A0A096NGR0_PAPAN Loading...

DnaJ homolog subfamily C member 2

Acts both as a chaperone in the cytosol and as a chromatin regulator in the nucleus. When cytosolic, acts as a molecular chaperone: component of the ribosome-associated complex (RAC), a complex involved in folding or maintaining nascent polypeptides in a folding-competent state. In the RAC complex, stimulates the ATPase activity of the ribosome-associated pool of Hsp70-type chaperones HSPA14 that bind to the nascent polypeptide chain. When nuclear, mediates the switching from polycomb-repressed genes to an active state: specifically recruited at histone H2A ubiquitinated at 'Lys-119' (H2AK119ub), and promotes the displacement of the polycomb PRC1 complex from chromatin, thereby facilitating transcription activation.

AlphaFold DB , UniProt , Accession A0A096NGR0, Species PAPAN (Papio anubis, Olive baboon), Gene DNAJC2, Length 621 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	39.1	Very low	43.6	Very low	233 Å²	233	152.2 Å²	152.2	100%	1.148	87%	0.866	S	S	*	*				0	110.8	0	-92.9	178.7	-178.7	0	0	107.9
2	L	30.6	Very low	44.1	Very low	179 Å²	179	146.6 Å²	146.6	94%	0.937	87%	0.867	S	S	*	*			trans	-119.7	110.1	163.4	-80.9	164.2	0	0	0	105.2
3	L	38.3	Very low	44	Very low	166 Å²	166	146.2 Å²	146.2	87%	0.869	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-83.9	117.3	177.3	-89.2	149.2	0	0	0	108.1
4	L	36	Very low	44.2	Very low	163 Å²	163	142.2 Å²	142.2	85%	0.853	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-80.5	143.6	165.8	-74.6	168.2	0	0	0	109.4
5	P	47.2	Very low	44.1	Very low	118 Å²	118	143.1 Å²	143.1	77%	0.766	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-74.3	149.3	-177.7	30.6	-33.1	0	0	0	111.6
6	S	47.4	Very low	43.7	Very low	113 Å²	113	142.3 Å²	142.3	79%	0.79	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-67.1	139.8	174.7	-172.3	0	0	0	0	110.8
7	P	44	Very low	43.2	Very low	116 Å²	116	144.3 Å²	144.3	75%	0.753	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-70.1	142.6	173.2	28.9	-30.9	0	0	0	110.3
8	A	50.6	Low	43.1	Very low	96 Å²	96	141.7 Å²	141.7	79%	0.793	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-76.7	144.1	170.8	0	0	0	0	0	110.4	G10	A8-G10 PolarHBondContact O-N 3.39Å
9	D	47	Very low	43.1	Very low	174 Å²	174	142.8 Å²	142.8	93%	0.93	85%	0.847	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	126.1	-176.5	-69.3	-45.6	0	0	0	112.6
10	G	55.1	Low	43.4	Very low	76 Å²	76	142.5 Å²	142.5	78%	0.784	85%	0.846	S	S	*	*	T	Hydrogen-bonded Turn	trans	112.4	16.1	154.7	0	0	0	0	0	119.7	A8	A8-G10 PolarHBondContact O-N 3.39Å
11	R	44	Very low	43.8	Very low	240 Å²	240	140.7 Å²	140.7	91%	0.906	84%	0.841	S	S	*	*			trans	-131.5	108.4	167.1	-68.1	-169.9	-171.7	-174.1	3.7	112.6
12	G	49.6	Very low	44.4	Very low	85 Å²	85	134.2 Å²	134.2	88%	0.876	82%	0.824	S	S	*	*			trans	-75.2	125.4	169.2	0	0	0	0	0	111.1
13	T	43.8	Very low	45.5	Very low	141 Å²	141	131.5 Å²	131.5	87%	0.865	82%	0.821	S	S	*	*			trans	-107.3	104.5	161.1	8.5	0	0	0	0	107.8
14	A	45.8	Very low	46.5	Very low	91 Å²	91	129.1 Å²	129.1	75%	0.752	81%	0.813	S	S	*	*			trans	-77.3	124.4	172.5	0	0	0	0	0	109.9
15	I	42.5	Very low	47.5	Very low	156 Å²	156	129.9 Å²	129.9	80%	0.8	82%	0.817	S	S	*	*			trans	-128.7	101.4	152	-60.8	175.9	0	0	0	105.7
16	T	37.9	Very low	47.6	Very low	129 Å²	129	129 Å²	129	79%	0.791	81%	0.813	S	S	*	*			trans	-99	106.4	172.7	52	0	0	0	0	109.1
17	H	34.8	Very low	48.2	Very low	177 Å²	177	134.4 Å²	134.4	82%	0.819	82%	0.816	S	S	*	*			trans	-97.8	118.8	147.7	-91.6	-80.2	0	0	0	107.1	L19	H17-L19 PolarHBondContact O-N 2.96Å
18	A	42.1	Very low	49.4	Very low	97 Å²	97	135.1 Å²	135.1	80%	0.802	82%	0.817	S	S	*	*			trans	-68.9	98.6	179.9	0	0	0	0	0	110.2	T20	A18-T20 PolarHBondContact O-N 2.76Å
19	L	42.2	Very low	50.6	Low	163 Å²	163	137 Å²	137	85%	0.853	81%	0.81	S	S	*	*			trans	-82.8	100.7	155.4	-77.4	164.6	0	0	0	106.9	H17 S21	H17-L19 PolarHBondContact O-N 2.96Å; L19-S21 VanDerWaalsContact C-N 3.34Å; L19-S21 PolarHBondContact O-N 2.56Å
20	T	50.6	Low	51.9	Low	136 Å²	136	132.5 Å²	132.5	83%	0.834	79%	0.79	S	S	*	*	S	Bend	trans	-63.2	92.5	168.5	30.1	0	0	0	0	110	A18	A18-T20 PolarHBondContact O-N 2.76Å
21	S	51.2	Low	52.8	Low	105 Å²	105	134.5 Å²	134.5	73%	0.734	79%	0.787	S	S	*	*	S	Bend	trans	-176.3	124	146	-75.7	0	0	0	0	106.2	L19 S23	L19-S21 VanDerWaalsContact C-N 3.34Å; L19-S21 PolarHBondContact O-N 2.56Å; S21-S23 PolarHBondContact O-N 3.26Å
22	A	52.2	Low	53.8	Low	97 Å²	97	125 Å²	125	80%	0.802	76%	0.763	S	S	*	*			trans	-51.8	112.9	-171.1	0	0	0	0	0	112.7	T24	A22-T24 PolarHBondContact O-N 3.3Å
23	S	53.5	Low	54.2	Low	123 Å²	123	127.9 Å²	127.9	86%	0.86	75%	0.748	S	S	*	*			trans	-68.5	97.3	169	-55.9	0	0	0	0	108.9	S21 L25	S21-S23 PolarHBondContact O-N 3.26Å; S23-L25 PolarHBondContact O-N 3.35Å
24	T	59.2	Low	55.4	Low	115 Å²	115	126.7 Å²	126.7	71%	0.706	73%	0.728	S	S	*	*			trans	-72.3	120.1	170.3	45.8	0	0	0	0	109.5	A22 C26	A22-T24 PolarHBondContact O-N 3.3Å; T24-C26 PolarHBondContact O-N 3.08Å
25	L	56.3	Low	57	Low	180 Å²	180	126.4 Å²	126.4	94%	0.942	71%	0.71	S	S	*	*			trans	-73.1	93.6	172.8	-155.6	113.9	0	0	0	108.7	S23 R27	S23-L25 PolarHBondContact O-N 3.35Å; L25-R27 PolarHBondContact O-N 3.02Å
26	C	48.7	Very low	58.5	Low	99 Å²	99	123.8 Å²	123.8	67%	0.669	69%	0.694	S	S	*	*			trans	-76	121.2	175	-89.8	0	0	0	0	110.3	T24 V28	T24-C26 PolarHBondContact O-N 3.08Å; C26-V28 PolarHBondContact O-N 3.29Å; C26-V28 VanDerWaalsContact O-N 3.14Å
27	R	61	Low	60	Low	226 Å²	226	118.7 Å²	118.7	85%	0.853	67%	0.665	S	S	*	*			trans	-73.9	101.4	167.8	-166	178.4	-172.8	-175.2	0.6	108	L25	L25-R27 PolarHBondContact O-N 3.02Å
28	V	68.3	Low	61.8	Low	131 Å²	131	116 Å²	116	79%	0.794	65%	0.651	S	S	*	*			trans	-88.8	119.9	173.4	-102.3	0	0	0	0	109	C26	C26-V28 PolarHBondContact O-N 3.29Å; C26-V28 VanDerWaalsContact O-N 3.14Å
29	E	76.6	Confident	63.5	Low	135 Å²	135	113.6 Å²	113.6	63%	0.631	63%	0.626	S	S	*	*			trans	-85.1	131.9	169.4	-64.6	-169.8	157.7	0	0	109	V31	E29-V31 HydrophobicContact CB-CG1 4.09Å; E29-V31 PolarHBondContact O-N 3.25Å
30	P	73.4	Confident	64.8	Low	80 Å²	80	111.8 Å²	111.8	52%	0.519	61%	0.611	S	S	.	*			trans	-69.4	108.9	172.1	30	-33.1	0	0	0	107.9	F35	P30-F35 HydrophobicContact CB-CB 4.44Å; P30-F35 HydrophobicContact CB-CD1 4.11Å; P30-F35 HydrophobicContact CB-CD2 3.53Å; P30-F35 HydrophobicContact CB-CE1 4.22Å; P30-F35 HydrophobicContact CB-CE2 3.65Å; P30-F35 HydrophobicContact CB-CG 3.76Å; P30-F35 HydrophobicContact CB-CZ 4Å; P30-F35 HydrophobicContact CG-CD1 4.21Å; P30-F35 HydrophobicContact CG-CD2 3.9Å; P30-F35 HydrophobicContact CG-CE1 3.8Å; P30-F35 HydrophobicContact CG-CE2 3.46Å; P30-F35 VanDerWaalsContact CG-CE2 3.46Å; P30-F35 HydrophobicContact CG-CG 4.24Å; P30-F35 HydrophobicContact CG-CZ 3.41Å; P30-F35 VanDerWaalsContact CG-CZ 3.41Å; P30-F35 WeakPolarHBondContact O-CD1 3.35Å; P30-F35 VanDerWaalsContact O-CE1 3.3Å; P30-F35 WeakPolarHBondContact O-CE1 3.33Å
31	V	74.6	Confident	65.9	Low	118 Å²	118	111.4 Å²	111.4	72%	0.715	60%	0.595	S	S	*	*			trans	-120.6	156.7	-178	-66.2	0	0	0	0	110.5	E29	E29-V31 HydrophobicContact CB-CG1 4.09Å; E29-V31 PolarHBondContact O-N 3.25Å
32	G	65.2	Low	66.9	Low	40 Å²	40	115.4 Å²	115.4	41%	0.412	59%	0.594	S	S	.	*	S	Bend	trans	102	163.9	174.5	0	0	0	0	0	114.5	W34 F35 E36	G32-W34 PolarHBondContact O-N 3.49Å; G32-F35 WeakPolarHBondContact O-CB 3.46Å; G32-F35 PolarHBondContact O-N 3.13Å; G32-E36 PolarHBondContact O-N 2.98Å
33	R	58.6	Low	67.8	Low	146 Å²	146	116.1 Å²	116.1	55%	0.551	58%	0.584	S	S	*	*	H	α-helix	trans	-56.2	-28.7	-167.1	66.1	-178.8	-178.5	-109.1	0.1	115.5	E36 A37	R33-E36 PolarHBondContact O-N 3.06Å; R33-A37 VanDerWaalsContact O-CB 3.24Å; R33-A37 WeakPolarHBondContact O-CB 3.43Å; R33-A37 PolarHBondContact O-N 3.45Å
34	W	68.2	Low	68.4	Low	116 Å²	116	120.1 Å²	120.1	44%	0.439	58%	0.58	S	S	.	*	H	α-helix	trans	-72.9	-37.6	177.7	-64.3	117.6	0	0	0	111.9	G32 A37 F38 F50 L53	G32-W34 PolarHBondContact O-N 3.49Å; W34-A37 PolarHBondContact O-N 3.28Å; W34-F38 WeakPolarHBondContact O-CB 3.49Å; W34-F38 PolarHBondContact O-N 3.18Å; W34-F50 AromaticContact CH2-CD2 3.61Å; W34-F50 HydrophobicContact CH2-CD2 3.61Å; W34-F50 AromaticContact CH2-CE2 3.29Å; W34-F50 HydrophobicContact CH2-CE2 3.29Å; W34-F50 HydrophobicContact CH2-CZ 4.03Å; W34-F50 AromaticContact CZ2-CE2 3.91Å; W34-F50 HydrophobicContact CZ2-CE2 3.91Å; W34-F50 HydrophobicContact CZ2-CZ 4.43Å; W34-F50 AromaticContact CZ3-CD2 3.69Å; W34-F50 HydrophobicContact CZ3-CD2 3.69Å; W34-F50 AromaticContact CZ3-CE2 3.75Å; W34-F50 HydrophobicContact CZ3-CE2 3.75Å; W34-L53 HydrophobicContact CE3-CD1 4.44Å; W34-L53 HydrophobicContact CH2-CB 4.44Å; W34-L53 HydrophobicContact CZ3-CB 4.37Å; W34-L53 HydrophobicContact CZ3-CD1 3.92Å
35	F	79.6	Confident	68.3	Low	85 Å²	85	122.4 Å²	122.4	37%	0.373	59%	0.588	S	S	.	*	H	α-helix	trans	-68.7	-41	171.4	-178.4	-108.8	0	0	0	110.7	P30 G32 A37 F38 V39	P30-F35 HydrophobicContact CB-CB 4.44Å; P30-F35 HydrophobicContact CB-CD1 4.11Å; P30-F35 HydrophobicContact CB-CD2 3.53Å; P30-F35 HydrophobicContact CB-CE1 4.22Å; P30-F35 HydrophobicContact CB-CE2 3.65Å; P30-F35 HydrophobicContact CB-CG 3.76Å; P30-F35 HydrophobicContact CB-CZ 4Å; P30-F35 HydrophobicContact CG-CD1 4.21Å; P30-F35 HydrophobicContact CG-CD2 3.9Å; P30-F35 HydrophobicContact CG-CE1 3.8Å; P30-F35 HydrophobicContact CG-CE2 3.46Å; P30-F35 VanDerWaalsContact CG-CE2 3.46Å; P30-F35 HydrophobicContact CG-CG 4.24Å; P30-F35 HydrophobicContact CG-CZ 3.41Å; P30-F35 VanDerWaalsContact CG-CZ 3.41Å; P30-F35 WeakPolarHBondContact O-CD1 3.35Å; P30-F35 VanDerWaalsContact O-CE1 3.3Å; P30-F35 WeakPolarHBondContact O-CE1 3.33Å; G32-F35 WeakPolarHBondContact O-CB 3.46Å; G32-F35 PolarHBondContact O-N 3.13Å; F35-A37 PolarHBondContact O-N 3.34Å; F35-F38 HydrophobicContact CD2-CD1 4.36Å; F35-F38 HydrophobicContact CE2-CD1 4.36Å; F35-F38 WeakPolarHBondContact O-CB 3.48Å; F35-F38 PolarHBondContact O-N 3.48Å; F35-V39 HydrophobicContact CD1-CG2 4.28Å; F35-V39 HydrophobicContact CE1-CG2 3.9Å; F35-V39 HydrophobicContact CE2-CG2 4.21Å; F35-V39 HydrophobicContact CZ-CG2 3.86Å; F35-V39 VanDerWaalsContact O-CG2 3.3Å; F35-V39 WeakPolarHBondContact O-CG2 3.43Å; F35-V39 PolarHBondContact O-N 3.41Å
36	E	74.1	Confident	68.4	Low	102 Å²	102	116.8 Å²	116.8	48%	0.477	57%	0.568	S	S	.	*	H	α-helix	trans	-62	-40.5	172.9	-67.4	-177.7	-167.1	0	0	112.9	G32 R33 V39 K40	G32-E36 PolarHBondContact O-N 2.98Å; R33-E36 PolarHBondContact O-N 3.06Å; E36-V39 PolarHBondContact O-N 2.79Å; E36-K40 WeakPolarHBondContact O-CB 3.39Å; E36-K40 VanDerWaalsContact O-CG 3.25Å; E36-K40 WeakPolarHBondContact O-CG 3.43Å; E36-K40 PolarHBondContact O-N 3.3Å; E36-K40 IonicContact OE2-NZ 3.94Å
37	A	68.6	Low	68.8	Low	21 Å²	21	116.7 Å²	116.7	17%	0.174	57%	0.568	C	S	.	*	H	α-helix	trans	-65.7	-40.5	176.1	0	0	0	0	0	111.2	R33 W34 F35 K40 R41 L53	R33-A37 VanDerWaalsContact O-CB 3.24Å; R33-A37 WeakPolarHBondContact O-CB 3.43Å; R33-A37 PolarHBondContact O-N 3.45Å; W34-A37 PolarHBondContact O-N 3.28Å; F35-A37 PolarHBondContact O-N 3.34Å; A37-K40 PolarHBondContact O-N 3.46Å; A37-R41 VanDerWaalsContact O-CB 3.29Å; A37-R41 WeakPolarHBondContact O-CB 3.49Å; A37-R41 PolarHBondContact O-N 3.07Å; A37-L53 HydrophobicContact CB-CD1 3.9Å
38	F	73.9	Confident	68.5	Low	120 Å²	120	107.9 Å²	107.9	53%	0.526	54%	0.544	S	S	.	.	H	α-helix	trans	-59.9	-46.7	171.9	171.8	-97.6	0	0	0	111.6	W34 F35 R41 R42	W34-F38 WeakPolarHBondContact O-CB 3.49Å; W34-F38 PolarHBondContact O-N 3.18Å; F35-F38 HydrophobicContact CD2-CD1 4.36Å; F35-F38 HydrophobicContact CE2-CD1 4.36Å; F35-F38 WeakPolarHBondContact O-CB 3.48Å; F35-F38 PolarHBondContact O-N 3.48Å; F38-R41 PolarHBondContact O-N 3.24Å; F38-R42 WeakPolarHBondContact O-CB 3.39Å; F38-R42 PolarHBondContact O-N 3.11Å
39	V	76.8	Confident	68	Low	47 Å²	47	104.1 Å²	104.1	29%	0.285	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-43	176.7	172.5	0	0	0	0	111.3	F35 E36 R42 N43	F35-V39 HydrophobicContact CD1-CG2 4.28Å; F35-V39 HydrophobicContact CE1-CG2 3.9Å; F35-V39 HydrophobicContact CE2-CG2 4.21Å; F35-V39 HydrophobicContact CZ-CG2 3.86Å; F35-V39 VanDerWaalsContact O-CG2 3.3Å; F35-V39 WeakPolarHBondContact O-CG2 3.43Å; F35-V39 PolarHBondContact O-N 3.41Å; E36-V39 PolarHBondContact O-N 2.79Å; V39-R42 PolarHBondContact O-N 3.04Å; V39-N43 VanDerWaalsContact O-CB 3.3Å; V39-N43 WeakPolarHBondContact O-CB 3.39Å; V39-N43 VanDerWaalsContact O-CG 3.22Å; V39-N43 PolarHBondContact O-N 3.25Å
40	K	70.6	Confident	66.9	Low	125 Å²	125	103.1 Å²	103.1	54%	0.543	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-41.7	176.6	-75.8	172	-175.6	167.7	0	111.9	E36 A37 R42 N43 R44	E36-K40 WeakPolarHBondContact O-CB 3.39Å; E36-K40 VanDerWaalsContact O-CG 3.25Å; E36-K40 WeakPolarHBondContact O-CG 3.43Å; E36-K40 PolarHBondContact O-N 3.3Å; E36-K40 IonicContact OE2-NZ 3.94Å; A37-K40 PolarHBondContact O-N 3.46Å; K40-R42 VanDerWaalsContact C-N 3.33Å; K40-N43 PolarHBondContact O-N 3.39Å; K40-R44 WeakPolarHBondContact O-CB 3.41Å; K40-R44 PolarHBondContact O-N 3.42Å
41	R	72.2	Confident	66	Low	129 Å²	129	104.7 Å²	104.7	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-43.2	175	-170.8	-179.1	-78.3	-179.8	-4.2	110.6	A37 F38 N45 A48	A37-R41 VanDerWaalsContact O-CB 3.29Å; A37-R41 WeakPolarHBondContact O-CB 3.49Å; A37-R41 PolarHBondContact O-N 3.07Å; F38-R41 PolarHBondContact O-N 3.24Å; R41-N45 PolarHBondContact O-N 3.07Å; R41-A48 PolarHBondContact NH2-O 3.21Å
42	R	72.8	Confident	65.3	Low	189 Å²	189	104.2 Å²	104.2	71%	0.713	51%	0.507	S	S	*	.	H	α-helix	trans	-66.7	-35	177.3	-163.3	168.4	89.4	117.8	-1.9	113.2	F38 V39 K40	F38-R42 WeakPolarHBondContact O-CB 3.39Å; F38-R42 PolarHBondContact O-N 3.11Å; V39-R42 PolarHBondContact O-N 3.04Å; K40-R42 VanDerWaalsContact C-N 3.33Å
43	N	71.9	Confident	65	Low	112 Å²	112	105 Å²	105	60%	0.599	50%	0.502	S	S	*	.	H	α-helix	trans	-91.7	-20.9	-174.2	-70.6	-4.3	0	0	0	114.4	V39 K40	V39-N43 VanDerWaalsContact O-CB 3.3Å; V39-N43 WeakPolarHBondContact O-CB 3.39Å; V39-N43 VanDerWaalsContact O-CG 3.22Å; V39-N43 PolarHBondContact O-N 3.25Å; K40-N43 PolarHBondContact O-N 3.39Å
44	R	64.7	Low	65	Low	207 Å²	207	101.8 Å²	101.8	78%	0.781	49%	0.493	S	S	*	.	H	α-helix	trans	-124.4	1.6	-172.5	-74.9	-176.2	170.9	175	-2.8	116	K40 A46	K40-R44 WeakPolarHBondContact O-CB 3.41Å; K40-R44 PolarHBondContact O-N 3.42Å; R44-A46 PolarHBondContact O-N 3.01Å
45	N	57.7	Low	64.4	Low	163 Å²	163	99.4 Å²	99.4	87%	0.872	49%	0.489	S	S	*	.			trans	50.6	22.3	-176.3	-101	15.9	0	0	0	114.3	R41	R41-N45 PolarHBondContact O-N 3.07Å
46	A	58.8	Low	63.3	Low	62 Å²	62	102.7 Å²	102.7	51%	0.512	50%	0.503	S	S	.	.			trans	-101.3	122.9	176.6	0	0	0	0	0	108.9	R44 A48	R44-A46 PolarHBondContact O-N 3.01Å; A46-A48 PolarHBondContact O-N 2.86Å
47	S	56.3	Low	62.6	Low	96 Å²	96	102 Å²	102	67%	0.671	50%	0.498	S	S	*	.			trans	-92	87.7	177.6	-162.1	0	0	0	0	109.3	S49	S47-S49 PolarHBondContact O-N 3.08Å
48	A	55.3	Low	61.9	Low	42 Å²	42	107.4 Å²	107.4	35%	0.347	52%	0.52	S	S	.	.			trans	-67.2	124.3	160.2	0	0	0	0	0	107.5	R41 A46 E52	R41-A48 PolarHBondContact NH2-O 3.21Å; A46-A48 PolarHBondContact O-N 2.86Å; A48-E52 VanDerWaalsContact CA-OE2 3.28Å; A48-E52 WeakPolarHBondContact CA-OE2 3.48Å
49	S	58.1	Low	60.9	Low	51 Å²	51	107 Å²	107	36%	0.357	52%	0.523	S	S	.	.			trans	-71.7	156.8	178.5	93.3	0	0	0	0	109.9	S47 Q51 E52 L53	S47-S49 PolarHBondContact O-N 3.08Å; S49-Q51 PolarHBondContact O-N 3.47Å; S49-Q51 WeakPolarHBondContact OG-CB 3.47Å; S49-Q51 PolarHBondContact OG-N 2.97Å; S49-E52 PolarHBondContact N-OE2 3.44Å; S49-E52 VanDerWaalsContact N-OE2 3.1Å; S49-E52 PolarHBondContact O-N 3.47Å; S49-E52 PolarHBondContact OG-N 2.66Å; S49-L53 PolarHBondContact O-N 3.44Å
50	F	53	Low	59.7	Low	115 Å²	115	108 Å²	108	50%	0.504	53%	0.532	S	S	.	.	H	α-helix	trans	-56.4	-35	176.2	-176.2	-95.8	0	0	0	111.5	W34 L53 E54	W34-F50 AromaticContact CH2-CD2 3.61Å; W34-F50 HydrophobicContact CH2-CD2 3.61Å; W34-F50 AromaticContact CH2-CE2 3.29Å; W34-F50 HydrophobicContact CH2-CE2 3.29Å; W34-F50 HydrophobicContact CH2-CZ 4.03Å; W34-F50 AromaticContact CZ2-CE2 3.91Å; W34-F50 HydrophobicContact CZ2-CE2 3.91Å; W34-F50 HydrophobicContact CZ2-CZ 4.43Å; W34-F50 AromaticContact CZ3-CD2 3.69Å; W34-F50 HydrophobicContact CZ3-CD2 3.69Å; W34-F50 AromaticContact CZ3-CE2 3.75Å; W34-F50 HydrophobicContact CZ3-CE2 3.75Å; F50-L53 PolarHBondContact O-N 2.72Å; F50-E54 VanDerWaalsContact CE1-CD 3.44Å; F50-E54 HydrophobicContact CE1-CG 4.35Å; F50-E54 VanDerWaalsContact CE1-OE1 3.32Å; F50-E54 WeakPolarHBondContact CE1-OE1 3.39Å; F50-E54 WeakPolarHBondContact CE1-OE2 3.43Å; F50-E54 PolarHBondContact O-N 3.2Å
51	Q	54.3	Low	58.6	Low	112 Å²	112	106 Å²	106	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-63.7	-46	176.7	-154.1	73.8	31.2	0	0	111.9	S49 L53 E54 D55	S49-Q51 PolarHBondContact O-N 3.47Å; S49-Q51 WeakPolarHBondContact OG-CB 3.47Å; S49-Q51 PolarHBondContact OG-N 2.97Å; Q51-L53 PolarHBondContact O-N 3.14Å; Q51-E54 CarbonylContact O-C 3.6Å; Q51-E54 PolarHBondContact O-N 3.47Å; Q51-E54 VanDerWaalsContact O-N 3.08Å; Q51-D55 WeakPolarHBondContact O-CB 3.46Å; Q51-D55 PolarHBondContact O-N 2.95Å
52	E	60.2	Low	57.4	Low	109 Å²	109	106 Å²	106	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-64.2	-27.5	-178.6	-74.6	179.9	140.2	0	0	113.2	A48 S49 K56	A48-E52 VanDerWaalsContact CA-OE2 3.28Å; A48-E52 WeakPolarHBondContact CA-OE2 3.48Å; S49-E52 PolarHBondContact N-OE2 3.44Å; S49-E52 VanDerWaalsContact N-OE2 3.1Å; S49-E52 PolarHBondContact O-N 3.47Å; S49-E52 PolarHBondContact OG-N 2.66Å; E52-K56 WeakPolarHBondContact O-CB 3.39Å; E52-K56 PolarHBondContact O-N 3.41Å
53	L	58.9	Low	56	Low	56 Å²	56	101.8 Å²	101.8	29%	0.293	53%	0.53	S	S	.	.	H	α-helix	trans	-79.9	-31.1	175.8	-78.2	163.6	0	0	0	112.4	W34 A37 S49 F50 Q51 K57	W34-L53 HydrophobicContact CE3-CD1 4.44Å; W34-L53 HydrophobicContact CH2-CB 4.44Å; W34-L53 HydrophobicContact CZ3-CB 4.37Å; W34-L53 HydrophobicContact CZ3-CD1 3.92Å; A37-L53 HydrophobicContact CB-CD1 3.9Å; S49-L53 PolarHBondContact O-N 3.44Å; F50-L53 PolarHBondContact O-N 2.72Å; Q51-L53 PolarHBondContact O-N 3.14Å; L53-K57 WeakPolarHBondContact O-CB 3.36Å; L53-K57 PolarHBondContact O-N 3.37Å
54	E	57.9	Low	54.8	Low	79 Å²	79	103.1 Å²	103.1	37%	0.369	53%	0.532	S	S	.	.	H	α-helix	trans	-72.6	-42.4	169.8	-82.9	-178.4	160.1	0	0	111.3	F50 Q51 K56 K57 E58	F50-E54 VanDerWaalsContact CE1-CD 3.44Å; F50-E54 HydrophobicContact CE1-CG 4.35Å; F50-E54 VanDerWaalsContact CE1-OE1 3.32Å; F50-E54 WeakPolarHBondContact CE1-OE1 3.39Å; F50-E54 WeakPolarHBondContact CE1-OE2 3.43Å; F50-E54 PolarHBondContact O-N 3.2Å; Q51-E54 CarbonylContact O-C 3.6Å; Q51-E54 PolarHBondContact O-N 3.47Å; Q51-E54 VanDerWaalsContact O-N 3.08Å; E54-K56 VanDerWaalsContact C-N 3.35Å; E54-K56 PolarHBondContact O-N 3.18Å; E54-K57 WeakPolarHBondContact O-CA 3.05Å; E54-K57 VanDerWaalsContact O-CB 3.27Å; E54-K57 WeakPolarHBondContact O-CB 3.46Å; E54-K57 PolarHBondContact O-N 3.08Å; E54-E58 PolarHBondContact O-N 3.39Å
55	D	55.8	Low	54.1	Low	66 Å²	66	98.6 Å²	98.6	35%	0.353	52%	0.523	S	S	.	.	H	α-helix	trans	-64.7	-39.9	176.7	-61.1	-19.2	0	0	0	110.8	Q51 K57 E58 L59	Q51-D55 WeakPolarHBondContact O-CB 3.46Å; Q51-D55 PolarHBondContact O-N 2.95Å; D55-K57 VanDerWaalsContact C-N 3.27Å; D55-K57 PolarHBondContact O-N 3.31Å; D55-E58 PolarHBondContact O-N 3.1Å; D55-L59 WeakPolarHBondContact O-CB 3.42Å; D55-L59 WeakPolarHBondContact O-CD1 3.48Å; D55-L59 PolarHBondContact O-N 3.03Å
56	K	58.4	Low	53.8	Low	154 Å²	154	98.8 Å²	98.8	67%	0.67	52%	0.519	S	S	*	.	H	α-helix	trans	-64.2	-30.6	171.5	-112.1	173	178.3	158.4	0	113.3	E52 E54 S60	E52-K56 WeakPolarHBondContact O-CB 3.39Å; E52-K56 PolarHBondContact O-N 3.41Å; E54-K56 VanDerWaalsContact C-N 3.35Å; E54-K56 PolarHBondContact O-N 3.18Å; K56-S60 WeakPolarHBondContact O-CB 3.28Å; K56-S60 PolarHBondContact O-N 3.47Å
57	K	58.9	Low	53.8	Low	87 Å²	87	104.4 Å²	104.4	38%	0.378	54%	0.535	S	S	.	.	H	α-helix	trans	-70.3	-46.7	175.2	179.5	-166.6	169.4	-157	0	109.8	L53 E54 D55 S60 E61	L53-K57 WeakPolarHBondContact O-CB 3.36Å; L53-K57 PolarHBondContact O-N 3.37Å; E54-K57 WeakPolarHBondContact O-CA 3.05Å; E54-K57 VanDerWaalsContact O-CB 3.27Å; E54-K57 WeakPolarHBondContact O-CB 3.46Å; E54-K57 PolarHBondContact O-N 3.08Å; D55-K57 VanDerWaalsContact C-N 3.27Å; D55-K57 PolarHBondContact O-N 3.31Å; K57-S60 PolarHBondContact O-N 3.38Å; K57-E61 WeakPolarHBondContact CE-OE1 3.4Å; K57-E61 HydrophobicContact CG-CG 4.42Å; K57-E61 VanDerWaalsContact CG-OE1 3.32Å; K57-E61 WeakPolarHBondContact CG-OE1 3.28Å; K57-E61 IonicContact NZ-OE1 3.91Å; K57-E61 VanDerWaalsContact O-CB 3.26Å; K57-E61 WeakPolarHBondContact O-CB 3.02Å; K57-E61 VanDerWaalsContact O-CG 3.24Å; K57-E61 WeakPolarHBondContact O-CG 3.25Å; K57-E61 PolarHBondContact O-N 3.08Å
58	E	53.8	Low	54.2	Low	134 Å²	134	102.8 Å²	102.8	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-61.7	-44.7	176	-69.6	-163.8	155.5	0	0	111.5	E54 D55 E61 E62	E54-E58 PolarHBondContact O-N 3.39Å; D55-E58 PolarHBondContact O-N 3.1Å; E58-E61 PolarHBondContact O-N 3.35Å; E58-E62 WeakPolarHBondContact O-CB 3.42Å; E58-E62 WeakPolarHBondContact O-CG 3.36Å; E58-E62 PolarHBondContact O-N 3.05Å
59	L	52.4	Low	54.9	Low	113 Å²	113	108.4 Å²	108.4	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-66	-38.1	177	-87.6	150.4	0	0	0	114.1	D55 S63	D55-L59 WeakPolarHBondContact O-CB 3.42Å; D55-L59 WeakPolarHBondContact O-CD1 3.48Å; D55-L59 PolarHBondContact O-N 3.03Å; L59-S63 PolarHBondContact O-N 2.77Å
60	S	51.1	Low	55.8	Low	67 Å²	67	108.7 Å²	108.7	47%	0.469	54%	0.535	S	S	.	.	H	α-helix	trans	-72.7	-34.1	176.5	174	0	0	0	0	111.9	K56 K57 S63	K56-S60 WeakPolarHBondContact O-CB 3.28Å; K56-S60 PolarHBondContact O-N 3.47Å; K57-S60 PolarHBondContact O-N 3.38Å; S60-S63 PolarHBondContact O-OG 3.37Å
61	E	48.3	Very low	57	Low	82 Å²	82	108.3 Å²	108.3	38%	0.383	53%	0.534	S	S	.	.	H	α-helix	trans	-74.3	-35.3	176.1	-73.1	175.1	-173.6	0	0	109.6	K57 E58 S63 E64 R105	K57-E61 WeakPolarHBondContact CE-OE1 3.4Å; K57-E61 HydrophobicContact CG-CG 4.42Å; K57-E61 VanDerWaalsContact CG-OE1 3.32Å; K57-E61 WeakPolarHBondContact CG-OE1 3.28Å; K57-E61 IonicContact NZ-OE1 3.91Å; K57-E61 VanDerWaalsContact O-CB 3.26Å; K57-E61 WeakPolarHBondContact O-CB 3.02Å; K57-E61 VanDerWaalsContact O-CG 3.24Å; K57-E61 WeakPolarHBondContact O-CG 3.25Å; K57-E61 PolarHBondContact O-N 3.08Å; E58-E61 PolarHBondContact O-N 3.35Å; E61-S63 VanDerWaalsContact C-N 3.29Å; E61-S63 PolarHBondContact O-N 3.38Å; E61-E64 PolarHBondContact O-N 3.01Å; E61-R105 PolarHBondContact O-NH1 3.34Å; E61-R105 PolarHBondContact O-NH2 3.36Å
62	E	47.3	Very low	58	Low	131 Å²	131	109.8 Å²	109.8	61%	0.612	54%	0.541	S	S	*	.	H	α-helix	trans	-61.6	-26.7	172.5	-80.9	-173.6	164.3	0	0	114.5	E58	E58-E62 WeakPolarHBondContact O-CB 3.42Å; E58-E62 WeakPolarHBondContact O-CG 3.36Å; E58-E62 PolarHBondContact O-N 3.05Å
63	S	43.9	Very low	58.7	Low	100 Å²	100	107.6 Å²	107.6	70%	0.699	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-13.7	179.5	70.4	0	0	0	0	114.4	L59 S60 E61 D65	L59-S63 PolarHBondContact O-N 2.77Å; S60-S63 PolarHBondContact O-OG 3.37Å; E61-S63 VanDerWaalsContact C-N 3.29Å; E61-S63 PolarHBondContact O-N 3.38Å; S63-D65 VanDerWaalsContact C-N 3.26Å; S63-D65 PolarHBondContact O-N 3Å
64	E	45.2	Very low	59.5	Low	139 Å²	139	109.6 Å²	109.6	65%	0.65	56%	0.555	S	S	*	*			trans	-91.6	58.8	169.4	-68.8	-179.5	178	0	0	109.3	E61 E66 R105	E61-E64 PolarHBondContact O-N 3.01Å; E64-E66 VanDerWaalsContact C-N 3.32Å; E64-E66 PolarHBondContact O-N 3.04Å; E64-E66 VanDerWaalsContact O-N 3.14Å; E64-R105 PolarHBondContact O-NH2 2.99Å
65	D	50.2	Low	60.5	Low	112 Å²	112	111.2 Å²	111.2	60%	0.599	56%	0.564	S	S	*	*			trans	-79	87.3	167.5	-83.1	-14.3	0	0	0	107.6	S63 E67 R105	S63-D65 VanDerWaalsContact C-N 3.26Å; S63-D65 PolarHBondContact O-N 3Å; D65-E67 PolarHBondContact O-N 3.46Å; D65-R105 IonicContact OD1-CZ 3.26Å; D65-R105 IonicContact OD1-NH2 2.79Å; D65-R105 PolarHBondContact OD1-NH2 2.89Å
66	E	52.2	Low	61.9	Low	168 Å²	168	108.4 Å²	108.4	79%	0.785	55%	0.548	S	S	*	.			trans	-50.7	123.4	153.9	-73.9	-179.1	168.1	0	0	106.8	E64 L68	E64-E66 VanDerWaalsContact C-N 3.32Å; E64-E66 PolarHBondContact O-N 3.04Å; E64-E66 VanDerWaalsContact O-N 3.14Å; E66-L68 PolarHBondContact O-N 3.26Å
67	E	57.9	Low	63.2	Low	180 Å²	180	106.9 Å²	106.9	84%	0.841	54%	0.542	S	S	*	.			trans	-51.1	100.9	178.5	-173.1	174	-167.2	0	0	109.1	D65 Q69	D65-E67 PolarHBondContact O-N 3.46Å; E67-Q69 PolarHBondContact O-N 3.17Å
68	L	65.3	Low	64.5	Low	61 Å²	61	107.2 Å²	107.2	32%	0.319	55%	0.552	S	S	.	*			trans	-65.1	107.8	-178.6	-78	166.9	0	0	0	107.6	E66 L70 Q106 A109	E66-L68 PolarHBondContact O-N 3.26Å; L68-L70 HydrophobicContact CB-CG 4.48Å; L68-L70 PolarHBondContact O-N 3.13Å; L68-Q106 HydrophobicContact CD2-CB 4.37Å; L68-Q106 HydrophobicContact CD2-CG 3.81Å; L68-A109 HydrophobicContact CD1-CB 3.35Å
69	Q	70.4	Confident	66.2	Low	160 Å²	160	102.1 Å²	102.1	75%	0.748	53%	0.528	S	S	*	.			trans	-70	78.5	175.3	-68.8	-176.9	-16.7	0	0	109.4	E67 E71 H97	E67-Q69 PolarHBondContact O-N 3.17Å; Q69-E71 PolarHBondContact O-N 3.02Å; Q69-H97 PolarHBondContact O-CE1 3.45Å
70	L	77.5	Confident	67.9	Low	58 Å²	58	100.7 Å²	100.7	30%	0.304	52%	0.521	S	S	.	.			trans	-71.5	124.7	173.8	-61.8	178.1	0	0	0	109.2	L68 L95 A110 A113	L68-L70 HydrophobicContact CB-CG 4.48Å; L68-L70 PolarHBondContact O-N 3.13Å; L70-L95 HydrophobicContact CD2-CD2 4.09Å; L70-A110 HydrophobicContact CD2-CB 3.65Å; L70-A113 HydrophobicContact CD1-CB 3.43Å; L70-A113 VanDerWaalsContact CD1-CB 3.43Å
71	E	77.6	Confident	69.7	Low	106 Å²	106	98 Å²	98	50%	0.495	50%	0.502	S	S	.	.			trans	-81	132.4	173.2	-71.3	171	146.6	0	0	109.4	Q69 F73 G94 H97	Q69-E71 PolarHBondContact O-N 3.02Å; E71-F73 PolarHBondContact O-N 3.14Å; E71-G94 PolarHBondContact N-O 3.3Å; E71-G94 VanDerWaalsContact N-O 3.17Å; E71-G94 VanDerWaalsContact O-CA 3.27Å; E71-G94 WeakPolarHBondContact O-CA 3.5Å; E71-H97 IonicContact OE1-ND1 3.71Å; E71-H97 IonicContact OE2-CG 2.73Å; E71-H97 PolarHBondContact OE2-N 3.12Å; E71-H97 IonicContact OE2-ND1 3.91Å; E71-H97 PolarHBondContact OE2-ND1 3.33Å
72	E	74.4	Confident	71.7	Confident	144 Å²	144	101.8 Å²	101.8	67%	0.673	52%	0.517	S	S	*	.			trans	-70.6	114.2	174	-172.9	160.2	-131	0	0	109.6	A74 K117	E72-A74 PolarHBondContact O-N 2.95Å; E72-K117 IonicContact OE1-NZ 3.95Å; E72-K117 PolarHBondContact OE1-NZ 3.4Å
