolarHBondContact O-CG1 3.31Å; R522-I526 PolarHBondContact O-N 3.32Å
523	K	79.6	Confident	71.6	Confident	148 Å²	148	126.2 Å²	126.2	64%	0.643	60%	0.596	S	S	*	*	H	α-helix	trans	-60.4	-40.3	175.8	-77.8	-178.9	179.3	-179.4	0	112.7	D519 S520 I526 K527	D519-K523 WeakPolarHBondContact O-CB 3.35Å; D519-K523 WeakPolarHBondContact O-CG 3.44Å; D519-K523 PolarHBondContact O-N 3.04Å; S520-K523 PolarHBondContact O-N 3.34Å; K523-I526 PolarHBondContact O-N 3.5Å; K523-K527 WeakPolarHBondContact O-CG 3.27Å; K523-K527 PolarHBondContact O-N 3.25Å
524	K	78.4	Confident	73.7	Confident	146 Å²	146	122.1 Å²	122.1	64%	0.635	58%	0.58	S	S	*	*	H	α-helix	trans	-64.2	-43	174	-76.6	-174.5	179.9	-176.1	0	112.3	S520 K521 R522 K527 Q528	S520-K524 PolarHBondContact O-N 2.9Å; K521-K524 PolarHBondContact O-N 2.87Å; R522-K524 PolarHBondContact O-N 3.05Å; K524-K527 PolarHBondContact O-N 2.93Å; K524-Q528 PolarHBondContact O-N 3.34Å
525	K	79.7	Confident	75.8	Confident	148 Å²	148	125.6 Å²	125.6	64%	0.643	59%	0.585	S	S	*	*	H	α-helix	trans	-64.4	-39.1	176	-77.2	-173.5	176	-174.8	0	112.8	K521 R522 Q528 R529	K521-K525 PolarHBondContact O-N 3.38Å; K521-K525 VanDerWaalsContact O-N 3.09Å; R522-K525 PolarHBondContact O-N 3.38Å; K525-Q528 PolarHBondContact O-N 2.87Å; K525-R529 PolarHBondContact O-N 3.27Å
526	I	83.3	Confident	77.7	Confident	104 Å²	104	129.7 Å²	129.7	53%	0.533	60%	0.596	S	S	.	*	H	α-helix	trans	-64.2	-46.5	175.7	-66.8	164.2	0	0	0	110.2	R522 K523 Q528 R529 T530	R522-I526 VanDerWaalsContact O-CG1 3.32Å; R522-I526 WeakPolarHBondContact O-CG1 3.31Å; R522-I526 PolarHBondContact O-N 3.32Å; K523-I526 PolarHBondContact O-N 3.5Å; I526-Q528 VanDerWaalsContact C-N 3.31Å; I526-Q528 PolarHBondContact O-N 3.48Å; I526-R529 PolarHBondContact O-N 2.8Å; I526-R529 VanDerWaalsContact O-N 3.15Å; I526-T530 HydrophobicContact CG2-CG2 4.41Å; I526-T530 WeakPolarHBondContact O-CG2 3.42Å; I526-T530 PolarHBondContact O-N 3.16Å; I526-T530 PolarHBondContact O-OG1 3.19Å
527	K	84.7	Confident	79.4	Confident	150 Å²	150	132.7 Å²	132.7	65%	0.652	60%	0.601	S	S	*	*	H	α-helix	trans	-60.6	-35.4	175.8	-74.1	-176.5	178.9	-171.6	0	113.6	K523 K524 T530 K531	K523-K527 WeakPolarHBondContact O-CG 3.27Å; K523-K527 PolarHBondContact O-N 3.25Å; K524-K527 PolarHBondContact O-N 2.93Å; K527-T530 WeakPolarHBondContact CA-OG1 3.44Å; K527-T530 PolarHBondContact O-OG1 3.05Å; K527-K531 WeakPolarHBondContact O-CG 3.37Å; K527-K531 PolarHBondContact O-N 2.92Å; K527-K531 VanDerWaalsContact O-N 3.17Å
528	Q	81.2	Confident	81.2	Confident	128 Å²	128	131.3 Å²	131.3	60%	0.598	60%	0.595	S	S	*	*	H	α-helix	trans	-69.5	-42	174.1	-75.3	179.8	-15.3	0	0	111.6	K524 K525 I526 K531 I532	K524-Q528 PolarHBondContact O-N 3.34Å; K525-Q528 PolarHBondContact O-N 2.87Å; I526-Q528 VanDerWaalsContact C-N 3.31Å; I526-Q528 PolarHBondContact O-N 3.48Å; Q528-K531 PolarHBondContact O-N 3.47Å; Q528-I532 VanDerWaalsContact O-CG1 3.28Å; Q528-I532 WeakPolarHBondContact O-CG1 3.4Å; Q528-I532 PolarHBondContact O-N 3.2Å
529	R	85	Confident	82.6	Confident	193 Å²	193	130.8 Å²	130.8	73%	0.728	60%	0.596	S	S	*	*	H	α-helix	trans	-62.8	-43	175.9	-79.9	-179.5	127.1	162.3	-2	112.4	K525 I526 I532 L533	K525-R529 PolarHBondContact O-N 3.27Å; I526-R529 PolarHBondContact O-N 2.8Å; I526-R529 VanDerWaalsContact O-N 3.15Å; R529-I532 PolarHBondContact O-N 3.23Å; R529-L533 PolarHBondContact O-N 2.98Å
530	T	88.6	Confident	83.4	Confident	80 Å²	80	132.9 Å²	132.9	49%	0.491	60%	0.603	S	S	.	*	H	α-helix	trans	-64.6	-42.6	177.1	57.2	0	0	0	0	111.7	I526 K527 I532 L533 E534	I526-T530 HydrophobicContact CG2-CG2 4.41Å; I526-T530 WeakPolarHBondContact O-CG2 3.42Å; I526-T530 PolarHBondContact O-N 3.16Å; I526-T530 PolarHBondContact O-OG1 3.19Å; K527-T530 WeakPolarHBondContact CA-OG1 3.44Å; K527-T530 PolarHBondContact O-OG1 3.05Å; T530-I532 VanDerWaalsContact C-N 3.33Å; T530-I532 PolarHBondContact O-N 3.38Å; T530-L533 PolarHBondContact O-N 3.12Å; T530-E534 WeakPolarHBondContact O-CB 3.4Å; T530-E534 PolarHBondContact O-N 3.18Å
531	K	88.7	Confident	84.2	Confident	144 Å²	144	132.2 Å²	132.2	63%	0.626	60%	0.601	S	S	*	*	H	α-helix	trans	-59.8	-39.5	173.3	-78	-174.7	177.7	-168.1	0	112.9	K527 Q528 K535	K527-K531 WeakPolarHBondContact O-CG 3.37Å; K527-K531 PolarHBondContact O-N 2.92Å; K527-K531 VanDerWaalsContact O-N 3.17Å; Q528-K531 PolarHBondContact O-N 3.47Å; K531-K535 WeakPolarHBondContact O-CG 3.42Å; K531-K535 PolarHBondContact O-N 3.37Å
532	I	85.5	Confident	84.7	Confident	97 Å²	97	132.9 Å²	132.9	50%	0.497	60%	0.6	S	S	.	*	H	α-helix	trans	-68.2	-41.9	176.7	-68.2	164.8	0	0	0	110.8	Q528 R529 T530 K535 K536	Q528-I532 VanDerWaalsContact O-CG1 3.28Å; Q528-I532 WeakPolarHBondContact O-CG1 3.4Å; Q528-I532 PolarHBondContact O-N 3.2Å; R529-I532 PolarHBondContact O-N 3.23Å; T530-I532 VanDerWaalsContact C-N 3.33Å; T530-I532 PolarHBondContact O-N 3.38Å; I532-K535 PolarHBondContact O-N 3.23Å; I532-K536 WeakPolarHBondContact O-CG 3.45Å; I532-K536 PolarHBondContact O-N 2.9Å
533	L	87.9	Confident	85	Confident	126 Å²	126	128.7 Å²	128.7	66%	0.66	59%	0.59	S	S	*	*	H	α-helix	trans	-63.3	-41.8	176.5	-118.9	115.9	0	0	0	111.9	R529 T530 K536 R537	R529-L533 PolarHBondContact O-N 2.98Å; T530-L533 PolarHBondContact O-N 3.12Å; L533-K536 PolarHBondContact O-N 3.4Å; L533-R537 PolarHBondContact O-N 3.3Å