73	F	76.3	Confident	73.7	Confident	63 Å²	63	99.2 Å²	99.2	28%	0.276	51%	0.508	S	S	.	.			trans	-73.3	101.6	175.1	-175	-119.2	0	0	0	109.6	E71 M75 L76 L79 A91	E71-F73 PolarHBondContact O-N 3.14Å; F73-M75 HydrophobicContact CD1-CB 4.49Å; F73-M75 HydrophobicContact CE1-CB 3.83Å; F73-M75 HydrophobicContact CZ-CB 3.88Å; F73-M75 PolarHBondContact O-N 3.02Å; F73-L76 HydrophobicContact CB-CB 4.28Å; F73-L76 HydrophobicContact CD1-CB 3.82Å; F73-L76 HydrophobicContact CD1-CD1 4.22Å; F73-L76 WeakPolarHBondContact O-CB 3.31Å; F73-L76 PolarHBondContact O-N 3.17Å; F73-L79 HydrophobicContact CD1-CD1 4.34Å; F73-L79 HydrophobicContact CE1-CD1 3.91Å; F73-L79 HydrophobicContact CE1-CD2 4.04Å; F73-L79 HydrophobicContact CE1-CG 4.15Å; F73-A91 WeakPolarHBondContact CB-O 3.34Å; F73-A91 HydrophobicContact CD2-CB 3.69Å; F73-A91 HydrophobicContact CE2-CB 3.78Å; F73-A91 HydrophobicContact CG-CB 4.37Å
74	A	74.3	Confident	75.9	Confident	98 Å²	98	97.3 Å²	97.3	81%	0.81	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.3	-172.7	0	0	0	0	0	114.1	E72	E72-A74 PolarHBondContact O-N 2.95Å
75	M	79.7	Confident	78	Confident	113 Å²	113	93.8 Å²	93.8	56%	0.557	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	5.8	-177.7	-63.3	-76.1	-72.8	0	0	113.3	F73 K77 T78 L79	F73-M75 HydrophobicContact CD1-CB 4.49Å; F73-M75 HydrophobicContact CE1-CB 3.83Å; F73-M75 HydrophobicContact CZ-CB 3.88Å; F73-M75 PolarHBondContact O-N 3.02Å; M75-K77 VanDerWaalsContact C-N 3.3Å; M75-K77 PolarHBondContact O-N 3.49Å; M75-T78 WeakPolarHBondContact CA-OG1 3.4Å; M75-T78 PolarHBondContact O-N 3.47Å; M75-T78 PolarHBondContact O-OG1 3.22Å; M75-L79 WeakPolarHBondContact O-CG 3.36Å; M75-L79 PolarHBondContact O-N 2.9Å
76	L	84.9	Confident	79.8	Confident	6 Å²	6	94.7 Å²	94.7	3%	0.031	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-55.7	-43.8	-173.4	-175.5	66.7	0	0	0	112.7	F73 T78 L79 V92 M114 H118 Y137 I141	F73-L76 HydrophobicContact CB-CB 4.28Å; F73-L76 HydrophobicContact CD1-CB 3.82Å; F73-L76 HydrophobicContact CD1-CD1 4.22Å; F73-L76 WeakPolarHBondContact O-CB 3.31Å; F73-L76 PolarHBondContact O-N 3.17Å; L76-T78 PolarHBondContact O-N 3.34Å; L76-L79 HydrophobicContact CD1-CD1 4.03Å; L76-L79 PolarHBondContact O-N 3.1Å; L76-V92 HydrophobicContact CD1-CG1 4.05Å; L76-M114 HydrophobicContact CD1-CE 4.23Å; L76-M114 HydrophobicContact CD2-CE 3.38Å; L76-M114 HydrophobicContact CG-CE 4.46Å; L76-H118 WeakPolarHBondContact CD2-NE2 3.41Å; L76-Y137 HydrophobicContact CD1-CD2 4.48Å; L76-Y137 HydrophobicContact CD2-CE2 4.2Å; L76-Y137 HydrophobicContact CG-CD2 3.96Å; L76-Y137 HydrophobicContact CG-CE2 4.04Å; L76-Y137 WeakPolarHBondContact O-CB 3.48Å; L76-I141 HydrophobicContact CD1-CD1 4.41Å; L76-I141 HydrophobicContact CD1-CG1 4.09Å; L76-I141 HydrophobicContact CD2-CD1 4.27Å
77	K	85.4	Confident	81.7	Confident	122 Å²	122	87.4 Å²	87.4	53%	0.53	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-72.3	-17.4	-178.9	-62.2	-174.6	177.5	-171	0	113.3	M75 E128 Y137	M75-K77 VanDerWaalsContact C-N 3.3Å; M75-K77 PolarHBondContact O-N 3.49Å; K77-E128 IonicContact NZ-OE1 3.38Å; K77-Y137 HydrophobicContact CB-CD1 4.38Å; K77-Y137 HydrophobicContact CB-CE1 4.23Å; K77-Y137 HydrophobicContact CG-CE1 3.92Å
78	T	86.4	Confident	83.4	Confident	95 Å²	95	81.2 Å²	81.2	58%	0.583	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-95.4	-3.6	-179.3	60	0	0	0	0	113.1	M75 L76	M75-T78 WeakPolarHBondContact CA-OG1 3.4Å; M75-T78 PolarHBondContact O-N 3.47Å; M75-T78 PolarHBondContact O-OG1 3.22Å; L76-T78 PolarHBondContact O-N 3.34Å
79	L	88.7	Confident	84.8	Confident	26 Å²	26	78.3 Å²	78.3	14%	0.136	40%	0.396	C	S	.	.			trans	-66.9	140	179.8	-66.7	178.5	0	0	0	111.7	F73 M75 L76 Q87 V92 C140	F73-L79 HydrophobicContact CD1-CD1 4.34Å; F73-L79 HydrophobicContact CE1-CD1 3.91Å; F73-L79 HydrophobicContact CE1-CD2 4.04Å; F73-L79 HydrophobicContact CE1-CG 4.15Å; M75-L79 WeakPolarHBondContact O-CG 3.36Å; M75-L79 PolarHBondContact O-N 2.9Å; L76-L79 HydrophobicContact CD1-CD1 4.03Å; L76-L79 PolarHBondContact O-N 3.1Å; L79-Q87 HydrophobicContact CD2-CG 4.01Å; L79-V92 HydrophobicContact CD1-CG2 3.68Å; L79-C140 HydrophobicContact CB-CB 4.46Å; L79-C140 HydrophobicContact CD1-CB 4.06Å
80	D	88.1	Confident	86	Confident	83 Å²	83	70.7 Å²	70.7	44%	0.444	36%	0.36	S	S	.	.			trans	-94.2	118.1	170.3	-174.3	-7.5	0	0	0	109.7	K82 D83 Q87	D80-K82 PolarHBondContact O-N 3.39Å; D80-K82 VanDerWaalsContact O-N 3.13Å; D80-K82 WeakPolarHBondContact OD1-CB 3.39Å; D80-K82 PolarHBondContact OD1-N 2.8Å; D80-D83 HydrophobicContact CB-CB 4.42Å; D80-D83 PolarHBondContact O-N 2.81Å; D80-Q87 PolarHBondContact O-NE2 3.08Å
81	P	90.4	Very high	86.7	Confident	10 Å²	10	68.6 Å²	68.6	7%	0.065	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-53.6	-27.6	173.9	-30.8	39.8	0	0	0	115.1	D83 W84 D134 D136 T139 C140	P81-D83 VanDerWaalsContact C-N 3.27Å; P81-D83 PolarHBondContact O-N 2.96Å; P81-W84 WeakPolarHBondContact O-CB 3.26Å; P81-W84 VanDerWaalsContact O-CD1 3.23Å; P81-W84 PolarHBondContact O-N 3.21Å; P81-D134 VanDerWaalsContact CB-O 3.25Å; P81-D134 WeakPolarHBondContact CB-O 3.46Å; P81-D134 WeakPolarHBondContact CG-O 3.5Å; P81-D136 WeakPolarHBondContact CG-O 3.31Å; P81-T139 HydrophobicContact CB-CG2 4.08Å; P81-C140 VanDerWaalsContact CA-SG 3.58Å
82	K	89.1	Confident	87.5	Confident	162 Å²	162	63.5 Å²	63.5	70%	0.704	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-70.8	-26.4	178.2	-65.3	179.1	-178.9	177.1	0	112.5	D80	D80-K82 PolarHBondContact O-N 3.39Å; D80-K82 VanDerWaalsContact O-N 3.13Å; D80-K82 WeakPolarHBondContact OD1-CB 3.39Å; D80-K82 PolarHBondContact OD1-N 2.8Å
83	D	89.7	Confident	88.5	Confident	77 Å²	77	56.7 Å²	56.7	41%	0.412	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-99.4	22.2	179.3	-165.8	34.5	0	0	0	112.6	D80 P81 K85 N86 Q87	D80-D83 HydrophobicContact CB-CB 4.42Å; D80-D83 PolarHBondContact O-N 2.81Å; P81-D83 VanDerWaalsContact C-N 3.27Å; P81-D83 PolarHBondContact O-N 2.96Å; D83-K85 PolarHBondContact O-N 3.26Å; D83-K85 VanDerWaalsContact O-N 3.08Å; D83-N86 PolarHBondContact O-N 3.04Å; D83-N86 VanDerWaalsContact O-N 3.12Å; D83-N86 PolarHBondContact OD1-ND2 3.4Å; D83-Q87 WeakPolarHBondContact O-CG 3.48Å
84	W	89.6	Confident	89.2	Confident	61 Å²	61	53.7 Å²	53.7	23%	0.231	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-55.6	-31.8	-176.9	73.7	-89.1	0	0	0	113.3	P81 N86 Q87 H89 K143 M147	P81-W84 WeakPolarHBondContact O-CB 3.26Å; P81-W84 VanDerWaalsContact O-CD1 3.23Å; P81-W84 PolarHBondContact O-N 3.21Å; W84-N86 VanDerWaalsContact C-N 3.25Å; W84-N86 PolarHBondContact O-N 3.35Å; W84-Q87 WeakPolarHBondContact O-CB 3.34Å; W84-Q87 PolarHBondContact O-N 3.03Å; W84-H89 AromaticContact CE3-CE1 3.71Å; W84-H89 PolarHBondContact O-CE1 3.04Å; W84-H89 PolarHBondContact O-NE2 3.04Å; W84-K143 HydrophobicContact CB-CB 4.23Å; W84-K143 HydrophobicContact CB-CG 4.32Å; W84-K143 HydrophobicContact CD2-CB 4.06Å; W84-K143 HydrophobicContact CD2-CD 4.02Å; W84-K143 HydrophobicContact CD2-CG 4.08Å; W84-K143 HydrophobicContact CE3-CB 3.91Å; W84-K143 HydrophobicContact CE3-CD 4.35Å; W84-K143 HydrophobicContact CE3-CG 4.39Å; W84-K143 HydrophobicContact CG-CB 4.21Å; W84-K143 HydrophobicContact CG-CD 4.36Å; W84-K143 HydrophobicContact CG-CG 4.03Å; W84-M147 HydrophobicContact CE3-CG 4.44Å; W84-M147 HydrophobicContact CH2-CE 3.97Å; W84-M147 HydrophobicContact CH2-CG 4.44Å; W84-M147 HydrophobicContact CH2-SD 3.97Å; W84-M147 HydrophobicContact CZ3-CE 4.01Å; W84-M147 HydrophobicContact CZ3-CG 3.62Å; W84-M147 HydrophobicContact CZ3-SD 3.72Å
85	K	89.1	Confident	90.1	Very high	65 Å²	65	49.1 Å²	49.1	28%	0.283	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-65.5	-25.2	-178	-166.1	175.6	179.4	-179.5	0	113.2	D83 Y229 D231	D83-K85 PolarHBondContact O-N 3.26Å; D83-K85 VanDerWaalsContact O-N 3.08Å; K85-Y229 WeakPolarHBondContact CE-O 3.44Å; K85-Y229 HydrophobicContact CG-CE1 3.94Å; K85-Y229 PolarHBondContact NZ-O 2.95Å; K85-Y229 WeakPolarHBondContact O-CE1 3.49Å; K85-Y229 PolarHBondContact O-OH 3.46Å; K85-D231 PolarHBondContact NZ-O 3.11Å; K85-D231 VanDerWaalsContact NZ-O 3.1Å
86	N	90	Very high	90.6	Very high	130 Å²	130	44.8 Å²	44.8	70%	0.695	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-96.3	-0.3	178.9	-65	-43.2	0	0	0	113.2	D83 W84	D83-N86 PolarHBondContact O-N 3.04Å; D83-N86 VanDerWaalsContact O-N 3.12Å; D83-N86 PolarHBondContact OD1-ND2 3.4Å; W84-N86 VanDerWaalsContact C-N 3.25Å; W84-N86 PolarHBondContact O-N 3.35Å
87	Q	91.6	Very high	90.8	Very high	16 Å²	16	49 Å²	49	8%	0.075	25%	0.249	C	C	.	.	S	Bend	trans	-81.9	152.9	-179.4	-63.4	171.3	9.9	0	0	112	L79 D80 D83 W84 H89 V92 C140	L79-Q87 HydrophobicContact CD2-CG 4.01Å; D80-Q87 PolarHBondContact O-NE2 3.08Å; D83-Q87 WeakPolarHBondContact O-CG 3.48Å; W84-Q87 WeakPolarHBondContact O-CB 3.34Å; W84-Q87 PolarHBondContact O-N 3.03Å; Q87-H89 PolarHBondContact O-N 3.04Å; Q87-H89 VanDerWaalsContact O-N 3.16Å; Q87-V92 HydrophobicContact CB-CG2 4.38Å; Q87-C140 PolarHBondContact NE2-SG 3.4Å; Q87-C140 VanDerWaalsContact NE2-SG 3.43Å; Q87-C140 VanDerWaalsContact OE1-CB 3.28Å; Q87-C140 PolarHBondContact OE1-SG 3.36Å
88	D	92.8	Very high	91.1	Very high	49 Å²	49	44.6 Å²	44.6	26%	0.262	23%	0.231	S	C	.	.			trans	-79.6	96.1	171.8	-170.7	-36.2	0	0	0	110.7	Y90 A91 V92 R99	D88-Y90 PolarHBondContact O-N 3.25Å; D88-Y90 VanDerWaalsContact O-N 3.14Å; D88-Y90 PolarHBondContact OD1-N 3.19Å; D88-A91 HydrophobicContact CB-CB 3.83Å; D88-A91 PolarHBondContact O-N 2.97Å; D88-A91 VanDerWaalsContact O-N 3.07Å; D88-A91 PolarHBondContact OD1-N 3.19Å; D88-V92 VanDerWaalsContact O-CG2 3.31Å; D88-V92 WeakPolarHBondContact O-CG2 3.32Å; D88-V92 PolarHBondContact O-N 3.47Å; D88-R99 IonicContact OD1-CZ 2.68Å; D88-R99 IonicContact OD1-NH1 3.17Å; D88-R99 PolarHBondContact OD1-NH1 2.64Å; D88-R99 IonicContact OD2-CZ 3.79Å; D88-R99 IonicContact OD2-NH1 3.14Å; D88-R99 PolarHBondContact OD2-NH1 3.19Å; D88-R99 IonicContact OD2-NH2 3.62Å; D88-R99 PolarHBondContact OD2-NH2 2.98Å
89	H	94.9	Very high	91.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.7	-29	-178.3	-63.1	-51.7	0	0	0	114.2	W84 Q87 L93 A144 L148 F157 Y229	W84-H89 AromaticContact CE3-CE1 3.71Å; W84-H89 PolarHBondContact O-CE1 3.04Å; W84-H89 PolarHBondContact O-NE2 3.04Å; Q87-H89 PolarHBondContact O-N 3.04Å; Q87-H89 VanDerWaalsContact O-N 3.16Å; H89-L93 PolarHBondContact O-N 3.01Å; H89-A144 HydrophobicContact CB-CB 3.93Å; H89-A144 WeakPolarHBondContact ND1-CA 3.36Å; H89-L148 HydrophobicContact CB-CD1 3.95Å; H89-L148 HydrophobicContact CB-CD2 4.22Å; H89-L148 HydrophobicContact CB-CG 3.91Å; H89-L148 WeakPolarHBondContact O-CD1 3.3Å; H89-F157 HydrophobicContact CB-CE1 3.96Å; H89-F157 HydrophobicContact CB-CZ 4.1Å; H89-F157 AromaticContact CD2-CD2 3.69Å; H89-F157 AromaticContact CD2-CE2 3.46Å; H89-F157 VanDerWaalsContact CD2-CE2 3.46Å; H89-F157 WeakPolarHBondContact CD2-CE2 3.32Å; H89-F157 AromaticContact CD2-CZ 3.63Å; H89-Y229 PolarHBondContact NE2-OH 2.94Å; H89-Y229 VanDerWaalsContact NE2-OH 3.08Å
90	Y	95	Very high	91.5	Very high	1 Å²	1	44.3 Å²	44.3	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-74.7	-44.5	175.8	-70.4	-75.5	0	0	0	110.9	D88 V92 L93 G94 L95 R99 A102 L148 R154 F157 N158	D88-Y90 PolarHBondContact O-N 3.25Å; D88-Y90 VanDerWaalsContact O-N 3.14Å; D88-Y90 PolarHBondContact OD1-N 3.19Å; Y90-V92 VanDerWaalsContact C-N 3.31Å; Y90-V92 PolarHBondContact O-N 3.37Å; Y90-L93 PolarHBondContact O-N 3.3Å; Y90-G94 PolarHBondContact O-N 2.9Å; Y90-L95 HydrophobicContact CD1-CB 4.26Å; Y90-L95 CarbonylContact O-C 3.54Å; Y90-L95 WeakPolarHBondContact O-CA 3.47Å; Y90-L95 PolarHBondContact O-N 3.39Å; Y90-R99 WeakPolarHBondContact CD1-O 3.49Å; Y90-R99 VanDerWaalsContact CE1-C 3.46Å; Y90-R99 WeakPolarHBondContact CE1-O 3.42Å; Y90-A102 HydrophobicContact CE1-CB 4.2Å; Y90-L148 HydrophobicContact CD1-CD1 3.65Å; Y90-L148 HydrophobicContact CD1-CD2 4.12Å; Y90-L148 HydrophobicContact CD2-CD2 4.21Å; Y90-L148 HydrophobicContact CE1-CD1 3.88Å; Y90-L148 HydrophobicContact CE1-CD2 3.63Å; Y90-L148 HydrophobicContact CE1-CG 4.36Å; Y90-L148 HydrophobicContact CE2-CD2 3.75Å; Y90-L148 HydrophobicContact CG-CD1 4.05Å; Y90-L148 HydrophobicContact CG-CD2 4.39Å; Y90-L148 VanDerWaalsContact CZ-CD2 3.43Å; Y90-R154 PolarHBondContact OH-NE 2.85Å; Y90-R154 PolarHBondContact OH-NH2 2.73Å; Y90-F157 HydrophobicContact CD2-CD1 4.49Å; Y90-F157 AromaticContact CD2-CE1 3.77Å; Y90-F157 HydrophobicContact CD2-CE1 3.77Å; Y90-F157 HydrophobicContact CE2-CD1 4.06Å; Y90-F157 AromaticContact CE2-CE1 3.78Å; Y90-F157 HydrophobicContact CE2-CE1 3.78Å; Y90-N158 VanDerWaalsContact CE2-OD1 3.32Å; Y90-N158 WeakPolarHBondContact CE2-OD1 3.43Å; Y90-N158 PolarHBondContact OH-ND2 3.32Å; Y90-N158 PolarHBondContact OH-OD1 3.3Å
91	A	93.7	Very high	91.8	Very high	13 Å²	13	47.1 Å²	47.1	11%	0.107	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-40.2	176.9	0	0	0	0	0	111.2	F73 D88 L93 G94	F73-A91 WeakPolarHBondContact CB-O 3.34Å; F73-A91 HydrophobicContact CD2-CB 3.69Å; F73-A91 HydrophobicContact CE2-CB 3.78Å; F73-A91 HydrophobicContact CG-CB 4.37Å; D88-A91 HydrophobicContact CB-CB 3.83Å; D88-A91 PolarHBondContact O-N 2.97Å; D88-A91 VanDerWaalsContact O-N 3.07Å; D88-A91 PolarHBondContact OD1-N 3.19Å; A91-L93 PolarHBondContact O-N 2.89Å; A91-G94 PolarHBondContact O-N 3.25Å
92	V	94.2	Very high	91.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.9	-35.7	175.4	171.9	0	0	0	0	112.3	L76 L79 Q87 D88 Y90 G94 M114 C140 I141 A144	L76-V92 HydrophobicContact CD1-CG1 4.05Å; L79-V92 HydrophobicContact CD1-CG2 3.68Å; Q87-V92 HydrophobicContact CB-CG2 4.38Å; D88-V92 VanDerWaalsContact O-CG2 3.31Å; D88-V92 WeakPolarHBondContact O-CG2 3.32Å; D88-V92 PolarHBondContact O-N 3.47Å; Y90-V92 VanDerWaalsContact C-N 3.31Å; Y90-V92 PolarHBondContact O-N 3.37Å; V92-G94 VanDerWaalsContact C-N 3.35Å; V92-M114 WeakPolarHBondContact O-CE 3.46Å; V92-C140 HydrophobicContact CG1-CB 4.5Å; V92-I141 HydrophobicContact CG1-CG1 4.15Å; V92-A144 HydrophobicContact CB-CB 3.89Å; V92-A144 HydrophobicContact CG1-CB 3.62Å
93	L	93.9	Very high	92.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	4.6	175.5	-64.6	-172.3	0	0	0	114.1	H89 Y90 A91 L95 I107 A110 H111 I141 A144 L148	H89-L93 PolarHBondContact O-N 3.01Å; Y90-L93 PolarHBondContact O-N 3.3Å; A91-L93 PolarHBondContact O-N 2.89Å; L93-L95 VanDerWaalsContact C-N 3.27Å; L93-L95 HydrophobicContact CB-CD1 4.36Å; L93-L95 HydrophobicContact CB-CG 4.41Å; L93-L95 PolarHBondContact O-N 2.9Å; L93-I107 HydrophobicContact CD1-CG2 4.13Å; L93-A110 HydrophobicContact CB-CB 4.42Å; L93-H111 HydrophobicContact CD2-CB 4.41Å; L93-I141 HydrophobicContact CD2-CG2 4Å; L93-A144 HydrophobicContact CD2-CB 4.18Å; L93-A144 HydrophobicContact CG-CB 4.04Å; L93-L148 HydrophobicContact CD1-CD1 3.79Å; L93-L148 HydrophobicContact CG-CD1 4.43Å
94	G	91.5	Very high	92.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.01	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	16.9	-175.5	0	0	0	0	0	114.4	E71 Y90 A91 V92	E71-G94 PolarHBondContact N-O 3.3Å; E71-G94 VanDerWaalsContact N-O 3.17Å; E71-G94 VanDerWaalsContact O-CA 3.27Å; E71-G94 WeakPolarHBondContact O-CA 3.5Å; Y90-G94 PolarHBondContact O-N 2.9Å; A91-G94 PolarHBondContact O-N 3.25Å; V92-G94 VanDerWaalsContact C-N 3.35Å
95	L	93.4	Very high	92.2	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	21%	0.214	C	C	.	.			trans	-103.2	24.4	178.9	-64	175.7	0	0	0	112.3	L70 Y90 L93 H97 V98 R99 A102 I107 A110	L70-L95 HydrophobicContact CD2-CD2 4.09Å; Y90-L95 HydrophobicContact CD1-CB 4.26Å; Y90-L95 CarbonylContact O-C 3.54Å; Y90-L95 WeakPolarHBondContact O-CA 3.47Å; Y90-L95 PolarHBondContact O-N 3.39Å; L93-L95 VanDerWaalsContact C-N 3.27Å; L93-L95 HydrophobicContact CB-CD1 4.36Å; L93-L95 HydrophobicContact CB-CG 4.41Å; L93-L95 PolarHBondContact O-N 2.9Å; L95-H97 VanDerWaalsContact C-N 3.35Å; L95-H97 PolarHBondContact O-N 2.91Å; L95-V98 HydrophobicContact CD2-CG2 4.44Å; L95-V98 PolarHBondContact O-N 3.34Å; L95-V98 VanDerWaalsContact O-N 3.17Å; L95-R99 PolarHBondContact O-N 3.27Å; L95-A102 HydrophobicContact CD1-CB 4.24Å; L95-I107 HydrophobicContact CD1-CB 4.45Å; L95-I107 HydrophobicContact CD1-CG1 3.85Å; L95-A110 HydrophobicContact CD1-CB 3.76Å; L95-A110 HydrophobicContact CD2-CB 4.02Å; L95-A110 HydrophobicContact CG-CB 3.82Å
96	G	91	Very high	92.4	Very high	22 Å²	22	42.9 Å²	42.9	23%	0.227	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-43.7	-178.1	0	0	0	0	0	113.1	R99	G96-R99 WeakPolarHBondContact O-CD 3.45Å; G96-R99 WeakPolarHBondContact O-CG 3.27Å
97	H	89.4	Confident	92.6	Very high	95 Å²	95	36.7 Å²	36.7	44%	0.44	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-30.8	176.3	59.6	-73.9	0	0	0	114.8	Q69 E71 L95	Q69-H97 PolarHBondContact O-CE1 3.45Å; E71-H97 IonicContact OE1-ND1 3.71Å; E71-H97 IonicContact OE2-CG 2.73Å; E71-H97 PolarHBondContact OE2-N 3.12Å; E71-H97 IonicContact OE2-ND1 3.91Å; E71-H97 PolarHBondContact OE2-ND1 3.33Å; L95-H97 VanDerWaalsContact C-N 3.35Å; L95-H97 PolarHBondContact O-N 2.91Å
98	V	90.3	Very high	92.7	Very high	28 Å²	28	41.4 Å²	41.4	17%	0.17	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-35.1	-177.2	-161	0	0	0	0	112.5	L95 Y100 K101 A102	L95-V98 HydrophobicContact CD2-CG2 4.44Å; L95-V98 PolarHBondContact O-N 3.34Å; L95-V98 VanDerWaalsContact O-N 3.17Å; V98-Y100 PolarHBondContact O-N 3.34Å; V98-K101 HydrophobicContact CG1-CB 4.06Å; V98-K101 WeakPolarHBondContact O-CB 3.39Å; V98-K101 PolarHBondContact O-N 3.05Å; V98-K101 VanDerWaalsContact O-N 3.1Å; V98-A102 HydrophobicContact CB-CB 4.21Å; V98-A102 HydrophobicContact CG1-CB 3.96Å
99	R	92.6	Very high	92.7	Very high	27 Å²	27	40.5 Å²	40.5	10%	0.102	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	50.9	-135.7	178.6	-52.1	-73.3	-72.6	154.7	-18	112.3	D88 Y90 L95 G96 K101 A102 D161 T163	D88-R99 IonicContact OD1-CZ 2.68Å; D88-R99 IonicContact OD1-NH1 3.17Å; D88-R99 PolarHBondContact OD1-NH1 2.64Å; D88-R99 IonicContact OD2-CZ 3.79Å; D88-R99 IonicContact OD2-NH1 3.14Å; D88-R99 PolarHBondContact OD2-NH1 3.19Å; D88-R99 IonicContact OD2-NH2 3.62Å; D88-R99 PolarHBondContact OD2-NH2 2.98Å; Y90-R99 WeakPolarHBondContact CD1-O 3.49Å; Y90-R99 VanDerWaalsContact CE1-C 3.46Å; Y90-R99 WeakPolarHBondContact CE1-O 3.42Å; L95-R99 PolarHBondContact O-N 3.27Å; G96-R99 WeakPolarHBondContact O-CD 3.45Å; G96-R99 WeakPolarHBondContact O-CG 3.27Å; R99-K101 PolarHBondContact O-N 2.88Å; R99-A102 VanDerWaalsContact O-CB 3.29Å; R99-A102 WeakPolarHBondContact O-CB 3.39Å; R99-A102 PolarHBondContact O-N 3.07Å; R99-D161 IonicContact CZ-OD1 2.8Å; R99-D161 IonicContact NH2-OD1 2.79Å; R99-D161 PolarHBondContact NH2-OD1 3.06Å; R99-T163 PolarHBondContact NE-OG1 3.26Å; R99-T163 PolarHBondContact NH2-OG1 2.96Å
100	Y	92.3	Very high	92.6	Very high	88 Å²	88	40.5 Å²	40.5	35%	0.345	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-56.5	-17.9	178.6	78.1	-82.7	0	0	0	114.8	V98 A102 R154 R191	V98-Y100 PolarHBondContact O-N 3.34Å; Y100-A102 VanDerWaalsContact C-N 3.29Å; Y100-R154 PolarHBondContact O-NH2 3.28Å; Y100-R191 VanDerWaalsContact CE1-NH1 3.28Å; Y100-R191 HydrophobicContact CE2-CB 4.37Å
101	K	92.5	Very high	92.6	Very high	143 Å²	143	42.2 Å²	42.2	62%	0.622	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-79.7	-10.8	176.8	-59.9	180	178.6	176.8	0	112.9	V98 R99 T103	V98-K101 HydrophobicContact CG1-CB 4.06Å; V98-K101 WeakPolarHBondContact O-CB 3.39Å; V98-K101 PolarHBondContact O-N 3.05Å; V98-K101 VanDerWaalsContact O-N 3.1Å; R99-K101 PolarHBondContact O-N 2.88Å; K101-T103 PolarHBondContact O-N 3.31Å
102	A	93.3	Very high	92.6	Very high	3 Å²	3	48.6 Å²	48.6	3%	0.025	23%	0.231	C	C	.	.			trans	-60.9	132.6	-176.2	0	0	0	0	0	111.4	Y90 L95 V98 R99 Y100 I107 R154	Y90-A102 HydrophobicContact CE1-CB 4.2Å; L95-A102 HydrophobicContact CD1-CB 4.24Å; V98-A102 HydrophobicContact CB-CB 4.21Å; V98-A102 HydrophobicContact CG1-CB 3.96Å; R99-A102 VanDerWaalsContact O-CB 3.29Å; R99-A102 WeakPolarHBondContact O-CB 3.39Å; R99-A102 PolarHBondContact O-N 3.07Å; Y100-A102 VanDerWaalsContact C-N 3.29Å; A102-I107 HydrophobicContact CB-CD1 4.31Å; A102-I107 HydrophobicContact CB-CG1 4.09Å; A102-R154 PolarHBondContact O-NH1 3.47Å; A102-R154 PolarHBondContact O-NH2 3.47Å
103	T	93.3	Very high	92.5	Very high	72 Å²	72	50.4 Å²	50.4	44%	0.442	25%	0.246	S	C	.	.			trans	-76.4	160.4	176.2	73.5	0	0	0	0	110.7	K101 R105 Q106 I107	K101-T103 PolarHBondContact O-N 3.31Å; T103-R105 PolarHBondContact O-N 2.86Å; T103-Q106 PolarHBondContact O-N 3.08Å; T103-Q106 VanDerWaalsContact OG1-CG 3.32Å; T103-Q106 WeakPolarHBondContact OG1-CG 3.26Å; T103-Q106 PolarHBondContact OG1-N 3Å; T103-Q106 VanDerWaalsContact OG1-N 3.15Å; T103-I107 WeakPolarHBondContact O-CG1 3.45Å; T103-I107 PolarHBondContact O-N 3.39Å
104	Q	92.5	Very high	92.3	Very high	68 Å²	68	51.2 Å²	51.2	32%	0.318	25%	0.25	S	C	.	.	H	α-helix	trans	-58.8	-34.7	175.6	-168.5	65.9	20.5	0	0	111.8	I107 K108 S149	Q104-I107 PolarHBondContact O-N 3.3Å; Q104-K108 WeakPolarHBondContact O-CG 3.27Å; Q104-K108 PolarHBondContact O-N 2.94Å; Q104-K108 VanDerWaalsContact O-N 3.08Å; Q104-S149 VanDerWaalsContact NE2-CA 3.33Å; Q104-S149 PolarHBondContact NE2-O 3.37Å
105	R	90	Very high	92.4	Very high	94 Å²	94	53 Å²	53	36%	0.355	26%	0.26	S	S	.	.	H	α-helix	trans	-65	-47.8	175.7	-178.3	176.5	166.4	-153.5	-12.6	111.1	E61 E64 D65 T103 I107 K108 A109	E61-R105 PolarHBondContact O-NH1 3.34Å; E61-R105 PolarHBondContact O-NH2 3.36Å; E64-R105 PolarHBondContact O-NH2 2.99Å; D65-R105 IonicContact OD1-CZ 3.26Å; D65-R105 IonicContact OD1-NH2 2.79Å; D65-R105 PolarHBondContact OD1-NH2 2.89Å; T103-R105 PolarHBondContact O-N 2.86Å; R105-I107 VanDerWaalsContact C-N 3.3Å; R105-I107 PolarHBondContact O-N 3.26Å; R105-K108 PolarHBondContact O-N 2.88Å; R105-A109 WeakPolarHBondContact O-CB 3.44Å; R105-A109 PolarHBondContact O-N 3.44Å
106	Q	92.5	Very high	92.2	Very high	49 Å²	49	57.4 Å²	57.4	23%	0.229	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-41.4	176.5	-71.5	175.1	-35.3	0	0	111.8	L68 T103 A109 A110	L68-Q106 HydrophobicContact CD2-CB 4.37Å; L68-Q106 HydrophobicContact CD2-CG 3.81Å; T103-Q106 PolarHBondContact O-N 3.08Å; T103-Q106 VanDerWaalsContact OG1-CG 3.32Å; T103-Q106 WeakPolarHBondContact OG1-CG 3.26Å; T103-Q106 PolarHBondContact OG1-N 3Å; T103-Q106 VanDerWaalsContact OG1-N 3.15Å; Q106-A109 PolarHBondContact O-N 3.45Å; Q106-A110 WeakPolarHBondContact O-CB 3.34Å; Q106-A110 PolarHBondContact O-N 3.41Å
107	I	94.9	Very high	92	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-45	177.2	-68.2	162.6	0	0	0	111.7	L93 L95 A102 T103 Q104 R105 H111 Y145 L148 R154	L93-I107 HydrophobicContact CD1-CG2 4.13Å; L95-I107 HydrophobicContact CD1-CB 4.45Å; L95-I107 HydrophobicContact CD1-CG1 3.85Å; A102-I107 HydrophobicContact CB-CD1 4.31Å; A102-I107 HydrophobicContact CB-CG1 4.09Å; T103-I107 WeakPolarHBondContact O-CG1 3.45Å; T103-I107 PolarHBondContact O-N 3.39Å; Q104-I107 PolarHBondContact O-N 3.3Å; R105-I107 VanDerWaalsContact C-N 3.3Å; R105-I107 PolarHBondContact O-N 3.26Å; I107-H111 WeakPolarHBondContact O-CB 3.31Å; I107-H111 PolarHBondContact O-N 3.01Å; I107-Y145 HydrophobicContact CG2-CD2 3.96Å; I107-Y145 HydrophobicContact CG2-CE2 4.18Å; I107-L148 HydrophobicContact CD1-CB 4.17Å; I107-L148 HydrophobicContact CG2-CB 3.85Å; I107-R154 VanDerWaalsContact CD1-CZ 3.4Å
108	K	93.7	Very high	92.1	Very high	114 Å²	114	57.9 Å²	57.9	50%	0.496	28%	0.278	S	S	.	.	H	α-helix	trans	-64.2	-45.4	177.2	-73.2	177.9	176.7	-174.4	0	112.1	Q104 R105 H111 K112 Y145	Q104-K108 WeakPolarHBondContact O-CG 3.27Å; Q104-K108 PolarHBondContact O-N 2.94Å; Q104-K108 VanDerWaalsContact O-N 3.08Å; R105-K108 PolarHBondContact O-N 2.88Å; K108-H111 PolarHBondContact O-N 3.43Å; K108-K112 PolarHBondContact O-N 3.22Å; K108-Y145 HydrophobicContact CG-CE2 4.12Å
109	A	92.2	Very high	92.1	Very high	30 Å²	30	59.3 Å²	59.3	25%	0.248	28%	0.283	C	S	.	.	H	α-helix	trans	-65.4	-44.5	179.5	0	0	0	0	0	111.6	L68 R105 Q106 H111 K112 A113	L68-A109 HydrophobicContact CD1-CB 3.35Å; R105-A109 WeakPolarHBondContact O-CB 3.44Å; R105-A109 PolarHBondContact O-N 3.44Å; Q106-A109 PolarHBondContact O-N 3.45Å; A109-H111 PolarHBondContact O-N 3.23Å; A109-K112 PolarHBondContact O-N 2.9Å; A109-A113 PolarHBondContact O-N 3.23Å
110	A	93.2	Very high	91.9	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-46.6	174.2	0	0	0	0	0	111.8	L70 L93 L95 Q106 K112 A113 M114	L70-A110 HydrophobicContact CD2-CB 3.65Å; L93-A110 HydrophobicContact CB-CB 4.42Å; L95-A110 HydrophobicContact CD1-CB 3.76Å; L95-A110 HydrophobicContact CD2-CB 4.02Å; L95-A110 HydrophobicContact CG-CB 3.82Å; Q106-A110 WeakPolarHBondContact O-CB 3.34Å; Q106-A110 PolarHBondContact O-N 3.41Å; A110-K112 PolarHBondContact O-N 2.97Å; A110-A113 PolarHBondContact O-N 2.92Å; A110-M114 WeakPolarHBondContact O-CB 3.43Å; A110-M114 VanDerWaalsContact O-CG 3.22Å; A110-M114 WeakPolarHBondContact O-CG 3.35Å; A110-M114 PolarHBondContact O-N 2.88Å
111	H	94.9	Very high	91.7	Very high	38 Å²	38	60.7 Å²	60.7	18%	0.176	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-45.1	174.7	174.4	-109.1	0	0	0	112.2	L93 I107 K108 A109 A113 M114 V115 Y145	L93-H111 HydrophobicContact CD2-CB 4.41Å; I107-H111 WeakPolarHBondContact O-CB 3.31Å; I107-H111 PolarHBondContact O-N 3.01Å; K108-H111 PolarHBondContact O-N 3.43Å; A109-H111 PolarHBondContact O-N 3.23Å; H111-A113 VanDerWaalsContact C-N 3.33Å; H111-A113 PolarHBondContact O-N 3.24Å; H111-M114 PolarHBondContact O-N 2.87Å; H111-V115 WeakPolarHBondContact NE2-CG2 3.44Å; H111-V115 WeakPolarHBondContact O-CB 3.41Å; H111-V115 VanDerWaalsContact O-CG2 3.28Å; H111-V115 WeakPolarHBondContact O-CG2 3.25Å; H111-V115 PolarHBondContact O-N 3.19Å; H111-Y145 HydrophobicContact CB-CD2 3.43Å; H111-Y145 VanDerWaalsContact CB-CD2 3.43Å; H111-Y145 HydrophobicContact CB-CE2 3.98Å; H111-Y145 HydrophobicContact CB-CG 3.85Å; H111-Y145 WeakPolarHBondContact CD2-CB 3.4Å; H111-Y145 AromaticContact CD2-CG 3.55Å; H111-Y145 AromaticContact CE1-CD1 3.69Å; H111-Y145 AromaticContact CE1-CG 3.98Å; H111-Y145 AromaticContact CG-CD1 3.93Å; H111-Y145 AromaticContact CG-CD2 3.55Å; H111-Y145 AromaticContact CG-CG 3.43Å; H111-Y145 VanDerWaalsContact CG-CG 3.43Å; H111-Y145 AromaticContact ND1-CD1 3.74Å; H111-Y145 AromaticContact ND1-CD2 3.94Å; H111-Y145 AromaticContact ND1-CE1 3.95Å; H111-Y145 AromaticContact ND1-CG 3.73Å; H111-Y145 AromaticContact NE2-CD1 3.87Å; H111-Y145 AromaticContact NE2-CG 3.89Å
112	K	92.9	Very high	91.4	Very high	146 Å²	146	58.9 Å²	58.9	64%	0.635	29%	0.292	S	S	*	.	H	α-helix	trans	-58.1	-45.3	176.1	-175.4	-178.4	177.7	-175.5	0	111.4	K108 A109 A110 V115 L116	K108-K112 PolarHBondContact O-N 3.22Å; A109-K112 PolarHBondContact O-N 2.9Å; A110-K112 PolarHBondContact O-N 2.97Å; K112-V115 PolarHBondContact O-N 3.46Å; K112-L116 HydrophobicContact CG-CD1 4.3Å; K112-L116 WeakPolarHBondContact O-CB 3.48Å; K112-L116 VanDerWaalsContact O-CG 3.25Å; K112-L116 WeakPolarHBondContact O-CG 3.12Å; K112-L116 PolarHBondContact O-N 3.36Å
113	A	91.3	Very high	91.2	Very high	38 Å²	38	59.3 Å²	59.3	31%	0.314	29%	0.293	S	S	.	.	H	α-helix	trans	-63.1	-44.6	177	0	0	0	0	0	112.3	L70 A109 A110 H111 V115 L116 K117	L70-A113 HydrophobicContact CD1-CB 3.43Å; L70-A113 VanDerWaalsContact CD1-CB 3.43Å; A109-A113 PolarHBondContact O-N 3.23Å; A110-A113 PolarHBondContact O-N 2.92Å; H111-A113 VanDerWaalsContact C-N 3.33Å; H111-A113 PolarHBondContact O-N 3.24Å; A113-V115 PolarHBondContact O-N 2.91Å; A113-L116 PolarHBondContact O-N 3.43Å; A113-K117 PolarHBondContact O-N 2.97Å; A113-K117 VanDerWaalsContact O-N 3.1Å
114	M	91.1	Very high	90.9	Very high	17 Å²	17	63.3 Å²	63.3	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-41.3	177	-69.1	-63.9	-69.9	0	0	112.2	L76 V92 A110 H111 K117 H118 I141	L76-M114 HydrophobicContact CD1-CE 4.23Å; L76-M114 HydrophobicContact CD2-CE 3.38Å; L76-M114 HydrophobicContact CG-CE 4.46Å; V92-M114 WeakPolarHBondContact O-CE 3.46Å; A110-M114 WeakPolarHBondContact O-CB 3.43Å; A110-M114 VanDerWaalsContact O-CG 3.22Å; A110-M114 WeakPolarHBondContact O-CG 3.35Å; A110-M114 PolarHBondContact O-N 2.88Å; H111-M114 PolarHBondContact O-N 2.87Å; M114-K117 PolarHBondContact O-N 2.94Å; M114-H118 WeakPolarHBondContact O-CB 3.33Å; M114-H118 PolarHBondContact O-N 3.14Å; M114-I141 HydrophobicContact CB-CG2 3.83Å; M114-I141 HydrophobicContact CE-CD1 3.93Å; M114-I141 HydrophobicContact CE-CG1 4.26Å
115	V	92.3	Very high	90.7	Very high	38 Å²	38	64.5 Å²	64.5	23%	0.23	33%	0.326	C	S	.	.	H	α-helix	trans	-62.3	-46.5	173.8	170.8	0	0	0	0	110.6	H111 K112 A113 K117 H118 H119 F138	H111-V115 WeakPolarHBondContact NE2-CG2 3.44Å; H111-V115 WeakPolarHBondContact O-CB 3.41Å; H111-V115 VanDerWaalsContact O-CG2 3.28Å; H111-V115 WeakPolarHBondContact O-CG2 3.25Å; H111-V115 PolarHBondContact O-N 3.19Å; K112-V115 PolarHBondContact O-N 3.46Å; A113-V115 PolarHBondContact O-N 2.91Å; V115-K117 PolarHBondContact O-N 3.09Å; V115-H118 PolarHBondContact O-N 2.99Å; V115-H119 HydrophobicContact CG1-CB 4.49Å; V115-H119 WeakPolarHBondContact O-CB 3.35Å; V115-H119 PolarHBondContact O-N 3.3Å; V115-F138 HydrophobicContact CG1-CZ 4.37Å; V115-F138 HydrophobicContact CG2-CE2 4.22Å; V115-F138 HydrophobicContact CG2-CZ 4.07Å
116	L	89.9	Confident	90.6	Very high	95 Å²	95	63.7 Å²	63.7	50%	0.497	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-33.4	179.6	-73.6	170.4	0	0	0	113.1	K112 A113 K122	K112-L116 HydrophobicContact CG-CD1 4.3Å; K112-L116 WeakPolarHBondContact O-CB 3.48Å; K112-L116 VanDerWaalsContact O-CG 3.25Å; K112-L116 WeakPolarHBondContact O-CG 3.12Å; K112-L116 PolarHBondContact O-N 3.36Å; A113-L116 PolarHBondContact O-N 3.43Å; L116-K122 WeakPolarHBondContact O-CD 3.41Å; L116-K122 PolarHBondContact O-NZ 2.93Å
117	K	87.7	Confident	90.2	Very high	117 Å²	117	64.5 Å²	64.5	51%	0.509	36%	0.361	S	S	.	.	H	α-helix	trans	-86	-38.4	-179.5	-172.1	175.2	174.7	-174.4	0	113.4	E72 A113 M114 V115	E72-K117 IonicContact OE1-NZ 3.95Å; E72-K117 PolarHBondContact OE1-NZ 3.4Å; A113-K117 PolarHBondContact O-N 2.97Å; A113-K117 VanDerWaalsContact O-N 3.1Å; M114-K117 PolarHBondContact O-N 2.94Å; V115-K117 PolarHBondContact O-N 3.09Å
118	H	89.8	Confident	89.7	Confident	10 Å²	10	68 Å²	68	5%	0.046	38%	0.377	C	S	.	.	H	α-helix	trans	-115.8	4.6	-167.1	-62.8	-68.1	0	0	0	115.5	L76 M114 V115 R123 Y137 F138 I141	L76-H118 WeakPolarHBondContact CD2-NE2 3.41Å; M114-H118 WeakPolarHBondContact O-CB 3.33Å; M114-H118 PolarHBondContact O-N 3.14Å; V115-H118 PolarHBondContact O-N 2.99Å; H118-R123 WeakPolarHBondContact O-CD 3.35Å; H118-Y137 HydrophobicContact CB-CE2 4.1Å; H118-Y137 PolarHBondContact ND1-OH 3.49Å; H118-Y137 VanDerWaalsContact ND1-OH 3.1Å; H118-F138 HydrophobicContact CB-CD2 4.31Å; H118-F138 WeakPolarHBondContact O-CD2 3.26Å; H118-I141 HydrophobicContact CB-CD1 3.67Å
119	H	90.6	Very high	89	Confident	58 Å²	58	68.2 Å²	68.2	27%	0.269	39%	0.39	S	S	.	.			trans	-57.1	136.2	178	-165.1	-90.3	0	0	0	112.3	V115 D121 K122 R123 F138	V115-H119 HydrophobicContact CG1-CB 4.49Å; V115-H119 WeakPolarHBondContact O-CB 3.35Å; V115-H119 PolarHBondContact O-N 3.3Å; H119-D121 IonicContact CE1-OD2 3.24Å; H119-D121 PolarHBondContact CE1-OD2 2.92Å; H119-D121 VanDerWaalsContact CE1-OD2 3.24Å; H119-D121 PolarHBondContact ND1-N 3.15Å; H119-D121 VanDerWaalsContact ND1-N 3.19Å; H119-D121 IonicContact ND1-OD2 3.72Å; H119-D121 PolarHBondContact O-N 3.49Å; H119-K122 HydrophobicContact CB-CB 4.5Å; H119-K122 HydrophobicContact CB-CG 4.41Å; H119-K122 PolarHBondContact O-N 3.01Å; H119-R123 PolarHBondContact O-N 3.16Å; H119-F138 HydrophobicContact CB-CE2 4.28Å; H119-F138 HydrophobicContact CB-CZ 4.5Å; H119-F138 AromaticContact CD2-CZ 3.64Å
120	P	89.5	Confident	88.5	Confident	31 Å²	31	69.5 Å²	69.5	20%	0.201	39%	0.392	C	S	.	.	H	α-helix	trans	-53	-48.3	-179.5	-28.2	35.6	0	0	0	113.1	K122 R123 K124 I130 F138	P120-K122 VanDerWaalsContact C-N 3.3Å; P120-K122 PolarHBondContact O-N 3.4Å; P120-R123 PolarHBondContact O-N 3.19Å; P120-K124 WeakPolarHBondContact O-CB 3.46Å; P120-K124 PolarHBondContact O-N 3.43Å; P120-I130 HydrophobicContact CB-CD1 4.39Å; P120-I130 HydrophobicContact CB-CG2 4.36Å; P120-I130 WeakPolarHBondContact O-CD1 2.99Å; P120-F138 HydrophobicContact CG-CB 4.18Å; P120-F138 HydrophobicContact CG-CD1 4Å; P120-F138 HydrophobicContact CG-CG 4.06Å
121	D	87	Confident	88	Confident	114 Å²	114	75.9 Å²	75.9	61%	0.61	42%	0.42	S	S	*	.	H	α-helix	trans	-59.2	-39	-178.9	-63.5	-19.2	0	0	0	113.5	H119 K124 A125	H119-D121 IonicContact CE1-OD2 3.24Å; H119-D121 PolarHBondContact CE1-OD2 2.92Å; H119-D121 VanDerWaalsContact CE1-OD2 3.24Å; H119-D121 PolarHBondContact ND1-N 3.15Å; H119-D121 VanDerWaalsContact ND1-N 3.19Å; H119-D121 IonicContact ND1-OD2 3.72Å; H119-D121 PolarHBondContact O-N 3.49Å; D121-K124 PolarHBondContact O-N 3.45Å; D121-A125 PolarHBondContact O-N 3.33Å
122	K	86.5	Confident	87.1	Confident	104 Å²	104	82.4 Å²	82.4	45%	0.452	45%	0.451	S	S	.	.	H	α-helix	trans	-72.9	-40.7	179.7	-68.9	-173.6	174.8	-162.9	0	111.8	L116 H119 P120 K124 A125 A126	L116-K122 WeakPolarHBondContact O-CD 3.41Å; L116-K122 PolarHBondContact O-NZ 2.93Å; H119-K122 HydrophobicContact CB-CB 4.5Å; H119-K122 HydrophobicContact CB-CG 4.41Å; H119-K122 PolarHBondContact O-N 3.01Å; P120-K122 VanDerWaalsContact C-N 3.3Å; P120-K122 PolarHBondContact O-N 3.4Å; K122-K124 VanDerWaalsContact C-N 3.29Å; K122-K124 PolarHBondContact O-N 2.93Å; K122-A125 PolarHBondContact O-N 2.89Å; K122-A126 PolarHBondContact O-N 2.92Å
123	R	89.1	Confident	86.3	Confident	12 Å²	12	78.4 Å²	78.4	5%	0.045	45%	0.451	C	S	.	.	H	α-helix	trans	-64.6	-36	174.3	-74.8	172.4	57.5	-146.1	-9.6	111.6	H118 H119 P120 A126 G127 E128 P129 I130 D136 Y137	H118-R123 WeakPolarHBondContact O-CD 3.35Å; H119-R123 PolarHBondContact O-N 3.16Å; P120-R123 PolarHBondContact O-N 3.19Å; R123-A126 CarbonylContact O-C 3.49Å; R123-A126 PolarHBondContact O-N 3.37Å; R123-G127 PolarHBondContact O-N 3.42Å; R123-G127 VanDerWaalsContact O-N 3.15Å; R123-E128 HydrophobicContact CB-CB 4.18Å; R123-E128 WeakPolarHBondContact CG-OE2 3.35Å; R123-E128 IonicContact CZ-OE2 2.83Å; R123-E128 IonicContact NE-OE2 2.8Å; R123-E128 PolarHBondContact NE-OE2 2.74Å; R123-E128 IonicContact NH2-OE2 2.82Å; R123-E128 PolarHBondContact O-N 3.12Å; R123-P129 PolarHBondContact NH2-O 3.4Å; R123-I130 HydrophobicContact CB-CD1 4.3Å; R123-I130 HydrophobicContact CB-CG1 4.46Å; R123-D136 IonicContact CZ-OD1 3.44Å; R123-D136 IonicContact CZ-OD2 2.86Å; R123-D136 IonicContact NH1-OD1 3.44Å; R123-D136 PolarHBondContact NH1-OD1 3.02Å; R123-D136 IonicContact NH1-OD2 3.73Å; R123-D136 PolarHBondContact NH1-OD2 3.09Å; R123-D136 IonicContact NH2-OD2 3.59Å; R123-D136 PolarHBondContact NH2-OD2 2.88Å; R123-Y137 WeakPolarHBondContact CD-OH 3.39Å; R123-Y137 VanDerWaalsContact CZ-CZ 3.48Å; R123-Y137 PolarHBondContact NE-OH 3.42Å; R123-Y137 PolarHBondContact NH1-OH 3.42Å; R123-Y137 VanDerWaalsContact NH2-CE1 3.33Å
124	K	87.6	Confident	85.6	Confident	156 Å²	156	82.9 Å²	82.9	68%	0.678	47%	0.47	S	S	*	.	H	α-helix	trans	-64	-44.3	174.9	-163.2	175.5	179.3	177.5	0	110.7	P120 D121 K122 A126 G127 I130	P120-K124 WeakPolarHBondContact O-CB 3.46Å; P120-K124 PolarHBondContact O-N 3.43Å; D121-K124 PolarHBondContact O-N 3.45Å; K122-K124 VanDerWaalsContact C-N 3.29Å; K122-K124 PolarHBondContact O-N 2.93Å; K124-A126 PolarHBondContact O-N 2.97Å; K124-G127 PolarHBondContact O-N 2.88Å; K124-G127 VanDerWaalsContact O-N 3.08Å; K124-I130 HydrophobicContact CB-CD1 3.46Å; K124-I130 VanDerWaalsContact CB-CD1 3.46Å; K124-I130 HydrophobicContact CG-CD1 4.08Å
125	A	88.4	Confident	85.2	Confident	94 Å²	94	86 Å²	86	78%	0.777	49%	0.487	S	S	*	.	H	α-helix	trans	-63.5	-30.1	174.6	0	0	0	0	0	112.7	D121 K122 G127	D121-A125 PolarHBondContact O-N 3.33Å; K122-A125 PolarHBondContact O-N 2.89Å; A125-G127 VanDerWaalsContact C-N 3.3Å
126	A	87.2	Confident	85.1	Confident	77 Å²	77	84.5 Å²	84.5	64%	0.636	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-0.3	174.1	0	0	0	0	0	114.2	K122 R123 K124	K122-A126 PolarHBondContact O-N 2.92Å; R123-A126 CarbonylContact O-C 3.49Å; R123-A126 PolarHBondContact O-N 3.37Å; K124-A126 PolarHBondContact O-N 2.97Å
127	G	84.3	Confident	85.1	Confident	65 Å²	65	80.5 Å²	80.5	67%	0.67	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	15.5	178.8	0	0	0	0	0	115.3	R123 K124 A125	R123-G127 PolarHBondContact O-N 3.42Å; R123-G127 VanDerWaalsContact O-N 3.15Å; K124-G127 PolarHBondContact O-N 2.88Å; K124-G127 VanDerWaalsContact O-N 3.08Å; A125-G127 VanDerWaalsContact C-N 3.3Å
128	E	84.6	Confident	85.3	Confident	73 Å²	73	76.3 Å²	76.3	34%	0.341	44%	0.438	S	S	.	.			trans	-77	144.1	176.3	-63.9	-168.9	173.9	0	0	112	K77 R123 I130	K77-E128 IonicContact NZ-OE1 3.38Å; R123-E128 HydrophobicContact CB-CB 4.18Å; R123-E128 WeakPolarHBondContact CG-OE2 3.35Å; R123-E128 IonicContact CZ-OE2 2.83Å; R123-E128 IonicContact NE-OE2 2.8Å; R123-E128 PolarHBondContact NE-OE2 2.74Å; R123-E128 IonicContact NH2-OE2 2.82Å; R123-E128 PolarHBondContact O-N 3.12Å; E128-I130 PolarHBondContact O-N 3.4Å
129	P	79.6	Confident	85.5	Confident	120 Å²	120	77 Å²	77	78%	0.779	44%	0.443	S	S	*	.			trans	-67.1	132.5	172.3	28.2	-33.5	0	0	0	110.6	R123	R123-P129 PolarHBondContact NH2-O 3.4Å
130	I	82.1	Confident	85.7	Confident	57 Å²	57	74.3 Å²	74.3	29%	0.292	43%	0.43	S	S	.	.			trans	-120.6	133.1	-179.7	-64.8	161.5	0	0	0	108.6	P120 R123 K124 E128	P120-I130 HydrophobicContact CB-CD1 4.39Å; P120-I130 HydrophobicContact CB-CG2 4.36Å; P120-I130 WeakPolarHBondContact O-CD1 2.99Å; R123-I130 HydrophobicContact CB-CD1 4.3Å; R123-I130 HydrophobicContact CB-CG1 4.46Å; K124-I130 HydrophobicContact CB-CD1 3.46Å; K124-I130 VanDerWaalsContact CB-CD1 3.46Å; K124-I130 HydrophobicContact CG-CD1 4.08Å; E128-I130 PolarHBondContact O-N 3.4Å
131	K	81	Confident	85.9	Confident	134 Å²	134	72.8 Å²	72.8	58%	0.583	42%	0.421	S	S	*	.			trans	-76.4	141.4	171.2	-67.3	180	179	176.1	0	109.4	N135 D136	K131-N135 HydrophobicContact CB-CB 4.38Å; K131-N135 WeakPolarHBondContact CD-O 3.29Å; K131-D136 HydrophobicContact CB-CB 4.26Å; K131-D136 PolarHBondContact N-OD2 3.02Å
132	E	76.4	Confident	86.3	Confident	174 Å²	174	69.6 Å²	69.6	81%	0.813	41%	0.405	S	S	*	.	S	Bend	trans	-71.4	138.3	-176.2	-67	-175.2	168	0	0	113	N135	E132-N135 PolarHBondContact O-ND2 3.22Å; E132-N135 VanDerWaalsContact O-ND2 3.12Å
133	G	76.5	Confident	86.7	Confident	63 Å²	63	67.5 Å²	67.5	65%	0.649	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	62.3	-140.4	174.3	0	0	0	0	0	113.6	N135	G133-N135 PolarHBondContact O-N 3.01Å; G133-N135 VanDerWaalsContact O-N 3.09Å
134	D	76.3	Confident	87	Confident	132 Å²	132	66.9 Å²	66.9	71%	0.706	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-71.8	-1.3	-174.6	-63.6	-16.9	0	0	0	114	P81 T139	P81-D134 VanDerWaalsContact CB-O 3.25Å; P81-D134 WeakPolarHBondContact CB-O 3.46Å; P81-D134 WeakPolarHBondContact CG-O 3.5Å; D134-T139 PolarHBondContact O-OG1 3.45Å
135	N	83.6	Confident	87.4	Confident	81 Å²	81	62.3 Å²	62.3	43%	0.433	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-84.8	-4.7	-178.2	-57.2	-65.6	0	0	0	113.9	K131 E132 G133	K131-N135 HydrophobicContact CB-CB 4.38Å; K131-N135 WeakPolarHBondContact CD-O 3.29Å; E132-N135 PolarHBondContact O-ND2 3.22Å; E132-N135 VanDerWaalsContact O-ND2 3.12Å; G133-N135 PolarHBondContact O-N 3.01Å; G133-N135 VanDerWaalsContact O-N 3.09Å
136	D	89.7	Confident	87.8	Confident	7 Å²	7	61 Å²	61	4%	0.037	35%	0.35	C	S	.	.	S	Bend	trans	-80.1	144.9	174.5	-167.9	-94.8	0	0	0	111.8	P81 R123 K131 F138 T139	P81-D136 WeakPolarHBondContact CG-O 3.31Å; R123-D136 IonicContact CZ-OD1 3.44Å; R123-D136 IonicContact CZ-OD2 2.86Å; R123-D136 IonicContact NH1-OD1 3.44Å; R123-D136 PolarHBondContact NH1-OD1 3.02Å; R123-D136 IonicContact NH1-OD2 3.73Å; R123-D136 PolarHBondContact NH1-OD2 3.09Å; R123-D136 IonicContact NH2-OD2 3.59Å; R123-D136 PolarHBondContact NH2-OD2 2.88Å; K131-D136 HydrophobicContact CB-CB 4.26Å; K131-D136 PolarHBondContact N-OD2 3.02Å; D136-F138 PolarHBondContact O-N 2.92Å; D136-F138 VanDerWaalsContact OD1-CB 3.26Å; D136-F138 WeakPolarHBondContact OD1-CB 3.46Å; D136-F138 PolarHBondContact OD1-N 3.49Å; D136-T139 WeakPolarHBondContact O-CB 3.36Å; D136-T139 PolarHBondContact O-N 2.69Å; D136-T139 PolarHBondContact O-OG1 3.24Å
137	Y	89.6	Confident	88.1	Confident	12 Å²	12	58 Å²	58	5%	0.047	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.7	-179.6	73.5	-98.1	0	0	0	112.8	L76 K77 H118 R123 T139 C140 I141	L76-Y137 HydrophobicContact CD1-CD2 4.48Å; L76-Y137 HydrophobicContact CD2-CE2 4.2Å; L76-Y137 HydrophobicContact CG-CD2 3.96Å; L76-Y137 HydrophobicContact CG-CE2 4.04Å; L76-Y137 WeakPolarHBondContact O-CB 3.48Å; K77-Y137 HydrophobicContact CB-CD1 4.38Å; K77-Y137 HydrophobicContact CB-CE1 4.23Å; K77-Y137 HydrophobicContact CG-CE1 3.92Å; H118-Y137 HydrophobicContact CB-CE2 4.1Å; H118-Y137 PolarHBondContact ND1-OH 3.49Å; H118-Y137 VanDerWaalsContact ND1-OH 3.1Å; R123-Y137 WeakPolarHBondContact CD-OH 3.39Å; R123-Y137 VanDerWaalsContact CZ-CZ 3.48Å; R123-Y137 PolarHBondContact NE-OH 3.42Å; R123-Y137 PolarHBondContact NH1-OH 3.42Å; R123-Y137 VanDerWaalsContact NH2-CE1 3.33Å; Y137-T139 PolarHBondContact O-N 3.29Å; Y137-C140 WeakPolarHBondContact O-CA 3.48Å; Y137-C140 WeakPolarHBondContact O-CB 3.45Å; Y137-C140 PolarHBondContact O-N 2.99Å; Y137-I141 HydrophobicContact CE2-CD1 4.32Å
138	F	92.3	Very high	88.7	Confident	28 Å²	28	54.9 Å²	54.9	12%	0.123	29%	0.292	C	S	.	.	H	α-helix	trans	-54.4	-34.1	171.7	-174.3	-101.6	0	0	0	112.7	V115 H118 H119 P120 D136 C140 I141 T142	V115-F138 HydrophobicContact CG1-CZ 4.37Å; V115-F138 HydrophobicContact CG2-CE2 4.22Å; V115-F138 HydrophobicContact CG2-CZ 4.07Å; H118-F138 HydrophobicContact CB-CD2 4.31Å; H118-F138 WeakPolarHBondContact O-CD2 3.26Å; H119-F138 HydrophobicContact CB-CE2 4.28Å; H119-F138 HydrophobicContact CB-CZ 4.5Å; H119-F138 AromaticContact CD2-CZ 3.64Å; P120-F138 HydrophobicContact CG-CB 4.18Å; P120-F138 HydrophobicContact CG-CD1 4Å; P120-F138 HydrophobicContact CG-CG 4.06Å; D136-F138 PolarHBondContact O-N 2.92Å; D136-F138 VanDerWaalsContact OD1-CB 3.26Å; D136-F138 WeakPolarHBondContact OD1-CB 3.46Å; D136-F138 PolarHBondContact OD1-N 3.49Å; F138-C140 PolarHBondContact O-N 3.41Å; F138-I141 HydrophobicContact CD2-CD1 4.11Å; F138-I141 WeakPolarHBondContact O-CA 3.4Å; F138-I141 WeakPolarHBondContact O-CB 3.37Å; F138-I141 PolarHBondContact O-N 3.38Å; F138-T142 PolarHBondContact O-N 2.99Å; F138-T142 VanDerWaalsContact O-N 3.14Å; F138-T142 PolarHBondContact O-OG1 2.98Å
139	T	93.3	Very high	89.2	Confident	26 Å²	26	52.8 Å²	52.8	16%	0.16	29%	0.285	C	S	.	.	H	α-helix	trans	-56.8	-34.4	173	-54.3	0	0	0	0	111.8	P81 D134 D136 Y137 I141 T142 K143	P81-T139 HydrophobicContact CB-CG2 4.08Å; D134-T139 PolarHBondContact O-OG1 3.45Å; D136-T139 WeakPolarHBondContact O-CB 3.36Å; D136-T139 PolarHBondContact O-N 2.69Å; D136-T139 PolarHBondContact O-OG1 3.24Å; Y137-T139 PolarHBondContact O-N 3.29Å; T139-I141 VanDerWaalsContact C-N 3.33Å; T139-I141 PolarHBondContact O-N 3.01Å; T139-T142 PolarHBondContact O-N 3.37Å; T139-K143 HydrophobicContact CG2-CG 4.34Å; T139-K143 WeakPolarHBondContact O-CB 3.45Å; T139-K143 VanDerWaalsContact O-CG 3.27Å; T139-K143 WeakPolarHBondContact O-CG 3.5Å; T139-K143 PolarHBondContact O-N 3.5Å
140	C	94.5	Very high	90	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-38.7	175.7	-55.9	0	0	0	0	111.4	L79 P81 Q87 V92 Y137 F138 K143 A144	L79-C140 HydrophobicContact CB-CB 4.46Å; L79-C140 HydrophobicContact CD1-CB 4.06Å; P81-C140 VanDerWaalsContact CA-SG 3.58Å; Q87-C140 PolarHBondContact NE2-SG 3.4Å; Q87-C140 VanDerWaalsContact NE2-SG 3.43Å; Q87-C140 VanDerWaalsContact OE1-CB 3.28Å; Q87-C140 PolarHBondContact OE1-SG 3.36Å; V92-C140 HydrophobicContact CG1-CB 4.5Å; Y137-C140 WeakPolarHBondContact O-CA 3.48Å; Y137-C140 WeakPolarHBondContact O-CB 3.45Å; Y137-C140 PolarHBondContact O-N 2.99Å; F138-C140 PolarHBondContact O-N 3.41Å; C140-K143 PolarHBondContact O-N 2.89Å; C140-A144 VanDerWaalsContact O-CB 3.28Å; C140-A144 WeakPolarHBondContact O-CB 3.48Å; C140-A144 PolarHBondContact O-N 2.78Å
141	I	94.6	Very high	90.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-45.2	176.5	-59.5	173.2	0	0	0	110.1	L76 V92 L93 M114 H118 Y137 F138 T139 A144 Y145	L76-I141 HydrophobicContact CD1-CD1 4.41Å; L76-I141 HydrophobicContact CD1-CG1 4.09Å; L76-I141 HydrophobicContact CD2-CD1 4.27Å; V92-I141 HydrophobicContact CG1-CG1 4.15Å; L93-I141 HydrophobicContact CD2-CG2 4Å; M114-I141 HydrophobicContact CB-CG2 3.83Å; M114-I141 HydrophobicContact CE-CD1 3.93Å; M114-I141 HydrophobicContact CE-CG1 4.26Å; H118-I141 HydrophobicContact CB-CD1 3.67Å; Y137-I141 HydrophobicContact CE2-CD1 4.32Å; F138-I141 HydrophobicContact CD2-CD1 4.11Å; F138-I141 WeakPolarHBondContact O-CA 3.4Å; F138-I141 WeakPolarHBondContact O-CB 3.37Å; F138-I141 PolarHBondContact O-N 3.38Å; T139-I141 VanDerWaalsContact C-N 3.33Å; T139-I141 PolarHBondContact O-N 3.01Å; I141-A144 PolarHBondContact O-N 3.16Å; I141-Y145 PolarHBondContact O-N 2.96Å
142	T	94.6	Very high	91.1	Very high	47 Å²	47	50.4 Å²	50.4	29%	0.288	28%	0.281	S	S	.	.	H	α-helix	trans	-61.3	-47	176.2	-52	0	0	0	0	111.3	F138 T139 A144 Y145 E146	F138-T142 PolarHBondContact O-N 2.99Å; F138-T142 VanDerWaalsContact O-N 3.14Å; F138-T142 PolarHBondContact O-OG1 2.98Å; T139-T142 PolarHBondContact O-N 3.37Å; T142-A144 PolarHBondContact O-N 2.97Å; T142-Y145 PolarHBondContact O-N 2.97Å; T142-E146 WeakPolarHBondContact O-CG 3.28Å; T142-E146 PolarHBondContact O-N 3.49Å
143	K	94.9	Very high	92	Very high	59 Å²	59	46.4 Å²	46.4	26%	0.257	26%	0.261	S	S	.	.	H	α-helix	trans	-62.9	-40.7	177.8	-70	-72	160.2	-150.8	0	112.5	W84 T139 C140 Y145 E146 M147	W84-K143 HydrophobicContact CB-CB 4.23Å; W84-K143 HydrophobicContact CB-CG 4.32Å; W84-K143 HydrophobicContact CD2-CB 4.06Å; W84-K143 HydrophobicContact CD2-CD 4.02Å; W84-K143 HydrophobicContact CD2-CG 4.08Å; W84-K143 HydrophobicContact CE3-CB 3.91Å; W84-K143 HydrophobicContact CE3-CD 4.35Å; W84-K143 HydrophobicContact CE3-CG 4.39Å; W84-K143 HydrophobicContact CG-CB 4.21Å; W84-K143 HydrophobicContact CG-CD 4.36Å; W84-K143 HydrophobicContact CG-CG 4.03Å; T139-K143 HydrophobicContact CG2-CG 4.34Å; T139-K143 WeakPolarHBondContact O-CB 3.45Å; T139-K143 VanDerWaalsContact O-CG 3.27Å; T139-K143 WeakPolarHBondContact O-CG 3.5Å; T139-K143 PolarHBondContact O-N 3.5Å; C140-K143 PolarHBondContact O-N 2.89Å; K143-Y145 VanDerWaalsContact C-N 3.35Å; K143-Y145 PolarHBondContact O-N 3.32Å; K143-E146 IonicContact NZ-OE1 3.65Å; K143-E146 IonicContact NZ-OE2 3.99Å; K143-E146 PolarHBondContact NZ-OE2 3.46Å; K143-E146 PolarHBondContact O-N 3.27Å; K143-M147 WeakPolarHBondContact O-CG 3.27Å; K143-M147 PolarHBondContact O-N 2.94Å
144	A	95.9	Very high	92.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-43.9	175.9	0	0	0	0	0	111.9	H89 V92 L93 C140 I141 T142 M147 L148	H89-A144 HydrophobicContact CB-CB 3.93Å; H89-A144 WeakPolarHBondContact ND1-CA 3.36Å; V92-A144 HydrophobicContact CB-CB 3.89Å; V92-A144 HydrophobicContact CG1-CB 3.62Å; L93-A144 HydrophobicContact CD2-CB 4.18Å; L93-A144 HydrophobicContact CG-CB 4.04Å; C140-A144 VanDerWaalsContact O-CB 3.28Å; C140-A144 WeakPolarHBondContact O-CB 3.48Å; C140-A144 PolarHBondContact O-N 2.78Å; I141-A144 PolarHBondContact O-N 3.16Å; T142-A144 PolarHBondContact O-N 2.97Å; A144-M147 PolarHBondContact O-N 3.49Å; A144-L148 WeakPolarHBondContact O-CB 3.37Å; A144-L148 WeakPolarHBondContact O-CG 3.49Å; A144-L148 PolarHBondContact O-N 2.87Å
145	Y	96.6	Very high	93.8	Very high	59 Å²	59	44.3 Å²	44.3	23%	0.231	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-42.1	174.3	178.7	-109.9	0	0	0	112.7	I107 K108 H111 I141 T142 K143 M147 L148 S149	I107-Y145 HydrophobicContact CG2-CD2 3.96Å; I107-Y145 HydrophobicContact CG2-CE2 4.18Å; K108-Y145 HydrophobicContact CG-CE2 4.12Å; H111-Y145 HydrophobicContact CB-CD2 3.43Å; H111-Y145 VanDerWaalsContact CB-CD2 3.43Å; H111-Y145 HydrophobicContact CB-CE2 3.98Å; H111-Y145 HydrophobicContact CB-CG 3.85Å; H111-Y145 WeakPolarHBondContact CD2-CB 3.4Å; H111-Y145 AromaticContact CD2-CG 3.55Å; H111-Y145 AromaticContact CE1-CD1 3.69Å; H111-Y145 AromaticContact CE1-CG 3.98Å; H111-Y145 AromaticContact CG-CD1 3.93Å; H111-Y145 AromaticContact CG-CD2 3.55Å; H111-Y145 AromaticContact CG-CG 3.43Å; H111-Y145 VanDerWaalsContact CG-CG 3.43Å; H111-Y145 AromaticContact ND1-CD1 3.74Å; H111-Y145 AromaticContact ND1-CD2 3.94Å; H111-Y145 AromaticContact ND1-CE1 3.95Å; H111-Y145 AromaticContact ND1-CG 3.73Å; H111-Y145 AromaticContact NE2-CD1 3.87Å; H111-Y145 AromaticContact NE2-CG 3.89Å; I141-Y145 PolarHBondContact O-N 2.96Å; T142-Y145 PolarHBondContact O-N 2.97Å; K143-Y145 VanDerWaalsContact C-N 3.35Å; K143-Y145 PolarHBondContact O-N 3.32Å; Y145-M147 VanDerWaalsContact C-N 3.26Å; Y145-M147 PolarHBondContact O-N 2.89Å; Y145-L148 PolarHBondContact O-N 3.31Å; Y145-S149 WeakPolarHBondContact O-CA 3.45Å; Y145-S149 WeakPolarHBondContact O-CB 3.25Å; Y145-S149 PolarHBondContact O-N 2.9Å; Y145-S149 PolarHBondContact O-OG 3.26Å
146	E	95.6	Very high	94.3	Very high	67 Å²	67	40.7 Å²	40.7	31%	0.313	21%	0.205	S	C	.	.	H	α-helix	trans	-56.5	-39.2	173.7	-74.4	174.6	-172.6	0	0	112.4	T142 K143	T142-E146 WeakPolarHBondContact O-CG 3.28Å; T142-E146 PolarHBondContact O-N 3.49Å; K143-E146 IonicContact NZ-OE1 3.65Å; K143-E146 IonicContact NZ-OE2 3.99Å; K143-E146 PolarHBondContact NZ-OE2 3.46Å; K143-E146 PolarHBondContact O-N 3.27Å
147	M	95.1	Very high	94.6	Very high	14 Å²	14	40.9 Å²	40.9	7%	0.069	21%	0.205	C	C	.	.	H	α-helix	trans	-72.5	-43.6	178.1	-71.6	-53.1	100.8	0	0	112.8	W84 K143 A144 Y145 K153 R154 Y229	W84-M147 HydrophobicContact CE3-CG 4.44Å; W84-M147 HydrophobicContact CH2-CE 3.97Å; W84-M147 HydrophobicContact CH2-CG 4.44Å; W84-M147 HydrophobicContact CH2-SD 3.97Å; W84-M147 HydrophobicContact CZ3-CE 4.01Å; W84-M147 HydrophobicContact CZ3-CG 3.62Å; W84-M147 HydrophobicContact CZ3-SD 3.72Å; K143-M147 WeakPolarHBondContact O-CG 3.27Å; K143-M147 PolarHBondContact O-N 2.94Å; A144-M147 PolarHBondContact O-N 3.49Å; Y145-M147 VanDerWaalsContact C-N 3.26Å; Y145-M147 PolarHBondContact O-N 2.89Å; M147-K153 HydrophobicContact CE-CD 3.64Å; M147-K153 CarbonylContact O-C 3.52Å; M147-K153 HydrophobicContact SD-CB 4.18Å; M147-K153 HydrophobicContact SD-CD 4.27Å; M147-R154 WeakPolarHBondContact O-CA 3.4Å; M147-R154 PolarHBondContact O-N 2.93Å; M147-Y229 HydrophobicContact SD-CE2 4.36Å
148	L	96.3	Very high	94.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-84.8	-22.3	-174.2	-65.3	-178.3	0	0	0	113.3	H89 Y90 L93 I107 A144 Y145 R154 F157	H89-L148 HydrophobicContact CB-CD1 3.95Å; H89-L148 HydrophobicContact CB-CD2 4.22Å; H89-L148 HydrophobicContact CB-CG 3.91Å; H89-L148 WeakPolarHBondContact O-CD1 3.3Å; Y90-L148 HydrophobicContact CD1-CD1 3.65Å; Y90-L148 HydrophobicContact CD1-CD2 4.12Å; Y90-L148 HydrophobicContact CD2-CD2 4.21Å; Y90-L148 HydrophobicContact CE1-CD1 3.88Å; Y90-L148 HydrophobicContact CE1-CD2 3.63Å; Y90-L148 HydrophobicContact CE1-CG 4.36Å; Y90-L148 HydrophobicContact CE2-CD2 3.75Å; Y90-L148 HydrophobicContact CG-CD1 4.05Å; Y90-L148 HydrophobicContact CG-CD2 4.39Å; Y90-L148 VanDerWaalsContact CZ-CD2 3.43Å; L93-L148 HydrophobicContact CD1-CD1 3.79Å; L93-L148 HydrophobicContact CG-CD1 4.43Å; I107-L148 HydrophobicContact CD1-CB 4.17Å; I107-L148 HydrophobicContact CG2-CB 3.85Å; A144-L148 WeakPolarHBondContact O-CB 3.37Å; A144-L148 WeakPolarHBondContact O-CG 3.49Å; A144-L148 PolarHBondContact O-N 2.87Å; Y145-L148 PolarHBondContact O-N 3.31Å; L148-R154 HydrophobicContact CD2-CG 4.11Å; L148-R154 WeakPolarHBondContact O-CD 3.46Å; L148-F157 HydrophobicContact CD2-CD1 4.04Å; L148-F157 HydrophobicContact CD2-CE1 4.35Å
149	S	95.3	Very high	95	Very high	29 Å²	29	39.6 Å²	39.6	20%	0.203	20%	0.201	C	C	.	.	H	α-helix	trans	-79.6	-32.5	-179.5	62.8	0	0	0	0	113	Q104 Y145	Q104-S149 VanDerWaalsContact NE2-CA 3.33Å; Q104-S149 PolarHBondContact NE2-O 3.37Å; Y145-S149 WeakPolarHBondContact O-CA 3.45Å; Y145-S149 WeakPolarHBondContact O-CB 3.25Å; Y145-S149 PolarHBondContact O-N 2.9Å; Y145-S149 PolarHBondContact O-OG 3.26Å
150	D	94.9	Very high	95	Very high	61 Å²	61	39.7 Å²	39.7	33%	0.326	20%	0.201	S	C	.	.	S	Bend	trans	-83.7	121.8	176.5	-179.8	-62.3	0	0	0	110.6	V152 K153 R154	D150-V152 VanDerWaalsContact C-N 3.27Å; D150-V152 PolarHBondContact O-N 2.84Å; D150-V152 WeakPolarHBondContact OD1-CA 3.49Å; D150-V152 VanDerWaalsContact OD1-CB 3.32Å; D150-V152 WeakPolarHBondContact OD1-CB 3.33Å; D150-V152 PolarHBondContact OD1-N 3.45Å; D150-K153 HydrophobicContact CB-CB 4.04Å; D150-K153 HydrophobicContact CB-CD 3.88Å; D150-K153 HydrophobicContact CB-CG 4.07Å; D150-K153 PolarHBondContact O-N 3.48Å; D150-K153 PolarHBondContact OD1-N 3.45Å; D150-R154 WeakPolarHBondContact O-CB 3.32Å; D150-R154 PolarHBondContact O-N 3.48Å
151	P	94	Very high	94.9	Very high	94 Å²	94	40 Å²	40	61%	0.61	20%	0.203	S	C	*	.	H	α-helix	trans	-60.6	-30.7	-176.9	-25.9	35	0	0	0	114.9	R155	P151-R155 VanDerWaalsContact O-CB 3.27Å; P151-R155 WeakPolarHBondContact O-CB 3.18Å; P151-R155 PolarHBondContact O-N 3.42Å; P151-R155 VanDerWaalsContact O-N 3.12Å
152	V	93.9	Very high	94.6	Very high	105 Å²	105	45.6 Å²	45.6	64%	0.636	24%	0.239	S	C	*	.	H	α-helix	trans	-77.3	-48.2	-179.4	-179.4	0	0	0	0	109.9	D150 R154 R155 A156	D150-V152 VanDerWaalsContact C-N 3.27Å; D150-V152 PolarHBondContact O-N 2.84Å; D150-V152 WeakPolarHBondContact OD1-CA 3.49Å; D150-V152 VanDerWaalsContact OD1-CB 3.32Å; D150-V152 WeakPolarHBondContact OD1-CB 3.33Å; D150-V152 PolarHBondContact OD1-N 3.45Å; V152-R154 VanDerWaalsContact C-N 3.34Å; V152-R154 PolarHBondContact O-N 2.96Å; V152-R155 WeakPolarHBondContact O-CB 3.24Å; V152-R155 PolarHBondContact O-N 3.47Å; V152-A156 PolarHBondContact O-N 2.96Å