534	E	88.7	Confident	85.1	Confident	103 Å²	103	127.3 Å²	127.3	48%	0.481	59%	0.586	S	S	.	*	H	α-helix	trans	-65	-41.9	177.4	-163	-168.2	150.9	0	0	111.5	T530 K536 R537 K538	T530-E534 WeakPolarHBondContact O-CB 3.4Å; T530-E534 PolarHBondContact O-N 3.18Å; E534-K536 PolarHBondContact O-N 3.14Å; E534-R537 PolarHBondContact O-N 3.32Å; E534-K538 WeakPolarHBondContact O-CG 3.47Å; E534-K538 PolarHBondContact O-N 3.5Å; E534-K538 VanDerWaalsContact OE1-CE 3.29Å; E534-K538 WeakPolarHBondContact OE1-CE 3.35Å; E534-K538 IonicContact OE1-NZ 2.78Å; E534-K538 PolarHBondContact OE1-NZ 3.42Å
535	K	88.8	Confident	85.2	Confident	155 Å²	155	129.4 Å²	129.4	67%	0.674	59%	0.59	S	S	*	*	H	α-helix	trans	-60.5	-43.3	172.2	-75.9	-176.2	177.7	-169.5	0	111.7	K531 I532 K538 V539	K531-K535 WeakPolarHBondContact O-CG 3.42Å; K531-K535 PolarHBondContact O-N 3.37Å; I532-K535 PolarHBondContact O-N 3.23Å; K535-K538 PolarHBondContact O-N 3.28Å; K535-V539 WeakPolarHBondContact O-CG2 3.34Å; K535-V539 PolarHBondContact O-N 2.85Å
536	K	88.3	Confident	85.1	Confident	141 Å²	141	125.5 Å²	125.5	61%	0.613	57%	0.574	S	S	*	*	H	α-helix	trans	-62.7	-43.3	175.9	-76.5	-173.5	174.3	-167.8	0	112.3	I532 L533 E534 V539 Q540	I532-K536 WeakPolarHBondContact O-CG 3.45Å; I532-K536 PolarHBondContact O-N 2.9Å; L533-K536 PolarHBondContact O-N 3.4Å; E534-K536 PolarHBondContact O-N 3.14Å; K536-V539 PolarHBondContact O-N 2.92Å; K536-Q540 PolarHBondContact O-N 2.94Å
537	R	89.6	Confident	84.7	Confident	197 Å²	197	121.6 Å²	121.6	74%	0.743	56%	0.555	S	S	*	*	H	α-helix	trans	-63.6	-39.9	176.5	-171.5	178.1	171.2	-179.6	-2.5	111.9	L533 E534 Q540 A541	L533-R537 PolarHBondContact O-N 3.3Å; E534-R537 PolarHBondContact O-N 3.32Å; R537-Q540 PolarHBondContact O-N 3.05Å; R537-A541 WeakPolarHBondContact O-CB 3.45Å; R537-A541 PolarHBondContact O-N 3.3Å
538	K	88.3	Confident	84.4	Confident	133 Å²	133	119.8 Å²	119.8	58%	0.578	55%	0.547	S	S	*	.	H	α-helix	trans	-63.5	-39.2	174.1	-74.1	177.3	-175.5	170.1	0	112.3	E534 K535 R542	E534-K538 WeakPolarHBondContact O-CG 3.47Å; E534-K538 PolarHBondContact O-N 3.5Å; E534-K538 VanDerWaalsContact OE1-CE 3.29Å; E534-K538 WeakPolarHBondContact OE1-CE 3.35Å; E534-K538 IonicContact OE1-NZ 2.78Å; E534-K538 PolarHBondContact OE1-NZ 3.42Å; K535-K538 PolarHBondContact O-N 3.28Å; K538-R542 WeakPolarHBondContact O-CB 3.44Å; K538-R542 PolarHBondContact O-N 3.46Å
539	V	83.7	Confident	84	Confident	86 Å²	86	119.8 Å²	119.8	52%	0.521	55%	0.551	S	S	.	*	H	α-helix	trans	-68.2	-43.3	175.1	173.3	0	0	0	0	111.2	K535 K536 R542 L543	K535-V539 WeakPolarHBondContact O-CG2 3.34Å; K535-V539 PolarHBondContact O-N 2.85Å; K536-V539 PolarHBondContact O-N 2.92Å; V539-R542 WeakPolarHBondContact O-CB 3.48Å; V539-R542 PolarHBondContact O-N 3.3Å; V539-L543 HydrophobicContact CG1-CD1 4.15Å; V539-L543 WeakPolarHBondContact O-CG 3.33Å; V539-L543 PolarHBondContact O-N 2.86Å
540	Q	84.5	Confident	83.2	Confident	121 Å²	121	114.2 Å²	114.2	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-62.6	-45.5	175.2	-79.7	179.4	-39.2	0	0	112.3	K536 R537 R542 L543 E544	K536-Q540 PolarHBondContact O-N 2.94Å; R537-Q540 PolarHBondContact O-N 3.05Å; Q540-R542 PolarHBondContact O-N 3.27Å; Q540-L543 PolarHBondContact O-N 3.37Å; Q540-L543 VanDerWaalsContact O-N 3.13Å; Q540-E544 PolarHBondContact O-N 3.41Å
541	A	86.7	Confident	82.2	Confident	52 Å²	52	110.7 Å²	110.7	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-33.2	176.1	0	0	0	0	0	112.4	R537 R545	R537-A541 WeakPolarHBondContact O-CB 3.45Å; R537-A541 PolarHBondContact O-N 3.3Å; A541-R545 WeakPolarHBondContact O-CB 3.37Å; A541-R545 PolarHBondContact O-N 3.3Å
542	R	82.8	Confident	81.1	Confident	164 Å²	164	104.9 Å²	104.9	62%	0.619	49%	0.489	S	S	*	.	H	α-helix	trans	-67.1	-46.7	172.1	179.1	-179.6	170.6	179.9	-2.1	111.4	K538 V539 Q540 R545 E546	K538-R542 WeakPolarHBondContact O-CB 3.44Å; K538-R542 PolarHBondContact O-N 3.46Å; V539-R542 WeakPolarHBondContact O-CB 3.48Å; V539-R542 PolarHBondContact O-N 3.3Å; Q540-R542 PolarHBondContact O-N 3.27Å; R542-R545 PolarHBondContact O-N 3.07Å; R542-E546 IonicContact CZ-OE1 3.25Å; R542-E546 IonicContact NE-OE1 3.17Å; R542-E546 PolarHBondContact NE-OE1 3.4Å; R542-E546 IonicContact NH2-OE1 3.12Å; R542-E546 PolarHBondContact NH2-OE1 3.12Å; R542-E546 VanDerWaalsContact NH2-OE1 3.07Å; R542-E546 WeakPolarHBondContact O-CG 3.43Å; R542-E546 PolarHBondContact O-N 3.4Å
543	L	80.4	Confident	80.2	Confident	86 Å²	86	108 Å²	108	45%	0.45	50%	0.501	S	S	.	.	H	α-helix	trans	-62.6	-41.2	177.6	-73.7	169	0	0	0	111.8	V539 Q540 R545 E546 S547	V539-L543 HydrophobicContact CG1-CD1 4.15Å; V539-L543 WeakPolarHBondContact O-CG 3.33Å; V539-L543 PolarHBondContact O-N 2.86Å; Q540-L543 PolarHBondContact O-N 3.37Å; Q540-L543 VanDerWaalsContact O-N 3.13Å; L543-R545 VanDerWaalsContact C-N 3.33Å; L543-R545 PolarHBondContact O-N 3.09Å; L543-E546 PolarHBondContact O-N 3.12Å; L543-S547 WeakPolarHBondContact O-CB 3.25Å; L543-S547 PolarHBondContact O-N 3.13Å
544	E	81.6	Confident	79	Confident	119 Å²	119	107.2 Å²	107.2	56%	0.556	50%	0.498	S	S	*	.	H	α-helix	trans	-64.4	-36.8	173.6	-75.9	173.6	-176.5	0	0	112.2	Q540 S547 K548	Q540-E544 PolarHBondContact O-N 3.41Å; E544-S547 PolarHBondContact O-OG 3.03Å; E544-K548 WeakPolarHBondContact O-CB 3.38Å; E544-K548 VanDerWaalsContact O-CG 3.25Å; E544-K548 WeakPolarHBondContact O-CG 3.48Å; E544-K548 PolarHBondContact O-N 3.25Å
545	R	82.2	Confident	77.6	Confident	191 Å²	191	106.5 Å²	106.5	72%	0.721	50%	0.497	S	S	*	.	H	α-helix	trans	-68.7	-40.7	175.7	-161.6	-175.3	-163.9	117.7	1.6	111.5	A541 R542 L543 L549	A541-R545 WeakPolarHBondContact O-CB 3.37Å; A541-R545 PolarHBondContact O-N 3.3Å; R542-R545 PolarHBondContact O-N 3.07Å; L543-R545 VanDerWaalsContact C-N 3.33Å; L543-R545 PolarHBondContact O-N 3.09Å; R545-L549 WeakPolarHBondContact O-CB 3.4Å; R545-L549 PolarHBondContact O-N 3.02Å; R545-L549 VanDerWaalsContact O-N 3.12Å
546	E	76.3	Confident	76.3	Confident	66 Å²	66	102.7 Å²	102.7	31%	0.308	48%	0.484	S	S	.	.	H	α-helix	trans	-63.9	-45.6	173.7	-74.2	173.8	-176.7	0	0	110.1	R542 L543 K548 L549 W550	R542-E546 IonicContact CZ-OE1 3.25Å; R542-E546 IonicContact NE-OE1 3.17Å; R542-E546 PolarHBondContact NE-OE1 3.4Å; R542-E546 IonicContact NH2-OE1 3.12Å; R542-E546 PolarHBondContact NH2-OE1 3.12Å; R542-E546 VanDerWaalsContact NH2-OE1 3.07Å; R542-E546 WeakPolarHBondContact O-CG 3.43Å; R542-E546 PolarHBondContact O-N 3.4Å; L543-E546 PolarHBondContact O-N 3.12Å; E546-K548 PolarHBondContact O-N 3.32Å; E546-L549 VanDerWaalsContact O-CB 3.31Å; E546-L549 WeakPolarHBondContact O-CB 3.37Å; E546-L549 PolarHBondContact O-N 3.42Å; E546-W550 PolarHBondContact O-N 3.48Å
547	S	75.7	Confident	75	Confident	21 Å²	21	98.6 Å²	98.6	15%	0.147	47%	0.472	C	S	.	.	H	α-helix	trans	-63.8	-41.9	177.9	85.9	0	0	0	0	112.5	L543 E544 L549 W550 F551	L543-S547 WeakPolarHBondContact O-CB 3.25Å; L543-S547 PolarHBondContact O-N 3.13Å; E544-S547 PolarHBondContact O-OG 3.03Å; S547-L549 VanDerWaalsContact C-N 3.27Å; S547-L549 PolarHBondContact O-N 3.45Å; S547-W550 PolarHBondContact O-N 3.32Å; S547-F551 WeakPolarHBondContact O-CD2 3.15Å; S547-F551 PolarHBondContact O-N 2.88Å
548	K	77.2	Confident	73.6	Confident	112 Å²	112	95.2 Å²	95.2	49%	0.487	47%	0.469	S	S	.	.	H	α-helix	trans	-61.6	-34.2	174.9	-78.8	179.8	179.3	-166.5	0	112.8	E544 E546 W550 G552	E544-K548 WeakPolarHBondContact O-CB 3.38Å; E544-K548 VanDerWaalsContact O-CG 3.25Å; E544-K548 WeakPolarHBondContact O-CG 3.48Å; E544-K548 PolarHBondContact O-N 3.25Å; E546-K548 PolarHBondContact O-N 3.32Å; K548-W550 VanDerWaalsContact C-N 3.32Å; K548-G552 WeakPolarHBondContact O-CA 3.4Å; K548-G552 PolarHBondContact O-N 3.45Å
549	L	73.3	Confident	72.2	Confident	128 Å²	128	93.6 Å²	93.6	67%	0.67	46%	0.463	S	S	*	.	H	α-helix	trans	-64.5	-35.8	176.2	-110.4	149.5	0	0	0	112.2	R545 E546 S547	R545-L549 WeakPolarHBondContact O-CB 3.4Å; R545-L549 PolarHBondContact O-N 3.02Å; R545-L549 VanDerWaalsContact O-N 3.12Å; E546-L549 VanDerWaalsContact O-CB 3.31Å; E546-L549 WeakPolarHBondContact O-CB 3.37Å; E546-L549 PolarHBondContact O-N 3.42Å; S547-L549 VanDerWaalsContact C-N 3.27Å; S547-L549 PolarHBondContact O-N 3.45Å
550	W	68.5	Low	71.1	Confident	77 Å²	77	89.9 Å²	89.9	29%	0.292	44%	0.44	S	S	.	.	H	α-helix	trans	-90.6	-34.3	-178.2	-62.8	111.6	0	0	0	113.9	E546 S547 K548 F590 Y593	E546-W550 PolarHBondContact O-N 3.48Å; S547-W550 PolarHBondContact O-N 3.32Å; K548-W550 VanDerWaalsContact C-N 3.32Å; W550-F590 HydrophobicContact CE3-CD2 4.34Å; W550-F590 AromaticContact CH2-CD2 3.24Å; W550-F590 HydrophobicContact CH2-CD2 3.24Å; W550-F590 AromaticContact CH2-CE2 3.61Å; W550-F590 HydrophobicContact CH2-CE2 3.61Å; W550-F590 HydrophobicContact CH2-CG 4.38Å; W550-F590 HydrophobicContact CZ2-CB 4.37Å; W550-F590 AromaticContact CZ2-CD2 3.63Å; W550-F590 HydrophobicContact CZ2-CD2 3.63Å; W550-F590 HydrophobicContact CZ2-CE2 4.39Å; W550-F590 HydrophobicContact CZ2-CG 4.41Å; W550-F590 AromaticContact CZ3-CD2 3.63Å; W550-F590 HydrophobicContact CZ3-CD2 3.63Å; W550-F590 AromaticContact CZ3-CE2 3.93Å; W550-F590 HydrophobicContact CZ3-CE2 3.93Å; W550-Y593 HydrophobicContact CB-CD2 4.25Å; W550-Y593 HydrophobicContact CD2-CG 4.27Å; W550-Y593 AromaticContact CE3-CD1 3.51Å; W550-Y593 HydrophobicContact CE3-CD1 3.51Å; W550-Y593 AromaticContact CE3-CD2 3.65Å; W550-Y593 HydrophobicContact CE3-CD2 3.65Å; W550-Y593 AromaticContact CE3-CE1 3.89Å; W550-Y593 HydrophobicContact CE3-CE1 3.89Å; W550-Y593 HydrophobicContact CE3-CE2 4.01Å; W550-Y593 AromaticContact CE3-CG 3.39Å; W550-Y593 HydrophobicContact CE3-CG 3.39Å; W550-Y593 AromaticContact CZ3-CD1 3.57Å; W550-Y593 HydrophobicContact CZ3-CD1 3.57Å; W550-Y593 HydrophobicContact CZ3-CD2 4.45Å; W550-Y593 AromaticContact CZ3-CE1 3.72Å; W550-Y593 HydrophobicContact CZ3-CE1 3.72Å; W550-Y593 AromaticContact CZ3-CG 3.98Å; W550-Y593 HydrophobicContact CZ3-CG 3.98Å; W550-Y593 WeakPolarHBondContact O-CD2 3.48Å
551	F	66.6	Low	70.1	Confident	5 Å²	5	87.8 Å²	87.8	2%	0.022	44%	0.439	C	S	.	.	H	α-helix	trans	-122.1	10.3	-168.8	-54.9	-70.8	0	0	0	114.7	S547 N556 L560 D589 R592 I596	S547-F551 WeakPolarHBondContact O-CD2 3.15Å; S547-F551 PolarHBondContact O-N 2.88Å; F551-N556 PolarHBondContact O-N 3.39Å; F551-L560 HydrophobicContact CD1-CD1 4.45Å; F551-D589 HydrophobicContact CE2-CB 4.16Å; F551-D589 WeakPolarHBondContact CZ-O 3.37Å; F551-R592 HydrophobicContact CE1-CG 4.07Å; F551-R592 HydrophobicContact CZ-CB 3.92Å; F551-R592 HydrophobicContact CZ-CG 3.83Å; F551-I596 HydrophobicContact CE1-CD1 4Å
552	G	67.6	Low	69.1	Low	22 Å²	22	90.5 Å²	90.5	23%	0.227	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	-175.7	-178.6	0	0	0	0	0	113.6	K548 N554	K548-G552 WeakPolarHBondContact O-CA 3.4Å; K548-G552 PolarHBondContact O-N 3.45Å; G552-N554 PolarHBondContact O-N 2.86Å
553	E	65.9	Low	68.5	Low	162 Å²	162	84.6 Å²	84.6	76%	0.757	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26	-175.7	-110.4	174.6	169.6	0	0	113.5
554	N	62.5	Low	68.2	Low	110 Å²	110	86.3 Å²	86.3	59%	0.588	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	5.6	-171.3	-68.7	-35.4	0	0	0	114.7	G552 N556	G552-N554 PolarHBondContact O-N 2.86Å; N554-N556 HydrophobicContact CB-CB 4.09Å; N554-N556 PolarHBondContact O-N 3.38Å