153	K	94.1	Very high	94.3	Very high	91 Å²	91	47.7 Å²	47.7	40%	0.396	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-41.7	176.8	-65.4	175.8	170.1	179.3	0	111.5	M147 D150 R155 A156 F157	M147-K153 HydrophobicContact CE-CD 3.64Å; M147-K153 CarbonylContact O-C 3.52Å; M147-K153 HydrophobicContact SD-CB 4.18Å; M147-K153 HydrophobicContact SD-CD 4.27Å; D150-K153 HydrophobicContact CB-CB 4.04Å; D150-K153 HydrophobicContact CB-CD 3.88Å; D150-K153 HydrophobicContact CB-CG 4.07Å; D150-K153 PolarHBondContact O-N 3.48Å; D150-K153 PolarHBondContact OD1-N 3.45Å; K153-R155 VanDerWaalsContact C-N 3.3Å; K153-R155 PolarHBondContact O-N 3.41Å; K153-A156 WeakPolarHBondContact O-CB 3.35Å; K153-A156 PolarHBondContact O-N 3.31Å; K153-F157 PolarHBondContact O-N 3.02Å
154	R	95.5	Very high	94.3	Very high	29 Å²	29	45.4 Å²	45.4	11%	0.109	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-40.8	175.3	-173.4	-177.5	-177.6	-170.8	-4.3	111.6	Y90 Y100 A102 I107 M147 L148 D150 V152 F157 N158	Y90-R154 PolarHBondContact OH-NE 2.85Å; Y90-R154 PolarHBondContact OH-NH2 2.73Å; Y100-R154 PolarHBondContact O-NH2 3.28Å; A102-R154 PolarHBondContact O-NH1 3.47Å; A102-R154 PolarHBondContact O-NH2 3.47Å; I107-R154 VanDerWaalsContact CD1-CZ 3.4Å; M147-R154 WeakPolarHBondContact O-CA 3.4Å; M147-R154 PolarHBondContact O-N 2.93Å; L148-R154 HydrophobicContact CD2-CG 4.11Å; L148-R154 WeakPolarHBondContact O-CD 3.46Å; D150-R154 WeakPolarHBondContact O-CB 3.32Å; D150-R154 PolarHBondContact O-N 3.48Å; V152-R154 VanDerWaalsContact C-N 3.34Å; V152-R154 PolarHBondContact O-N 2.96Å; R154-F157 PolarHBondContact O-N 3.27Å; R154-N158 VanDerWaalsContact O-CB 3.23Å; R154-N158 WeakPolarHBondContact O-CB 3.08Å; R154-N158 PolarHBondContact O-N 3.46Å; R154-N158 PolarHBondContact O-ND2 3.45Å
155	R	94.7	Very high	94.2	Very high	121 Å²	121	48.6 Å²	48.6	46%	0.457	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-44.7	175.8	-173.2	-174.3	-66.1	-159.3	-2.5	111.6	P151 V152 K153 N158 S159 W224	P151-R155 VanDerWaalsContact O-CB 3.27Å; P151-R155 WeakPolarHBondContact O-CB 3.18Å; P151-R155 PolarHBondContact O-N 3.42Å; P151-R155 VanDerWaalsContact O-N 3.12Å; V152-R155 WeakPolarHBondContact O-CB 3.24Å; V152-R155 PolarHBondContact O-N 3.47Å; K153-R155 VanDerWaalsContact C-N 3.3Å; K153-R155 PolarHBondContact O-N 3.41Å; R155-N158 PolarHBondContact O-N 3.47Å; R155-S159 WeakPolarHBondContact O-CB 3.35Å; R155-S159 PolarHBondContact O-N 2.9Å; R155-S159 PolarHBondContact O-OG 3.24Å; R155-W224 HydrophobicContact CB-CZ3 4.4Å; R155-W224 HydrophobicContact CG-CD2 4.35Å; R155-W224 HydrophobicContact CG-CE3 3.29Å; R155-W224 HydrophobicContact CG-CH2 4.4Å; R155-W224 HydrophobicContact CG-CZ3 3.34Å
156	A	94.8	Very high	94.1	Very high	5 Å²	5	48.6 Å²	48.6	4%	0.041	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-49.6	176.9	0	0	0	0	0	111.2	V152 K153 S159 E226 S228	V152-A156 PolarHBondContact O-N 2.96Å; K153-A156 WeakPolarHBondContact O-CB 3.35Å; K153-A156 PolarHBondContact O-N 3.31Å; A156-S159 WeakPolarHBondContact O-CB 3.44Å; A156-S159 PolarHBondContact O-N 3.44Å; A156-E226 WeakPolarHBondContact CA-OE1 3.37Å; A156-E226 WeakPolarHBondContact CB-OE1 3.49Å; A156-S228 WeakPolarHBondContact CB-OG 3.45Å
157	F	95.4	Very high	94.1	Very high	11 Å²	11	48.4 Å²	48.4	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-62.9	-48.3	177.7	178	-114.5	0	0	0	112.3	H89 Y90 L148 K153 R154 S159 V160 D161 Y229	H89-F157 HydrophobicContact CB-CE1 3.96Å; H89-F157 HydrophobicContact CB-CZ 4.1Å; H89-F157 AromaticContact CD2-CD2 3.69Å; H89-F157 AromaticContact CD2-CE2 3.46Å; H89-F157 VanDerWaalsContact CD2-CE2 3.46Å; H89-F157 WeakPolarHBondContact CD2-CE2 3.32Å; H89-F157 AromaticContact CD2-CZ 3.63Å; Y90-F157 HydrophobicContact CD2-CD1 4.49Å; Y90-F157 AromaticContact CD2-CE1 3.77Å; Y90-F157 HydrophobicContact CD2-CE1 3.77Å; Y90-F157 HydrophobicContact CE2-CD1 4.06Å; Y90-F157 AromaticContact CE2-CE1 3.78Å; Y90-F157 HydrophobicContact CE2-CE1 3.78Å; L148-F157 HydrophobicContact CD2-CD1 4.04Å; L148-F157 HydrophobicContact CD2-CE1 4.35Å; K153-F157 PolarHBondContact O-N 3.02Å; R154-F157 PolarHBondContact O-N 3.27Å; F157-S159 PolarHBondContact O-N 2.9Å; F157-V160 VanDerWaalsContact O-CG2 3.24Å; F157-V160 WeakPolarHBondContact O-CG2 3.32Å; F157-V160 PolarHBondContact O-N 3.36Å; F157-D161 PolarHBondContact O-N 2.91Å; F157-Y229 HydrophobicContact CB-CD2 4.14Å; F157-Y229 HydrophobicContact CB-CE2 4.16Å; F157-Y229 HydrophobicContact CD2-CD2 4.44Å; F157-Y229 HydrophobicContact CD2-CE1 4.07Å; F157-Y229 AromaticContact CD2-CE2 3.95Å; F157-Y229 HydrophobicContact CD2-CE2 3.95Å; F157-Y229 AromaticContact CD2-CZ 3.73Å
158	N	95.3	Very high	94.1	Very high	14 Å²	14	49.9 Å²	49.9	8%	0.075	28%	0.279	C	S	.	.	H	α-helix	trans	-56.6	-37.3	178.7	-77.6	-11.8	0	0	0	111.5	Y90 R154 R155 V160 D161 R191 W192 W224	Y90-N158 VanDerWaalsContact CE2-OD1 3.32Å; Y90-N158 WeakPolarHBondContact CE2-OD1 3.43Å; Y90-N158 PolarHBondContact OH-ND2 3.32Å; Y90-N158 PolarHBondContact OH-OD1 3.3Å; R154-N158 VanDerWaalsContact O-CB 3.23Å; R154-N158 WeakPolarHBondContact O-CB 3.08Å; R154-N158 PolarHBondContact O-N 3.46Å; R154-N158 PolarHBondContact O-ND2 3.45Å; R155-N158 PolarHBondContact O-N 3.47Å; N158-V160 PolarHBondContact O-N 2.91Å; N158-D161 WeakPolarHBondContact O-CB 3.3Å; N158-D161 PolarHBondContact O-N 2.85Å; N158-R191 PolarHBondContact O-NH2 3.02Å; N158-W192 WeakPolarHBondContact O-CH2 3.47Å; N158-W224 HydrophobicContact CB-CH2 4.35Å
159	S	95.2	Very high	94.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-21.4	-177.8	-62.7	0	0	0	0	113.7	R155 A156 F157 R225 E226	R155-S159 WeakPolarHBondContact O-CB 3.35Å; R155-S159 PolarHBondContact O-N 2.9Å; R155-S159 PolarHBondContact O-OG 3.24Å; A156-S159 WeakPolarHBondContact O-CB 3.44Å; A156-S159 PolarHBondContact O-N 3.44Å; F157-S159 PolarHBondContact O-N 2.9Å; S159-R225 PolarHBondContact O-NE 3.04Å; S159-R225 PolarHBondContact O-NH2 2.87Å; S159-E226 WeakPolarHBondContact CB-O 3.4Å; S159-E226 PolarHBondContact OG-N 2.99Å; S159-E226 PolarHBondContact OG-O 2.9Å
160	V	93.6	Very high	93.9	Very high	28 Å²	28	50.7 Å²	50.7	17%	0.17	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	19.2	-177.3	-58.2	0	0	0	0	112.5	F157 N158 P162 F227 Y229 L230	F157-V160 VanDerWaalsContact O-CG2 3.24Å; F157-V160 WeakPolarHBondContact O-CG2 3.32Å; F157-V160 PolarHBondContact O-N 3.36Å; N158-V160 PolarHBondContact O-N 2.91Å; V160-P162 WeakPolarHBondContact O-CD 3.38Å; V160-P162 VanDerWaalsContact O-N 3.17Å; V160-F227 HydrophobicContact CG1-CD1 4Å; V160-Y229 HydrophobicContact CG2-CD1 3.59Å; V160-Y229 HydrophobicContact CG2-CE1 4.42Å; V160-Y229 HydrophobicContact CG2-CG 3.89Å; V160-L230 HydrophobicContact CB-CD1 4.44Å; V160-L230 HydrophobicContact CB-CG 4.44Å; V160-L230 HydrophobicContact CG1-CD1 3.67Å; V160-L230 HydrophobicContact CG1-CD2 4.45Å; V160-L230 HydrophobicContact CG1-CG 3.78Å
161	D	91.6	Very high	93.7	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.032	29%	0.293	C	S	.	.			trans	-52.2	112	176.5	176.8	2	0	0	0	111.9	R99 F157 N158 T163 F164 R191	R99-D161 IonicContact CZ-OD1 2.8Å; R99-D161 IonicContact NH2-OD1 2.79Å; R99-D161 PolarHBondContact NH2-OD1 3.06Å; F157-D161 PolarHBondContact O-N 2.91Å; N158-D161 WeakPolarHBondContact O-CB 3.3Å; N158-D161 PolarHBondContact O-N 2.85Å; D161-T163 PolarHBondContact O-N 3.35Å; D161-T163 WeakPolarHBondContact OD1-CB 3.4Å; D161-T163 PolarHBondContact OD1-N 2.83Å; D161-T163 PolarHBondContact OD1-OG1 2.66Å; D161-T163 PolarHBondContact OD2-OG1 2.95Å; D161-F164 HydrophobicContact CB-CB 4.38Å; D161-F164 WeakPolarHBondContact O-CB 3.38Å; D161-F164 PolarHBondContact O-N 2.85Å; D161-F164 VanDerWaalsContact O-N 3.1Å; D161-R191 IonicContact OD2-CZ 3.82Å; D161-R191 IonicContact OD2-NH1 2.85Å; D161-R191 IonicContact OD2-NH2 3.99Å; D161-R191 PolarHBondContact OD2-NH2 3.26Å
162	P	88.3	Confident	93.4	Very high	117 Å²	117	53.3 Å²	53.3	76%	0.76	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.1	-177.8	-23	34.5	0	0	0	113.9	V160 F164	V160-P162 WeakPolarHBondContact O-CD 3.38Å; V160-P162 VanDerWaalsContact O-N 3.17Å; P162-F164 VanDerWaalsContact C-N 3.26Å; P162-F164 PolarHBondContact O-N 2.83Å
163	T	89.9	Confident	93	Very high	92 Å²	92	54.2 Å²	54.2	56%	0.564	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-9.5	178.9	68.3	0	0	0	0	112.6	R99 D161 D165	R99-T163 PolarHBondContact NE-OG1 3.26Å; R99-T163 PolarHBondContact NH2-OG1 2.96Å; D161-T163 PolarHBondContact O-N 3.35Å; D161-T163 WeakPolarHBondContact OD1-CB 3.4Å; D161-T163 PolarHBondContact OD1-N 2.83Å; D161-T163 PolarHBondContact OD1-OG1 2.66Å; D161-T163 PolarHBondContact OD2-OG1 2.95Å; T163-D165 PolarHBondContact O-N 3.38Å
164	F	93.8	Very high	92.7	Very high	11 Å²	11	49.9 Å²	49.9	5%	0.048	27%	0.274	C	S	.	.	S	Bend	trans	-75.8	116.1	176.6	-175	-86.3	0	0	0	110.5	D161 P162 N166 R188 R191 W192	D161-F164 HydrophobicContact CB-CB 4.38Å; D161-F164 WeakPolarHBondContact O-CB 3.38Å; D161-F164 PolarHBondContact O-N 2.85Å; D161-F164 VanDerWaalsContact O-N 3.1Å; P162-F164 VanDerWaalsContact C-N 3.26Å; P162-F164 PolarHBondContact O-N 2.83Å; F164-N166 HydrophobicContact CD1-CB 4.48Å; F164-N166 VanDerWaalsContact CD1-OD1 3.25Å; F164-N166 WeakPolarHBondContact CD1-OD1 3.33Å; F164-N166 WeakPolarHBondContact CE1-OD1 3.34Å; F164-N166 PolarHBondContact O-N 3.37Å; F164-N166 VanDerWaalsContact O-N 3.14Å; F164-N166 PolarHBondContact O-ND2 2.78Å; F164-R188 HydrophobicContact CD2-CG 4.12Å; F164-R188 HydrophobicContact CE2-CG 3.5Å; F164-R188 VanDerWaalsContact CE2-CG 3.5Å; F164-R188 HydrophobicContact CZ-CG 3.95Å; F164-R191 HydrophobicContact CE2-CG 4.46Å; F164-W192 HydrophobicContact CD1-CZ2 4.38Å; F164-W192 AromaticContact CD2-CZ2 3.6Å; F164-W192 HydrophobicContact CD2-CZ2 3.6Å; F164-W192 HydrophobicContact CE1-CZ2 4.48Å; F164-W192 AromaticContact CE1-NE1 3.68Å; F164-W192 AromaticContact CE2-CE2 3.64Å; F164-W192 AromaticContact CE2-CZ2 3.67Å; F164-W192 HydrophobicContact CE2-CZ2 3.67Å; F164-W192 AromaticContact CE2-NE1 3.24Å; F164-W192 AromaticContact CG-CZ2 3.97Å; F164-W192 HydrophobicContact CG-CZ2 3.97Å; F164-W192 AromaticContact CZ-CE2 3.88Å; F164-W192 HydrophobicContact CZ-CZ2 4.16Å; F164-W192 AromaticContact CZ-NE1 3.05Å
165	D	94.7	Very high	91.9	Very high	66 Å²	66	56.1 Å²	56.1	35%	0.353	30%	0.302	S	S	.	.			trans	-70.3	106.6	172.2	171.4	25.6	0	0	0	111.1	T163 S167 R188	T163-D165 PolarHBondContact O-N 3.38Å; D165-S167 VanDerWaalsContact CG-OG 3.26Å; D165-S167 WeakPolarHBondContact OD1-CB 3.47Å; D165-S167 PolarHBondContact OD1-N 2.83Å; D165-S167 PolarHBondContact OD1-OG 2.93Å; D165-S167 PolarHBondContact OD2-OG 3.38Å; D165-S167 VanDerWaalsContact OD2-OG 3.1Å; D165-R188 VanDerWaalsContact CG-NH1 3.35Å; D165-R188 PolarHBondContact O-NH1 3.47Å; D165-R188 IonicContact OD2-CZ 2.88Å; D165-R188 IonicContact OD2-NH1 2.71Å; D165-R188 PolarHBondContact OD2-NH1 3.3Å; D165-R188 IonicContact OD2-NH2 3.82Å
166	N	94.3	Very high	91.4	Very high	60 Å²	60	57.1 Å²	57.1	32%	0.321	32%	0.316	S	S	.	.			trans	-87.8	1.7	177.5	-65.8	-78.4	0	0	0	113.2	F164 R225 R265	F164-N166 HydrophobicContact CD1-CB 4.48Å; F164-N166 VanDerWaalsContact CD1-OD1 3.25Å; F164-N166 WeakPolarHBondContact CD1-OD1 3.33Å; F164-N166 WeakPolarHBondContact CE1-OD1 3.34Å; F164-N166 PolarHBondContact O-N 3.37Å; F164-N166 VanDerWaalsContact O-N 3.14Å; F164-N166 PolarHBondContact O-ND2 2.78Å; N166-R225 PolarHBondContact OD1-NH1 3.46Å; N166-R225 PolarHBondContact OD1-NH2 3.04Å; N166-R265 WeakPolarHBondContact O-CD 3.38Å; N166-R265 PolarHBondContact O-NH1 3.49Å
167	S	95.2	Very high	91.3	Very high	63 Å²	63	61 Å²	61	44%	0.441	34%	0.336	S	S	.	.			trans	-58.7	148.5	-178.9	69.3	0	0	0	0	112.1	D165	D165-S167 VanDerWaalsContact CG-OG 3.26Å; D165-S167 WeakPolarHBondContact OD1-CB 3.47Å; D165-S167 PolarHBondContact OD1-N 2.83Å; D165-S167 PolarHBondContact OD1-OG 2.93Å; D165-S167 PolarHBondContact OD2-OG 3.38Å; D165-S167 VanDerWaalsContact OD2-OG 3.1Å
168	V	95.8	Very high	91.3	Very high	44 Å²	44	60.8 Å²	60.8	27%	0.267	34%	0.335	S	S	.	.			trans	-119.1	118	177.9	176	0	0	0	0	107.7	R265 T268 L269	V168-R265 HydrophobicContact CG2-CG 3.59Å; V168-T268 HydrophobicContact CG1-CG2 4.33Å; V168-L269 HydrophobicContact CG1-CB 3.85Å; V168-L269 HydrophobicContact CG1-CD1 4.16Å; V168-L269 HydrophobicContact CG2-CB 4.27Å
169	P	95.1	Very high	91.3	Very high	12 Å²	12	62.1 Å²	62.1	8%	0.078	34%	0.341	C	S	.	.			trans	-58.5	141.1	177.8	-24	32.8	0	0	0	112.3	V181 F182 V185 N272	P169-V181 HydrophobicContact CB-CG1 3.46Å; P169-V181 VanDerWaalsContact CB-CG1 3.46Å; P169-V181 HydrophobicContact CG-CG1 3.77Å; P169-F182 HydrophobicContact CB-CD1 4.43Å; P169-F182 HydrophobicContact CB-CE1 3.88Å; P169-F182 HydrophobicContact CB-CZ 4.01Å; P169-F182 HydrophobicContact CG-CD1 4.27Å; P169-F182 HydrophobicContact CG-CE1 4.12Å; P169-V185 HydrophobicContact CG-CB 4.48Å; P169-V185 HydrophobicContact CG-CG2 3.75Å; P169-N272 PolarHBondContact O-ND2 3.03Å
170	S	92.7	Very high	91.3	Very high	35 Å²	35	68.9 Å²	68.9	25%	0.245	37%	0.372	C	S	.	.			trans	-79.9	162.4	174.4	71.6	0	0	0	0	111.5	S172 E173	S170-S172 PolarHBondContact O-N 2.8Å; S170-S172 PolarHBondContact OG-OG 2.81Å; S170-S172 VanDerWaalsContact OG-OG 3.04Å; S170-E173 WeakPolarHBondContact CB-OE2 3.4Å; S170-E173 PolarHBondContact N-OE2 2.83Å; S170-E173 VanDerWaalsContact OG-CG 3.23Å; S170-E173 WeakPolarHBondContact OG-CG 3.31Å; S170-E173 PolarHBondContact OG-N 3.33Å; S170-E173 PolarHBondContact OG-OE2 3.46Å
171	K	90.4	Very high	91.4	Very high	115 Å²	115	69.4 Å²	69.4	50%	0.5	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-27.9	178.3	-59.8	176.6	-174.5	179.6	0	112.8	N272 S275	K171-N272 VanDerWaalsContact CE-OD1 3.25Å; K171-N272 WeakPolarHBondContact CE-OD1 3.21Å; K171-N272 HydrophobicContact CG-CB 4.26Å; K171-S275 WeakPolarHBondContact CD-OG 3.38Å; K171-S275 WeakPolarHBondContact CE-OG 3.35Å
172	S	87.8	Confident	91.7	Very high	94 Å²	94	69.1 Å²	69.1	66%	0.657	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-39.5	-179.2	35.6	0	0	0	0	112.7	S170 A174 K175	S170-S172 PolarHBondContact O-N 2.8Å; S170-S172 PolarHBondContact OG-OG 2.81Å; S170-S172 VanDerWaalsContact OG-OG 3.04Å; S172-A174 PolarHBondContact O-N 3.36Å; S172-K175 PolarHBondContact O-N 3.38Å
173	E	85.9	Confident	92.1	Very high	124 Å²	124	65.4 Å²	65.4	58%	0.579	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-27.7	-179	-71.8	158.8	158.7	0	0	112.3	S170	S170-E173 WeakPolarHBondContact CB-OE2 3.4Å; S170-E173 PolarHBondContact N-OE2 2.83Å; S170-E173 VanDerWaalsContact OG-CG 3.23Å; S170-E173 WeakPolarHBondContact OG-CG 3.31Å; S170-E173 PolarHBondContact OG-N 3.33Å; S170-E173 PolarHBondContact OG-OE2 3.46Å
174	A	86.4	Confident	92.4	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.008	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	11.4	-173.4	0	0	0	0	0	114.8	S172 D176 F178 V181 F182	S172-A174 PolarHBondContact O-N 3.36Å; A174-D176 PolarHBondContact O-N 2.76Å; A174-F178 WeakPolarHBondContact O-CA 3.39Å; A174-F178 PolarHBondContact O-N 3.21Å; A174-V181 HydrophobicContact CB-CB 4.28Å; A174-V181 HydrophobicContact CB-CG1 4.17Å; A174-F182 HydrophobicContact CB-CD2 3.81Å; A174-F182 HydrophobicContact CB-CE2 3.25Å; A174-F182 HydrophobicContact CB-CZ 4.2Å
175	K	79.4	Confident	92.6	Very high	160 Å²	160	63.5 Å²	63.5	70%	0.696	34%	0.341	S	S	*	.	S	Bend	trans	-62.1	-42.7	-171.9	-169.9	179.8	175.5	-169.9	0	113	S172	S172-K175 PolarHBondContact O-N 3.38Å
176	D	84.6	Confident	92.8	Very high	141 Å²	141	60.7 Å²	60.7	75%	0.754	33%	0.325	S	S	*	.	S	Bend	trans	-108.4	-22.9	-175.2	-56.7	-40.5	0	0	0	112.7	A174	A174-D176 PolarHBondContact O-N 2.76Å
177	N	91.6	Very high	92.9	Very high	87 Å²	87	64.3 Å²	64.3	47%	0.465	34%	0.341	S	S	.	.			trans	-124.2	42.9	-174.8	-62.3	-16.2	0	0	0	112.7	F179 E180 V181	N177-F179 VanDerWaalsContact C-N 3.33Å; N177-F179 PolarHBondContact O-N 2.67Å; N177-E180 HydrophobicContact CB-CB 4.27Å; N177-E180 PolarHBondContact O-N 2.94Å; N177-E180 VanDerWaalsContact O-N 3.14Å; N177-V181 HydrophobicContact CB-CG2 4.47Å; N177-V181 WeakPolarHBondContact O-CG2 3.33Å; N177-V181 PolarHBondContact O-N 2.9Å; N177-V181 VanDerWaalsContact O-N 3.08Å
178	F	95.9	Very high	92.9	Very high	6 Å²	6	65.1 Å²	65.1	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-45.8	-50.9	-173.5	171.7	-101.1	0	0	0	114.2	A174 V181 F182 L201 A273 D277 P278	A174-F178 WeakPolarHBondContact O-CA 3.39Å; A174-F178 PolarHBondContact O-N 3.21Å; F178-V181 PolarHBondContact O-N 3.41Å; F178-F182 AromaticContact CD2-CD2 3.5Å; F178-F182 HydrophobicContact CD2-CD2 3.5Å; F178-F182 VanDerWaalsContact CD2-CD2 3.5Å; F178-F182 AromaticContact CD2-CE2 3.91Å; F178-F182 HydrophobicContact CD2-CE2 3.91Å; F178-F182 AromaticContact CE2-CD2 3.5Å; F178-F182 HydrophobicContact CE2-CD2 3.5Å; F178-F182 VanDerWaalsContact CE2-CD2 3.5Å; F178-F182 AromaticContact CE2-CE2 3.94Å; F178-F182 HydrophobicContact CE2-CE2 3.94Å; F178-F182 HydrophobicContact CE2-CG 4.22Å; F178-F182 HydrophobicContact CG-CD2 4.39Å; F178-F182 HydrophobicContact CZ-CD2 4.4Å; F178-F182 PolarHBondContact O-N 3.24Å; F178-L201 HydrophobicContact CD1-CD2 4.49Å; F178-L201 HydrophobicContact CE1-CD1 4.01Å; F178-L201 HydrophobicContact CE1-CD2 3.81Å; F178-L201 HydrophobicContact CE1-CG 4.17Å; F178-L201 HydrophobicContact CZ-CD1 4.02Å; F178-L201 HydrophobicContact CZ-CD2 4.16Å; F178-A273 HydrophobicContact CE2-CB 4.19Å; F178-A273 WeakPolarHBondContact CE2-O 3.44Å; F178-A273 HydrophobicContact CZ-CB 4.48Å; F178-D277 HydrophobicContact CE1-CB 4.09Å; F178-D277 WeakPolarHBondContact CE1-OD2 3.34Å; F178-D277 HydrophobicContact CE2-CB 3.84Å; F178-D277 HydrophobicContact CZ-CB 3.56Å; F178-D277 WeakPolarHBondContact CZ-OD2 3.25Å; F178-P278 HydrophobicContact CB-CG 4.32Å
179	F	95.9	Very high	93	Very high	43 Å²	43	63 Å²	63	19%	0.189	32%	0.321	C	S	.	.	H	α-helix	trans	-69.4	-38.7	-176.1	-64.4	-76.9	0	0	0	112.5	N177 V181 S183 L201 G202 M204	N177-F179 VanDerWaalsContact C-N 3.33Å; N177-F179 PolarHBondContact O-N 2.67Å; F179-V181 VanDerWaalsContact C-N 3.3Å; F179-V181 PolarHBondContact O-N 2.93Å; F179-S183 WeakPolarHBondContact O-CB 3.5Å; F179-S183 PolarHBondContact O-N 3.25Å; F179-S183 PolarHBondContact O-OG 3.49Å; F179-L201 HydrophobicContact CD1-CD2 4.01Å; F179-L201 HydrophobicContact CD1-CG 4.14Å; F179-L201 HydrophobicContact CE1-CG 4.35Å; F179-G202 WeakPolarHBondContact CD1-O 3.4Å; F179-M204 HydrophobicContact CE2-CB 4.29Å; F179-M204 HydrophobicContact CE2-CE 4.19Å
180	E	95.3	Very high	93	Very high	141 Å²	141	64 Å²	64	66%	0.659	33%	0.329	S	S	*	.	H	α-helix	trans	-66.5	-36.1	179.2	-60.7	-179.8	172.4	0	0	111.3	N177 P184	N177-E180 HydrophobicContact CB-CB 4.27Å; N177-E180 PolarHBondContact O-N 2.94Å; N177-E180 VanDerWaalsContact O-N 3.14Å; E180-P184 WeakPolarHBondContact O-CD 3.3Å; E180-P184 VanDerWaalsContact O-CG 3.26Å; E180-P184 WeakPolarHBondContact O-CG 3.32Å
181	V	96.1	Very high	93.1	Very high	39 Å²	39	64.3 Å²	64.3	24%	0.236	32%	0.324	C	S	.	.	H	α-helix	trans	-76.8	-48.6	-179.8	174.5	0	0	0	0	111.8	P169 A174 N177 F178 F179 V185	P169-V181 HydrophobicContact CB-CG1 3.46Å; P169-V181 VanDerWaalsContact CB-CG1 3.46Å; P169-V181 HydrophobicContact CG-CG1 3.77Å; A174-V181 HydrophobicContact CB-CB 4.28Å; A174-V181 HydrophobicContact CB-CG1 4.17Å; N177-V181 HydrophobicContact CB-CG2 4.47Å; N177-V181 WeakPolarHBondContact O-CG2 3.33Å; N177-V181 PolarHBondContact O-N 2.9Å; N177-V181 VanDerWaalsContact O-N 3.08Å; F178-V181 PolarHBondContact O-N 3.41Å; F179-V181 VanDerWaalsContact C-N 3.3Å; F179-V181 PolarHBondContact O-N 2.93Å; V181-V185 WeakPolarHBondContact O-CG2 3.28Å
182	F	97.3	Very high	93.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-89.4	-31.7	-171.3	-79.1	-73.4	0	0	0	114.7	P169 A174 F178 V185 F186 L201 L269 N272 A273 C276	P169-F182 HydrophobicContact CB-CD1 4.43Å; P169-F182 HydrophobicContact CB-CE1 3.88Å; P169-F182 HydrophobicContact CB-CZ 4.01Å; P169-F182 HydrophobicContact CG-CD1 4.27Å; P169-F182 HydrophobicContact CG-CE1 4.12Å; A174-F182 HydrophobicContact CB-CD2 3.81Å; A174-F182 HydrophobicContact CB-CE2 3.25Å; A174-F182 HydrophobicContact CB-CZ 4.2Å; F178-F182 AromaticContact CD2-CD2 3.5Å; F178-F182 HydrophobicContact CD2-CD2 3.5Å; F178-F182 VanDerWaalsContact CD2-CD2 3.5Å; F178-F182 AromaticContact CD2-CE2 3.91Å; F178-F182 HydrophobicContact CD2-CE2 3.91Å; F178-F182 AromaticContact CE2-CD2 3.5Å; F178-F182 HydrophobicContact CE2-CD2 3.5Å; F178-F182 VanDerWaalsContact CE2-CD2 3.5Å; F178-F182 AromaticContact CE2-CE2 3.94Å; F178-F182 HydrophobicContact CE2-CE2 3.94Å; F178-F182 HydrophobicContact CE2-CG 4.22Å; F178-F182 HydrophobicContact CG-CD2 4.39Å; F178-F182 HydrophobicContact CZ-CD2 4.4Å; F178-F182 PolarHBondContact O-N 3.24Å; F182-V185 PolarHBondContact O-N 3.43Å; F182-F186 HydrophobicContact CB-CD2 4.01Å; F182-F186 HydrophobicContact CB-CE2 3.93Å; F182-F186 AromaticContact CD1-CE2 3.98Å; F182-F186 HydrophobicContact CD1-CE2 3.98Å; F182-F186 HydrophobicContact CG-CE2 4.28Å; F182-F186 VanDerWaalsContact O-CD2 3.22Å; F182-F186 WeakPolarHBondContact O-CD2 3.48Å; F182-F186 PolarHBondContact O-N 3.45Å; F182-L201 HydrophobicContact CB-CD2 3.83Å; F182-L269 HydrophobicContact CD1-CD1 3.82Å; F182-L269 HydrophobicContact CE1-CD1 3.84Å; F182-N272 HydrophobicContact CE1-CB 4.41Å; F182-N272 HydrophobicContact CZ-CB 4.17Å; F182-A273 HydrophobicContact CD1-CB 3.76Å; F182-A273 HydrophobicContact CD2-CB 4.34Å; F182-A273 HydrophobicContact CE1-CB 3.78Å; F182-A273 HydrophobicContact CE2-CB 4.31Å; F182-A273 HydrophobicContact CG-CB 4.06Å; F182-A273 HydrophobicContact CZ-CB 4.07Å; F182-C276 WeakPolarHBondContact CE2-SG 3.44Å
183	S	96.6	Very high	93.8	Very high	40 Å²	40	54.9 Å²	54.9	28%	0.28	27%	0.273	S	S	.	.	H	α-helix	trans	-54.9	-52.4	-179.2	-59.1	0	0	0	0	113.3	F179 V185 F186 E187	F179-S183 WeakPolarHBondContact O-CB 3.5Å; F179-S183 PolarHBondContact O-N 3.25Å; F179-S183 PolarHBondContact O-OG 3.49Å; S183-V185 PolarHBondContact O-N 2.88Å; S183-F186 PolarHBondContact O-N 3.43Å; S183-E187 WeakPolarHBondContact O-CB 3.4Å; S183-E187 PolarHBondContact O-N 2.9Å
184	P	96.8	Very high	94.3	Very high	56 Å²	56	52.7 Å²	52.7	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-65	-30.5	-179.3	25.6	-34.7	0	0	0	112.3	E180 R188	E180-P184 WeakPolarHBondContact O-CD 3.3Å; E180-P184 VanDerWaalsContact O-CG 3.26Å; E180-P184 WeakPolarHBondContact O-CG 3.32Å; P184-R188 VanDerWaalsContact O-CB 3.24Å; P184-R188 WeakPolarHBondContact O-CB 3.27Å; P184-R188 PolarHBondContact O-N 2.94Å
185	V	97.6	Very high	94.7	Very high	7 Å²	7	57.7 Å²	57.7	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-70.7	-45.7	178.7	-178.3	0	0	0	0	110.6	P169 V181 F182 S183 R188 N189 L269	P169-V185 HydrophobicContact CG-CB 4.48Å; P169-V185 HydrophobicContact CG-CG2 3.75Å; V181-V185 WeakPolarHBondContact O-CG2 3.28Å; F182-V185 PolarHBondContact O-N 3.43Å; S183-V185 PolarHBondContact O-N 2.88Å; V185-R188 PolarHBondContact O-N 2.72Å; V185-N189 PolarHBondContact O-N 3.42Å; V185-N189 PolarHBondContact O-ND2 2.95Å; V185-L269 HydrophobicContact CB-CD1 4.43Å; V185-L269 HydrophobicContact CG1-CD1 3.61Å; V185-L269 HydrophobicContact CG1-CD2 3.84Å; V185-L269 HydrophobicContact CG1-CG 4.4Å
186	F	98	Very high	95.1	Very high	6 Å²	6	59.7 Å²	59.7	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-41.4	174.7	-77.1	-64.4	0	0	0	112	F182 S183 R188 N189 S190 L201 F214 W218 L269 V270 A273	F182-F186 HydrophobicContact CB-CD2 4.01Å; F182-F186 HydrophobicContact CB-CE2 3.93Å; F182-F186 AromaticContact CD1-CE2 3.98Å; F182-F186 HydrophobicContact CD1-CE2 3.98Å; F182-F186 HydrophobicContact CG-CE2 4.28Å; F182-F186 VanDerWaalsContact O-CD2 3.22Å; F182-F186 WeakPolarHBondContact O-CD2 3.48Å; F182-F186 PolarHBondContact O-N 3.45Å; S183-F186 PolarHBondContact O-N 3.43Å; F186-R188 PolarHBondContact O-N 3.5Å; F186-N189 PolarHBondContact O-N 2.89Å; F186-S190 WeakPolarHBondContact O-CB 3.38Å; F186-S190 PolarHBondContact O-N 3.2Å; F186-L201 HydrophobicContact CD2-CD1 4.5Å; F186-L201 HydrophobicContact CD2-CD2 4.44Å; F186-L201 HydrophobicContact CE2-CD1 4.44Å; F186-F214 HydrophobicContact CB-CZ 4.4Å; F186-F214 AromaticContact CD1-CZ 3.97Å; F186-F214 HydrophobicContact CD1-CZ 3.97Å; F186-F214 HydrophobicContact CD2-CE1 4.5Å; F186-F214 AromaticContact CD2-CZ 3.67Å; F186-F214 HydrophobicContact CD2-CZ 3.67Å; F186-F214 HydrophobicContact CE1-CZ 4.08Å; F186-F214 HydrophobicContact CE2-CE1 4.2Å; F186-F214 AromaticContact CE2-CZ 3.8Å; F186-F214 HydrophobicContact CE2-CZ 3.8Å; F186-F214 HydrophobicContact CG-CE2 4.37Å; F186-F214 AromaticContact CG-CZ 3.76Å; F186-F214 HydrophobicContact CG-CZ 3.76Å; F186-F214 HydrophobicContact CZ-CE1 4.26Å; F186-F214 HydrophobicContact CZ-CZ 4.01Å; F186-W218 HydrophobicContact CB-CH2 4.46Å; F186-W218 HydrophobicContact CB-CZ2 3.88Å; F186-W218 AromaticContact CD1-CD2 3.63Å; F186-W218 HydrophobicContact CD1-CD2 3.63Å; F186-W218 AromaticContact CD1-CE2 3.45Å; F186-W218 VanDerWaalsContact CD1-CE2 3.45Å; F186-W218 AromaticContact CD1-CE3 3.95Å; F186-W218 HydrophobicContact CD1-CE3 3.95Å; F186-W218 HydrophobicContact CD1-CG 4.18Å; F186-W218 AromaticContact CD1-CH2 3.94Å; F186-W218 HydrophobicContact CD1-CH2 3.94Å; F186-W218 AromaticContact CD1-CZ2 3.63Å; F186-W218 HydrophobicContact CD1-CZ2 3.63Å; F186-W218 HydrophobicContact CD1-CZ3 4.1Å; F186-W218 AromaticContact CD1-NE1 3.87Å; F186-W218 AromaticContact CE1-CD2 3.88Å; F186-W218 HydrophobicContact CE1-CD2 3.88Å; F186-W218 HydrophobicContact CE1-CE3 4.16Å; F186-W218 HydrophobicContact CE1-CG 4.08Å; F186-W218 HydrophobicContact CG-CZ2 4.21Å; F186-W218 VanDerWaalsContact O-CH2 3.31Å; F186-W218 WeakPolarHBondContact O-CH2 3.49Å; F186-W218 WeakPolarHBondContact O-CZ2 3.49Å; F186-L269 HydrophobicContact CD1-CD2 4.03Å; F186-L269 HydrophobicContact CD1-CG 4.43Å; F186-L269 HydrophobicContact CE1-CD2 3.87Å; F186-L269 HydrophobicContact CE1-CG 3.83Å; F186-L269 HydrophobicContact CZ-CD1 4.38Å; F186-L269 HydrophobicContact CZ-CD2 4.47Å; F186-L269 HydrophobicContact CZ-CG 3.99Å; F186-V270 HydrophobicContact CE1-CG2 4.08Å; F186-A273 HydrophobicContact CE2-CB 3.72Å; F186-A273 HydrophobicContact CZ-CB 3.73Å
187	E	96.2	Very high	95.5	Very high	137 Å²	137	60.2 Å²	60.2	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-60.7	-45	176.2	-177.1	168.6	-156.9	0	0	111.6	S183 N189 S190	S183-E187 WeakPolarHBondContact O-CB 3.4Å; S183-E187 PolarHBondContact O-N 2.9Å; E187-N189 PolarHBondContact O-N 3.28Å; E187-S190 VanDerWaalsContact O-CB 3.31Å; E187-S190 WeakPolarHBondContact O-CB 3.47Å; E187-S190 PolarHBondContact O-N 2.95Å; E187-S190 PolarHBondContact O-OG 3.42Å
188	R	95.8	Very high	95.7	Very high	79 Å²	79	57.9 Å²	57.9	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-62.8	-42.8	177.2	-166.8	-168.2	-57.4	132.6	1.4	112.2	F164 D165 P184 V185 F186 S190 R191	F164-R188 HydrophobicContact CD2-CG 4.12Å; F164-R188 HydrophobicContact CE2-CG 3.5Å; F164-R188 VanDerWaalsContact CE2-CG 3.5Å; F164-R188 HydrophobicContact CZ-CG 3.95Å; D165-R188 VanDerWaalsContact CG-NH1 3.35Å; D165-R188 PolarHBondContact O-NH1 3.47Å; D165-R188 IonicContact OD2-CZ 2.88Å; D165-R188 IonicContact OD2-NH1 2.71Å; D165-R188 PolarHBondContact OD2-NH1 3.3Å; D165-R188 IonicContact OD2-NH2 3.82Å; P184-R188 VanDerWaalsContact O-CB 3.24Å; P184-R188 WeakPolarHBondContact O-CB 3.27Å; P184-R188 PolarHBondContact O-N 2.94Å; V185-R188 PolarHBondContact O-N 2.72Å; F186-R188 PolarHBondContact O-N 3.5Å; R188-S190 VanDerWaalsContact C-N 3.29Å; R188-S190 PolarHBondContact O-N 3.48Å; R188-R191 WeakPolarHBondContact O-CG 3.47Å
189	N	97	Very high	95.8	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-72.6	-21.8	178.5	-75.4	-79.6	0	0	0	112.7	V185 F186 E187 R191 W192 W218 R265 I266	V185-N189 PolarHBondContact O-N 3.42Å; V185-N189 PolarHBondContact O-ND2 2.95Å; F186-N189 PolarHBondContact O-N 2.89Å; E187-N189 PolarHBondContact O-N 3.28Å; N189-R191 PolarHBondContact O-N 2.81Å; N189-R191 VanDerWaalsContact O-N 3.13Å; N189-W192 WeakPolarHBondContact O-CB 3.39Å; N189-W192 PolarHBondContact O-N 2.96Å; N189-W192 VanDerWaalsContact O-N 3.08Å; N189-W218 HydrophobicContact CB-CH2 3.84Å; N189-W218 HydrophobicContact CB-CZ3 4.05Å; N189-R265 PolarHBondContact OD1-NH2 3.35Å; N189-I266 HydrophobicContact CB-CD1 4.18Å; N189-I266 WeakPolarHBondContact OD1-CD1 3.39Å
190	S	96.4	Very high	95.8	Very high	34 Å²	34	65.7 Å²	65.7	24%	0.238	32%	0.324	C	S	.	.	H	α-helix	trans	-58.4	-27.2	177.6	78.9	0	0	0	0	112.5	F186 E187 R188 W192 S193	F186-S190 WeakPolarHBondContact O-CB 3.38Å; F186-S190 PolarHBondContact O-N 3.2Å; E187-S190 VanDerWaalsContact O-CB 3.31Å; E187-S190 WeakPolarHBondContact O-CB 3.47Å; E187-S190 PolarHBondContact O-N 2.95Å; E187-S190 PolarHBondContact O-OG 3.42Å; R188-S190 VanDerWaalsContact C-N 3.29Å; R188-S190 PolarHBondContact O-N 3.48Å; S190-W192 PolarHBondContact O-N 2.86Å; S190-S193 WeakPolarHBondContact O-CB 3.3Å; S190-S193 PolarHBondContact O-N 2.85Å
191	R	94.1	Very high	95.9	Very high	40 Å²	40	59.4 Å²	59.4	15%	0.151	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.5	177.6	91.5	179.5	-149.7	180	3.9	112.8	Y100 N158 D161 F164 R188 N189 W224	Y100-R191 VanDerWaalsContact CE1-NH1 3.28Å; Y100-R191 HydrophobicContact CE2-CB 4.37Å; N158-R191 PolarHBondContact O-NH2 3.02Å; D161-R191 IonicContact OD2-CZ 3.82Å; D161-R191 IonicContact OD2-NH1 2.85Å; D161-R191 IonicContact OD2-NH2 3.99Å; D161-R191 PolarHBondContact OD2-NH2 3.26Å; F164-R191 HydrophobicContact CE2-CG 4.46Å; R188-R191 WeakPolarHBondContact O-CG 3.47Å; N189-R191 PolarHBondContact O-N 2.81Å; N189-R191 VanDerWaalsContact O-N 3.13Å; R191-W224 VanDerWaalsContact O-CE2 3.31Å; R191-W224 VanDerWaalsContact O-CZ2 3.27Å; R191-W224 WeakPolarHBondContact O-CZ2 3.33Å; R191-W224 PolarHBondContact O-NE1 3.11Å
192	W	96.3	Very high	95.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-2.5	-178.7	-52	131.5	0	0	0	114.4	N158 F164 N189 S190 F221 S223 W224 R225	N158-W192 WeakPolarHBondContact O-CH2 3.47Å; F164-W192 HydrophobicContact CD1-CZ2 4.38Å; F164-W192 AromaticContact CD2-CZ2 3.6Å; F164-W192 HydrophobicContact CD2-CZ2 3.6Å; F164-W192 HydrophobicContact CE1-CZ2 4.48Å; F164-W192 AromaticContact CE1-NE1 3.68Å; F164-W192 AromaticContact CE2-CE2 3.64Å; F164-W192 AromaticContact CE2-CZ2 3.67Å; F164-W192 HydrophobicContact CE2-CZ2 3.67Å; F164-W192 AromaticContact CE2-NE1 3.24Å; F164-W192 AromaticContact CG-CZ2 3.97Å; F164-W192 HydrophobicContact CG-CZ2 3.97Å; F164-W192 AromaticContact CZ-CE2 3.88Å; F164-W192 HydrophobicContact CZ-CZ2 4.16Å; F164-W192 AromaticContact CZ-NE1 3.05Å; N189-W192 WeakPolarHBondContact O-CB 3.39Å; N189-W192 PolarHBondContact O-N 2.96Å; N189-W192 VanDerWaalsContact O-N 3.08Å; S190-W192 PolarHBondContact O-N 2.86Å; W192-F221 HydrophobicContact CB-CE1 4.32Å; W192-F221 HydrophobicContact CB-CZ 4.17Å; W192-S223 WeakPolarHBondContact CB-OG 3.44Å; W192-S223 CarbonylContact O-C 3.1Å; W192-S223 WeakPolarHBondContact O-CA 3.44Å; W192-S223 PolarHBondContact O-OG 3.3Å; W192-W224 VanDerWaalsContact C-CD1 3.47Å; W192-W224 HydrophobicContact CE3-CD2 4.47Å; W192-W224 HydrophobicContact CE3-CE3 4.36Å; W192-W224 AromaticContact CE3-CH2 3.45Å; W192-W224 HydrophobicContact CE3-CH2 3.45Å; W192-W224 VanDerWaalsContact CE3-CH2 3.45Å; W192-W224 AromaticContact CE3-CZ2 3.5Å; W192-W224 HydrophobicContact CE3-CZ2 3.5Å; W192-W224 AromaticContact CE3-CZ3 3.86Å; W192-W224 HydrophobicContact CE3-CZ3 3.86Å; W192-W224 AromaticContact CZ3-CH2 3.31Å; W192-W224 HydrophobicContact CZ3-CH2 3.31Å; W192-W224 AromaticContact CZ3-CZ2 3.83Å; W192-W224 HydrophobicContact CZ3-CZ2 3.83Å; W192-W224 AromaticContact CZ3-CZ3 3.74Å; W192-W224 HydrophobicContact CZ3-CZ3 3.74Å; W192-W224 PolarHBondContact O-N 3.26Å; W192-R225 HydrophobicContact CB-CB 4.33Å; W192-R225 HydrophobicContact CD2-CB 4.39Å; W192-R225 HydrophobicContact CD2-CG 4.28Å; W192-R225 HydrophobicContact CE3-CB 4.31Å; W192-R225 HydrophobicContact CE3-CG 4.22Å; W192-R225 HydrophobicContact CG-CB 4.43Å; W192-R225 HydrophobicContact CZ3-CG 4.44Å
193	S	96.9	Very high	95.7	Very high	12 Å²	12	63.4 Å²	63.4	8%	0.084	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-75.4	139.8	-175.8	-166.6	0	0	0	0	112.6	S190 K195 F217 D222 W224	S190-S193 WeakPolarHBondContact O-CB 3.3Å; S190-S193 PolarHBondContact O-N 2.85Å; S193-K195 PolarHBondContact O-N 3.4Å; S193-K195 PolarHBondContact OG-N 3.38Å; S193-K195 VanDerWaalsContact OG-N 3.11Å; S193-K195 PolarHBondContact OG-O 3.03Å; S193-F217 WeakPolarHBondContact OG-CZ 3.46Å; S193-D222 WeakPolarHBondContact CA-O 3.47Å; S193-W224 VanDerWaalsContact O-CD1 3.23Å
194	N	95.6	Very high	95.6	Very high	77 Å²	77	66.7 Å²	66.7	41%	0.412	34%	0.336	S	S	.	.	S	Bend	trans	-68.5	-23.3	165.8	-78.5	-44	0	0	0	112.6	D222 S223 W224	N194-D222 WeakPolarHBondContact CB-OD2 3.14Å; N194-D222 PolarHBondContact N-O 2.96Å; N194-D222 PolarHBondContact ND2-OD1 3.09Å; N194-D222 PolarHBondContact ND2-OD2 3.42Å; N194-S223 PolarHBondContact ND2-O 2.95Å; N194-W224 VanDerWaalsContact OD1-CB 3.27Å; N194-W224 WeakPolarHBondContact OD1-CB 3.25Å
195	K	94.5	Very high	95.4	Very high	107 Å²	107	71 Å²	71	47%	0.465	36%	0.356	S	S	.	.	S	Bend	trans	-91.9	130.6	-178.5	-64.6	175.6	-177.9	172.3	0	109.6	S193 F217	S193-K195 PolarHBondContact O-N 3.4Å; S193-K195 PolarHBondContact OG-N 3.38Å; S193-K195 VanDerWaalsContact OG-N 3.11Å; S193-K195 PolarHBondContact OG-O 3.03Å; K195-F217 HydrophobicContact CB-CE2 3.9Å; K195-F217 HydrophobicContact CB-CZ 4.36Å; K195-F217 HydrophobicContact CD-CD2 4.18Å; K195-F217 HydrophobicContact CD-CE2 3.62Å; K195-F217 HydrophobicContact CG-CE2 4.36Å
196	K	89	Confident	95.3	Very high	202 Å²	202	71.7 Å²	71.7	88%	0.878	36%	0.362	S	S	*	.	S	Bend	trans	-69.2	-39.7	-178.8	-65.8	-174.5	178.9	-177.8	0	113.2	V198	K196-V198 PolarHBondContact O-N 3.23Å
197	N	92.3	Very high	95.2	Very high	151 Å²	151	73.4 Å²	73.4	81%	0.807	37%	0.374	S	S	*	.			trans	-94.1	92.7	-177.4	-62.5	-14	0	0	0	109
198	V	96.2	Very high	95.1	Very high	38 Å²	38	71.9 Å²	71.9	23%	0.23	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-91.1	121.7	176.8	-177.5	0	0	0	0	109.3	K196 F217 W218	K196-V198 PolarHBondContact O-N 3.23Å; V198-F217 HydrophobicContact CB-CE1 4.37Å; V198-F217 HydrophobicContact CB-CZ 4.12Å; V198-F217 HydrophobicContact CG1-CD1 4.28Å; V198-F217 HydrophobicContact CG1-CE1 3.59Å; V198-F217 HydrophobicContact CG1-CZ 3.85Å; V198-F217 HydrophobicContact CG2-CE1 4.34Å; V198-F217 HydrophobicContact CG2-CZ 3.79Å; V198-W218 HydrophobicContact CG1-CZ2 4Å
199	P	97.1	Very high	95.1	Very high	33 Å²	33	74 Å²	74	21%	0.214	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-60	137.3	174.9	-22.9	34	0	0	0	111.5	I213 F214 F217	P199-I213 HydrophobicContact CB-CG2 4.39Å; P199-I213 HydrophobicContact CG-CG2 3.98Å; P199-F214 HydrophobicContact CB-CB 4.3Å; P199-F214 HydrophobicContact CB-CD2 4.23Å; P199-F214 WeakPolarHBondContact O-CD2 3.41Å; P199-F217 VanDerWaalsContact CD-CD2 3.48Å; P199-F217 VanDerWaalsContact CD-CG 3.47Å; P199-F217 HydrophobicContact CG-CB 3.85Å; P199-F217 HydrophobicContact CG-CD2 4.11Å; P199-F217 HydrophobicContact CG-CG 3.95Å
200	K	96.4	Very high	95.1	Very high	181 Å²	181	78.4 Å²	78.4	79%	0.787	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-81	155.7	173.8	-64	-174.6	178	-174.1	0	110.1	G202 F214	K200-G202 PolarHBondContact O-N 2.88Å; K200-F214 VanDerWaalsContact C-CD2 3.41Å; K200-F214 WeakPolarHBondContact O-CD2 3.45Å
201	L	96.8	Very high	95.1	Very high	9 Å²	9	76.9 Å²	76.9	5%	0.047	39%	0.392	C	S	.	.			trans	-61.4	-28.7	178.4	-177.4	62.4	0	0	0	112.6	F178 F179 F182 F186 F214 R279	F178-L201 HydrophobicContact CD1-CD2 4.49Å; F178-L201 HydrophobicContact CE1-CD1 4.01Å; F178-L201 HydrophobicContact CE1-CD2 3.81Å; F178-L201 HydrophobicContact CE1-CG 4.17Å; F178-L201 HydrophobicContact CZ-CD1 4.02Å; F178-L201 HydrophobicContact CZ-CD2 4.16Å; F179-L201 HydrophobicContact CD1-CD2 4.01Å; F179-L201 HydrophobicContact CD1-CG 4.14Å; F179-L201 HydrophobicContact CE1-CG 4.35Å; F182-L201 HydrophobicContact CB-CD2 3.83Å; F186-L201 HydrophobicContact CD2-CD1 4.5Å; F186-L201 HydrophobicContact CD2-CD2 4.44Å; F186-L201 HydrophobicContact CE2-CD1 4.44Å; L201-F214 VanDerWaalsContact CA-CE2 3.49Å; L201-F214 HydrophobicContact CB-CE2 3.95Å; L201-F214 HydrophobicContact CB-CZ 4.02Å; L201-F214 HydrophobicContact CD1-CD1 3.93Å; L201-F214 HydrophobicContact CD1-CE1 3.33Å; L201-F214 HydrophobicContact CD1-CE2 4.16Å; L201-F214 HydrophobicContact CD1-CZ 3.47Å; L201-F214 VanDerWaalsContact CD1-CZ 3.47Å; L201-F214 HydrophobicContact CG-CZ 4.34Å; L201-R279 PolarHBondContact O-NH1 3.5Å; L201-R279 PolarHBondContact O-NH2 2.91Å
202	G	95.3	Very high	95.3	Very high	38 Å²	38	78.8 Å²	78.8	39%	0.392	41%	0.405	S	S	.	.			trans	81.9	-152.4	-179.4	0	0	0	0	0	112.5	F179 K200	F179-G202 WeakPolarHBondContact CD1-O 3.4Å; K200-G202 PolarHBondContact O-N 2.88Å
203	D	94.4	Very high	95.3	Very high	85 Å²	85	83.4 Å²	83.4	46%	0.455	43%	0.429	S	S	.	.			trans	-135.6	-175.3	-177.7	61.9	26.1	0	0	0	110.8	N205 S206 R279	D203-N205 PolarHBondContact O-N 3.4Å; D203-N205 WeakPolarHBondContact OD1-CA 3.26Å; D203-N205 PolarHBondContact OD1-N 3.14Å; D203-S206 PolarHBondContact N-OG 3.04Å; D203-S206 WeakPolarHBondContact O-CB 3.12Å; D203-S206 PolarHBondContact O-N 3.45Å; D203-S206 PolarHBondContact O-OG 2.9Å; D203-S206 PolarHBondContact OD1-N 3.1Å; D203-S206 PolarHBondContact OD1-OG 3.34Å; D203-S206 VanDerWaalsContact OD1-OG 3.08Å; D203-R279 WeakPolarHBondContact O-CD 3.48Å; D203-R279 PolarHBondContact O-NH1 3.04Å
204	M	93.9	Very high	95.4	Very high	108 Å²	108	82.9 Å²	82.9	53%	0.532	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.7	180	-169.7	63.7	78.9	0	0	113.7	F179 P278 R279	F179-M204 HydrophobicContact CE2-CB 4.29Å; F179-M204 HydrophobicContact CE2-CE 4.19Å; M204-P278 HydrophobicContact CE-CB 3.95Å; M204-P278 HydrophobicContact CE-CG 4.24Å; M204-P278 HydrophobicContact SD-CB 4.13Å; M204-R279 HydrophobicContact SD-CG 4.2Å
205	N	93.7	Very high	95.5	Very high	147 Å²	147	79.4 Å²	79.4	79%	0.786	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	0	-175.9	-62.6	-37.8	0	0	0	112.8	D203	D203-N205 PolarHBondContact O-N 3.4Å; D203-N205 WeakPolarHBondContact OD1-CA 3.26Å; D203-N205 PolarHBondContact OD1-N 3.14Å
206	S	95.4	Very high	95.7	Very high	22 Å²	22	76.7 Å²	76.7	15%	0.154	40%	0.401	C	S	.	.			trans	-61.7	138.5	179.1	-56.5	0	0	0	0	111.3	D203 R279	D203-S206 PolarHBondContact N-OG 3.04Å; D203-S206 WeakPolarHBondContact O-CB 3.12Å; D203-S206 PolarHBondContact O-N 3.45Å; D203-S206 PolarHBondContact O-OG 2.9Å; D203-S206 PolarHBondContact OD1-N 3.1Å; D203-S206 PolarHBondContact OD1-OG 3.34Å; D203-S206 VanDerWaalsContact OD1-OG 3.08Å; S206-R279 PolarHBondContact OG-NH1 3.45Å
207	S	95.9	Very high	96.1	Very high	42 Å²	42	68 Å²	68	29%	0.294	36%	0.363	S	S	.	.			trans	-66.3	163.2	-178.5	69.9	0	0	0	0	111.9	E209 D210 V211	S207-E209 PolarHBondContact O-N 2.69Å; S207-D210 PolarHBondContact O-N 3.42Å; S207-D210 PolarHBondContact OG-N 3.2Å; S207-D210 VanDerWaalsContact OG-N 3.09Å; S207-D210 PolarHBondContact OG-OD2 2.88Å; S207-V211 VanDerWaalsContact O-CG2 3.27Å; S207-V211 WeakPolarHBondContact O-CG2 3.44Å; S207-V211 PolarHBondContact O-N 3.38Å; S207-V211 VanDerWaalsContact O-N 3.11Å
208	F	94.3	Very high	96.4	Very high	105 Å²	105	61 Å²	61	46%	0.461	33%	0.325	S	S	.	.	H	α-helix	trans	-58.9	-40.5	173.9	174.4	-93.7	0	0	0	110.8	V211 D212 F283	F208-V211 PolarHBondContact O-N 3.23Å; F208-D212 HydrophobicContact CE1-CB 4.31Å; F208-D212 WeakPolarHBondContact O-CB 3.4Å; F208-D212 PolarHBondContact O-N 2.95Å; F208-F283 HydrophobicContact CB-CD2 4.45Å; F208-F283 HydrophobicContact CB-CE1 4.22Å; F208-F283 HydrophobicContact CB-CE2 4.13Å; F208-F283 HydrophobicContact CB-CZ 4.01Å; F208-F283 HydrophobicContact CD2-CB 4.12Å; F208-F283 HydrophobicContact CD2-CD1 4.42Å; F208-F283 AromaticContact CD2-CD2 3.55Å; F208-F283 HydrophobicContact CD2-CD2 3.55Å; F208-F283 AromaticContact CD2-CE2 3.98Å; F208-F283 HydrophobicContact CD2-CE2 3.98Å; F208-F283 AromaticContact CD2-CG 3.8Å; F208-F283 HydrophobicContact CD2-CG 3.8Å; F208-F283 HydrophobicContact CE2-CD2 4.33Å; F208-F283 HydrophobicContact CG-CD2 4.48Å
209	E	96.1	Very high	96.5	Very high	123 Å²	123	62.8 Å²	62.8	58%	0.575	33%	0.328	S	S	*	.	H	α-helix	trans	-62.3	-46	179.6	-66.8	73.8	-165	0	0	111.8	S207 V211 D212 I213	S207-E209 PolarHBondContact O-N 2.69Å; E209-V211 VanDerWaalsContact C-N 3.33Å; E209-V211 PolarHBondContact O-N 2.97Å; E209-D212 PolarHBondContact O-N 3.45Å; E209-I213 WeakPolarHBondContact O-CB 3.36Å; E209-I213 VanDerWaalsContact O-CG1 3.24Å; E209-I213 WeakPolarHBondContact O-CG1 3.32Å; E209-I213 PolarHBondContact O-N 3.44Å
210	D	96.4	Very high	96.5	Very high	92 Å²	92	66.7 Å²	66.7	49%	0.492	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-41.3	178.4	-64.1	-45.1	0	0	0	111.4	S207 I213 F214	S207-D210 PolarHBondContact O-N 3.42Å; S207-D210 PolarHBondContact OG-N 3.2Å; S207-D210 VanDerWaalsContact OG-N 3.09Å; S207-D210 PolarHBondContact OG-OD2 2.88Å; D210-I213 PolarHBondContact O-N 2.93Å; D210-F214 WeakPolarHBondContact O-CB 3.39Å; D210-F214 PolarHBondContact O-N 3.41Å
211	V	97.4	Very high	96.6	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-66.2	-41.1	177.3	174.8	0	0	0	0	111	S207 F208 E209 F214 Y215 I280 F283	S207-V211 VanDerWaalsContact O-CG2 3.27Å; S207-V211 WeakPolarHBondContact O-CG2 3.44Å; S207-V211 PolarHBondContact O-N 3.38Å; S207-V211 VanDerWaalsContact O-N 3.11Å; F208-V211 PolarHBondContact O-N 3.23Å; E209-V211 VanDerWaalsContact C-N 3.33Å; E209-V211 PolarHBondContact O-N 2.97Å; V211-F214 PolarHBondContact O-N 3.45Å; V211-Y215 HydrophobicContact CG1-CD2 3.67Å; V211-Y215 HydrophobicContact CG1-CE2 3.72Å; V211-Y215 VanDerWaalsContact O-CD2 3.28Å; V211-Y215 WeakPolarHBondContact O-CD2 3.41Å; V211-Y215 PolarHBondContact O-N 2.9Å; V211-I280 HydrophobicContact CG1-CD1 3.55Å; V211-I280 HydrophobicContact CG1-CG1 4.27Å; V211-F283 HydrophobicContact CB-CE2 4.26Å; V211-F283 HydrophobicContact CG1-CE2 4.39Å; V211-F283 HydrophobicContact CG2-CE2 4.23Å
212	D	96.6	Very high	96.6	Very high	81 Å²	81	62.3 Å²	62.3	43%	0.433	33%	0.332	S	S	.	.	H	α-helix	trans	-66	-42	176.6	-174.1	65.5	0	0	0	111.9	F208 E209 F214 Y215 S216	F208-D212 HydrophobicContact CE1-CB 4.31Å; F208-D212 WeakPolarHBondContact O-CB 3.4Å; F208-D212 PolarHBondContact O-N 2.95Å; E209-D212 PolarHBondContact O-N 3.45Å; D212-F214 VanDerWaalsContact C-N 3.33Å; D212-F214 PolarHBondContact O-N 3.03Å; D212-Y215 PolarHBondContact O-N 3.43Å; D212-S216 WeakPolarHBondContact O-CB 3.25Å; D212-S216 PolarHBondContact O-N 2.86Å; D212-S216 PolarHBondContact O-OG 2.86Å
213	I	97.5	Very high	96.6	Very high	96 Å²	96	61.5 Å²	61.5	49%	0.492	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-45.5	173.9	-71.3	164.6	0	0	0	110.5	P199 E209 D210 F217	P199-I213 HydrophobicContact CB-CG2 4.39Å; P199-I213 HydrophobicContact CG-CG2 3.98Å; E209-I213 WeakPolarHBondContact O-CB 3.36Å; E209-I213 VanDerWaalsContact O-CG1 3.24Å; E209-I213 WeakPolarHBondContact O-CG1 3.32Å; E209-I213 PolarHBondContact O-N 3.44Å; D210-I213 PolarHBondContact O-N 2.93Å; I213-F217 WeakPolarHBondContact O-CB 3.39Å; I213-F217 PolarHBondContact O-N 2.64Å
214	F	98.4	Very high	96.7	Very high	1 Å²	1	60.1 Å²	60.1	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-58.2	-56.3	177.2	171.8	-93.8	0	0	0	111.3	F186 P199 K200 L201 D210 V211 D212 S216 F217 W218	F186-F214 HydrophobicContact CB-CZ 4.4Å; F186-F214 AromaticContact CD1-CZ 3.97Å; F186-F214 HydrophobicContact CD1-CZ 3.97Å; F186-F214 HydrophobicContact CD2-CE1 4.5Å; F186-F214 AromaticContact CD2-CZ 3.67Å; F186-F214 HydrophobicContact CD2-CZ 3.67Å; F186-F214 HydrophobicContact CE1-CZ 4.08Å; F186-F214 HydrophobicContact CE2-CE1 4.2Å; F186-F214 AromaticContact CE2-CZ 3.8Å; F186-F214 HydrophobicContact CE2-CZ 3.8Å; F186-F214 HydrophobicContact CG-CE2 4.37Å; F186-F214 AromaticContact CG-CZ 3.76Å; F186-F214 HydrophobicContact CG-CZ 3.76Å; F186-F214 HydrophobicContact CZ-CE1 4.26Å; F186-F214 HydrophobicContact CZ-CZ 4.01Å; P199-F214 HydrophobicContact CB-CB 4.3Å; P199-F214 HydrophobicContact CB-CD2 4.23Å; P199-F214 WeakPolarHBondContact O-CD2 3.41Å; K200-F214 VanDerWaalsContact C-CD2 3.41Å; K200-F214 WeakPolarHBondContact O-CD2 3.45Å; L201-F214 VanDerWaalsContact CA-CE2 3.49Å; L201-F214 HydrophobicContact CB-CE2 3.95Å; L201-F214 HydrophobicContact CB-CZ 4.02Å; L201-F214 HydrophobicContact CD1-CD1 3.93Å; L201-F214 HydrophobicContact CD1-CE1 3.33Å; L201-F214 HydrophobicContact CD1-CE2 4.16Å; L201-F214 HydrophobicContact CD1-CZ 3.47Å; L201-F214 VanDerWaalsContact CD1-CZ 3.47Å; L201-F214 HydrophobicContact CG-CZ 4.34Å; D210-F214 WeakPolarHBondContact O-CB 3.39Å; D210-F214 PolarHBondContact O-N 3.41Å; V211-F214 PolarHBondContact O-N 3.45Å; D212-F214 VanDerWaalsContact C-N 3.33Å; D212-F214 PolarHBondContact O-N 3.03Å; F214-S216 PolarHBondContact O-N 3.37Å; F214-F217 WeakPolarHBondContact O-CB 3.37Å; F214-F217 PolarHBondContact O-N 3.37Å; F214-W218 AromaticContact CD2-CD1 3.7Å; F214-W218 AromaticContact CD2-NE1 3.71Å; F214-W218 AromaticContact CE1-CD1 3.87Å; F214-W218 AromaticContact CE2-CD1 3.35Å; F214-W218 AromaticContact CE2-NE1 3.11Å; F214-W218 AromaticContact CZ-CD1 3.42Å; F214-W218 VanDerWaalsContact CZ-CD1 3.42Å; F214-W218 HydrophobicContact CZ-CG 4.39Å; F214-W218 AromaticContact CZ-NE1 3.5Å; F214-W218 VanDerWaalsContact O-CD1 3.22Å; F214-W218 PolarHBondContact O-N 3.42Å; F214-W218 VanDerWaalsContact O-N 3.17Å
215	Y	98.3	Very high	96.7	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-65.1	-43.7	-177.9	-80.6	-65	0	0	0	111.4	V211 D212 F217 W218 Y219 V270 A273 Y274 D277 I280	V211-Y215 HydrophobicContact CG1-CD2 3.67Å; V211-Y215 HydrophobicContact CG1-CE2 3.72Å; V211-Y215 VanDerWaalsContact O-CD2 3.28Å; V211-Y215 WeakPolarHBondContact O-CD2 3.41Å; V211-Y215 PolarHBondContact O-N 2.9Å; D212-Y215 PolarHBondContact O-N 3.43Å; Y215-F217 VanDerWaalsContact C-N 3.26Å; Y215-F217 PolarHBondContact O-N 3.27Å; Y215-W218 PolarHBondContact O-N 3.36Å; Y215-Y219 HydrophobicContact CD1-CE2 4.01Å; Y215-Y219 HydrophobicContact CG-CE2 4.35Å; Y215-Y219 WeakPolarHBondContact O-CB 3.2Å; Y215-Y219 WeakPolarHBondContact O-CD2 3.45Å; Y215-Y219 PolarHBondContact O-N 3.03Å; Y215-V270 HydrophobicContact CD1-CG1 4.06Å; Y215-A273 HydrophobicContact CE1-CB 4.34Å; Y215-Y274 AromaticContact CD1-CD2 3.8Å; Y215-Y274 HydrophobicContact CD1-CD2 3.8Å; Y215-Y274 HydrophobicContact CD1-CG 4.47Å; Y215-Y274 AromaticContact CD2-CD2 3.81Å; Y215-Y274 HydrophobicContact CD2-CD2 3.81Å; Y215-Y274 HydrophobicContact CD2-CE2 4.27Å; Y215-Y274 AromaticContact CE1-CD2 3.92Å; Y215-Y274 HydrophobicContact CE1-CD2 3.92Å; Y215-Y274 HydrophobicContact CE1-CG 4.34Å; Y215-Y274 AromaticContact CE2-CD2 3.92Å; Y215-Y274 HydrophobicContact CE2-CD2 3.92Å; Y215-Y274 AromaticContact CG-CD2 3.75Å; Y215-Y274 HydrophobicContact CG-CD2 3.75Å; Y215-Y274 HydrophobicContact CG-CE2 4.37Å; Y215-Y274 AromaticContact CZ-CD2 3.99Å; Y215-Y274 PolarHBondContact OH-N 2.67Å; Y215-D277 WeakPolarHBondContact OH-CB 3.44Å; Y215-D277 PolarHBondContact OH-OD2 3.39Å; Y215-I280 HydrophobicContact CD2-CD1 4.22Å; Y215-I280 HydrophobicContact CE2-CD1 4.1Å; Y215-I280 HydrophobicContact CE2-CG1 3.97Å
216	S	97.9	Very high	96.8	Very high	51 Å²	51	49.8 Å²	49.8	36%	0.357	25%	0.254	S	S	.	.	H	α-helix	trans	-57.5	-38.7	177	-71.8	0	0	0	0	112.6	D212 F214 N220	D212-S216 WeakPolarHBondContact O-CB 3.25Å; D212-S216 PolarHBondContact O-N 2.86Å; D212-S216 PolarHBondContact O-OG 2.86Å; F214-S216 PolarHBondContact O-N 3.37Å; S216-N220 WeakPolarHBondContact O-CB 3.39Å; S216-N220 PolarHBondContact O-N 3.46Å; S216-N220 PolarHBondContact O-ND2 3.39Å
217	F	98.4	Very high	96.8	Very high	19 Å²	19	49.6 Å²	49.6	8%	0.083	25%	0.25	C	S	.	.	H	α-helix	trans	-61.3	-47.7	173	174.9	-83.8	0	0	0	111.6	S193 K195 V198 P199 I213 F214 Y215 N220 F221	S193-F217 WeakPolarHBondContact OG-CZ 3.46Å; K195-F217 HydrophobicContact CB-CE2 3.9Å; K195-F217 HydrophobicContact CB-CZ 4.36Å; K195-F217 HydrophobicContact CD-CD2 4.18Å; K195-F217 HydrophobicContact CD-CE2 3.62Å; K195-F217 HydrophobicContact CG-CE2 4.36Å; V198-F217 HydrophobicContact CB-CE1 4.37Å; V198-F217 HydrophobicContact CB-CZ 4.12Å; V198-F217 HydrophobicContact CG1-CD1 4.28Å; V198-F217 HydrophobicContact CG1-CE1 3.59Å; V198-F217 HydrophobicContact CG1-CZ 3.85Å; V198-F217 HydrophobicContact CG2-CE1 4.34Å; V198-F217 HydrophobicContact CG2-CZ 3.79Å; P199-F217 VanDerWaalsContact CD-CD2 3.48Å; P199-F217 VanDerWaalsContact CD-CG 3.47Å; P199-F217 HydrophobicContact CG-CB 3.85Å; P199-F217 HydrophobicContact CG-CD2 4.11Å; P199-F217 HydrophobicContact CG-CG 3.95Å; I213-F217 WeakPolarHBondContact O-CB 3.39Å; I213-F217 PolarHBondContact O-N 2.64Å; F214-F217 WeakPolarHBondContact O-CB 3.37Å; F214-F217 PolarHBondContact O-N 3.37Å; Y215-F217 VanDerWaalsContact C-N 3.26Å; Y215-F217 PolarHBondContact O-N 3.27Å; F217-N220 CarbonylContact O-C 3.48Å; F217-N220 PolarHBondContact O-N 2.86Å; F217-F221 HydrophobicContact CD1-CD2 4.44Å; F217-F221 AromaticContact CE1-CD2 3.7Å; F217-F221 HydrophobicContact CE1-CD2 3.7Å; F217-F221 AromaticContact CE1-CE2 3.99Å; F217-F221 HydrophobicContact CE1-CE2 3.99Å; F217-F221 HydrophobicContact CZ-CD2 4.36Å; F217-F221 HydrophobicContact CZ-CE2 4.48Å; F217-F221 WeakPolarHBondContact O-CA 3.29Å; F217-F221 PolarHBondContact O-N 3.06Å
218	W	98.4	Very high	96.7	Very high	5 Å²	5	49.5 Å²	49.5	2%	0.019	25%	0.25	C	C	.	.	H	α-helix	trans	-77.5	-31	-174.9	-77.8	105.2	0	0	0	114.2	F186 N189 V198 F214 Y215 N220 F221 I266 V270	F186-W218 HydrophobicContact CB-CH2 4.46Å; F186-W218 HydrophobicContact CB-CZ2 3.88Å; F186-W218 AromaticContact CD1-CD2 3.63Å; F186-W218 HydrophobicContact CD1-CD2 3.63Å; F186-W218 AromaticContact CD1-CE2 3.45Å; F186-W218 VanDerWaalsContact CD1-CE2 3.45Å; F186-W218 AromaticContact CD1-CE3 3.95Å; F186-W218 HydrophobicContact CD1-CE3 3.95Å; F186-W218 HydrophobicContact CD1-CG 4.18Å; F186-W218 AromaticContact CD1-CH2 3.94Å; F186-W218 HydrophobicContact CD1-CH2 3.94Å; F186-W218 AromaticContact CD1-CZ2 3.63Å; F186-W218 HydrophobicContact CD1-CZ2 3.63Å; F186-W218 HydrophobicContact CD1-CZ3 4.1Å; F186-W218 AromaticContact CD1-NE1 3.87Å; F186-W218 AromaticContact CE1-CD2 3.88Å; F186-W218 HydrophobicContact CE1-CD2 3.88Å; F186-W218 HydrophobicContact CE1-CE3 4.16Å; F186-W218 HydrophobicContact CE1-CG 4.08Å; F186-W218 HydrophobicContact CG-CZ2 4.21Å; F186-W218 VanDerWaalsContact O-CH2 3.31Å; F186-W218 WeakPolarHBondContact O-CH2 3.49Å; F186-W218 WeakPolarHBondContact O-CZ2 3.49Å; N189-W218 HydrophobicContact CB-CH2 3.84Å; N189-W218 HydrophobicContact CB-CZ3 4.05Å; V198-W218 HydrophobicContact CG1-CZ2 4Å; F214-W218 AromaticContact CD2-CD1 3.7Å; F214-W218 AromaticContact CD2-NE1 3.71Å; F214-W218 AromaticContact CE1-CD1 3.87Å; F214-W218 AromaticContact CE2-CD1 3.35Å; F214-W218 AromaticContact CE2-NE1 3.11Å; F214-W218 AromaticContact CZ-CD1 3.42Å; F214-W218 VanDerWaalsContact CZ-CD1 3.42Å; F214-W218 HydrophobicContact CZ-CG 4.39Å; F214-W218 AromaticContact CZ-NE1 3.5Å; F214-W218 VanDerWaalsContact O-CD1 3.22Å; F214-W218 PolarHBondContact O-N 3.42Å; F214-W218 VanDerWaalsContact O-N 3.17Å; Y215-W218 PolarHBondContact O-N 3.36Å; W218-N220 PolarHBondContact O-N 3.18Å; W218-F221 HydrophobicContact CD2-CD2 4.25Å; W218-F221 HydrophobicContact CE3-CB 4.33Å; W218-F221 AromaticContact CE3-CD2 3.52Å; W218-F221 HydrophobicContact CE3-CD2 3.52Å; W218-F221 AromaticContact CE3-CE2 3.92Å; W218-F221 HydrophobicContact CE3-CE2 3.92Å; W218-F221 AromaticContact CE3-CG 3.97Å; W218-F221 HydrophobicContact CE3-CG 3.97Å; W218-F221 HydrophobicContact CH2-CD2 4.28Å; W218-F221 AromaticContact CH2-CE2 3.82Å; W218-F221 HydrophobicContact CH2-CE2 3.82Å; W218-F221 HydrophobicContact CH2-CZ 4.34Å; W218-F221 AromaticContact CZ3-CD2 3.54Å; W218-F221 HydrophobicContact CZ3-CD2 3.54Å; W218-F221 HydrophobicContact CZ3-CE1 4.4Å; W218-F221 AromaticContact CZ3-CE2 3.42Å; W218-F221 HydrophobicContact CZ3-CE2 3.42Å; W218-F221 VanDerWaalsContact CZ3-CE2 3.42Å; W218-F221 HydrophobicContact CZ3-CG 4.11Å; W218-F221 AromaticContact CZ3-CZ 3.89Å; W218-F221 HydrophobicContact CZ3-CZ 3.89Å; W218-F221 VanDerWaalsContact O-CB 3.27Å; W218-F221 WeakPolarHBondContact O-CB 3.31Å; W218-F221 PolarHBondContact O-N 2.95Å; W218-I266 HydrophobicContact CE3-CG2 4.26Å; W218-V270 HydrophobicContact CB-CG1 4.34Å; W218-V270 HydrophobicContact CB-CG2 3.66Å; W218-V270 HydrophobicContact CG-CG2 4.48Å
219	Y	98.1	Very high	96.6	Very high	75 Å²	75	45.8 Å²	45.8	29%	0.294	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-30.1	168.8	-82.9	-78.5	0	0	0	111.5	Y215 R267 V270 D271 Y274	Y215-Y219 HydrophobicContact CD1-CE2 4.01Å; Y215-Y219 HydrophobicContact CG-CE2 4.35Å; Y215-Y219 WeakPolarHBondContact O-CB 3.2Å; Y215-Y219 WeakPolarHBondContact O-CD2 3.45Å; Y215-Y219 PolarHBondContact O-N 3.03Å; Y219-R267 VanDerWaalsContact CD1-CZ 3.44Å; Y219-R267 VanDerWaalsContact CE1-NH2 3.29Å; Y219-V270 HydrophobicContact CD1-CG1 4.19Å; Y219-V270 HydrophobicContact CD2-CG1 3.83Å; Y219-V270 HydrophobicContact CE1-CG1 4.04Å; Y219-V270 HydrophobicContact CE2-CG1 3.57Å; Y219-V270 HydrophobicContact CG-CG1 4.07Å; Y219-D271 PolarHBondContact OH-OD1 3.37Å; Y219-Y274 HydrophobicContact CE2-CD2 4.27Å; Y219-Y274 WeakPolarHBondContact OH-CB 3.46Å
220	N	97.3	Very high	96.4	Very high	114 Å²	114	43.4 Å²	43.4	61%	0.61	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.8	34.1	175.2	-59.2	-63.9	0	0	0	111.7	S216 F217 W218 D222	S216-N220 WeakPolarHBondContact O-CB 3.39Å; S216-N220 PolarHBondContact O-N 3.46Å; S216-N220 PolarHBondContact O-ND2 3.39Å; F217-N220 CarbonylContact O-C 3.48Å; F217-N220 PolarHBondContact O-N 2.86Å; W218-N220 PolarHBondContact O-N 3.18Å; N220-D222 PolarHBondContact O-N 3.03Å