555	N	59.8	Low	67.9	Low	88 Å²	88	89.8 Å²	89.8	47%	0.471	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	29.9	-170	-76.3	-36.7	0	0	0	112.3
556	N	61	Low	67.3	Low	75 Å²	75	86.6 Å²	86.6	40%	0.401	44%	0.436	S	S	.	.			trans	-88.8	122.5	-173.1	-134	3	0	0	0	107.4	F551 N554 D558 E559	F551-N556 PolarHBondContact O-N 3.39Å; N554-N556 HydrophobicContact CB-CB 4.09Å; N554-N556 PolarHBondContact O-N 3.38Å; N556-D558 PolarHBondContact O-N 3.04Å; N556-E559 PolarHBondContact O-N 3.47Å; N556-E559 VanDerWaalsContact O-N 3.12Å
557	P	60	Low	67.3	Low	56 Å²	56	84.2 Å²	84.2	36%	0.364	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-12.9	-178.8	25.6	-33.6	0	0	0	113.2	I596 R600	P557-I596 HydrophobicContact CB-CD1 4.41Å; P557-R600 PolarHBondContact O-NH2 3.09Å
558	D	60.6	Low	67.3	Low	125 Å²	125	88.2 Å²	88.2	67%	0.668	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-25.7	178.9	-67	-20.1	0	0	0	113.5	N556 L560 R600	N556-D558 PolarHBondContact O-N 3.04Å; D558-L560 VanDerWaalsContact C-N 3.29Å; D558-L560 PolarHBondContact O-N 3.04Å; D558-R600 VanDerWaalsContact CA-NH2 3.34Å; D558-R600 PolarHBondContact O-NH2 3.25Å
559	E	59.2	Low	67.2	Low	99 Å²	99	85.4 Å²	85.4	46%	0.463	43%	0.429	S	S	.	.	S	Bend	trans	-93.1	35.9	179	-71.2	-179.1	160.7	0	0	112.7	N556 C561	N556-E559 PolarHBondContact O-N 3.47Å; N556-E559 VanDerWaalsContact O-N 3.12Å; E559-C561 PolarHBondContact O-N 3.39Å
560	L	61.9	Low	67.1	Low	8 Å²	8	80.9 Å²	80.9	4%	0.042	41%	0.405	C	S	.	.			trans	-61.9	133.2	177.3	-152.2	83.1	0	0	0	109.9	F551 D558 D562 Y593 I596 R597	F551-L560 HydrophobicContact CD1-CD1 4.45Å; D558-L560 VanDerWaalsContact C-N 3.29Å; D558-L560 PolarHBondContact O-N 3.04Å; L560-D562 PolarHBondContact O-N 3.4Å; L560-Y593 HydrophobicContact CD1-CD2 3.64Å; L560-Y593 HydrophobicContact CD1-CE2 3.9Å; L560-Y593 HydrophobicContact CD2-CD2 4.27Å; L560-Y593 HydrophobicContact CD2-CE2 3.9Å; L560-Y593 HydrophobicContact CG-CD2 3.98Å; L560-Y593 HydrophobicContact CG-CE2 3.69Å; L560-I596 HydrophobicContact CD1-CB 4.45Å; L560-I596 HydrophobicContact CD1-CG2 4.06Å; L560-I596 HydrophobicContact CD2-CG2 4.16Å; L560-R597 HydrophobicContact CD2-CB 4.12Å; L560-R597 HydrophobicContact CD2-CG 4.48Å
561	C	63.3	Low	67.5	Low	78 Å²	78	84.5 Å²	84.5	53%	0.527	42%	0.419	S	S	.	.			trans	-67.2	100.1	171.9	-167.9	0	0	0	0	109.2	E559 D563 Y593	E559-C561 PolarHBondContact O-N 3.39Å; C561-D563 PolarHBondContact O-N 2.92Å; C561-D563 VanDerWaalsContact O-N 3.11Å; C561-Y593 PolarHBondContact O-OH 3.35Å; C561-Y593 VanDerWaalsContact O-OH 3.12Å
562	D	64.8	Low	68.1	Low	108 Å²	108	87.4 Å²	87.4	58%	0.578	44%	0.435	S	S	*	.			trans	-76.2	89.5	177.8	-63.6	-35.9	0	0	0	109.1	L560 R600	L560-D562 PolarHBondContact O-N 3.4Å; D562-R600 IonicContact OD1-NH1 2.8Å; D562-R600 PolarHBondContact OD1-NH1 3.23Å; D562-R600 IonicContact OD2-NH1 3.3Å
563	D	69.5	Low	68.7	Low	41 Å²	41	90 Å²	90	22%	0.219	45%	0.454	C	S	.	.			trans	-113.2	84.7	177.9	-174.6	-2.3	0	0	0	111.5	C561 R565 F566 R597	C561-D563 PolarHBondContact O-N 2.92Å; C561-D563 VanDerWaalsContact O-N 3.11Å; D563-R565 PolarHBondContact O-N 3.37Å; D563-R565 WeakPolarHBondContact OD1-CB 3.43Å; D563-R565 WeakPolarHBondContact OD1-CG 3.43Å; D563-R565 IonicContact OD1-CZ 3.03Å; D563-R565 PolarHBondContact OD1-N 2.91Å; D563-R565 IonicContact OD1-NE 3.06Å; D563-R565 PolarHBondContact OD1-NE 2.93Å; D563-R565 IonicContact OD1-NH2 3.59Å; D563-R565 IonicContact OD2-CZ 2.72Å; D563-R565 IonicContact OD2-NE 3.26Å; D563-R565 PolarHBondContact OD2-NE 3.28Å; D563-R565 IonicContact OD2-NH2 2.72Å; D563-R565 PolarHBondContact OD2-NH2 3.15Å; D563-F566 PolarHBondContact O-N 3.01Å; D563-R597 PolarHBondContact O-NH1 3Å; D563-R597 PolarHBondContact O-NH2 3.21Å
564	D	75.8	Confident	69.4	Low	121 Å²	121	86.3 Å²	86.3	65%	0.647	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-51.7	-16.3	-175.1	-58.9	-8.3	0	0	0	115.5	F566 D567	D564-F566 PolarHBondContact O-N 2.88Å; D564-D567 WeakPolarHBondContact O-CB 3.38Å; D564-D567 PolarHBondContact O-N 3.4Å; D564-D567 VanDerWaalsContact O-N 3.13Å
565	R	74.4	Confident	70.2	Confident	192 Å²	192	86 Å²	86	73%	0.725	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-59.1	-22.5	-179	-67.1	-177.9	-68.8	177.4	-1.3	113.8	D563	D563-R565 PolarHBondContact O-N 3.37Å; D563-R565 WeakPolarHBondContact OD1-CB 3.43Å; D563-R565 WeakPolarHBondContact OD1-CG 3.43Å; D563-R565 IonicContact OD1-CZ 3.03Å; D563-R565 PolarHBondContact OD1-N 2.91Å; D563-R565 IonicContact OD1-NE 3.06Å; D563-R565 PolarHBondContact OD1-NE 2.93Å; D563-R565 IonicContact OD1-NH2 3.59Å; D563-R565 IonicContact OD2-CZ 2.72Å; D563-R565 IonicContact OD2-NE 3.26Å; D563-R565 PolarHBondContact OD2-NE 3.28Å; D563-R565 IonicContact OD2-NH2 2.72Å; D563-R565 PolarHBondContact OD2-NH2 3.15Å
566	F	68.9	Low	71	Confident	124 Å²	124	87.6 Å²	87.6	54%	0.544	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-110.7	5.5	-177.9	-55.4	-77.4	0	0	0	113.6	D563 D564 E568 F569	D563-F566 PolarHBondContact O-N 3.01Å; D564-F566 PolarHBondContact O-N 2.88Å; F566-E568 PolarHBondContact O-N 2.97Å; F566-F569 VanDerWaalsContact O-CB 3.23Å; F566-F569 WeakPolarHBondContact O-CB 3.4Å; F566-F569 PolarHBondContact O-N 3.23Å; F566-F569 VanDerWaalsContact O-N 3.12Å
567	D	76.9	Confident	71.6	Confident	16 Å²	16	88 Å²	88	9%	0.086	46%	0.455	C	S	.	.	H	α-helix	trans	-61.3	-30	177.8	-91	5.3	0	0	0	112.9	D564 F569 L570 R571 R597 I601	D564-D567 WeakPolarHBondContact O-CB 3.38Å; D564-D567 PolarHBondContact O-N 3.4Å; D564-D567 VanDerWaalsContact O-N 3.13Å; D567-F569 PolarHBondContact O-N 2.84Å; D567-L570 WeakPolarHBondContact O-CB 3.42Å; D567-L570 PolarHBondContact O-N 3.13Å; D567-R571 PolarHBondContact O-N 2.92Å; D567-R571 VanDerWaalsContact O-N 3.14Å; D567-R571 IonicContact OD2-CZ 3.14Å; D567-R571 IonicContact OD2-NH1 3.63Å; D567-R571 IonicContact OD2-NH2 3.4Å; D567-R571 PolarHBondContact OD2-NH2 2.99Å; D567-R597 IonicContact OD1-CZ 2.76Å; D567-R597 VanDerWaalsContact OD1-CZ 3.28Å; D567-R597 IonicContact OD1-NE 3.27Å; D567-R597 PolarHBondContact OD1-NE 3.48Å; D567-R597 VanDerWaalsContact OD1-NE 3.1Å; D567-R597 IonicContact OD1-NH2 2.91Å; D567-R597 PolarHBondContact OD1-NH2 2.93Å; D567-I601 VanDerWaalsContact OD1-CD1 3.27Å; D567-I601 WeakPolarHBondContact OD1-CD1 3.25Å
568	E	76.5	Confident	72.7	Confident	105 Å²	105	88.1 Å²	88.1	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-60.4	-32	178.4	-158.4	69.7	-154.6	0	0	111.5	F566 L570 R571 N572 F575	F566-E568 PolarHBondContact O-N 2.97Å; E568-L570 PolarHBondContact O-N 2.87Å; E568-R571 PolarHBondContact O-N 2.89Å; E568-N572 HydrophobicContact CG-CB 4.5Å; E568-N572 VanDerWaalsContact O-CB 3.25Å; E568-N572 WeakPolarHBondContact O-CB 3.35Å; E568-N572 PolarHBondContact O-N 3.25Å; E568-N572 PolarHBondContact OE1-ND2 3.07Å; E568-F575 HydrophobicContact CG-CD2 4.43Å; E568-F575 HydrophobicContact CG-CE2 3.83Å
569	F	74.2	Confident	73.7	Confident	54 Å²	54	88.3 Å²	88.3	24%	0.237	45%	0.454	C	S	.	.	H	α-helix	trans	-64	-29.6	175	-179.3	-82.1	0	0	0	112.1	F566 D567 F575 I577 M594	F566-F569 VanDerWaalsContact O-CB 3.23Å; F566-F569 WeakPolarHBondContact O-CB 3.4Å; F566-F569 PolarHBondContact O-N 3.23Å; F566-F569 VanDerWaalsContact O-N 3.12Å; D567-F569 PolarHBondContact O-N 2.84Å; F569-F575 HydrophobicContact CB-CB 4.45Å; F569-F575 HydrophobicContact CD2-CB 3.71Å; F569-F575 WeakPolarHBondContact CD2-O 3.46Å; F569-F575 HydrophobicContact CE2-CB 4.19Å; F569-F575 WeakPolarHBondContact CE2-O 3.47Å; F569-F575 HydrophobicContact CG-CB 4.3Å; F569-F575 WeakPolarHBondContact CZ-O 3.28Å; F569-I577 HydrophobicContact CE1-CD1 4.15Å; F569-I577 HydrophobicContact CE2-CD1 3.85Å; F569-I577 HydrophobicContact CE2-CG1 3.72Å; F569-I577 HydrophobicContact CZ-CB 4.36Å; F569-I577 HydrophobicContact CZ-CD1 3.27Å; F569-I577 HydrophobicContact CZ-CG1 3.42Å; F569-I577 VanDerWaalsContact CZ-CG1 3.42Å; F569-M594 HydrophobicContact CD1-CE 3.65Å; F569-M594 HydrophobicContact CE1-CE 3.36Å
570	L	72.6	Confident	74.9	Confident	32 Å²	32	87.3 Å²	87.3	17%	0.168	46%	0.455	C	S	.	.	H	α-helix	trans	-87.9	-25.5	-179.6	-71.1	172.1	0	0	0	113.4	D567 E568 M594 R597 Q598 I601	D567-L570 WeakPolarHBondContact O-CB 3.42Å; D567-L570 PolarHBondContact O-N 3.13Å; E568-L570 PolarHBondContact O-N 2.87Å; L570-M594 HydrophobicContact CD2-CE 3.21Å; L570-M594 HydrophobicContact CD2-SD 3.72Å; L570-M594 HydrophobicContact CG-CE 4.21Å; L570-M594 HydrophobicContact CG-SD 4.38Å; L570-R597 HydrophobicContact CD1-CB 4.08Å; L570-R597 HydrophobicContact CD1-CG 3.64Å; L570-Q598 HydrophobicContact CD2-CG 3.66Å; L570-I601 HydrophobicContact CB-CD1 4.26Å; L570-I601 HydrophobicContact CD1-CD1 3.49Å; L570-I601 VanDerWaalsContact CD1-CD1 3.49Å
571	R	75.4	Confident	75.8	Confident	153 Å²	153	91.9 Å²	91.9	58%	0.577	48%	0.476	S	S	*	.	H	α-helix	trans	-93.7	-28.6	-177.1	-66.3	-174.8	-174.5	117.7	12.5	113.4	D567 E568 I601	D567-R571 PolarHBondContact O-N 2.92Å; D567-R571 VanDerWaalsContact O-N 3.14Å; D567-R571 IonicContact OD2-CZ 3.14Å; D567-R571 IonicContact OD2-NH1 3.63Å; D567-R571 IonicContact OD2-NH2 3.4Å; D567-R571 PolarHBondContact OD2-NH2 2.99Å; E568-R571 PolarHBondContact O-N 2.89Å; R571-I601 HydrophobicContact CG-CG2 4.34Å
572	N	79.6	Confident	76.7	Confident	66 Å²	66	93 Å²	93	35%	0.353	48%	0.482	S	S	.	.			trans	-116.7	112.8	-164.4	-165.2	-9	0	0	0	110.8	E568 A574 F575	E568-N572 HydrophobicContact CG-CB 4.5Å; E568-N572 VanDerWaalsContact O-CB 3.25Å; E568-N572 WeakPolarHBondContact O-CB 3.35Å; E568-N572 PolarHBondContact O-N 3.25Å; E568-N572 PolarHBondContact OE1-ND2 3.07Å; N572-A574 PolarHBondContact O-N 3.02Å; N572-F575 HydrophobicContact CB-CD2 3.89Å; N572-F575 HydrophobicContact CB-CE2 4.14Å; N572-F575 PolarHBondContact O-N 3.49Å
573	A	80.5	Confident	77.6	Confident	76 Å²	76	94.2 Å²	94.2	63%	0.628	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-59.6	-16	-176	0	0	0	0	0	114	F575 D576	A573-F575 PolarHBondContact O-N 3.47Å; A573-D576 PolarHBondContact O-N 3.17Å
574	A	80.7	Confident	78.2	Confident	85 Å²	85	95.6 Å²	95.6	70%	0.702	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-65.6	-17.5	173.1	0	0	0	0	0	113.6	N572	N572-A574 PolarHBondContact O-N 3.02Å
575	F	78.6	Confident	78.4	Confident	105 Å²	105	98.6 Å²	98.6	46%	0.461	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-104.1	5	179	-59.9	-72.8	0	0	0	113.7	E568 F569 N572 A573 I577	E568-F575 HydrophobicContact CG-CD2 4.43Å; E568-F575 HydrophobicContact CG-CE2 3.83Å; F569-F575 HydrophobicContact CB-CB 4.45Å; F569-F575 HydrophobicContact CD2-CB 3.71Å; F569-F575 WeakPolarHBondContact CD2-O 3.46Å; F569-F575 HydrophobicContact CE2-CB 4.19Å; F569-F575 WeakPolarHBondContact CE2-O 3.47Å; F569-F575 HydrophobicContact CG-CB 4.3Å; F569-F575 WeakPolarHBondContact CZ-O 3.28Å; N572-F575 HydrophobicContact CB-CD2 3.89Å; N572-F575 HydrophobicContact CB-CE2 4.14Å; N572-F575 PolarHBondContact O-N 3.49Å; A573-F575 PolarHBondContact O-N 3.47Å; F575-I577 PolarHBondContact O-N 3.02Å