221	F	98	Very high	96.2	Very high	18 Å²	18	40.1 Å²	40.1	8%	0.079	21%	0.206	C	C	.	.			trans	-62.7	120.1	-175.7	-172.6	-109.1	0	0	0	110.3	W192 F217 W218 M263 I266	W192-F221 HydrophobicContact CB-CE1 4.32Å; W192-F221 HydrophobicContact CB-CZ 4.17Å; F217-F221 HydrophobicContact CD1-CD2 4.44Å; F217-F221 AromaticContact CE1-CD2 3.7Å; F217-F221 HydrophobicContact CE1-CD2 3.7Å; F217-F221 AromaticContact CE1-CE2 3.99Å; F217-F221 HydrophobicContact CE1-CE2 3.99Å; F217-F221 HydrophobicContact CZ-CD2 4.36Å; F217-F221 HydrophobicContact CZ-CE2 4.48Å; F217-F221 WeakPolarHBondContact O-CA 3.29Å; F217-F221 PolarHBondContact O-N 3.06Å; W218-F221 HydrophobicContact CD2-CD2 4.25Å; W218-F221 HydrophobicContact CE3-CB 4.33Å; W218-F221 AromaticContact CE3-CD2 3.52Å; W218-F221 HydrophobicContact CE3-CD2 3.52Å; W218-F221 AromaticContact CE3-CE2 3.92Å; W218-F221 HydrophobicContact CE3-CE2 3.92Å; W218-F221 AromaticContact CE3-CG 3.97Å; W218-F221 HydrophobicContact CE3-CG 3.97Å; W218-F221 HydrophobicContact CH2-CD2 4.28Å; W218-F221 AromaticContact CH2-CE2 3.82Å; W218-F221 HydrophobicContact CH2-CE2 3.82Å; W218-F221 HydrophobicContact CH2-CZ 4.34Å; W218-F221 AromaticContact CZ3-CD2 3.54Å; W218-F221 HydrophobicContact CZ3-CD2 3.54Å; W218-F221 HydrophobicContact CZ3-CE1 4.4Å; W218-F221 AromaticContact CZ3-CE2 3.42Å; W218-F221 HydrophobicContact CZ3-CE2 3.42Å; W218-F221 VanDerWaalsContact CZ3-CE2 3.42Å; W218-F221 HydrophobicContact CZ3-CG 4.11Å; W218-F221 AromaticContact CZ3-CZ 3.89Å; W218-F221 HydrophobicContact CZ3-CZ 3.89Å; W218-F221 VanDerWaalsContact O-CB 3.27Å; W218-F221 WeakPolarHBondContact O-CB 3.31Å; W218-F221 PolarHBondContact O-N 2.95Å; F221-M263 HydrophobicContact CD1-CE 4.5Å; F221-I266 HydrophobicContact CB-CG2 4.16Å; F221-I266 HydrophobicContact CD1-CG1 4.41Å; F221-I266 HydrophobicContact CD1-CG2 4.03Å; F221-I266 HydrophobicContact CG-CG2 4.24Å
222	D	96.8	Very high	95.4	Very high	81 Å²	81	47.1 Å²	47.1	43%	0.433	24%	0.238	S	C	.	.			trans	-108.1	119.4	177.7	178.9	28.2	0	0	0	109.3	S193 N194 N220	S193-D222 WeakPolarHBondContact CA-O 3.47Å; N194-D222 WeakPolarHBondContact CB-OD2 3.14Å; N194-D222 PolarHBondContact N-O 2.96Å; N194-D222 PolarHBondContact ND2-OD1 3.09Å; N194-D222 PolarHBondContact ND2-OD2 3.42Å; N220-D222 PolarHBondContact O-N 3.03Å
223	S	96.1	Very high	94.5	Very high	20 Å²	20	48 Å²	48	14%	0.14	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-115.4	136.4	-170	-172	0	0	0	0	113	W192 N194 R225	W192-S223 WeakPolarHBondContact CB-OG 3.44Å; W192-S223 CarbonylContact O-C 3.1Å; W192-S223 WeakPolarHBondContact O-CA 3.44Å; W192-S223 PolarHBondContact O-OG 3.3Å; N194-S223 PolarHBondContact ND2-O 2.95Å; S223-R225 VanDerWaalsContact C-N 3.27Å; S223-R225 VanDerWaalsContact OG-CB 3.27Å; S223-R225 WeakPolarHBondContact OG-CB 3.43Å; S223-R225 PolarHBondContact OG-N 3.05Å; S223-R225 VanDerWaalsContact OG-N 3.09Å
224	W	95.1	Very high	93.8	Very high	56 Å²	56	47.4 Å²	47.4	21%	0.212	24%	0.235	C	C	.	.			trans	-79.6	-9.5	167.7	57.1	-99.3	0	0	0	113.3	R155 N158 R191 W192 S193 N194 E226	R155-W224 HydrophobicContact CB-CZ3 4.4Å; R155-W224 HydrophobicContact CG-CD2 4.35Å; R155-W224 HydrophobicContact CG-CE3 3.29Å; R155-W224 HydrophobicContact CG-CH2 4.4Å; R155-W224 HydrophobicContact CG-CZ3 3.34Å; N158-W224 HydrophobicContact CB-CH2 4.35Å; R191-W224 VanDerWaalsContact O-CE2 3.31Å; R191-W224 VanDerWaalsContact O-CZ2 3.27Å; R191-W224 WeakPolarHBondContact O-CZ2 3.33Å; R191-W224 PolarHBondContact O-NE1 3.11Å; W192-W224 VanDerWaalsContact C-CD1 3.47Å; W192-W224 HydrophobicContact CE3-CD2 4.47Å; W192-W224 HydrophobicContact CE3-CE3 4.36Å; W192-W224 AromaticContact CE3-CH2 3.45Å; W192-W224 HydrophobicContact CE3-CH2 3.45Å; W192-W224 VanDerWaalsContact CE3-CH2 3.45Å; W192-W224 AromaticContact CE3-CZ2 3.5Å; W192-W224 HydrophobicContact CE3-CZ2 3.5Å; W192-W224 AromaticContact CE3-CZ3 3.86Å; W192-W224 HydrophobicContact CE3-CZ3 3.86Å; W192-W224 AromaticContact CZ3-CH2 3.31Å; W192-W224 HydrophobicContact CZ3-CH2 3.31Å; W192-W224 AromaticContact CZ3-CZ2 3.83Å; W192-W224 HydrophobicContact CZ3-CZ2 3.83Å; W192-W224 AromaticContact CZ3-CZ3 3.74Å; W192-W224 HydrophobicContact CZ3-CZ3 3.74Å; W192-W224 PolarHBondContact O-N 3.26Å; S193-W224 VanDerWaalsContact O-CD1 3.23Å; N194-W224 VanDerWaalsContact OD1-CB 3.27Å; N194-W224 WeakPolarHBondContact OD1-CB 3.25Å; W224-E226 PolarHBondContact O-N 3.14Å
225	R	95.4	Very high	92.9	Very high	14 Å²	14	52.4 Å²	52.4	5%	0.053	26%	0.257	C	S	.	.			trans	-58.3	130.9	-175.8	-164.4	176.8	-172.9	-176.9	3.9	110	S159 N166 W192 S223 F227 E262	S159-R225 PolarHBondContact O-NE 3.04Å; S159-R225 PolarHBondContact O-NH2 2.87Å; N166-R225 PolarHBondContact OD1-NH1 3.46Å; N166-R225 PolarHBondContact OD1-NH2 3.04Å; W192-R225 HydrophobicContact CB-CB 4.33Å; W192-R225 HydrophobicContact CD2-CB 4.39Å; W192-R225 HydrophobicContact CD2-CG 4.28Å; W192-R225 HydrophobicContact CE3-CB 4.31Å; W192-R225 HydrophobicContact CE3-CG 4.22Å; W192-R225 HydrophobicContact CG-CB 4.43Å; W192-R225 HydrophobicContact CZ3-CG 4.44Å; S223-R225 VanDerWaalsContact C-N 3.27Å; S223-R225 VanDerWaalsContact OG-CB 3.27Å; S223-R225 WeakPolarHBondContact OG-CB 3.43Å; S223-R225 PolarHBondContact OG-N 3.05Å; S223-R225 VanDerWaalsContact OG-N 3.09Å; R225-F227 HydrophobicContact CG-CZ 4.13Å; R225-E262 IonicContact CZ-OE1 3.94Å; R225-E262 VanDerWaalsContact NH1-CD 3.25Å; R225-E262 IonicContact NH1-OE1 3.23Å; R225-E262 PolarHBondContact NH1-OE1 3.41Å; R225-E262 IonicContact NH1-OE2 3.01Å; R225-E262 PolarHBondContact NH1-OE2 2.97Å
226	E	94.2	Very high	92.1	Very high	25 Å²	25	59.8 Å²	59.8	12%	0.117	29%	0.291	C	S	.	.			trans	-145.4	160.2	-173.1	80.2	80.7	-156.4	0	0	110.6	A156 S159 W224 S228	A156-E226 WeakPolarHBondContact CA-OE1 3.37Å; A156-E226 WeakPolarHBondContact CB-OE1 3.49Å; S159-E226 WeakPolarHBondContact CB-O 3.4Å; S159-E226 PolarHBondContact OG-N 2.99Å; S159-E226 PolarHBondContact OG-O 2.9Å; W224-E226 PolarHBondContact O-N 3.14Å; E226-S228 VanDerWaalsContact CD-OG 3.25Å; E226-S228 PolarHBondContact OE1-OG 3.48Å; E226-S228 WeakPolarHBondContact OE2-CB 3.27Å; E226-S228 PolarHBondContact OE2-N 3Å; E226-S228 PolarHBondContact OE2-OG 3.4Å
227	F	95.7	Very high	91.4	Very high	18 Å²	18	64.1 Å²	64.1	8%	0.079	30%	0.304	C	S	.	.			trans	-125.4	22.6	-163.2	-59.7	-79.2	0	0	0	113.7	V160 R225 Y229 L230 R255 R258 K259 E262	V160-F227 HydrophobicContact CG1-CD1 4Å; R225-F227 HydrophobicContact CG-CZ 4.13Å; F227-Y229 PolarHBondContact O-N 3.06Å; F227-L230 HydrophobicContact CD1-CD1 4.44Å; F227-L230 PolarHBondContact O-N 2.71Å; F227-L230 VanDerWaalsContact O-N 3.11Å; F227-R255 HydrophobicContact CB-CG 4.44Å; F227-R258 HydrophobicContact CB-CB 4.05Å; F227-R258 HydrophobicContact CD1-CB 4.26Å; F227-R258 HydrophobicContact CD2-CB 3.6Å; F227-R258 HydrophobicContact CE2-CB 4.1Å; F227-R258 HydrophobicContact CG-CB 3.7Å; F227-K259 HydrophobicContact CD2-CG 3.83Å; F227-K259 HydrophobicContact CE2-CG 3.97Å; F227-E262 HydrophobicContact CE2-CB 4.14Å; F227-E262 HydrophobicContact CZ-CB 3.93Å; F227-E262 HydrophobicContact CZ-CG 4.21Å
228	S	93.4	Very high	90.8	Very high	40 Å²	40	63.6 Å²	63.6	28%	0.28	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-64.5	-21.7	179	70.6	0	0	0	0	114.3	A156 E226 L230 D231	A156-S228 WeakPolarHBondContact CB-OG 3.45Å; E226-S228 VanDerWaalsContact CD-OG 3.25Å; E226-S228 PolarHBondContact OE1-OG 3.48Å; E226-S228 WeakPolarHBondContact OE2-CB 3.27Å; E226-S228 PolarHBondContact OE2-N 3Å; E226-S228 PolarHBondContact OE2-OG 3.4Å; S228-L230 PolarHBondContact O-N 3.45Å; S228-D231 VanDerWaalsContact O-CB 3.29Å; S228-D231 WeakPolarHBondContact O-CB 3.5Å; S228-D231 VanDerWaalsContact O-CG 3.32Å; S228-D231 PolarHBondContact O-N 3.01Å; S228-D231 VanDerWaalsContact O-N 3.14Å
229	Y	92.6	Very high	90.4	Very high	27 Å²	27	72.2 Å²	72.2	11%	0.106	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-61.7	-28.8	172.5	-161.4	-95.7	0	0	0	112.9	K85 H89 M147 F157 V160 F227 D231	K85-Y229 WeakPolarHBondContact CE-O 3.44Å; K85-Y229 HydrophobicContact CG-CE1 3.94Å; K85-Y229 PolarHBondContact NZ-O 2.95Å; K85-Y229 WeakPolarHBondContact O-CE1 3.49Å; K85-Y229 PolarHBondContact O-OH 3.46Å; H89-Y229 PolarHBondContact NE2-OH 2.94Å; H89-Y229 VanDerWaalsContact NE2-OH 3.08Å; M147-Y229 HydrophobicContact SD-CE2 4.36Å; F157-Y229 HydrophobicContact CB-CD2 4.14Å; F157-Y229 HydrophobicContact CB-CE2 4.16Å; F157-Y229 HydrophobicContact CD2-CD2 4.44Å; F157-Y229 HydrophobicContact CD2-CE1 4.07Å; F157-Y229 AromaticContact CD2-CE2 3.95Å; F157-Y229 HydrophobicContact CD2-CE2 3.95Å; F157-Y229 AromaticContact CD2-CZ 3.73Å; V160-Y229 HydrophobicContact CG2-CD1 3.59Å; V160-Y229 HydrophobicContact CG2-CE1 4.42Å; V160-Y229 HydrophobicContact CG2-CG 3.89Å; F227-Y229 PolarHBondContact O-N 3.06Å; Y229-D231 VanDerWaalsContact C-N 3.32Å
230	L	92	Very high	89.9	Confident	72 Å²	72	71.7 Å²	71.7	38%	0.377	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-94.6	16.9	179.2	-59.4	172.1	0	0	0	112.6	V160 F227 S228 E232 R258	V160-L230 HydrophobicContact CB-CD1 4.44Å; V160-L230 HydrophobicContact CB-CG 4.44Å; V160-L230 HydrophobicContact CG1-CD1 3.67Å; V160-L230 HydrophobicContact CG1-CD2 4.45Å; V160-L230 HydrophobicContact CG1-CG 3.78Å; F227-L230 HydrophobicContact CD1-CD1 4.44Å; F227-L230 PolarHBondContact O-N 2.71Å; F227-L230 VanDerWaalsContact O-N 3.11Å; S228-L230 PolarHBondContact O-N 3.45Å; L230-E232 PolarHBondContact O-N 3.34Å; L230-R258 VanDerWaalsContact CB-NH1 3.35Å; L230-R258 PolarHBondContact O-NH1 3.42Å
231	D	91.8	Very high	89.7	Confident	24 Å²	24	74.6 Å²	74.6	13%	0.128	35%	0.353	C	S	.	.			trans	-67.1	125	168.2	-73.6	-6.4	0	0	0	108	K85 S228 Y229 N251 R255	K85-D231 PolarHBondContact NZ-O 3.11Å; K85-D231 VanDerWaalsContact NZ-O 3.1Å; S228-D231 VanDerWaalsContact O-CB 3.29Å; S228-D231 WeakPolarHBondContact O-CB 3.5Å; S228-D231 VanDerWaalsContact O-CG 3.32Å; S228-D231 PolarHBondContact O-N 3.01Å; S228-D231 VanDerWaalsContact O-N 3.14Å; Y229-D231 VanDerWaalsContact C-N 3.32Å; D231-N251 HydrophobicContact CB-CB 4.24Å; D231-R255 WeakPolarHBondContact OD1-CD 3.44Å; D231-R255 WeakPolarHBondContact OD1-CG 3.28Å; D231-R255 IonicContact OD1-NE 3.54Å; D231-R255 IonicContact OD2-NE 2.69Å
232	E	80.7	Confident	89.2	Confident	149 Å²	149	79.4 Å²	79.4	70%	0.696	38%	0.379	S	S	*	.	S	Bend	trans	-75.1	-42.3	-175.3	-70.2	172.6	-166.5	0	0	110.8	L230	L230-E232 PolarHBondContact O-N 3.34Å
233	E	78.8	Confident	88.9	Confident	100 Å²	100	79 Å²	79	47%	0.467	38%	0.375	S	S	.	.	S	Bend	trans	-104.7	125.8	-176.8	-66.7	-62.6	162.1	0	0	111.4	K235 I247 N251	E233-K235 PolarHBondContact O-N 2.95Å; E233-I247 HydrophobicContact CB-CB 4.39Å; E233-I247 HydrophobicContact CB-CD1 4.36Å; E233-I247 HydrophobicContact CB-CG1 4.05Å; E233-I247 HydrophobicContact CB-CG2 3.6Å; E233-I247 WeakPolarHBondContact O-CG2 3.46Å; E233-N251 PolarHBondContact O-ND2 3.41Å
234	E	81.3	Confident	88.6	Confident	82 Å²	82	83.9 Å²	83.9	38%	0.383	39%	0.39	S	S	.	.			trans	-82.2	116.4	175.8	-74.6	169.7	-158.7	0	0	109.9	E236 K237	E234-E236 PolarHBondContact O-N 3.38Å; E234-K237 HydrophobicContact CB-CD 4.16Å; E234-K237 HydrophobicContact CB-CG 4.16Å; E234-K237 WeakPolarHBondContact O-CB 3.5Å; E234-K237 PolarHBondContact O-N 3.18Å; E234-K237 IonicContact OE1-NZ 3.4Å; E234-K237 WeakPolarHBondContact OE2-CE 3.42Å; E234-K237 IonicContact OE2-NZ 3.47Å; E234-K237 PolarHBondContact OE2-NZ 3.35Å
235	K	80.6	Confident	88.3	Confident	107 Å²	107	88.4 Å²	88.4	47%	0.465	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-18.7	179	74.5	179.9	-178.8	-175.7	0	114.7	E233 R244 I247	E233-K235 PolarHBondContact O-N 2.95Å; K235-R244 HydrophobicContact CB-CG 4.11Å; K235-R244 PolarHBondContact O-NE 3.31Å; K235-I247 HydrophobicContact CB-CG2 4.35Å
236	E	81.2	Confident	88.1	Confident	159 Å²	159	94.9 Å²	94.9	74%	0.743	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-21.4	-179.5	-65.6	178.8	-178.7	0	0	112.2	E234 A238	E234-E236 PolarHBondContact O-N 3.38Å; E236-A238 VanDerWaalsContact C-N 3.31Å
237	K	83.1	Confident	87.9	Confident	142 Å²	142	93.9 Å²	93.9	62%	0.617	43%	0.427	S	S	*	.	S	Bend	trans	-81.4	-8.9	174.9	-65.6	179.6	-179.5	158.2	0	113.7	E234 E239	E234-K237 HydrophobicContact CB-CD 4.16Å; E234-K237 HydrophobicContact CB-CG 4.16Å; E234-K237 WeakPolarHBondContact O-CB 3.5Å; E234-K237 PolarHBondContact O-N 3.18Å; E234-K237 IonicContact OE1-NZ 3.4Å; E234-K237 WeakPolarHBondContact OE2-CE 3.42Å; E234-K237 IonicContact OE2-NZ 3.47Å; E234-K237 PolarHBondContact OE2-NZ 3.35Å; K237-E239 PolarHBondContact O-N 3.44Å
238	A	87.2	Confident	87.7	Confident	8 Å²	8	95.5 Å²	95.5	7%	0.066	44%	0.435	C	S	.	.			trans	-66	127	178.4	0	0	0	0	0	111.7	E236 C240 E243 R244 I247	E236-A238 VanDerWaalsContact C-N 3.31Å; A238-C240 VanDerWaalsContact C-N 3.34Å; A238-E243 HydrophobicContact CB-CB 4.19Å; A238-E243 HydrophobicContact CB-CG 3.94Å; A238-R244 HydrophobicContact CB-CB 3.77Å; A238-R244 HydrophobicContact CB-CG 4.47Å; A238-I247 HydrophobicContact CB-CD1 4Å
239	E	88.2	Confident	87.7	Confident	186 Å²	186	100.9 Å²	100.9	87%	0.869	45%	0.453	S	S	*	.	S	Bend	trans	-74.7	-27.6	-179.9	-61.2	-176	169.9	0	0	111.6	K237 E243	K237-E239 PolarHBondContact O-N 3.44Å; E239-E243 PolarHBondContact N-OE2 3.28Å
240	C	89.3	Confident	87.8	Confident	64 Å²	64	103.9 Å²	103.9	43%	0.432	47%	0.468	S	S	.	.	S	Bend	trans	-134.8	166.9	-178.8	76.4	0	0	0	0	114.2	A238 D242 E243 R244	A238-C240 VanDerWaalsContact C-N 3.34Å; C240-D242 VanDerWaalsContact C-N 3.33Å; C240-D242 PolarHBondContact O-N 3Å; C240-E243 WeakPolarHBondContact SG-CB 3.34Å; C240-E243 PolarHBondContact SG-N 2.83Å; C240-E243 VanDerWaalsContact SG-N 3.39Å; C240-R244 PolarHBondContact O-N 3.36Å
241	R	91.1	Very high	87.9	Confident	175 Å²	175	100.9 Å²	100.9	66%	0.66	45%	0.453	S	S	*	.	H	α-helix	trans	-62.8	-38.3	-178.6	-174.9	-175.6	-176.6	-156.2	4.6	112.6	R244 R245	R241-R244 PolarHBondContact O-N 2.9Å; R241-R245 WeakPolarHBondContact O-CG 3.31Å; R241-R245 PolarHBondContact O-N 3.48Å; R241-R245 VanDerWaalsContact O-N 3.07Å
242	D	89	Confident	88	Confident	119 Å²	119	106.9 Å²	106.9	64%	0.636	47%	0.473	S	S	*	.	H	α-helix	trans	-74.3	-39	-176.5	-68.8	-26.3	0	0	0	111.3	C240 R245 W246	C240-D242 VanDerWaalsContact C-N 3.33Å; C240-D242 PolarHBondContact O-N 3Å; D242-R245 WeakPolarHBondContact O-CB 3.29Å; D242-R245 PolarHBondContact O-N 3.33Å; D242-W246 WeakPolarHBondContact O-CB 3.46Å; D242-W246 PolarHBondContact O-N 3.28Å
243	E	89.8	Confident	88.7	Confident	73 Å²	73	102.6 Å²	102.6	34%	0.341	46%	0.463	S	S	.	.	H	α-helix	trans	-60.7	-44.6	170.5	-176.9	178.6	-157.4	0	0	111.5	A238 E239 C240 R245 W246 I247	A238-E243 HydrophobicContact CB-CB 4.19Å; A238-E243 HydrophobicContact CB-CG 3.94Å; E239-E243 PolarHBondContact N-OE2 3.28Å; C240-E243 WeakPolarHBondContact SG-CB 3.34Å; C240-E243 PolarHBondContact SG-N 2.83Å; C240-E243 VanDerWaalsContact SG-N 3.39Å; E243-R245 VanDerWaalsContact C-N 3.29Å; E243-R245 PolarHBondContact O-N 3.46Å; E243-W246 PolarHBondContact O-N 2.9Å; E243-W246 VanDerWaalsContact O-N 3.08Å; E243-I247 HydrophobicContact CG-CD1 4.01Å; E243-I247 WeakPolarHBondContact O-CG1 3.38Å; E243-I247 PolarHBondContact O-N 3.48Å
244	R	89.1	Confident	89.4	Confident	122 Å²	122	99.9 Å²	99.9	46%	0.46	45%	0.454	S	S	.	.	H	α-helix	trans	-58.7	-40.4	174.5	-170.8	176.9	-65.2	144.3	8.1	112.4	K235 A238 C240 R241 E248	K235-R244 HydrophobicContact CB-CG 4.11Å; K235-R244 PolarHBondContact O-NE 3.31Å; A238-R244 HydrophobicContact CB-CB 3.77Å; A238-R244 HydrophobicContact CB-CG 4.47Å; C240-R244 PolarHBondContact O-N 3.36Å; R241-R244 PolarHBondContact O-N 2.9Å; R244-E248 WeakPolarHBondContact O-CB 3.33Å; R244-E248 PolarHBondContact O-N 3.42Å; R244-E248 VanDerWaalsContact O-N 3.09Å
245	R	89.4	Confident	90.1	Very high	150 Å²	150	98.6 Å²	98.6	57%	0.566	45%	0.445	S	S	*	.	H	α-helix	trans	-66.7	-39	175.8	-76.9	177.9	176.6	-132.8	2.6	111.6	R241 D242 E243 K249	R241-R245 WeakPolarHBondContact O-CG 3.31Å; R241-R245 PolarHBondContact O-N 3.48Å; R241-R245 VanDerWaalsContact O-N 3.07Å; D242-R245 WeakPolarHBondContact O-CB 3.29Å; D242-R245 PolarHBondContact O-N 3.33Å; E243-R245 VanDerWaalsContact C-N 3.29Å; E243-R245 PolarHBondContact O-N 3.46Å; R245-K249 WeakPolarHBondContact O-CB 3.36Å; R245-K249 PolarHBondContact O-N 2.86Å
246	W	90.8	Very high	90.8	Very high	150 Å²	150	96.1 Å²	96.1	57%	0.568	45%	0.445	S	S	*	.	H	α-helix	trans	-67.6	-46	178.9	-177.8	89.8	0	0	0	111.6	D242 E243 E248 K249 Q250	D242-W246 WeakPolarHBondContact O-CB 3.46Å; D242-W246 PolarHBondContact O-N 3.28Å; E243-W246 PolarHBondContact O-N 2.9Å; E243-W246 VanDerWaalsContact O-N 3.08Å; W246-E248 PolarHBondContact O-N 2.97Å; W246-K249 WeakPolarHBondContact O-CB 3.1Å; W246-K249 PolarHBondContact O-N 2.82Å; W246-K249 VanDerWaalsContact O-N 3.13Å; W246-Q250 HydrophobicContact CD2-CG 4.21Å; W246-Q250 HydrophobicContact CE3-CG 4.37Å; W246-Q250 HydrophobicContact CH2-CG 4.09Å; W246-Q250 HydrophobicContact CZ2-CG 3.92Å; W246-Q250 HydrophobicContact CZ3-CG 4.31Å; W246-Q250 PolarHBondContact O-N 2.87Å
247	I	90.7	Very high	91.5	Very high	5 Å²	5	93 Å²	93	3%	0.026	43%	0.43	C	S	.	.	H	α-helix	trans	-57.4	-50.5	174.1	-72.3	167.7	0	0	0	110.9	E233 K235 A238 E243 K249 Q250 N251	E233-I247 HydrophobicContact CB-CB 4.39Å; E233-I247 HydrophobicContact CB-CD1 4.36Å; E233-I247 HydrophobicContact CB-CG1 4.05Å; E233-I247 HydrophobicContact CB-CG2 3.6Å; E233-I247 WeakPolarHBondContact O-CG2 3.46Å; K235-I247 HydrophobicContact CB-CG2 4.35Å; A238-I247 HydrophobicContact CB-CD1 4Å; E243-I247 HydrophobicContact CG-CD1 4.01Å; E243-I247 WeakPolarHBondContact O-CG1 3.38Å; E243-I247 PolarHBondContact O-N 3.48Å; I247-K249 PolarHBondContact O-N 3.49Å; I247-Q250 PolarHBondContact O-N 3.35Å; I247-N251 WeakPolarHBondContact O-CB 3.3Å; I247-N251 PolarHBondContact O-N 2.94Å
248	E	91.9	Very high	92.2	Very high	52 Å²	52	89 Å²	89	24%	0.243	41%	0.412	C	S	.	.	H	α-helix	trans	-61.7	-33.7	178.3	176	59.2	-151.3	0	0	112	R244 W246 R252 R255	R244-E248 WeakPolarHBondContact O-CB 3.33Å; R244-E248 PolarHBondContact O-N 3.42Å; R244-E248 VanDerWaalsContact O-N 3.09Å; W246-E248 PolarHBondContact O-N 2.97Å; E248-R252 WeakPolarHBondContact O-CB 3.39Å; E248-R252 PolarHBondContact O-N 3.04Å; E248-R252 IonicContact OE1-NE 3.36Å; E248-R252 IonicContact OE1-NH2 2.8Å; E248-R252 PolarHBondContact OE1-NH2 3.42Å; E248-R255 IonicContact OE1-NH2 3.54Å; E248-R255 PolarHBondContact OE1-NH2 3.33Å
249	K	93.5	Very high	92.6	Very high	152 Å²	152	93.3 Å²	93.3	66%	0.661	43%	0.429	S	S	*	.	H	α-helix	trans	-67.1	-45.1	175.7	-175.5	-178	177.2	-175.1	0	111.4	R245 W246 I247 A253	R245-K249 WeakPolarHBondContact O-CB 3.36Å; R245-K249 PolarHBondContact O-N 2.86Å; W246-K249 WeakPolarHBondContact O-CB 3.1Å; W246-K249 PolarHBondContact O-N 2.82Å; W246-K249 VanDerWaalsContact O-N 3.13Å; I247-K249 PolarHBondContact O-N 3.49Å; K249-A253 PolarHBondContact O-N 3.18Å; K249-A253 VanDerWaalsContact O-N 3.08Å
250	Q	93.5	Very high	93	Very high	90 Å²	90	90.4 Å²	90.4	42%	0.421	41%	0.413	S	S	.	.	H	α-helix	trans	-61.1	-53.9	175.3	-71.9	-66.7	-27.2	0	0	110.8	W246 I247 R252 A253 T254	W246-Q250 HydrophobicContact CD2-CG 4.21Å; W246-Q250 HydrophobicContact CE3-CG 4.37Å; W246-Q250 HydrophobicContact CH2-CG 4.09Å; W246-Q250 HydrophobicContact CZ2-CG 3.92Å; W246-Q250 HydrophobicContact CZ3-CG 4.31Å; W246-Q250 PolarHBondContact O-N 2.87Å; I247-Q250 PolarHBondContact O-N 3.35Å; Q250-R252 VanDerWaalsContact C-N 3.28Å; Q250-R252 PolarHBondContact O-N 3.03Å; Q250-A253 WeakPolarHBondContact O-CA 3.41Å; Q250-A253 WeakPolarHBondContact O-CB 3.34Å; Q250-A253 PolarHBondContact O-N 2.74Å; Q250-T254 PolarHBondContact O-N 2.89Å; Q250-T254 PolarHBondContact O-OG1 2.94Å
251	N	94.1	Very high	93.4	Very high	10 Å²	10	92.3 Å²	92.3	5%	0.053	42%	0.416	C	S	.	.	H	α-helix	trans	-57.6	-41	179.1	-71.7	-7.1	0	0	0	112.1	D231 E233 I247 A253 T254 R255	D231-N251 HydrophobicContact CB-CB 4.24Å; E233-N251 PolarHBondContact O-ND2 3.41Å; I247-N251 WeakPolarHBondContact O-CB 3.3Å; I247-N251 PolarHBondContact O-N 2.94Å; N251-A253 PolarHBondContact O-N 3.4Å; N251-T254 PolarHBondContact O-N 3.49Å; N251-R255 WeakPolarHBondContact O-CB 3.49Å; N251-R255 VanDerWaalsContact O-CG 3.28Å; N251-R255 WeakPolarHBondContact O-CG 3.49Å; N251-R255 PolarHBondContact O-N 3.37Å; N251-R255 PolarHBondContact O-NE 3.2Å
252	R	94.1	Very high	93.6	Very high	150 Å²	150	84.6 Å²	84.6	57%	0.566	39%	0.387	S	S	*	.	H	α-helix	trans	-62.3	-41.6	175	-175	-179.3	-56.4	174.1	3.9	112.4	E248 Q250 A256	E248-R252 WeakPolarHBondContact O-CB 3.39Å; E248-R252 PolarHBondContact O-N 3.04Å; E248-R252 IonicContact OE1-NE 3.36Å; E248-R252 IonicContact OE1-NH2 2.8Å; E248-R252 PolarHBondContact OE1-NH2 3.42Å; Q250-R252 VanDerWaalsContact C-N 3.28Å; Q250-R252 PolarHBondContact O-N 3.03Å; R252-A256 VanDerWaalsContact O-CB 3.29Å; R252-A256 WeakPolarHBondContact O-CB 3.41Å; R252-A256 PolarHBondContact O-N 2.81Å
253	A	95.1	Very high	94	Very high	58 Å²	58	82.2 Å²	82.2	48%	0.479	37%	0.373	S	S	.	.	H	α-helix	trans	-63.4	-46.3	177.1	0	0	0	0	0	110.9	K249 Q250 N251 A256 Q257	K249-A253 PolarHBondContact O-N 3.18Å; K249-A253 VanDerWaalsContact O-N 3.08Å; Q250-A253 WeakPolarHBondContact O-CA 3.41Å; Q250-A253 WeakPolarHBondContact O-CB 3.34Å; Q250-A253 PolarHBondContact O-N 2.74Å; N251-A253 PolarHBondContact O-N 3.4Å; A253-A256 WeakPolarHBondContact O-CB 3.5Å; A253-A256 PolarHBondContact O-N 3.12Å; A253-Q257 PolarHBondContact O-N 2.95Å
254	T	95	Very high	94.4	Very high	44 Å²	44	83 Å²	83	27%	0.27	38%	0.379	S	S	.	.	H	α-helix	trans	-64.1	-43.7	178.6	-48.5	0	0	0	0	112.1	Q250 N251 A256 Q257 R258	Q250-T254 PolarHBondContact O-N 2.89Å; Q250-T254 PolarHBondContact O-OG1 2.94Å; N251-T254 PolarHBondContact O-N 3.49Å; T254-A256 VanDerWaalsContact C-N 3.34Å; T254-A256 PolarHBondContact O-N 3.48Å; T254-Q257 PolarHBondContact O-N 3.41Å; T254-R258 VanDerWaalsContact CG2-CZ 3.48Å; T254-R258 PolarHBondContact O-N 2.87Å
255	R	94.6	Very high	94.8	Very high	54 Å²	54	79 Å²	79	20%	0.204	36%	0.364	C	S	.	.	H	α-helix	trans	-61.3	-41.4	173.4	-73.4	-178.1	-67.2	149.6	-7.8	112.3	F227 D231 E248 N251 Q257 R258 K259	F227-R255 HydrophobicContact CB-CG 4.44Å; D231-R255 WeakPolarHBondContact OD1-CD 3.44Å; D231-R255 WeakPolarHBondContact OD1-CG 3.28Å; D231-R255 IonicContact OD1-NE 3.54Å; D231-R255 IonicContact OD2-NE 2.69Å; E248-R255 IonicContact OE1-NH2 3.54Å; E248-R255 PolarHBondContact OE1-NH2 3.33Å; N251-R255 WeakPolarHBondContact O-CB 3.49Å; N251-R255 VanDerWaalsContact O-CG 3.28Å; N251-R255 WeakPolarHBondContact O-CG 3.49Å; N251-R255 PolarHBondContact O-N 3.37Å; N251-R255 PolarHBondContact O-NE 3.2Å; R255-Q257 VanDerWaalsContact C-N 3.32Å; R255-R258 PolarHBondContact O-N 3.44Å; R255-K259 WeakPolarHBondContact O-CB 3.3Å; R255-K259 WeakPolarHBondContact O-CG 3.45Å; R255-K259 PolarHBondContact O-N 3.28Å
256	A	96.1	Very high	95.2	Very high	56 Å²	56	72 Å²	72	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-63.1	-40.3	177	0	0	0	0	0	111.6	R252 A253 T254 K259 K260	R252-A256 VanDerWaalsContact O-CB 3.29Å; R252-A256 WeakPolarHBondContact O-CB 3.41Å; R252-A256 PolarHBondContact O-N 2.81Å; A253-A256 WeakPolarHBondContact O-CB 3.5Å; A253-A256 PolarHBondContact O-N 3.12Å; T254-A256 VanDerWaalsContact C-N 3.34Å; T254-A256 PolarHBondContact O-N 3.48Å; A256-K259 PolarHBondContact O-N 3.4Å; A256-K260 WeakPolarHBondContact O-CB 3.48Å; A256-K260 PolarHBondContact O-N 2.88Å
257	Q	96.7	Very high	95.6	Very high	93 Å²	93	69.4 Å²	69.4	44%	0.435	33%	0.328	S	S	.	.	H	α-helix	trans	-62.9	-49	175.1	-178.9	59.9	22	0	0	111.8	A253 T254 R255 K259 K260 E261	A253-Q257 PolarHBondContact O-N 2.95Å; T254-Q257 PolarHBondContact O-N 3.41Å; R255-Q257 VanDerWaalsContact C-N 3.32Å; Q257-K259 VanDerWaalsContact C-N 3.34Å; Q257-K259 PolarHBondContact O-N 3.48Å; Q257-K260 WeakPolarHBondContact O-CB 3.38Å; Q257-K260 PolarHBondContact O-N 2.92Å; Q257-K260 VanDerWaalsContact O-N 3.09Å; Q257-E261 PolarHBondContact NE2-OE1 3.48Å; Q257-E261 WeakPolarHBondContact O-CG 3.2Å; Q257-E261 PolarHBondContact O-N 3.34Å
258	R	96	Very high	95.9	Very high	59 Å²	59	72.5 Å²	72.5	22%	0.223	35%	0.347	C	S	.	.	H	α-helix	trans	-62.5	-38.7	177	-69.3	-178.7	-179.5	122.2	3.8	112.7	F227 L230 T254 R255 K260 E261 E262	F227-R258 HydrophobicContact CB-CB 4.05Å; F227-R258 HydrophobicContact CD1-CB 4.26Å; F227-R258 HydrophobicContact CD2-CB 3.6Å; F227-R258 HydrophobicContact CE2-CB 4.1Å; F227-R258 HydrophobicContact CG-CB 3.7Å; L230-R258 VanDerWaalsContact CB-NH1 3.35Å; L230-R258 PolarHBondContact O-NH1 3.42Å; T254-R258 VanDerWaalsContact CG2-CZ 3.48Å; T254-R258 PolarHBondContact O-N 2.87Å; R255-R258 PolarHBondContact O-N 3.44Å; R258-K260 VanDerWaalsContact C-N 3.33Å; R258-K260 PolarHBondContact O-N 2.98Å; R258-E261 PolarHBondContact O-N 3.34Å; R258-E262 WeakPolarHBondContact O-CB 3.2Å; R258-E262 PolarHBondContact O-N 3.16Å
259	K	96.1	Very high	96.2	Very high	98 Å²	98	70 Å²	70	43%	0.426	34%	0.336	S	S	.	.	H	α-helix	trans	-61.8	-41.2	172.3	-77.4	-171.5	176.1	-169.4	0	112	F227 R255 A256 Q257 E262 M263	F227-K259 HydrophobicContact CD2-CG 3.83Å; F227-K259 HydrophobicContact CE2-CG 3.97Å; R255-K259 WeakPolarHBondContact O-CB 3.3Å; R255-K259 WeakPolarHBondContact O-CG 3.45Å; R255-K259 PolarHBondContact O-N 3.28Å; A256-K259 PolarHBondContact O-N 3.4Å; Q257-K259 VanDerWaalsContact C-N 3.34Å; Q257-K259 PolarHBondContact O-N 3.48Å; K259-E262 PolarHBondContact O-N 2.91Å; K259-M263 VanDerWaalsContact O-CG 3.31Å; K259-M263 WeakPolarHBondContact O-CG 3.24Å; K259-M263 PolarHBondContact O-N 2.84Å
260	K	97.1	Very high	96.4	Very high	125 Å²	125	62.8 Å²	62.8	54%	0.543	30%	0.304	S	S	.	.	H	α-helix	trans	-64.1	-44.5	176.6	-177.2	-178.4	176.7	-175.5	0	111.4	A256 Q257 R258 M263 N264	A256-K260 WeakPolarHBondContact O-CB 3.48Å; A256-K260 PolarHBondContact O-N 2.88Å; Q257-K260 WeakPolarHBondContact O-CB 3.38Å; Q257-K260 PolarHBondContact O-N 2.92Å; Q257-K260 VanDerWaalsContact O-N 3.09Å; R258-K260 VanDerWaalsContact C-N 3.33Å; R258-K260 PolarHBondContact O-N 2.98Å; K260-M263 PolarHBondContact O-N 3.49Å; K260-N264 WeakPolarHBondContact O-CB 3.5Å; K260-N264 PolarHBondContact O-N 3.27Å; K260-N264 PolarHBondContact O-ND2 2.96Å
261	E	96.9	Very high	96.6	Very high	103 Å²	103	61.2 Å²	61.2	48%	0.481	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-44.1	175.8	-72.7	165.3	-172.8	0	0	111.9	Q257 R258 N264 R265	Q257-E261 PolarHBondContact NE2-OE1 3.48Å; Q257-E261 WeakPolarHBondContact O-CG 3.2Å; Q257-E261 PolarHBondContact O-N 3.34Å; R258-E261 PolarHBondContact O-N 3.34Å; E261-N264 WeakPolarHBondContact O-CB 3.48Å; E261-N264 PolarHBondContact O-N 3.26Å; E261-R265 PolarHBondContact O-N 3.37Å