576	D	77.6	Confident	78.7	Confident	120 Å²	120	96.7 Å²	96.7	64%	0.642	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-57.6	126.6	179.8	-88.8	-25.7	0	0	0	111.7	A573 S578	A573-D576 PolarHBondContact O-N 3.17Å; D576-S578 PolarHBondContact O-N 3.12Å
577	I	74	Confident	79.3	Confident	85 Å²	85	93.1 Å²	93.1	44%	0.436	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-70.3	116.8	176.9	-69.4	152.9	0	0	0	108.5	F569 F575 Q579 Y584 F590	F569-I577 HydrophobicContact CE1-CD1 4.15Å; F569-I577 HydrophobicContact CE2-CD1 3.85Å; F569-I577 HydrophobicContact CE2-CG1 3.72Å; F569-I577 HydrophobicContact CZ-CB 4.36Å; F569-I577 HydrophobicContact CZ-CD1 3.27Å; F569-I577 HydrophobicContact CZ-CG1 3.42Å; F569-I577 VanDerWaalsContact CZ-CG1 3.42Å; F575-I577 PolarHBondContact O-N 3.02Å; I577-Q579 PolarHBondContact O-N 3.41Å; I577-Y584 HydrophobicContact CG2-CD2 3.41Å; I577-Y584 VanDerWaalsContact CG2-CD2 3.41Å; I577-Y584 HydrophobicContact CG2-CE2 3.56Å; I577-F590 HydrophobicContact CD1-CE1 4.34Å
578	S	81.6	Confident	79.4	Confident	57 Å²	57	96.4 Å²	96.4	40%	0.399	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-68.6	118.4	171.8	-176.3	0	0	0	0	111.2	D576 T580 H581	D576-S578 PolarHBondContact O-N 3.12Å; S578-T580 PolarHBondContact O-N 2.97Å; S578-T580 PolarHBondContact OG-N 2.64Å; S578-T580 VanDerWaalsContact OG-N 3.16Å; S578-T580 PolarHBondContact OG-OG1 3.21Å; S578-H581 WeakPolarHBondContact O-CB 3.46Å; S578-H581 PolarHBondContact O-N 3.12Å
579	Q	82.9	Confident	79.2	Confident	129 Å²	129	93.5 Å²	93.5	60%	0.603	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-9.7	170.2	-62.2	178.9	10.2	0	0	112.8	T383 I577 Y584	T383-Q579 PolarHBondContact OG1-O 2.99Å; I577-Q579 PolarHBondContact O-N 3.41Å; Q579-Y584 HydrophobicContact CB-CD1 4.45Å; Q579-Y584 HydrophobicContact CB-CE1 4.36Å; Q579-Y584 HydrophobicContact CG-CE1 4.1Å; Q579-Y584 HydrophobicContact CG-CE2 4.43Å
580	T	83.8	Confident	79.3	Confident	79 Å²	79	93.8 Å²	93.8	49%	0.485	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-3.3	175.6	69	0	0	0	0	113.1	P382 S578	P382-T580 HydrophobicContact CB-CG2 4.45Å; S578-T580 PolarHBondContact O-N 2.97Å; S578-T580 PolarHBondContact OG-N 2.64Å; S578-T580 VanDerWaalsContact OG-N 3.16Å; S578-T580 PolarHBondContact OG-OG1 3.21Å
581	H	81.5	Confident	79.6	Confident	104 Å²	104	95.2 Å²	95.2	48%	0.481	51%	0.511	S	S	.	.	S	Bend	trans	-73	133.6	177.1	-165.1	-83.3	0	0	0	110.6	S578 D583 Y584	S578-H581 WeakPolarHBondContact O-CB 3.46Å; S578-H581 PolarHBondContact O-N 3.12Å; H581-D583 IonicContact CE1-OD2 3.4Å; H581-D583 PolarHBondContact ND1-N 2.95Å; H581-D583 PolarHBondContact O-N 3.24Å; H581-D583 VanDerWaalsContact O-N 3.14Å; H581-Y584 WeakPolarHBondContact O-CB 3.45Å; H581-Y584 PolarHBondContact O-N 2.78Å
582	P	81.6	Confident	79.7	Confident	102 Å²	102	94.4 Å²	94.4	66%	0.662	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.7	-174.9	21.2	-32.8	0	0	0	114.1
583	D	82.4	Confident	79.7	Confident	132 Å²	132	92 Å²	92	71%	0.706	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	1.2	176.9	-61.8	-35.2	0	0	0	114.3	H581 K585	H581-D583 IonicContact CE1-OD2 3.4Å; H581-D583 PolarHBondContact ND1-N 2.95Å; H581-D583 PolarHBondContact O-N 3.24Å; H581-D583 VanDerWaalsContact O-N 3.14Å; D583-K585 PolarHBondContact O-N 3.14Å
584	Y	82.5	Confident	79.5	Confident	70 Å²	70	89.6 Å²	89.6	28%	0.275	47%	0.471	S	S	.	.			trans	-65.8	128.8	179.7	179.6	-101	0	0	0	111.1	I577 Q579 H581 E586	I577-Y584 HydrophobicContact CG2-CD2 3.41Å; I577-Y584 VanDerWaalsContact CG2-CD2 3.41Å; I577-Y584 HydrophobicContact CG2-CE2 3.56Å; Q579-Y584 HydrophobicContact CB-CD1 4.45Å; Q579-Y584 HydrophobicContact CB-CE1 4.36Å; Q579-Y584 HydrophobicContact CG-CE1 4.1Å; Q579-Y584 HydrophobicContact CG-CE2 4.43Å; H581-Y584 WeakPolarHBondContact O-CB 3.45Å; H581-Y584 PolarHBondContact O-N 2.78Å; Y584-E586 HydrophobicContact CE1-CB 4.35Å
585	K	80.9	Confident	79.4	Confident	185 Å²	185	92.9 Å²	92.9	80%	0.804	47%	0.469	S	S	*	.			trans	-131.2	125.5	173.8	-70.7	-178.7	-178.9	172.5	0	109.7	D583 A587	D583-K585 PolarHBondContact O-N 3.14Å; K585-A587 PolarHBondContact O-N 3.03Å
586	E	80.6	Confident	79.4	Confident	152 Å²	152	89.4 Å²	89.4	71%	0.71	46%	0.455	S	S	*	.			trans	-71.7	118.2	179.1	-156.4	175.1	-174.2	0	0	110	Y584 L591	Y584-E586 HydrophobicContact CE1-CB 4.35Å; E586-L591 HydrophobicContact CG-CD1 3.51Å
587	A	80.1	Confident	79.4	Confident	49 Å²	49	84.3 Å²	84.3	41%	0.405	43%	0.427	S	S	.	.			trans	-112	104.9	175.1	0	0	0	0	0	108.6	K585 D589 F590 L591	K585-A587 PolarHBondContact O-N 3.03Å; A587-D589 PolarHBondContact O-N 3.25Å; A587-F590 HydrophobicContact CB-CB 3.85Å; A587-F590 WeakPolarHBondContact O-CB 3.48Å; A587-F590 PolarHBondContact O-N 3.48Å; A587-F590 VanDerWaalsContact O-N 3.16Å; A587-L591 PolarHBondContact O-N 3.46Å
588	S	79.3	Confident	79.6	Confident	85 Å²	85	84.9 Å²	84.9	59%	0.594	43%	0.428	S	S	*	.	H	α-helix	trans	-54.4	-40.2	-176.6	53.7	0	0	0	0	112.9	L591 R592	S588-L591 PolarHBondContact O-N 2.79Å; S588-R592 WeakPolarHBondContact O-CB 3.3Å; S588-R592 PolarHBondContact O-N 3.3Å
589	D	73	Confident	79.4	Confident	43 Å²	43	86.1 Å²	86.1	23%	0.23	44%	0.436	C	S	.	.	H	α-helix	trans	-71.3	-38.3	-176.7	-64	-4.5	0	0	0	110.9	F551 A587 R592 Y593	F551-D589 HydrophobicContact CE2-CB 4.16Å; F551-D589 WeakPolarHBondContact CZ-O 3.37Å; A587-D589 PolarHBondContact O-N 3.25Å; D589-R592 PolarHBondContact O-N 3.01Å; D589-Y593 WeakPolarHBondContact O-CB 3.45Å; D589-Y593 PolarHBondContact O-N 3.06Å
590	F	76	Confident	78.9	Confident	60 Å²	60	84.6 Å²	84.6	26%	0.263	43%	0.425	S	S	.	.	H	α-helix	trans	-65.8	-44.6	173.3	178.8	-112.8	0	0	0	111.8	W550 I577 A587 R592 Y593 M594	W550-F590 HydrophobicContact CE3-CD2 4.34Å; W550-F590 AromaticContact CH2-CD2 3.24Å; W550-F590 HydrophobicContact CH2-CD2 3.24Å; W550-F590 AromaticContact CH2-CE2 3.61Å; W550-F590 HydrophobicContact CH2-CE2 3.61Å; W550-F590 HydrophobicContact CH2-CG 4.38Å; W550-F590 HydrophobicContact CZ2-CB 4.37Å; W550-F590 AromaticContact CZ2-CD2 3.63Å; W550-F590 HydrophobicContact CZ2-CD2 3.63Å; W550-F590 HydrophobicContact CZ2-CE2 4.39Å; W550-F590 HydrophobicContact CZ2-CG 4.41Å; W550-F590 AromaticContact CZ3-CD2 3.63Å; W550-F590 HydrophobicContact CZ3-CD2 3.63Å; W550-F590 AromaticContact CZ3-CE2 3.93Å; W550-F590 HydrophobicContact CZ3-CE2 3.93Å; I577-F590 HydrophobicContact CD1-CE1 4.34Å; A587-F590 HydrophobicContact CB-CB 3.85Å; A587-F590 WeakPolarHBondContact O-CB 3.48Å; A587-F590 PolarHBondContact O-N 3.48Å; A587-F590 VanDerWaalsContact O-N 3.16Å; F590-R592 VanDerWaalsContact C-N 3.28Å; F590-R592 PolarHBondContact O-N 3.31Å; F590-Y593 WeakPolarHBondContact O-CB 3.32Å; F590-Y593 PolarHBondContact O-N 2.9Å; F590-M594 HydrophobicContact CD1-CG 4.13Å; F590-M594 HydrophobicContact CD2-CG 4.15Å; F590-M594 HydrophobicContact CE1-CE 4.47Å; F590-M594 HydrophobicContact CE1-CG 3.78Å; F590-M594 HydrophobicContact CE1-SD 4.26Å; F590-M594 HydrophobicContact CE2-CG 3.83Å; F590-M594 HydrophobicContact CE2-SD 3.93Å; F590-M594 HydrophobicContact CG-CG 4.31Å; F590-M594 HydrophobicContact CZ-CE 4.21Å; F590-M594 HydrophobicContact CZ-CG 3.63Å; F590-M594 HydrophobicContact CZ-SD 3.63Å; F590-M594 WeakPolarHBondContact O-CB 3.49Å; F590-M594 WeakPolarHBondContact O-CG 3.46Å; F590-M594 PolarHBondContact O-N 3.06Å
591	L	78.6	Confident	78.2	Confident	62 Å²	62	83.3 Å²	83.3	33%	0.325	42%	0.415	S	S	.	.	H	α-helix	trans	-60.8	-38.5	176.2	-78.6	161.5	0	0	0	112.1	E586 A587 S588 M594 K595	E586-L591 HydrophobicContact CG-CD1 3.51Å; A587-L591 PolarHBondContact O-N 3.46Å; S588-L591 PolarHBondContact O-N 2.79Å; L591-M594 PolarHBondContact O-N 3.25Å; L591-K595 WeakPolarHBondContact O-CG 3.48Å; L591-K595 PolarHBondContact O-N 3.45Å
592	R	78.8	Confident	77.1	Confident	137 Å²	137	86.9 Å²	86.9	52%	0.517	44%	0.443	S	S	.	.	H	α-helix	trans	-67.5	-43.7	175.3	-176.7	-179.9	-177.1	-158.5	-1.3	111.6	F551 S588 D589 F590 M594 K595 I596	F551-R592 HydrophobicContact CE1-CG 4.07Å; F551-R592 HydrophobicContact CZ-CB 3.92Å; F551-R592 HydrophobicContact CZ-CG 3.83Å; S588-R592 WeakPolarHBondContact O-CB 3.3Å; S588-R592 PolarHBondContact O-N 3.3Å; D589-R592 PolarHBondContact O-N 3.01Å; F590-R592 VanDerWaalsContact C-N 3.28Å; F590-R592 PolarHBondContact O-N 3.31Å; R592-M594 VanDerWaalsContact C-N 3.35Å; R592-M594 PolarHBondContact O-N 3.3Å; R592-K595 PolarHBondContact O-N 3.04Å; R592-I596 HydrophobicContact CG-CD1 4.28Å; R592-I596 WeakPolarHBondContact O-CG1 3.36Å; R592-I596 PolarHBondContact O-N 3.33Å; R592-I596 VanDerWaalsContact O-N 3.17Å
593	Y	78.1	Confident	76.8	Confident	14 Å²	14	86.1 Å²	86.1	6%	0.055	43%	0.432	C	S	.	.	H	α-helix	trans	-57.1	-47.5	172.4	172.4	-95.1	0	0	0	111.7	W550 L560 C561 D589 F590 K595 I596 R597	W550-Y593 HydrophobicContact CB-CD2 4.25Å; W550-Y593 HydrophobicContact CD2-CG 4.27Å; W550-Y593 AromaticContact CE3-CD1 3.51Å; W550-Y593 HydrophobicContact CE3-CD1 3.51Å; W550-Y593 AromaticContact CE3-CD2 3.65Å; W550-Y593 HydrophobicContact CE3-CD2 3.65Å; W550-Y593 AromaticContact CE3-CE1 3.89Å; W550-Y593 HydrophobicContact CE3-CE1 3.89Å; W550-Y593 HydrophobicContact CE3-CE2 4.01Å; W550-Y593 AromaticContact CE3-CG 3.39Å; W550-Y593 HydrophobicContact CE3-CG 3.39Å; W550-Y593 AromaticContact CZ3-CD1 3.57Å; W550-Y593 HydrophobicContact CZ3-CD1 3.57Å; W550-Y593 HydrophobicContact CZ3-CD2 4.45Å; W550-Y593 AromaticContact CZ3-CE1 3.72Å; W550-Y593 HydrophobicContact CZ3-CE1 3.72Å; W550-Y593 AromaticContact CZ3-CG 3.98Å; W550-Y593 HydrophobicContact CZ3-CG 3.98Å; W550-Y593 WeakPolarHBondContact O-CD2 3.48Å; L560-Y593 HydrophobicContact CD1-CD2 3.64Å; L560-Y593 HydrophobicContact CD1-CE2 3.9Å; L560-Y593 HydrophobicContact CD2-CD2 4.27Å; L560-Y593 HydrophobicContact CD2-CE2 3.9Å; L560-Y593 HydrophobicContact CG-CD2 3.98Å; L560-Y593 HydrophobicContact CG-CE2 3.69Å; C561-Y593 PolarHBondContact O-OH 3.35Å; C561-Y593 VanDerWaalsContact O-OH 3.12Å; D589-Y593 WeakPolarHBondContact O-CB 3.45Å; D589-Y593 PolarHBondContact O-N 3.06Å; F590-Y593 WeakPolarHBondContact O-CB 3.32Å; F590-Y593 PolarHBondContact O-N 2.9Å; Y593-K595 PolarHBondContact O-N 3.42Å; Y593-I596 PolarHBondContact O-N 3.47Å; Y593-R597 WeakPolarHBondContact O-CB 3.42Å; Y593-R597 PolarHBondContact O-N 2.91Å; Y593-R597 PolarHBondContact OH-NH1 2.92Å
594	M	77	Confident	76.5	Confident	27 Å²	27	83.7 Å²	83.7	13%	0.133	42%	0.418	C	S	.	.	H	α-helix	trans	-61.2	-42.9	179.6	-72.1	-74.1	-75.4	0	0	112.5	F569 L570 F590 L591 R592 R597 Q598	F569-M594 HydrophobicContact CD1-CE 3.65Å; F569-M594 HydrophobicContact CE1-CE 3.36Å; L570-M594 HydrophobicContact CD2-CE 3.21Å; L570-M594 HydrophobicContact CD2-SD 3.72Å; L570-M594 HydrophobicContact CG-CE 4.21Å; L570-M594 HydrophobicContact CG-SD 4.38Å; F590-M594 HydrophobicContact CD1-CG 4.13Å; F590-M594 HydrophobicContact CD2-CG 4.15Å; F590-M594 HydrophobicContact CE1-CE 4.47Å; F590-M594 HydrophobicContact CE1-CG 3.78Å; F590-M594 HydrophobicContact CE1-SD 4.26Å; F590-M594 HydrophobicContact CE2-CG 3.83Å; F590-M594 HydrophobicContact CE2-SD 3.93Å; F590-M594 HydrophobicContact CG-CG 4.31Å; F590-M594 HydrophobicContact CZ-CE 4.21Å; F590-M594 HydrophobicContact CZ-CG 3.63Å; F590-M594 HydrophobicContact CZ-SD 3.63Å; F590-M594 WeakPolarHBondContact O-CB 3.49Å; F590-M594 WeakPolarHBondContact O-CG 3.46Å; F590-M594 PolarHBondContact O-N 3.06Å; L591-M594 PolarHBondContact O-N 3.25Å; R592-M594 VanDerWaalsContact C-N 3.35Å; R592-M594 PolarHBondContact O-N 3.3Å; M594-R597 PolarHBondContact O-N 2.92Å; M594-Q598 WeakPolarHBondContact O-CB 3.18Å; M594-Q598 WeakPolarHBondContact O-CG 3.46Å; M594-Q598 PolarHBondContact O-N 3.41Å