262	E	96.9	Very high	96.8	Very high	14 Å²	14	62 Å²	62	7%	0.065	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-44.6	176.4	175.9	62	175.1	0	0	112.3	R225 F227 R258 K259 N264 R265 I266	R225-E262 IonicContact CZ-OE1 3.94Å; R225-E262 VanDerWaalsContact NH1-CD 3.25Å; R225-E262 IonicContact NH1-OE1 3.23Å; R225-E262 PolarHBondContact NH1-OE1 3.41Å; R225-E262 IonicContact NH1-OE2 3.01Å; R225-E262 PolarHBondContact NH1-OE2 2.97Å; F227-E262 HydrophobicContact CE2-CB 4.14Å; F227-E262 HydrophobicContact CZ-CB 3.93Å; F227-E262 HydrophobicContact CZ-CG 4.21Å; R258-E262 WeakPolarHBondContact O-CB 3.2Å; R258-E262 PolarHBondContact O-N 3.16Å; K259-E262 PolarHBondContact O-N 2.91Å; E262-N264 VanDerWaalsContact C-N 3.3Å; E262-N264 PolarHBondContact O-N 3.2Å; E262-R265 WeakPolarHBondContact O-CB 3.3Å; E262-R265 PolarHBondContact O-N 2.89Å; E262-R265 VanDerWaalsContact O-N 3.15Å; E262-R265 IonicContact OE1-CZ 3.55Å; E262-R265 IonicContact OE1-NE 3.31Å; E262-R265 IonicContact OE1-NH2 2.78Å; E262-R265 PolarHBondContact OE1-NH2 3.22Å; E262-R265 IonicContact OE2-CZ 3.48Å; E262-R265 IonicContact OE2-NE 3.21Å; E262-R265 PolarHBondContact OE2-NE 3.45Å; E262-R265 IonicContact OE2-NH2 3.18Å; E262-R265 PolarHBondContact OE2-NH2 3.31Å; E262-I266 WeakPolarHBondContact O-CG1 3.43Å; E262-I266 PolarHBondContact O-N 2.83Å
263	M	96.8	Very high	96.9	Very high	69 Å²	69	54.9 Å²	54.9	34%	0.34	28%	0.276	S	S	.	.	H	α-helix	trans	-64.1	-36.9	176	-69.7	-59.7	100.8	0	0	111.7	F221 K259 K260 R265 I266 R267	F221-M263 HydrophobicContact CD1-CE 4.5Å; K259-M263 VanDerWaalsContact O-CG 3.31Å; K259-M263 WeakPolarHBondContact O-CG 3.24Å; K259-M263 PolarHBondContact O-N 2.84Å; K260-M263 PolarHBondContact O-N 3.49Å; M263-R265 VanDerWaalsContact C-N 3.34Å; M263-I266 HydrophobicContact CE-CG1 4.49Å; M263-I266 PolarHBondContact O-N 2.95Å; M263-R267 VanDerWaalsContact O-CB 3.24Å; M263-R267 WeakPolarHBondContact O-CB 3.23Å; M263-R267 PolarHBondContact O-N 3.47Å
264	N	97.9	Very high	97	Very high	88 Å²	88	55.8 Å²	55.8	47%	0.471	27%	0.268	S	S	.	.	H	α-helix	trans	-64.4	-38.2	172.9	-71.7	-17.3	0	0	0	112	K260 E261 E262 R267 T268	K260-N264 WeakPolarHBondContact O-CB 3.5Å; K260-N264 PolarHBondContact O-N 3.27Å; K260-N264 PolarHBondContact O-ND2 2.96Å; E261-N264 WeakPolarHBondContact O-CB 3.48Å; E261-N264 PolarHBondContact O-N 3.26Å; E262-N264 VanDerWaalsContact C-N 3.3Å; E262-N264 PolarHBondContact O-N 3.2Å; N264-R267 PolarHBondContact O-N 2.84Å; N264-T268 WeakPolarHBondContact O-CB 2.87Å; N264-T268 PolarHBondContact O-N 3Å; N264-T268 PolarHBondContact O-OG1 3.07Å
265	R	97.9	Very high	97	Very high	38 Å²	38	56.1 Å²	56.1	14%	0.143	27%	0.272	C	S	.	.	H	α-helix	trans	-62.9	-48.6	175	-171.1	-173.1	71.9	78.2	7.5	111.4	N166 V168 N189 E261 E262 M263 R267 T268 L269	N166-R265 WeakPolarHBondContact O-CD 3.38Å; N166-R265 PolarHBondContact O-NH1 3.49Å; V168-R265 HydrophobicContact CG2-CG 3.59Å; N189-R265 PolarHBondContact OD1-NH2 3.35Å; E261-R265 PolarHBondContact O-N 3.37Å; E262-R265 WeakPolarHBondContact O-CB 3.3Å; E262-R265 PolarHBondContact O-N 2.89Å; E262-R265 VanDerWaalsContact O-N 3.15Å; E262-R265 IonicContact OE1-CZ 3.55Å; E262-R265 IonicContact OE1-NE 3.31Å; E262-R265 IonicContact OE1-NH2 2.78Å; E262-R265 PolarHBondContact OE1-NH2 3.22Å; E262-R265 IonicContact OE2-CZ 3.48Å; E262-R265 IonicContact OE2-NE 3.21Å; E262-R265 PolarHBondContact OE2-NE 3.45Å; E262-R265 IonicContact OE2-NH2 3.18Å; E262-R265 PolarHBondContact OE2-NH2 3.31Å; M263-R265 VanDerWaalsContact C-N 3.34Å; R265-R267 VanDerWaalsContact C-N 3.34Å; R265-R267 PolarHBondContact O-N 3.32Å; R265-T268 WeakPolarHBondContact O-CB 3.37Å; R265-T268 PolarHBondContact O-N 3.19Å; R265-L269 PolarHBondContact O-N 3.34Å
266	I	98.2	Very high	96.9	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-43.4	174.8	-62.9	-61.7	0	0	0	110.7	N189 W218 F221 E262 M263 T268 L269 V270	N189-I266 HydrophobicContact CB-CD1 4.18Å; N189-I266 WeakPolarHBondContact OD1-CD1 3.39Å; W218-I266 HydrophobicContact CE3-CG2 4.26Å; F221-I266 HydrophobicContact CB-CG2 4.16Å; F221-I266 HydrophobicContact CD1-CG1 4.41Å; F221-I266 HydrophobicContact CD1-CG2 4.03Å; F221-I266 HydrophobicContact CG-CG2 4.24Å; E262-I266 WeakPolarHBondContact O-CG1 3.43Å; E262-I266 PolarHBondContact O-N 2.83Å; M263-I266 HydrophobicContact CE-CG1 4.49Å; M263-I266 PolarHBondContact O-N 2.95Å; I266-T268 VanDerWaalsContact C-N 3.29Å; I266-T268 PolarHBondContact O-N 2.99Å; I266-L269 WeakPolarHBondContact O-CB 3.4Å; I266-L269 PolarHBondContact O-N 3.36Å; I266-V270 HydrophobicContact CG2-CG2 4.38Å; I266-V270 VanDerWaalsContact O-CG2 3.29Å; I266-V270 WeakPolarHBondContact O-CG2 3.49Å; I266-V270 PolarHBondContact O-N 2.81Å
267	R	98.1	Very high	96.9	Very high	96 Å²	96	51.4 Å²	51.4	36%	0.362	24%	0.244	S	C	.	.	H	α-helix	trans	-57.7	-43.9	176.6	-169.4	76.2	-166.7	72.3	21.7	111.7	Y219 M263 N264 R265 V270 D271	Y219-R267 VanDerWaalsContact CD1-CZ 3.44Å; Y219-R267 VanDerWaalsContact CE1-NH2 3.29Å; M263-R267 VanDerWaalsContact O-CB 3.24Å; M263-R267 WeakPolarHBondContact O-CB 3.23Å; M263-R267 PolarHBondContact O-N 3.47Å; N264-R267 PolarHBondContact O-N 2.84Å; R265-R267 VanDerWaalsContact C-N 3.34Å; R265-R267 PolarHBondContact O-N 3.32Å; R267-V270 PolarHBondContact O-N 3.34Å; R267-D271 VanDerWaalsContact CZ-CG 3.5Å; R267-D271 IonicContact CZ-OD1 3.76Å; R267-D271 IonicContact CZ-OD2 3.22Å; R267-D271 IonicContact NH1-OD1 2.92Å; R267-D271 PolarHBondContact NH1-OD1 2.91Å; R267-D271 IonicContact NH1-OD2 3.05Å; R267-D271 PolarHBondContact NH1-OD2 3.32Å; R267-D271 VanDerWaalsContact NH1-OD2 3.17Å; R267-D271 VanDerWaalsContact NH2-CG 3.3Å; R267-D271 IonicContact NH2-OD1 3.78Å; R267-D271 PolarHBondContact NH2-OD1 2.83Å; R267-D271 IonicContact NH2-OD2 3.64Å; R267-D271 PolarHBondContact NH2-OD2 3.07Å; R267-D271 WeakPolarHBondContact O-CB 3.32Å; R267-D271 PolarHBondContact O-N 3.33Å
268	T	97.9	Very high	96.8	Very high	69 Å²	69	48.9 Å²	48.9	42%	0.423	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-43	177	-56.7	0	0	0	0	111.6	V168 N264 R265 I266 V270 D271 N272	V168-T268 HydrophobicContact CG1-CG2 4.33Å; N264-T268 WeakPolarHBondContact O-CB 2.87Å; N264-T268 PolarHBondContact O-N 3Å; N264-T268 PolarHBondContact O-OG1 3.07Å; R265-T268 WeakPolarHBondContact O-CB 3.37Å; R265-T268 PolarHBondContact O-N 3.19Å; I266-T268 VanDerWaalsContact C-N 3.29Å; I266-T268 PolarHBondContact O-N 2.99Å; T268-V270 VanDerWaalsContact C-N 3.35Å; T268-V270 PolarHBondContact O-N 3.09Å; T268-D271 PolarHBondContact O-N 3.33Å; T268-N272 WeakPolarHBondContact O-CB 3.34Å; T268-N272 VanDerWaalsContact O-CG 3.27Å; T268-N272 PolarHBondContact O-N 2.55Å
269	L	98.1	Very high	96.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.3	-48.9	173.8	170.5	65.2	0	0	0	111.5	V168 F182 V185 F186 R265 I266 N272 A273	V168-L269 HydrophobicContact CG1-CB 3.85Å; V168-L269 HydrophobicContact CG1-CD1 4.16Å; V168-L269 HydrophobicContact CG2-CB 4.27Å; F182-L269 HydrophobicContact CD1-CD1 3.82Å; F182-L269 HydrophobicContact CE1-CD1 3.84Å; V185-L269 HydrophobicContact CB-CD1 4.43Å; V185-L269 HydrophobicContact CG1-CD1 3.61Å; V185-L269 HydrophobicContact CG1-CD2 3.84Å; V185-L269 HydrophobicContact CG1-CG 4.4Å; F186-L269 HydrophobicContact CD1-CD2 4.03Å; F186-L269 HydrophobicContact CD1-CG 4.43Å; F186-L269 HydrophobicContact CE1-CD2 3.87Å; F186-L269 HydrophobicContact CE1-CG 3.83Å; F186-L269 HydrophobicContact CZ-CD1 4.38Å; F186-L269 HydrophobicContact CZ-CD2 4.47Å; F186-L269 HydrophobicContact CZ-CG 3.99Å; R265-L269 PolarHBondContact O-N 3.34Å; I266-L269 WeakPolarHBondContact O-CB 3.4Å; I266-L269 PolarHBondContact O-N 3.36Å; L269-N272 PolarHBondContact O-N 3.05Å; L269-A273 WeakPolarHBondContact O-CB 3.48Å; L269-A273 PolarHBondContact O-N 2.9Å
270	V	98.3	Very high	96.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-44.3	-179.5	179.8	0	0	0	0	111.4	F186 Y215 W218 Y219 I266 R267 T268 A273 Y274	F186-V270 HydrophobicContact CE1-CG2 4.08Å; Y215-V270 HydrophobicContact CD1-CG1 4.06Å; W218-V270 HydrophobicContact CB-CG1 4.34Å; W218-V270 HydrophobicContact CB-CG2 3.66Å; W218-V270 HydrophobicContact CG-CG2 4.48Å; Y219-V270 HydrophobicContact CD1-CG1 4.19Å; Y219-V270 HydrophobicContact CD2-CG1 3.83Å; Y219-V270 HydrophobicContact CE1-CG1 4.04Å; Y219-V270 HydrophobicContact CE2-CG1 3.57Å; Y219-V270 HydrophobicContact CG-CG1 4.07Å; I266-V270 HydrophobicContact CG2-CG2 4.38Å; I266-V270 VanDerWaalsContact O-CG2 3.29Å; I266-V270 WeakPolarHBondContact O-CG2 3.49Å; I266-V270 PolarHBondContact O-N 2.81Å; R267-V270 PolarHBondContact O-N 3.34Å; T268-V270 VanDerWaalsContact C-N 3.35Å; T268-V270 PolarHBondContact O-N 3.09Å; V270-A273 PolarHBondContact O-N 3.37Å; V270-Y274 VanDerWaalsContact O-CB 3.29Å; V270-Y274 WeakPolarHBondContact O-CB 2.98Å; V270-Y274 PolarHBondContact O-N 3.46Å
271	D	97.6	Very high	96.5	Very high	57 Å²	57	40.8 Å²	40.8	31%	0.305	20%	0.202	S	C	.	.	H	α-helix	trans	-66.2	-40.3	178.8	-78.1	-24.3	0	0	0	112.7	Y219 R267 T268 S275	Y219-D271 PolarHBondContact OH-OD1 3.37Å; R267-D271 VanDerWaalsContact CZ-CG 3.5Å; R267-D271 IonicContact CZ-OD1 3.76Å; R267-D271 IonicContact CZ-OD2 3.22Å; R267-D271 IonicContact NH1-OD1 2.92Å; R267-D271 PolarHBondContact NH1-OD1 2.91Å; R267-D271 IonicContact NH1-OD2 3.05Å; R267-D271 PolarHBondContact NH1-OD2 3.32Å; R267-D271 VanDerWaalsContact NH1-OD2 3.17Å; R267-D271 VanDerWaalsContact NH2-CG 3.3Å; R267-D271 IonicContact NH2-OD1 3.78Å; R267-D271 PolarHBondContact NH2-OD1 2.83Å; R267-D271 IonicContact NH2-OD2 3.64Å; R267-D271 PolarHBondContact NH2-OD2 3.07Å; R267-D271 WeakPolarHBondContact O-CB 3.32Å; R267-D271 PolarHBondContact O-N 3.33Å; T268-D271 PolarHBondContact O-N 3.33Å; D271-S275 VanDerWaalsContact O-CB 3.26Å; D271-S275 WeakPolarHBondContact O-CB 3.45Å; D271-S275 PolarHBondContact O-N 2.87Å; D271-S275 PolarHBondContact O-OG 3.45Å
272	N	96.8	Very high	96.4	Very high	28 Å²	28	41.5 Å²	41.5	15%	0.15	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-51.7	174.6	-76	-6.3	0	0	0	110	P169 K171 F182 T268 L269 S275 C276	P169-N272 PolarHBondContact O-ND2 3.03Å; K171-N272 VanDerWaalsContact CE-OD1 3.25Å; K171-N272 WeakPolarHBondContact CE-OD1 3.21Å; K171-N272 HydrophobicContact CG-CB 4.26Å; F182-N272 HydrophobicContact CE1-CB 4.41Å; F182-N272 HydrophobicContact CZ-CB 4.17Å; T268-N272 WeakPolarHBondContact O-CB 3.34Å; T268-N272 VanDerWaalsContact O-CG 3.27Å; T268-N272 PolarHBondContact O-N 2.55Å; L269-N272 PolarHBondContact O-N 3.05Å; N272-S275 PolarHBondContact O-N 3.24Å; N272-S275 PolarHBondContact O-OG 2.95Å; N272-C276 PolarHBondContact O-N 3.2Å; N272-C276 PolarHBondContact O-SG 2.88Å
273	A	97.1	Very high	96.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.9	-54	177.9	0	0	0	0	0	111.8	F178 F182 F186 Y215 L269 V270 S275 C276 D277	F178-A273 HydrophobicContact CE2-CB 4.19Å; F178-A273 WeakPolarHBondContact CE2-O 3.44Å; F178-A273 HydrophobicContact CZ-CB 4.48Å; F182-A273 HydrophobicContact CD1-CB 3.76Å; F182-A273 HydrophobicContact CD2-CB 4.34Å; F182-A273 HydrophobicContact CE1-CB 3.78Å; F182-A273 HydrophobicContact CE2-CB 4.31Å; F182-A273 HydrophobicContact CG-CB 4.06Å; F182-A273 HydrophobicContact CZ-CB 4.07Å; F186-A273 HydrophobicContact CE2-CB 3.72Å; F186-A273 HydrophobicContact CZ-CB 3.73Å; Y215-A273 HydrophobicContact CE1-CB 4.34Å; L269-A273 WeakPolarHBondContact O-CB 3.48Å; L269-A273 PolarHBondContact O-N 2.9Å; V270-A273 PolarHBondContact O-N 3.37Å; A273-S275 PolarHBondContact O-N 3.35Å; A273-C276 PolarHBondContact O-N 2.96Å; A273-C276 VanDerWaalsContact O-N 3.09Å; A273-C276 PolarHBondContact O-SG 2.7Å; A273-C276 VanDerWaalsContact O-SG 3.39Å; A273-D277 WeakPolarHBondContact O-CB 3.25Å; A273-D277 PolarHBondContact O-N 2.92Å
274	Y	96.7	Very high	96.1	Very high	76 Å²	76	44.7 Å²	44.7	30%	0.298	22%	0.215	S	C	.	.	H	α-helix	trans	-58.7	-35.5	-177.7	-174	-94.2	0	0	0	112.9	Y215 Y219 V270 I280	Y215-Y274 AromaticContact CD1-CD2 3.8Å; Y215-Y274 HydrophobicContact CD1-CD2 3.8Å; Y215-Y274 HydrophobicContact CD1-CG 4.47Å; Y215-Y274 AromaticContact CD2-CD2 3.81Å; Y215-Y274 HydrophobicContact CD2-CD2 3.81Å; Y215-Y274 HydrophobicContact CD2-CE2 4.27Å; Y215-Y274 AromaticContact CE1-CD2 3.92Å; Y215-Y274 HydrophobicContact CE1-CD2 3.92Å; Y215-Y274 HydrophobicContact CE1-CG 4.34Å; Y215-Y274 AromaticContact CE2-CD2 3.92Å; Y215-Y274 HydrophobicContact CE2-CD2 3.92Å; Y215-Y274 AromaticContact CG-CD2 3.75Å; Y215-Y274 HydrophobicContact CG-CD2 3.75Å; Y215-Y274 HydrophobicContact CG-CE2 4.37Å; Y215-Y274 AromaticContact CZ-CD2 3.99Å; Y215-Y274 PolarHBondContact OH-N 2.67Å; Y219-Y274 HydrophobicContact CE2-CD2 4.27Å; Y219-Y274 WeakPolarHBondContact OH-CB 3.46Å; V270-Y274 VanDerWaalsContact O-CB 3.29Å; V270-Y274 WeakPolarHBondContact O-CB 2.98Å; V270-Y274 PolarHBondContact O-N 3.46Å; Y274-I280 HydrophobicContact CD2-CD1 4.18Å; Y274-I280 HydrophobicContact CD2-CG1 4.09Å; Y274-I280 HydrophobicContact CE1-CG2 4.09Å; Y274-I280 HydrophobicContact CE2-CD1 3.65Å; Y274-I280 HydrophobicContact CE2-CG1 3.96Å; Y274-I280 HydrophobicContact CE2-CG2 4.05Å
275	S	94.7	Very high	95.9	Very high	51 Å²	51	47 Å²	47	36%	0.357	22%	0.223	S	C	.	.	H	α-helix	trans	-72.4	-26.9	179.9	72.7	0	0	0	0	114	K171 D271 N272 A273	K171-S275 WeakPolarHBondContact CD-OG 3.38Å; K171-S275 WeakPolarHBondContact CE-OG 3.35Å; D271-S275 VanDerWaalsContact O-CB 3.26Å; D271-S275 WeakPolarHBondContact O-CB 3.45Å; D271-S275 PolarHBondContact O-N 2.87Å; D271-S275 PolarHBondContact O-OG 3.45Å; N272-S275 PolarHBondContact O-N 3.24Å; N272-S275 PolarHBondContact O-OG 2.95Å; A273-S275 PolarHBondContact O-N 3.35Å
276	C	94.1	Very high	95.6	Very high	12 Å²	12	50 Å²	50	8%	0.081	24%	0.239	C	C	.	.	H	α-helix	trans	-106	-14.2	-177.7	64.6	0	0	0	0	114	F182 N272 A273 P278 K281	F182-C276 WeakPolarHBondContact CE2-SG 3.44Å; N272-C276 PolarHBondContact O-N 3.2Å; N272-C276 PolarHBondContact O-SG 2.88Å; A273-C276 PolarHBondContact O-N 2.96Å; A273-C276 VanDerWaalsContact O-N 3.09Å; A273-C276 PolarHBondContact O-SG 2.7Å; A273-C276 VanDerWaalsContact O-SG 3.39Å; C276-P278 WeakPolarHBondContact O-CD 3.46Å; C276-K281 PolarHBondContact O-NZ 3.3Å
277	D	96.1	Very high	95.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.257	C	S	.	.			trans	-52.6	118.7	-179.9	-170.1	-41	0	0	0	111.7	F178 Y215 A273 R279 I280 K281	F178-D277 HydrophobicContact CE1-CB 4.09Å; F178-D277 WeakPolarHBondContact CE1-OD2 3.34Å; F178-D277 HydrophobicContact CE2-CB 3.84Å; F178-D277 HydrophobicContact CZ-CB 3.56Å; F178-D277 WeakPolarHBondContact CZ-OD2 3.25Å; Y215-D277 WeakPolarHBondContact OH-CB 3.44Å; Y215-D277 PolarHBondContact OH-OD2 3.39Å; A273-D277 WeakPolarHBondContact O-CB 3.25Å; A273-D277 PolarHBondContact O-N 2.92Å; D277-R279 VanDerWaalsContact C-N 3.28Å; D277-R279 PolarHBondContact O-N 3.33Å; D277-R279 WeakPolarHBondContact OD1-CA 3.29Å; D277-R279 VanDerWaalsContact OD1-CB 3.25Å; D277-R279 WeakPolarHBondContact OD1-CB 3.13Å; D277-R279 PolarHBondContact OD1-N 2.95Å; D277-R279 IonicContact OD1-NE 3.49Å; D277-R279 PolarHBondContact OD1-NE 3.3Å; D277-R279 IonicContact OD2-CZ 3.47Å; D277-R279 IonicContact OD2-NE 3.9Å; D277-R279 PolarHBondContact OD2-NE 2.92Å; D277-R279 IonicContact OD2-NH2 2.96Å; D277-R279 PolarHBondContact OD2-NH2 3.01Å; D277-I280 HydrophobicContact CB-CB 4.15Å; D277-I280 HydrophobicContact CB-CG1 3.84Å; D277-I280 PolarHBondContact O-N 3.18Å; D277-K281 PolarHBondContact O-N 3.1Å
278	P	94.4	Very high	95.2	Very high	39 Å²	39	55.4 Å²	55.4	25%	0.253	27%	0.267	S	S	.	.	H	α-helix	trans	-59.1	-35	179.4	-25.2	34.7	0	0	0	114	F178 M204 C276 K281 K282	F178-P278 HydrophobicContact CB-CG 4.32Å; M204-P278 HydrophobicContact CE-CB 3.95Å; M204-P278 HydrophobicContact CE-CG 4.24Å; M204-P278 HydrophobicContact SD-CB 4.13Å; C276-P278 WeakPolarHBondContact O-CD 3.46Å; P278-K281 PolarHBondContact O-N 2.88Å; P278-K282 PolarHBondContact O-N 3.44Å
279	R	95.7	Very high	95.1	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-69.7	-43.3	-177.9	-56.4	169	-66.5	-176.3	7.2	110.6	L201 D203 M204 S206 D277 K281 K282 F283	L201-R279 PolarHBondContact O-NH1 3.5Å; L201-R279 PolarHBondContact O-NH2 2.91Å; D203-R279 WeakPolarHBondContact O-CD 3.48Å; D203-R279 PolarHBondContact O-NH1 3.04Å; M204-R279 HydrophobicContact SD-CG 4.2Å; S206-R279 PolarHBondContact OG-NH1 3.45Å; D277-R279 VanDerWaalsContact C-N 3.28Å; D277-R279 PolarHBondContact O-N 3.33Å; D277-R279 WeakPolarHBondContact OD1-CA 3.29Å; D277-R279 VanDerWaalsContact OD1-CB 3.25Å; D277-R279 WeakPolarHBondContact OD1-CB 3.13Å; D277-R279 PolarHBondContact OD1-N 2.95Å; D277-R279 IonicContact OD1-NE 3.49Å; D277-R279 PolarHBondContact OD1-NE 3.3Å; D277-R279 IonicContact OD2-CZ 3.47Å; D277-R279 IonicContact OD2-NE 3.9Å; D277-R279 PolarHBondContact OD2-NE 2.92Å; D277-R279 IonicContact OD2-NH2 2.96Å; D277-R279 PolarHBondContact OD2-NH2 3.01Å; R279-K281 VanDerWaalsContact C-N 3.28Å; R279-K281 PolarHBondContact O-N 3.48Å; R279-K282 WeakPolarHBondContact O-CB 3.45Å; R279-K282 PolarHBondContact O-N 2.95Å; R279-K282 VanDerWaalsContact O-N 3.16Å; R279-F283 HydrophobicContact CB-CD2 4.41Å; R279-F283 HydrophobicContact CB-CE2 3.84Å; R279-F283 HydrophobicContact CB-CZ 4.18Å; R279-F283 WeakPolarHBondContact O-CD2 3.41Å; R279-F283 WeakPolarHBondContact O-CG 3.31Å; R279-F283 PolarHBondContact O-N 3.16Å
280	I	95	Very high	94.9	Very high	11 Å²	11	61.2 Å²	61.2	6%	0.056	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-39.5	175.9	-63.8	-61.6	0	0	0	111.2	V211 Y215 Y274 D277 F283 K284	V211-I280 HydrophobicContact CG1-CD1 3.55Å; V211-I280 HydrophobicContact CG1-CG1 4.27Å; Y215-I280 HydrophobicContact CD2-CD1 4.22Å; Y215-I280 HydrophobicContact CE2-CD1 4.1Å; Y215-I280 HydrophobicContact CE2-CG1 3.97Å; Y274-I280 HydrophobicContact CD2-CD1 4.18Å; Y274-I280 HydrophobicContact CD2-CG1 4.09Å; Y274-I280 HydrophobicContact CE1-CG2 4.09Å; Y274-I280 HydrophobicContact CE2-CD1 3.65Å; Y274-I280 HydrophobicContact CE2-CG1 3.96Å; Y274-I280 HydrophobicContact CE2-CG2 4.05Å; D277-I280 HydrophobicContact CB-CB 4.15Å; D277-I280 HydrophobicContact CB-CG1 3.84Å; D277-I280 PolarHBondContact O-N 3.18Å; I280-F283 HydrophobicContact CD1-CD2 4.41Å; I280-K284 HydrophobicContact CG2-CD 4.11Å; I280-K284 WeakPolarHBondContact O-CB 3.36Å; I280-K284 VanDerWaalsContact O-CG 3.32Å; I280-K284 WeakPolarHBondContact O-CG 3.29Å; I280-K284 PolarHBondContact O-N 3.35Å
281	K	92.4	Very high	94.7	Very high	98 Å²	98	67.3 Å²	67.3	43%	0.426	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-49	174.6	-68.1	172	-176.4	160.4	0	110.9	C276 D277 P278 R279 F283 K284 E285	C276-K281 PolarHBondContact O-NZ 3.3Å; D277-K281 PolarHBondContact O-N 3.1Å; P278-K281 PolarHBondContact O-N 2.88Å; R279-K281 VanDerWaalsContact C-N 3.28Å; R279-K281 PolarHBondContact O-N 3.48Å; K281-F283 PolarHBondContact O-N 3.23Å; K281-K284 PolarHBondContact O-N 3.4Å; K281-E285 WeakPolarHBondContact O-CG 3.46Å; K281-E285 PolarHBondContact O-N 2.95Å
282	K	93.5	Very high	94.5	Very high	117 Å²	117	69 Å²	69	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-56.1	-49.5	176.5	-176.5	179.6	173.6	-176.1	0	112	P278 R279 K284 E285 E286	P278-K282 PolarHBondContact O-N 3.44Å; R279-K282 WeakPolarHBondContact O-CB 3.45Å; R279-K282 PolarHBondContact O-N 2.95Å; R279-K282 VanDerWaalsContact O-N 3.16Å; K282-K284 VanDerWaalsContact C-N 3.34Å; K282-K284 PolarHBondContact O-N 3.2Å; K282-E285 PolarHBondContact O-N 3.14Å; K282-E286 WeakPolarHBondContact CE-OE1 3.47Å; K282-E286 HydrophobicContact CG-CG 4.48Å; K282-E286 WeakPolarHBondContact CG-OE1 3.4Å; K282-E286 WeakPolarHBondContact O-CB 3.33Å; K282-E286 WeakPolarHBondContact O-CG 3.17Å; K282-E286 PolarHBondContact O-N 3.36Å
283	F	94.1	Very high	94.4	Very high	34 Å²	34	70.3 Å²	70.3	15%	0.149	34%	0.344	C	S	.	.	H	α-helix	trans	-61.8	-39.4	178.7	-58.9	-37.7	0	0	0	112.7	F208 V211 R279 I280 K281 E287	F208-F283 HydrophobicContact CB-CD2 4.45Å; F208-F283 HydrophobicContact CB-CE1 4.22Å; F208-F283 HydrophobicContact CB-CE2 4.13Å; F208-F283 HydrophobicContact CB-CZ 4.01Å; F208-F283 HydrophobicContact CD2-CB 4.12Å; F208-F283 HydrophobicContact CD2-CD1 4.42Å; F208-F283 AromaticContact CD2-CD2 3.55Å; F208-F283 HydrophobicContact CD2-CD2 3.55Å; F208-F283 AromaticContact CD2-CE2 3.98Å; F208-F283 HydrophobicContact CD2-CE2 3.98Å; F208-F283 AromaticContact CD2-CG 3.8Å; F208-F283 HydrophobicContact CD2-CG 3.8Å; F208-F283 HydrophobicContact CE2-CD2 4.33Å; F208-F283 HydrophobicContact CG-CD2 4.48Å; V211-F283 HydrophobicContact CB-CE2 4.26Å; V211-F283 HydrophobicContact CG1-CE2 4.39Å; V211-F283 HydrophobicContact CG2-CE2 4.23Å; R279-F283 HydrophobicContact CB-CD2 4.41Å; R279-F283 HydrophobicContact CB-CE2 3.84Å; R279-F283 HydrophobicContact CB-CZ 4.18Å; R279-F283 WeakPolarHBondContact O-CD2 3.41Å; R279-F283 WeakPolarHBondContact O-CG 3.31Å; R279-F283 PolarHBondContact O-N 3.16Å; I280-F283 HydrophobicContact CD1-CD2 4.41Å; K281-F283 PolarHBondContact O-N 3.23Å; F283-E287 WeakPolarHBondContact O-CB 3.31Å; F283-E287 PolarHBondContact O-N 3.39Å
284	K	93.4	Very high	94.4	Very high	116 Å²	116	76.6 Å²	76.6	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-39.1	176.1	-76.7	174.3	179.9	169.3	0	112.4	I280 K281 K282 K288	I280-K284 HydrophobicContact CG2-CD 4.11Å; I280-K284 WeakPolarHBondContact O-CB 3.36Å; I280-K284 VanDerWaalsContact O-CG 3.32Å; I280-K284 WeakPolarHBondContact O-CG 3.29Å; I280-K284 PolarHBondContact O-N 3.35Å; K281-K284 PolarHBondContact O-N 3.4Å; K282-K284 VanDerWaalsContact C-N 3.34Å; K282-K284 PolarHBondContact O-N 3.2Å; K284-K288 VanDerWaalsContact O-CB 3.25Å; K284-K288 WeakPolarHBondContact O-CB 2.94Å; K284-K288 PolarHBondContact O-N 2.78Å
285	E	93.3	Very high	94.3	Very high	137 Å²	137	80.8 Å²	80.8	64%	0.64	39%	0.393	S	S	*	.	H	α-helix	trans	-67.6	-44.5	176.5	-73.2	172.1	-172.2	0	0	111.6	K281 K282 K288 A289	K281-E285 WeakPolarHBondContact O-CG 3.46Å; K281-E285 PolarHBondContact O-N 2.95Å; K282-E285 PolarHBondContact O-N 3.14Å; E285-K288 PolarHBondContact O-N 3.33Å; E285-A289 VanDerWaalsContact O-CB 3.31Å; E285-A289 WeakPolarHBondContact O-CB 3.47Å; E285-A289 PolarHBondContact O-N 3.04Å
286	E	92.4	Very high	94.3	Very high	102 Å²	102	85.2 Å²	85.2	48%	0.477	41%	0.406	S	S	.	.	H	α-helix	trans	-62.1	-46.2	175.8	-73.3	174.2	179.8	0	0	111.9	K282 K288 A289 K290	K282-E286 WeakPolarHBondContact CE-OE1 3.47Å; K282-E286 HydrophobicContact CG-CG 4.48Å; K282-E286 WeakPolarHBondContact CG-OE1 3.4Å; K282-E286 WeakPolarHBondContact O-CB 3.33Å; K282-E286 WeakPolarHBondContact O-CG 3.17Å; K282-E286 PolarHBondContact O-N 3.36Å; E286-K288 PolarHBondContact O-N 3.38Å; E286-A289 PolarHBondContact O-N 2.85Å; E286-K290 WeakPolarHBondContact O-CB 3.37Å; E286-K290 PolarHBondContact O-N 3.43Å
287	E	93.1	Very high	94.4	Very high	83 Å²	83	87.4 Å²	87.4	39%	0.388	43%	0.425	S	S	.	.	H	α-helix	trans	-63.8	-39.2	175.7	-91	-70.4	116.9	0	0	112.4	F283 K290 K291	F283-E287 WeakPolarHBondContact O-CB 3.31Å; F283-E287 PolarHBondContact O-N 3.39Å; E287-K290 IonicContact OE1-NZ 3.79Å; E287-K291 WeakPolarHBondContact O-CB 3.19Å; E287-K291 WeakPolarHBondContact O-CG 3.47Å; E287-K291 PolarHBondContact O-N 3.16Å; E287-K291 WeakPolarHBondContact OE2-CE 3.17Å; E287-K291 IonicContact OE2-NZ 3.98Å
288	K	94.4	Very high	94.3	Very high	130 Å²	130	95 Å²	95	57%	0.565	46%	0.458	S	S	*	.	H	α-helix	trans	-64.5	-46.3	174.7	-175.8	-177.4	174	-169.9	0	110.8	K284 E285 E286 K290 K291 E292	K284-K288 VanDerWaalsContact O-CB 3.25Å; K284-K288 WeakPolarHBondContact O-CB 2.94Å; K284-K288 PolarHBondContact O-N 2.78Å; E285-K288 PolarHBondContact O-N 3.33Å; E286-K288 PolarHBondContact O-N 3.38Å; K288-K290 VanDerWaalsContact C-N 3.34Å; K288-K290 PolarHBondContact O-N 3.34Å; K288-K291 PolarHBondContact O-N 3.37Å; K288-E292 WeakPolarHBondContact CE-OE1 3.44Å; K288-E292 WeakPolarHBondContact O-CB 3.43Å; K288-E292 WeakPolarHBondContact O-CG 3.44Å; K288-E292 PolarHBondContact O-N 3.36Å
289	A	95.1	Very high	94.3	Very high	56 Å²	56	96.1 Å²	96.1	46%	0.463	47%	0.47	S	S	.	.	H	α-helix	trans	-61.4	-41.9	177.7	0	0	0	0	0	111.6	E285 E286 E292 A293	E285-A289 VanDerWaalsContact O-CB 3.31Å; E285-A289 WeakPolarHBondContact O-CB 3.47Å; E285-A289 PolarHBondContact O-N 3.04Å; E286-A289 PolarHBondContact O-N 2.85Å; A289-E292 PolarHBondContact O-N 3.5Å; A289-A293 VanDerWaalsContact O-CB 3.29Å; A289-A293 WeakPolarHBondContact O-CB 3.11Å; A289-A293 PolarHBondContact O-N 2.87Å
290	K	94.4	Very high	94.3	Very high	134 Å²	134	100 Å²	100	58%	0.583	49%	0.488	S	S	*	.	H	α-helix	trans	-61.7	-47.2	175.5	-175.7	-179.5	175	-173.2	0	112	E286 E287 K288 E292 A293 E294	E286-K290 WeakPolarHBondContact O-CB 3.37Å; E286-K290 PolarHBondContact O-N 3.43Å; E287-K290 IonicContact OE1-NZ 3.79Å; K288-K290 VanDerWaalsContact C-N 3.34Å; K288-K290 PolarHBondContact O-N 3.34Å; K290-E292 VanDerWaalsContact C-N 3.35Å; K290-E292 PolarHBondContact O-N 3.31Å; K290-A293 PolarHBondContact O-N 3.39Å; K290-E294 WeakPolarHBondContact O-CB 3.36Å; K290-E294 PolarHBondContact O-N 3.29Å
291	K	94.4	Very high	94.3	Very high	129 Å²	129	102.2 Å²	102.2	56%	0.561	51%	0.509	S	S	*	.	H	α-helix	trans	-63.7	-39.3	176.5	-73.9	173.4	-174.4	168.3	0	112.3	E287 K288 K295	E287-K291 WeakPolarHBondContact O-CB 3.19Å; E287-K291 WeakPolarHBondContact O-CG 3.47Å; E287-K291 PolarHBondContact O-N 3.16Å; E287-K291 WeakPolarHBondContact OE2-CE 3.17Å; E287-K291 IonicContact OE2-NZ 3.98Å; K288-K291 PolarHBondContact O-N 3.37Å; K291-K295 WeakPolarHBondContact O-CB 3.46Å; K291-K295 PolarHBondContact O-N 3.04Å
292	E	94	Very high	94.4	Very high	91 Å²	91	103.5 Å²	103.5	43%	0.425	51%	0.514	S	S	.	.	H	α-helix	trans	-66.6	-41.1	174.8	-74.9	-179.2	-168.4	0	0	112	K288 A289 K290 K295 K296	K288-E292 WeakPolarHBondContact CE-OE1 3.44Å; K288-E292 WeakPolarHBondContact O-CB 3.43Å; K288-E292 WeakPolarHBondContact O-CG 3.44Å; K288-E292 PolarHBondContact O-N 3.36Å; A289-E292 PolarHBondContact O-N 3.5Å; K290-E292 VanDerWaalsContact C-N 3.35Å; K290-E292 PolarHBondContact O-N 3.31Å; E292-K295 PolarHBondContact O-N 3.4Å; E292-K296 WeakPolarHBondContact O-CB 3.32Å; E292-K296 VanDerWaalsContact O-CG 3.26Å; E292-K296 WeakPolarHBondContact O-CG 3.45Å; E292-K296 PolarHBondContact O-N 2.72Å
293	A	94.9	Very high	94.4	Very high	57 Å²	57	104.6 Å²	104.6	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-44.1	175.4	0	0	0	0	0	111.6	A289 K290 K295 K296 A297	A289-A293 VanDerWaalsContact O-CB 3.29Å; A289-A293 WeakPolarHBondContact O-CB 3.11Å; A289-A293 PolarHBondContact O-N 2.87Å; K290-A293 PolarHBondContact O-N 3.39Å; A293-K295 PolarHBondContact O-N 3.04Å; A293-K296 PolarHBondContact O-N 3.34Å; A293-A297 WeakPolarHBondContact O-CB 3.39Å; A293-A297 PolarHBondContact O-N 3.11Å