595	K	78.7	Confident	76.2	Confident	153 Å²	153	84.4 Å²	84.4	67%	0.665	43%	0.426	S	S	*	.	H	α-helix	trans	-62.1	-43.6	175.8	-80.3	-178.7	178.9	178.8	0	112.6	L591 R592 Y593 S599	L591-K595 WeakPolarHBondContact O-CG 3.48Å; L591-K595 PolarHBondContact O-N 3.45Å; R592-K595 PolarHBondContact O-N 3.04Å; Y593-K595 PolarHBondContact O-N 3.42Å; K595-S599 PolarHBondContact O-N 3.36Å; K595-S599 VanDerWaalsContact O-N 3.12Å
596	I	78	Confident	75.9	Confident	32 Å²	32	78.5 Å²	78.5	16%	0.164	40%	0.404	C	S	.	.	H	α-helix	trans	-65.5	-43.4	178.1	-64.6	167.6	0	0	0	109.9	F551 P557 L560 R592 Y593 S599 R600	F551-I596 HydrophobicContact CE1-CD1 4Å; P557-I596 HydrophobicContact CB-CD1 4.41Å; L560-I596 HydrophobicContact CD1-CB 4.45Å; L560-I596 HydrophobicContact CD1-CG2 4.06Å; L560-I596 HydrophobicContact CD2-CG2 4.16Å; R592-I596 HydrophobicContact CG-CD1 4.28Å; R592-I596 WeakPolarHBondContact O-CG1 3.36Å; R592-I596 PolarHBondContact O-N 3.33Å; R592-I596 VanDerWaalsContact O-N 3.17Å; Y593-I596 PolarHBondContact O-N 3.47Å; I596-S599 PolarHBondContact O-N 3Å; I596-S599 PolarHBondContact O-OG 3.39Å; I596-R600 PolarHBondContact O-N 3.22Å
597	R	78	Confident	75.6	Confident	14 Å²	14	73.9 Å²	73.9	5%	0.053	38%	0.384	C	S	.	.	H	α-helix	trans	-67.1	-40.1	179.4	-165.8	167.9	170.9	170.1	-1	112.9	L560 D563 D567 L570 Y593 M594 S599 R600 I601	L560-R597 HydrophobicContact CD2-CB 4.12Å; L560-R597 HydrophobicContact CD2-CG 4.48Å; D563-R597 PolarHBondContact O-NH1 3Å; D563-R597 PolarHBondContact O-NH2 3.21Å; D567-R597 IonicContact OD1-CZ 2.76Å; D567-R597 VanDerWaalsContact OD1-CZ 3.28Å; D567-R597 IonicContact OD1-NE 3.27Å; D567-R597 PolarHBondContact OD1-NE 3.48Å; D567-R597 VanDerWaalsContact OD1-NE 3.1Å; D567-R597 IonicContact OD1-NH2 2.91Å; D567-R597 PolarHBondContact OD1-NH2 2.93Å; L570-R597 HydrophobicContact CD1-CB 4.08Å; L570-R597 HydrophobicContact CD1-CG 3.64Å; Y593-R597 WeakPolarHBondContact O-CB 3.42Å; Y593-R597 PolarHBondContact O-N 2.91Å; Y593-R597 PolarHBondContact OH-NH1 2.92Å; M594-R597 PolarHBondContact O-N 2.92Å; R597-S599 VanDerWaalsContact C-N 3.29Å; R597-S599 PolarHBondContact O-N 3.02Å; R597-R600 PolarHBondContact O-N 3.32Å; R597-R600 VanDerWaalsContact O-N 3.12Å; R597-I601 HydrophobicContact CG-CD1 3.88Å; R597-I601 WeakPolarHBondContact O-CG1 3.23Å; R597-I601 PolarHBondContact O-N 3.34Å; R597-I601 VanDerWaalsContact O-N 3.13Å
598	Q	77.4	Confident	75.4	Confident	97 Å²	97	75.6 Å²	75.6	45%	0.453	38%	0.383	S	S	.	.	H	α-helix	trans	-58.2	-41.2	171	-79.3	-179.5	-21.6	0	0	111.8	L570 M594 R600 I601 V602	L570-Q598 HydrophobicContact CD2-CG 3.66Å; M594-Q598 WeakPolarHBondContact O-CB 3.18Å; M594-Q598 WeakPolarHBondContact O-CG 3.46Å; M594-Q598 PolarHBondContact O-N 3.41Å; Q598-R600 PolarHBondContact O-N 3.42Å; Q598-I601 PolarHBondContact O-N 3.25Å; Q598-V602 WeakPolarHBondContact O-CG2 3.32Å; Q598-V602 PolarHBondContact O-N 3.41Å
599	S	78	Confident	75.1	Confident	83 Å²	83	74.9 Å²	74.9	58%	0.58	37%	0.368	S	S	*	.	H	α-helix	trans	-68.4	-17.5	177.6	71.7	0	0	0	0	114.8	K595 I596 R597	K595-S599 PolarHBondContact O-N 3.36Å; K595-S599 VanDerWaalsContact O-N 3.12Å; I596-S599 PolarHBondContact O-N 3Å; I596-S599 PolarHBondContact O-OG 3.39Å; R597-S599 VanDerWaalsContact C-N 3.29Å; R597-S599 PolarHBondContact O-N 3.02Å
600	R	73.4	Confident	75.2	Confident	96 Å²	96	77.4 Å²	77.4	36%	0.362	38%	0.379	S	S	.	.	H	α-helix	trans	-92.5	-21.8	174.8	-71.6	-176.1	178.2	-164.6	-3.8	113.5	P557 D558 D562 I596 R597 Q598	P557-R600 PolarHBondContact O-NH2 3.09Å; D558-R600 VanDerWaalsContact CA-NH2 3.34Å; D558-R600 PolarHBondContact O-NH2 3.25Å; D562-R600 IonicContact OD1-NH1 2.8Å; D562-R600 PolarHBondContact OD1-NH1 3.23Å; D562-R600 IonicContact OD2-NH1 3.3Å; I596-R600 PolarHBondContact O-N 3.22Å; R597-R600 PolarHBondContact O-N 3.32Å; R597-R600 VanDerWaalsContact O-N 3.12Å; Q598-R600 PolarHBondContact O-N 3.42Å
601	I	68.9	Low	75.2	Confident	53 Å²	53	78.8 Å²	78.8	27%	0.272	39%	0.388	S	S	.	.	H	α-helix	trans	-89.6	-24.2	-177.6	-68.3	167.5	0	0	0	112.2	D567 L570 R571 R597 Q598	D567-I601 VanDerWaalsContact OD1-CD1 3.27Å; D567-I601 WeakPolarHBondContact OD1-CD1 3.25Å; L570-I601 HydrophobicContact CB-CD1 4.26Å; L570-I601 HydrophobicContact CD1-CD1 3.49Å; L570-I601 VanDerWaalsContact CD1-CD1 3.49Å; R571-I601 HydrophobicContact CG-CG2 4.34Å; R597-I601 HydrophobicContact CG-CD1 3.88Å; R597-I601 WeakPolarHBondContact O-CG1 3.23Å; R597-I601 PolarHBondContact O-N 3.34Å; R597-I601 VanDerWaalsContact O-N 3.13Å; Q598-I601 PolarHBondContact O-N 3.25Å
602	V	57.4	Low	74.9	Confident	178 Å²	178	80.4 Å²	80.4	100%	1.079	39%	0.394	S	S	*	.			trans	-81	0	169.3	-179.9	0	0	0	0	109.4	Q598	Q598-V602 WeakPolarHBondContact O-CG2 3.32Å; Q598-V602 PolarHBondContact O-N 3.41Å

Retrieved 602 of 602 residues in 88.3 ms (Link to these results)

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