294	E	95.2	Very high	94.5	Very high	131 Å²	131	108.4 Å²	108.4	61%	0.612	53%	0.532	S	S	*	.	H	α-helix	trans	-62	-44	175.5	-171.2	-172.9	164	0	0	111.4	K290 K296 A297 K298	K290-E294 WeakPolarHBondContact O-CB 3.36Å; K290-E294 PolarHBondContact O-N 3.29Å; E294-K296 PolarHBondContact O-N 3.31Å; E294-A297 PolarHBondContact O-N 3.16Å; E294-K298 WeakPolarHBondContact O-CB 3.23Å; E294-K298 PolarHBondContact O-N 3.02Å
295	K	95.1	Very high	94.5	Very high	165 Å²	165	107.7 Å²	107.7	72%	0.717	53%	0.53	S	S	*	.	H	α-helix	trans	-62.5	-42.3	176	-174.1	179.6	177.9	-176.2	0	111.7	K291 E292 A293 A299	K291-K295 WeakPolarHBondContact O-CB 3.46Å; K291-K295 PolarHBondContact O-N 3.04Å; E292-K295 PolarHBondContact O-N 3.4Å; A293-K295 PolarHBondContact O-N 3.04Å; K295-A299 WeakPolarHBondContact O-CB 3.36Å; K295-A299 PolarHBondContact O-N 3.36Å
296	K	95.4	Very high	94.5	Very high	144 Å²	144	106.5 Å²	106.5	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-63.6	-46.5	175.5	-75.6	172.3	-178.5	175.5	0	111.1	E292 A293 E294 K298 A299 E300	E292-K296 WeakPolarHBondContact O-CB 3.32Å; E292-K296 VanDerWaalsContact O-CG 3.26Å; E292-K296 WeakPolarHBondContact O-CG 3.45Å; E292-K296 PolarHBondContact O-N 2.72Å; A293-K296 PolarHBondContact O-N 3.34Å; E294-K296 PolarHBondContact O-N 3.31Å; K296-K298 PolarHBondContact O-N 2.81Å; K296-A299 PolarHBondContact O-N 3.22Å; K296-E300 WeakPolarHBondContact O-CB 3.17Å; K296-E300 PolarHBondContact O-N 3.42Å
297	A	95.4	Very high	94.5	Very high	58 Å²	58	106.8 Å²	106.8	48%	0.479	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-43.2	177.6	0	0	0	0	0	112	A293 E294 E300 A301	A293-A297 WeakPolarHBondContact O-CB 3.39Å; A293-A297 PolarHBondContact O-N 3.11Å; E294-A297 PolarHBondContact O-N 3.16Å; A297-E300 PolarHBondContact O-N 2.99Å; A297-A301 WeakPolarHBondContact O-CB 3.26Å; A297-A301 PolarHBondContact O-N 3.36Å
298	K	95.3	Very high	94.6	Very high	160 Å²	160	105.5 Å²	105.5	70%	0.696	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-38.6	176	-171.4	172.4	-175.8	170.8	0	112.5	E294 K296 K302	E294-K298 WeakPolarHBondContact O-CB 3.23Å; E294-K298 PolarHBondContact O-N 3.02Å; K296-K298 PolarHBondContact O-N 2.81Å; K298-K302 WeakPolarHBondContact O-CB 3.35Å; K298-K302 PolarHBondContact O-N 3.46Å
299	A	94.2	Very high	94.6	Very high	62 Å²	62	105 Å²	105	51%	0.512	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-42.3	175.4	0	0	0	0	0	111.6	K295 K296 K302 R303	K295-A299 WeakPolarHBondContact O-CB 3.36Å; K295-A299 PolarHBondContact O-N 3.36Å; K296-A299 PolarHBondContact O-N 3.22Å; A299-K302 PolarHBondContact O-N 3.16Å; A299-R303 WeakPolarHBondContact O-CB 3.42Å; A299-R303 PolarHBondContact O-N 3.1Å
300	E	94.7	Very high	94.4	Very high	84 Å²	84	108 Å²	108	39%	0.393	53%	0.532	S	S	.	.	H	α-helix	trans	-66.7	-43.4	176.6	-170.5	-177.2	159.4	0	0	112	K296 A297 K302 R303 K304	K296-E300 WeakPolarHBondContact O-CB 3.17Å; K296-E300 PolarHBondContact O-N 3.42Å; A297-E300 PolarHBondContact O-N 2.99Å; E300-K302 VanDerWaalsContact C-N 3.33Å; E300-K302 PolarHBondContact O-N 3.36Å; E300-R303 PolarHBondContact O-N 2.97Å; E300-K304 HydrophobicContact CG-CD 4.46Å; E300-K304 WeakPolarHBondContact O-CG 3.32Å; E300-K304 PolarHBondContact O-N 2.94Å; E300-K304 WeakPolarHBondContact OE1-CE 3.33Å; E300-K304 IonicContact OE1-NZ 3.69Å; E300-K304 PolarHBondContact OE1-NZ 3.03Å
301	A	94.9	Very high	94.4	Very high	59 Å²	59	109.2 Å²	109.2	49%	0.488	54%	0.537	S	S	.	.	H	α-helix	trans	-59.3	-44.2	175.3	0	0	0	0	0	111.5	A297 K304 E305	A297-A301 WeakPolarHBondContact O-CB 3.26Å; A297-A301 PolarHBondContact O-N 3.36Å; A301-K304 PolarHBondContact O-N 3.33Å; A301-E305 WeakPolarHBondContact O-CB 3.25Å; A301-E305 PolarHBondContact O-N 3.45Å
302	K	94.8	Very high	94.4	Very high	125 Å²	125	109.4 Å²	109.4	54%	0.543	54%	0.54	S	S	.	.	H	α-helix	trans	-64.6	-39.2	175.9	-171.4	178.5	-179.7	-176.7	0	112.2	K298 A299 E300 E305 Q306	K298-K302 WeakPolarHBondContact O-CB 3.35Å; K298-K302 PolarHBondContact O-N 3.46Å; A299-K302 PolarHBondContact O-N 3.16Å; E300-K302 VanDerWaalsContact C-N 3.33Å; E300-K302 PolarHBondContact O-N 3.36Å; K302-E305 PolarHBondContact O-N 3.08Å; K302-Q306 WeakPolarHBondContact O-CB 3.2Å; K302-Q306 WeakPolarHBondContact O-CG 3.42Å; K302-Q306 PolarHBondContact O-N 3.33Å
303	R	94.6	Very high	94.3	Very high	139 Å²	139	113.6 Å²	113.6	53%	0.525	55%	0.552	S	S	.	*	H	α-helix	trans	-63.4	-47.7	176.2	-168.6	-178.4	72.6	-153.2	-3.4	110.9	A299 E300 E305 Q306 E307	A299-R303 WeakPolarHBondContact O-CB 3.42Å; A299-R303 PolarHBondContact O-N 3.1Å; E300-R303 PolarHBondContact O-N 2.97Å; R303-E305 VanDerWaalsContact C-N 3.32Å; R303-E305 PolarHBondContact O-N 3.09Å; R303-Q306 PolarHBondContact O-N 3.44Å; R303-E307 WeakPolarHBondContact CG-OE1 3.4Å; R303-E307 IonicContact NE-OE1 3.51Å; R303-E307 PolarHBondContact NE-OE1 3.24Å; R303-E307 WeakPolarHBondContact O-CB 3.36Å; R303-E307 WeakPolarHBondContact O-CG 3.32Å; R303-E307 PolarHBondContact O-N 3.49Å
304	K	94.9	Very high	94.1	Very high	115 Å²	115	116.3 Å²	116.3	50%	0.5	56%	0.555	S	S	.	*	H	α-helix	trans	-60.7	-39.6	175.9	-72.7	179.4	-177.2	168.8	0	112.2	E300 A301 A308	E300-K304 HydrophobicContact CG-CD 4.46Å; E300-K304 WeakPolarHBondContact O-CG 3.32Å; E300-K304 PolarHBondContact O-N 2.94Å; E300-K304 WeakPolarHBondContact OE1-CE 3.33Å; E300-K304 IonicContact OE1-NZ 3.69Å; E300-K304 PolarHBondContact OE1-NZ 3.03Å; A301-K304 PolarHBondContact O-N 3.33Å; K304-A308 VanDerWaalsContact O-CB 3.28Å; K304-A308 WeakPolarHBondContact O-CB 3.36Å; K304-A308 PolarHBondContact O-N 3.04Å
305	E	94.5	Very high	94	Very high	101 Å²	101	112.7 Å²	112.7	47%	0.472	55%	0.548	S	S	.	.	H	α-helix	trans	-65.5	-41.3	175.5	-170	-168.7	164	0	0	112	A301 K302 R303 A308 K309	A301-E305 WeakPolarHBondContact O-CB 3.25Å; A301-E305 PolarHBondContact O-N 3.45Å; K302-E305 PolarHBondContact O-N 3.08Å; R303-E305 VanDerWaalsContact C-N 3.32Å; R303-E305 PolarHBondContact O-N 3.09Å; E305-A308 PolarHBondContact O-N 2.83Å; E305-K309 WeakPolarHBondContact O-CB 3.42Å; E305-K309 WeakPolarHBondContact O-CG 3.47Å; E305-K309 PolarHBondContact O-N 3.1Å; E305-K309 VanDerWaalsContact OE1-CE 3.25Å; E305-K309 WeakPolarHBondContact OE1-CE 3.49Å; E305-K309 IonicContact OE1-NZ 3.22Å; E305-K309 PolarHBondContact OE1-NZ 3.36Å
306	Q	92	Very high	93.9	Very high	111 Å²	111	111.3 Å²	111.3	52%	0.519	54%	0.544	S	S	.	.	H	α-helix	trans	-65.2	-46.9	176.2	-75.3	178.1	-31.5	0	0	111.7	K302 R303 A308 K309 E310	K302-Q306 WeakPolarHBondContact O-CB 3.2Å; K302-Q306 WeakPolarHBondContact O-CG 3.42Å; K302-Q306 PolarHBondContact O-N 3.33Å; R303-Q306 PolarHBondContact O-N 3.44Å; Q306-A308 VanDerWaalsContact C-N 3.31Å; Q306-A308 PolarHBondContact O-N 3.5Å; Q306-K309 PolarHBondContact O-N 2.78Å; Q306-E310 WeakPolarHBondContact O-CB 3.3Å; Q306-E310 PolarHBondContact O-N 2.94Å
307	E	94.1	Very high	93.7	Very high	108 Å²	108	109.9 Å²	109.9	51%	0.505	54%	0.542	S	S	.	.	H	α-helix	trans	-59.2	-41.6	175.2	-72.7	169.2	-169.7	0	0	111.2	R303 E310 K311	R303-E307 WeakPolarHBondContact CG-OE1 3.4Å; R303-E307 IonicContact NE-OE1 3.51Å; R303-E307 PolarHBondContact NE-OE1 3.24Å; R303-E307 WeakPolarHBondContact O-CB 3.36Å; R303-E307 WeakPolarHBondContact O-CG 3.32Å; R303-E307 PolarHBondContact O-N 3.49Å; E307-E310 PolarHBondContact O-N 3.47Å; E307-K311 WeakPolarHBondContact O-CB 3.38Å; E307-K311 PolarHBondContact O-N 2.89Å
308	A	94	Very high	93.5	Very high	57 Å²	57	112.7 Å²	112.7	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-66.1	-43.3	176.4	0	0	0	0	0	112.7	K304 E305 Q306 K311 Q312	K304-A308 VanDerWaalsContact O-CB 3.28Å; K304-A308 WeakPolarHBondContact O-CB 3.36Å; K304-A308 PolarHBondContact O-N 3.04Å; E305-A308 PolarHBondContact O-N 2.83Å; Q306-A308 VanDerWaalsContact C-N 3.31Å; Q306-A308 PolarHBondContact O-N 3.5Å; A308-K311 PolarHBondContact O-N 2.99Å; A308-Q312 WeakPolarHBondContact O-CB 3.26Å; A308-Q312 PolarHBondContact O-N 2.89Å
309	K	94.3	Very high	93.4	Very high	119 Å²	119	107.9 Å²	107.9	52%	0.517	54%	0.536	S	S	.	.	H	α-helix	trans	-64.9	-39.3	176.2	-78.4	179.2	-175.9	169.5	0	112.3	E305 Q306 Q312 R313	E305-K309 WeakPolarHBondContact O-CB 3.42Å; E305-K309 WeakPolarHBondContact O-CG 3.47Å; E305-K309 PolarHBondContact O-N 3.1Å; E305-K309 VanDerWaalsContact OE1-CE 3.25Å; E305-K309 WeakPolarHBondContact OE1-CE 3.49Å; E305-K309 IonicContact OE1-NZ 3.22Å; E305-K309 PolarHBondContact OE1-NZ 3.36Å; Q306-K309 PolarHBondContact O-N 2.78Å; K309-Q312 PolarHBondContact O-N 3.38Å; K309-R313 WeakPolarHBondContact O-CB 3.36Å; K309-R313 PolarHBondContact O-N 3.48Å
310	E	92.1	Very high	93.4	Very high	120 Å²	120	107.8 Å²	107.8	56%	0.561	54%	0.535	S	S	*	.	H	α-helix	trans	-66.3	-44.1	176.3	-176.5	161.1	-164.8	0	0	111.3	Q306 E307 Q312 R313 Q314	Q306-E310 WeakPolarHBondContact O-CB 3.3Å; Q306-E310 PolarHBondContact O-N 2.94Å; E307-E310 PolarHBondContact O-N 3.47Å; E310-Q312 VanDerWaalsContact C-N 3.32Å; E310-Q312 PolarHBondContact O-N 2.84Å; E310-R313 PolarHBondContact O-N 3.06Å; E310-Q314 WeakPolarHBondContact O-CG 3.32Å; E310-Q314 PolarHBondContact O-N 3.42Å
311	K	94.1	Very high	93.2	Very high	158 Å²	158	111.5 Å²	111.5	69%	0.687	55%	0.545	S	S	*	.	H	α-helix	trans	-60.6	-41.2	173.8	-170	175.6	-178.1	179	0	112.1	E307 A308 Q314 A315	E307-K311 WeakPolarHBondContact O-CB 3.38Å; E307-K311 PolarHBondContact O-N 2.89Å; A308-K311 PolarHBondContact O-N 2.99Å; K311-Q314 PolarHBondContact O-N 3.37Å; K311-A315 WeakPolarHBondContact O-CB 3.4Å; K311-A315 PolarHBondContact O-N 2.9Å
312	Q	93.2	Very high	93	Very high	134 Å²	134	112.8 Å²	112.8	63%	0.626	54%	0.543	S	S	*	.	H	α-helix	trans	-64.3	-44	175.7	-172.5	177	8.7	0	0	111.6	A308 K309 E310 Q314 A315 E316	A308-Q312 WeakPolarHBondContact O-CB 3.26Å; A308-Q312 PolarHBondContact O-N 2.89Å; K309-Q312 PolarHBondContact O-N 3.38Å; E310-Q312 VanDerWaalsContact C-N 3.32Å; E310-Q312 PolarHBondContact O-N 2.84Å; Q312-Q314 VanDerWaalsContact C-N 3.35Å; Q312-Q314 PolarHBondContact O-N 3.32Å; Q312-A315 PolarHBondContact O-N 3.5Å; Q312-E316 WeakPolarHBondContact O-CB 3.4Å; Q312-E316 PolarHBondContact O-N 2.95Å
313	R	93.1	Very high	92.9	Very high	178 Å²	178	109.5 Å²	109.5	67%	0.672	54%	0.54	S	S	*	.	H	α-helix	trans	-62.8	-40.6	177	-170.5	-176.1	-169	-167.1	2.6	112.1	K309 E310 E316 L317	K309-R313 WeakPolarHBondContact O-CB 3.36Å; K309-R313 PolarHBondContact O-N 3.48Å; E310-R313 PolarHBondContact O-N 3.06Å; R313-E316 PolarHBondContact O-N 3.18Å; R313-L317 HydrophobicContact CG-CD1 4.33Å; R313-L317 WeakPolarHBondContact O-CB 3.44Å; R313-L317 VanDerWaalsContact O-CG 3.3Å; R313-L317 WeakPolarHBondContact O-CG 3.3Å; R313-L317 PolarHBondContact O-N 3.42Å
314	Q	91.1	Very high	92.7	Very high	114 Å²	114	108.9 Å²	108.9	53%	0.533	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-45.1	176	-73.5	177.5	2.2	0	0	111.3	E310 K311 Q312 E316 L317 E318	E310-Q314 WeakPolarHBondContact O-CG 3.32Å; E310-Q314 PolarHBondContact O-N 3.42Å; K311-Q314 PolarHBondContact O-N 3.37Å; Q312-Q314 VanDerWaalsContact C-N 3.35Å; Q312-Q314 PolarHBondContact O-N 3.32Å; Q314-E316 VanDerWaalsContact C-N 3.35Å; Q314-E316 PolarHBondContact O-N 2.98Å; Q314-L317 PolarHBondContact O-N 3.39Å; Q314-E318 PolarHBondContact O-N 3.3Å
315	A	93.2	Very high	92.4	Very high	56 Å²	56	108.7 Å²	108.7	46%	0.463	54%	0.542	S	S	.	.	H	α-helix	trans	-62.8	-39.1	176.1	0	0	0	0	0	112.5	K311 Q312 E318 A319	K311-A315 WeakPolarHBondContact O-CB 3.4Å; K311-A315 PolarHBondContact O-N 2.9Å; Q312-A315 PolarHBondContact O-N 3.5Å; A315-E318 PolarHBondContact O-N 3.34Å; A315-A319 WeakPolarHBondContact O-CB 3.42Å; A315-A319 PolarHBondContact O-N 2.98Å
316	E	92.1	Very high	92.2	Very high	135 Å²	135	109.7 Å²	109.7	63%	0.631	54%	0.544	S	S	*	.	H	α-helix	trans	-66.4	-42.7	176.6	-171.6	177.4	-171.6	0	0	112.1	Q312 R313 Q314 E318 A319 A320	Q312-E316 WeakPolarHBondContact O-CB 3.4Å; Q312-E316 PolarHBondContact O-N 2.95Å; R313-E316 PolarHBondContact O-N 3.18Å; Q314-E316 VanDerWaalsContact C-N 3.35Å; Q314-E316 PolarHBondContact O-N 2.98Å; E316-E318 PolarHBondContact O-N 3.13Å; E316-A319 PolarHBondContact O-N 3.23Å; E316-A320 WeakPolarHBondContact O-CB 3.46Å; E316-A320 PolarHBondContact O-N 3.08Å
317	L	92.1	Very high	92.1	Very high	114 Å²	114	110.5 Å²	110.5	60%	0.597	55%	0.548	S	S	*	.	H	α-helix	trans	-62.9	-40.7	175.1	-74.3	169.7	0	0	0	112.1	R313 Q314 R321	R313-L317 HydrophobicContact CG-CD1 4.33Å; R313-L317 WeakPolarHBondContact O-CB 3.44Å; R313-L317 VanDerWaalsContact O-CG 3.3Å; R313-L317 WeakPolarHBondContact O-CG 3.3Å; R313-L317 PolarHBondContact O-N 3.42Å; Q314-L317 PolarHBondContact O-N 3.39Å; L317-R321 WeakPolarHBondContact O-CB 3.46Å; L317-R321 PolarHBondContact O-N 3.02Å
318	E	90.9	Very high	91.9	Very high	118 Å²	118	109.7 Å²	109.7	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-67.3	-43.9	176.9	-174.6	172.8	-160.1	0	0	111.8	Q314 A315 E316 A320 R321 L322	Q314-E318 PolarHBondContact O-N 3.3Å; A315-E318 PolarHBondContact O-N 3.34Å; E316-E318 PolarHBondContact O-N 3.13Å; E318-A320 PolarHBondContact O-N 2.86Å; E318-R321 PolarHBondContact O-N 3.48Å; E318-R321 IonicContact OE1-NH2 3.03Å; E318-L322 PolarHBondContact O-N 3Å
319	A	93.3	Very high	91.6	Very high	59 Å²	59	111.2 Å²	111.2	49%	0.488	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-41.8	175.8	0	0	0	0	0	112	A315 E316 L322 A323	A315-A319 WeakPolarHBondContact O-CB 3.42Å; A315-A319 PolarHBondContact O-N 2.98Å; E316-A319 PolarHBondContact O-N 3.23Å; A319-L322 PolarHBondContact O-N 2.89Å; A319-A323 WeakPolarHBondContact O-CB 3.41Å; A319-A323 PolarHBondContact O-N 3.01Å
320	A	92.7	Very high	91.4	Very high	59 Å²	59	111 Å²	111	49%	0.488	54%	0.543	S	S	.	.	H	α-helix	trans	-64.5	-40.5	176.1	0	0	0	0	0	112.1	E316 E318 A323 K324	E316-A320 WeakPolarHBondContact O-CB 3.46Å; E316-A320 PolarHBondContact O-N 3.08Å; E318-A320 PolarHBondContact O-N 2.86Å; A320-A323 PolarHBondContact O-N 2.91Å; A320-K324 WeakPolarHBondContact O-CB 3.18Å; A320-K324 PolarHBondContact O-N 3.29Å
321	R	90.8	Very high	91.4	Very high	163 Å²	163	109.4 Å²	109.4	62%	0.615	54%	0.541	S	S	*	.	H	α-helix	trans	-61.6	-46.1	175	-170.3	-174.1	68.9	-151.6	-6	111	L317 E318 K324 E325	L317-R321 WeakPolarHBondContact O-CB 3.46Å; L317-R321 PolarHBondContact O-N 3.02Å; E318-R321 PolarHBondContact O-N 3.48Å; E318-R321 IonicContact OE1-NH2 3.03Å; R321-K324 PolarHBondContact O-N 3.24Å; R321-E325 PolarHBondContact O-N 3.47Å
322	L	91.4	Very high	91.2	Very high	86 Å²	86	108.2 Å²	108.2	45%	0.45	53%	0.532	S	S	.	.	H	α-helix	trans	-65.5	-38.5	179	-172.2	68.9	0	0	0	112.2	E318 A319 K326	E318-L322 PolarHBondContact O-N 3Å; A319-L322 PolarHBondContact O-N 2.89Å; L322-K326 WeakPolarHBondContact O-CG 3.4Å; L322-K326 PolarHBondContact O-N 3.01Å; L322-K326 VanDerWaalsContact O-N 3.09Å
323	A	91.8	Very high	91	Very high	56 Å²	56	107.1 Å²	107.1	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-64.7	-43.9	176	0	0	0	0	0	111.7	A319 A320 E325 K326 E327	A319-A323 WeakPolarHBondContact O-CB 3.41Å; A319-A323 PolarHBondContact O-N 3.01Å; A320-A323 PolarHBondContact O-N 2.91Å; A323-E325 PolarHBondContact O-N 3.14Å; A323-K326 PolarHBondContact O-N 2.78Å; A323-E327 PolarHBondContact O-N 3.46Å
324	K	91.2	Very high	90.8	Very high	126 Å²	126	104.7 Å²	104.7	55%	0.548	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-41.2	177.3	-165.9	-174.5	-178.5	-148.7	0	112.2	A320 R321 K326 E327 E328	A320-K324 WeakPolarHBondContact O-CB 3.18Å; A320-K324 PolarHBondContact O-N 3.29Å; R321-K324 PolarHBondContact O-N 3.24Å; K324-K326 VanDerWaalsContact C-N 3.35Å; K324-E327 PolarHBondContact O-N 3.08Å; K324-E328 WeakPolarHBondContact CE-OE1 3.48Å; K324-E328 IonicContact NZ-OE1 2.71Å; K324-E328 PolarHBondContact NZ-OE1 3.2Å; K324-E328 WeakPolarHBondContact O-CB 3.43Å; K324-E328 WeakPolarHBondContact O-CG 3.43Å; K324-E328 PolarHBondContact O-N 3.31Å
325	E	89.1	Confident	90.6	Very high	111 Å²	111	102.1 Å²	102.1	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-42.2	176.1	-174.4	174	-169.3	0	0	111.6	R321 A323 E328 E329	R321-E325 PolarHBondContact O-N 3.47Å; A323-E325 PolarHBondContact O-N 3.14Å; E325-E328 PolarHBondContact O-N 3.18Å; E325-E329 WeakPolarHBondContact O-CB 3.35Å; E325-E329 PolarHBondContact O-N 2.99Å
326	K	90.9	Very high	90.4	Very high	122 Å²	122	104.7 Å²	104.7	53%	0.53	53%	0.527	S	S	.	.	H	α-helix	trans	-63.9	-45.1	174.8	-73	176.8	179.9	-177.1	0	112.5	L322 A323 K324 E329 E330	L322-K326 WeakPolarHBondContact O-CG 3.4Å; L322-K326 PolarHBondContact O-N 3.01Å; L322-K326 VanDerWaalsContact O-N 3.09Å; A323-K326 PolarHBondContact O-N 2.78Å; K324-K326 VanDerWaalsContact C-N 3.35Å; K326-E329 WeakPolarHBondContact O-CB 3.41Å; K326-E329 PolarHBondContact O-N 3.18Å; K326-E330 WeakPolarHBondContact O-CG 3.29Å; K326-E330 PolarHBondContact O-N 3.02Å
327	E	88.8	Confident	90.2	Very high	127 Å²	127	103.7 Å²	103.7	59%	0.593	53%	0.525	S	S	*	.	H	α-helix	trans	-62	-44.5	177.3	-172.6	-178.2	177.4	0	0	111.4	A323 K324 E329 E330 V331	A323-E327 PolarHBondContact O-N 3.46Å; K324-E327 PolarHBondContact O-N 3.08Å; E327-E329 VanDerWaalsContact C-N 3.3Å; E327-E329 PolarHBondContact O-N 3.04Å; E327-E330 PolarHBondContact O-N 3.41Å; E327-V331 WeakPolarHBondContact O-CB 3.49Å; E327-V331 VanDerWaalsContact O-CG2 3.28Å; E327-V331 WeakPolarHBondContact O-CG2 3.25Å; E327-V331 PolarHBondContact O-N 2.89Å
328	E	89	Confident	90.1	Very high	91 Å²	91	100.4 Å²	100.4	43%	0.425	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-33.9	176	-74.7	177.8	-170.1	0	0	112.5	K324 E325 R332	K324-E328 WeakPolarHBondContact CE-OE1 3.48Å; K324-E328 IonicContact NZ-OE1 2.71Å; K324-E328 PolarHBondContact NZ-OE1 3.2Å; K324-E328 WeakPolarHBondContact O-CB 3.43Å; K324-E328 WeakPolarHBondContact O-CG 3.43Å; K324-E328 PolarHBondContact O-N 3.31Å; E325-E328 PolarHBondContact O-N 3.18Å; E328-R332 WeakPolarHBondContact O-CB 3.46Å; E328-R332 VanDerWaalsContact O-CG 3.28Å; E328-R332 WeakPolarHBondContact O-CG 3.47Å; E328-R332 PolarHBondContact O-N 3.09Å; E328-R332 VanDerWaalsContact O-N 3.15Å; E328-R332 PolarHBondContact O-NE 2.92Å
329	E	88.9	Confident	90.1	Very high	89 Å²	89	101.2 Å²	101.2	42%	0.416	52%	0.516	S	S	.	.	H	α-helix	trans	-69.6	-45.5	173.9	-160.8	70.5	-156.2	0	0	111.4	E325 K326 E327 R332 Q333	E325-E329 WeakPolarHBondContact O-CB 3.35Å; E325-E329 PolarHBondContact O-N 2.99Å; K326-E329 WeakPolarHBondContact O-CB 3.41Å; K326-E329 PolarHBondContact O-N 3.18Å; E327-E329 VanDerWaalsContact C-N 3.3Å; E327-E329 PolarHBondContact O-N 3.04Å; E329-R332 PolarHBondContact O-N 3.5Å; E329-R332 IonicContact OE2-CZ 2.77Å; E329-R332 IonicContact OE2-NH1 3.98Å; E329-R332 IonicContact OE2-NH2 3.35Å; E329-R332 PolarHBondContact OE2-NH2 2.97Å; E329-Q333 WeakPolarHBondContact O-CG 3.44Å; E329-Q333 PolarHBondContact O-N 2.77Å
330	E	90.6	Very high	89.9	Confident	116 Å²	116	105 Å²	105	54%	0.542	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-44.9	177.3	-75.4	177.2	-170.4	0	0	111.7	K326 E327 R332 Q333 Q334	K326-E330 WeakPolarHBondContact O-CG 3.29Å; K326-E330 PolarHBondContact O-N 3.02Å; E327-E330 PolarHBondContact O-N 3.41Å; E330-R332 VanDerWaalsContact C-N 3.33Å; E330-R332 PolarHBondContact O-N 3.47Å; E330-Q333 PolarHBondContact O-N 3.01Å; E330-Q334 WeakPolarHBondContact O-CG 3.34Å; E330-Q334 PolarHBondContact O-N 2.68Å
331	V	91.6	Very high	89.6	Confident	86 Å²	86	107.8 Å²	107.8	52%	0.521	52%	0.524	S	S	.	.	H	α-helix	trans	-61.3	-42	175.5	170.7	0	0	0	0	111.1	E327 Q334 A335	E327-V331 WeakPolarHBondContact O-CB 3.49Å; E327-V331 VanDerWaalsContact O-CG2 3.28Å; E327-V331 WeakPolarHBondContact O-CG2 3.25Å; E327-V331 PolarHBondContact O-N 2.89Å; V331-Q334 PolarHBondContact O-N 3.24Å; V331-A335 WeakPolarHBondContact O-CB 3.49Å; V331-A335 PolarHBondContact O-N 2.85Å
332	R	90.1	Very high	89.3	Confident	132 Å²	132	106.3 Å²	106.3	50%	0.498	52%	0.522	S	S	.	.	H	α-helix	trans	-61.9	-43	175.5	-82.2	-178.6	-80.7	176.5	1.6	111.8	E328 E329 E330 A335 L336	E328-R332 WeakPolarHBondContact O-CB 3.46Å; E328-R332 VanDerWaalsContact O-CG 3.28Å; E328-R332 WeakPolarHBondContact O-CG 3.47Å; E328-R332 PolarHBondContact O-N 3.09Å; E328-R332 VanDerWaalsContact O-N 3.15Å; E328-R332 PolarHBondContact O-NE 2.92Å; E329-R332 PolarHBondContact O-N 3.5Å; E329-R332 IonicContact OE2-CZ 2.77Å; E329-R332 IonicContact OE2-NH1 3.98Å; E329-R332 IonicContact OE2-NH2 3.35Å; E329-R332 PolarHBondContact OE2-NH2 2.97Å; E330-R332 VanDerWaalsContact C-N 3.33Å; E330-R332 PolarHBondContact O-N 3.47Å; R332-A335 PolarHBondContact O-N 3.16Å; R332-L336 WeakPolarHBondContact O-CG 3.37Å; R332-L336 PolarHBondContact O-N 3.39Å; R332-L336 VanDerWaalsContact O-N 3.11Å
333	Q	88.1	Confident	89	Confident	111 Å²	111	105.7 Å²	105.7	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-65.1	-45.1	177.2	-71.4	-177.5	13.4	0	0	112	E329 E330 A335 L336 L337	E329-Q333 WeakPolarHBondContact O-CG 3.44Å; E329-Q333 PolarHBondContact O-N 2.77Å; E330-Q333 PolarHBondContact O-N 3.01Å; Q333-A335 VanDerWaalsContact C-N 3.35Å; Q333-A335 PolarHBondContact O-N 3.17Å; Q333-L336 PolarHBondContact O-N 2.8Å; Q333-L337 WeakPolarHBondContact O-CG 3.47Å; Q333-L337 PolarHBondContact O-N 3.48Å
334	Q	88.9	Confident	88.8	Confident	128 Å²	128	108.9 Å²	108.9	60%	0.598	53%	0.528	S	S	*	.	H	α-helix	trans	-61.7	-42	176.8	-72.6	-177.4	11.2	0	0	112	E330 V331 L336 L337 A338	E330-Q334 WeakPolarHBondContact O-CG 3.34Å; E330-Q334 PolarHBondContact O-N 2.68Å; V331-Q334 PolarHBondContact O-N 3.24Å; Q334-L336 VanDerWaalsContact C-N 3.31Å; Q334-L336 PolarHBondContact O-N 3.15Å; Q334-L337 PolarHBondContact O-N 2.97Å; Q334-A338 WeakPolarHBondContact O-CB 3.32Å; Q334-A338 PolarHBondContact O-N 2.9Å
335	A	87	Confident	88.5	Confident	60 Å²	60	107.3 Å²	107.3	50%	0.496	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-38.2	176.7	0	0	0	0	0	112.4	V331 R332 Q333 K339	V331-A335 WeakPolarHBondContact O-CB 3.49Å; V331-A335 PolarHBondContact O-N 2.85Å; R332-A335 PolarHBondContact O-N 3.16Å; Q333-A335 VanDerWaalsContact C-N 3.35Å; Q333-A335 PolarHBondContact O-N 3.17Å; A335-K339 WeakPolarHBondContact O-CB 3.34Å; A335-K339 PolarHBondContact O-N 3.49Å
336	L	89.1	Confident	88.4	Confident	109 Å²	109	108.8 Å²	108.8	57%	0.571	53%	0.527	S	S	*	.	H	α-helix	trans	-66.4	-41.9	175.4	-73.4	170.7	0	0	0	112.2	R332 Q333 Q334 K339 K340	R332-L336 WeakPolarHBondContact O-CG 3.37Å; R332-L336 PolarHBondContact O-N 3.39Å; R332-L336 VanDerWaalsContact O-N 3.11Å; Q333-L336 PolarHBondContact O-N 2.8Å; Q334-L336 VanDerWaalsContact C-N 3.31Å; Q334-L336 PolarHBondContact O-N 3.15Å; L336-K339 PolarHBondContact O-N 3.11Å; L336-K340 WeakPolarHBondContact O-CG 3.34Å; L336-K340 PolarHBondContact O-N 3.4Å
337	L	89.1	Confident	88.4	Confident	115 Å²	115	110 Å²	110	60%	0.602	53%	0.532	S	S	*	.	H	α-helix	trans	-64.8	-47.5	176.5	-68.4	175.4	0	0	0	111.4	Q333 Q334 K339 K340 E341	Q333-L337 WeakPolarHBondContact O-CG 3.47Å; Q333-L337 PolarHBondContact O-N 3.48Å; Q334-L337 PolarHBondContact O-N 2.97Å; L337-K339 VanDerWaalsContact C-N 3.28Å; L337-K339 PolarHBondContact O-N 3.35Å; L337-K340 PolarHBondContact O-N 2.91Å; L337-K340 VanDerWaalsContact O-N 3.13Å; L337-E341 PolarHBondContact O-N 3Å
338	A	88.5	Confident	88.3	Confident	44 Å²	44	105.3 Å²	105.3	36%	0.364	52%	0.516	S	S	.	.	H	α-helix	trans	-60.9	-35.6	177.8	0	0	0	0	0	112.6	Q334 K342	Q334-A338 WeakPolarHBondContact O-CB 3.32Å; Q334-A338 PolarHBondContact O-N 2.9Å; A338-K342 WeakPolarHBondContact O-CB 3.47Å; A338-K342 WeakPolarHBondContact O-CG 3.2Å; A338-K342 PolarHBondContact O-N 3.18Å
339	K	90.4	Very high	88.4	Confident	136 Å²	136	103.1 Å²	103.1	59%	0.591	51%	0.506	S	S	*	.	H	α-helix	trans	-64.5	-46	174.5	-173.4	178.7	178.9	-178.8	0	111.6	A335 L336 L337 E341 K342 D343	A335-K339 WeakPolarHBondContact O-CB 3.34Å; A335-K339 PolarHBondContact O-N 3.49Å; L336-K339 PolarHBondContact O-N 3.11Å; L337-K339 VanDerWaalsContact C-N 3.28Å; L337-K339 PolarHBondContact O-N 3.35Å; K339-E341 VanDerWaalsContact C-N 3.33Å; K339-E341 PolarHBondContact O-N 2.97Å; K339-K342 PolarHBondContact O-N 2.79Å; K339-D343 PolarHBondContact O-N 3.13Å; K339-D343 VanDerWaalsContact O-N 3.08Å
340	K	89.3	Confident	88.5	Confident	139 Å²	139	106.6 Å²	106.6	60%	0.604	52%	0.52	S	S	*	.	H	α-helix	trans	-60.2	-42.8	177.6	-72.3	178.1	-179.7	179.5	0	111.7	L336 L337 D343 L344	L336-K340 WeakPolarHBondContact O-CG 3.34Å; L336-K340 PolarHBondContact O-N 3.4Å; L337-K340 PolarHBondContact O-N 2.91Å; L337-K340 VanDerWaalsContact O-N 3.13Å; K340-D343 PolarHBondContact O-N 3.22Å; K340-L344 PolarHBondContact O-N 3.38Å; K340-L344 VanDerWaalsContact O-N 3.12Å
341	E	86.7	Confident	88.5	Confident	116 Å²	116	108.4 Å²	108.4	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-45.7	178.6	-174	174.7	-164.2	0	0	112.3	L337 K339 D343 L344 Q345	L337-E341 PolarHBondContact O-N 3Å; K339-E341 VanDerWaalsContact C-N 3.33Å; K339-E341 PolarHBondContact O-N 2.97Å; E341-D343 VanDerWaalsContact C-N 3.28Å; E341-D343 PolarHBondContact O-N 3.47Å; E341-L344 WeakPolarHBondContact O-CB 3.27Å; E341-L344 PolarHBondContact O-N 3.36Å; E341-L344 VanDerWaalsContact O-N 3.14Å; E341-Q345 WeakPolarHBondContact O-CG 3.5Å; E341-Q345 PolarHBondContact O-N 3.17Å
342	K	84.8	Confident	88.5	Confident	133 Å²	133	105.9 Å²	105.9	58%	0.578	51%	0.509	S	S	*	.	H	α-helix	trans	-59.6	-38.4	175.8	-75.9	-179.7	179.1	-179	0	112.4	A338 K339 Q345 K346	A338-K342 WeakPolarHBondContact O-CB 3.47Å; A338-K342 WeakPolarHBondContact O-CG 3.2Å; A338-K342 PolarHBondContact O-N 3.18Å; K339-K342 PolarHBondContact O-N 2.79Å; K342-Q345 PolarHBondContact O-N 3.33Å; K342-K346 VanDerWaalsContact O-CG 3.31Å; K342-K346 WeakPolarHBondContact O-CG 3.38Å; K342-K346 PolarHBondContact O-N 3.12Å
343	D	85.3	Confident	88.6	Confident	73 Å²	73	102.7 Å²	102.7	39%	0.39	50%	0.497	S	S	.	.	H	α-helix	trans	-68.8	-34.6	177.6	-72	-18.9	0	0	0	112.3	K339 K340 E341 K347	K339-D343 PolarHBondContact O-N 3.13Å; K339-D343 VanDerWaalsContact O-N 3.08Å; K340-D343 PolarHBondContact O-N 3.22Å; E341-D343 VanDerWaalsContact C-N 3.28Å; E341-D343 PolarHBondContact O-N 3.47Å; D343-K347 WeakPolarHBondContact O-CG 3.45Å; D343-K347 PolarHBondContact O-N 3.12Å
344	L	86.8	Confident	88.7	Confident	122 Å²	122	101.7 Å²	101.7	64%	0.639	49%	0.492	S	S	*	.	H	α-helix	trans	-66	-47.6	172.4	-89.3	150.6	0	0	0	111.9	K340 E341 K346 K347 A348	K340-L344 PolarHBondContact O-N 3.38Å; K340-L344 VanDerWaalsContact O-N 3.12Å; E341-L344 WeakPolarHBondContact O-CB 3.27Å; E341-L344 PolarHBondContact O-N 3.36Å; E341-L344 VanDerWaalsContact O-N 3.14Å; L344-K346 PolarHBondContact O-N 3.2Å; L344-K347 PolarHBondContact O-N 3.3Å; L344-A348 PolarHBondContact O-N 3.42Å
345	Q	85.4	Confident	88.8	Confident	94 Å²	94	99.1 Å²	99.1	44%	0.439	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-43.6	178.7	-71.5	177.9	-6.2	0	0	112	E341 K342 K347 A348 I349	E341-Q345 WeakPolarHBondContact O-CG 3.5Å; E341-Q345 PolarHBondContact O-N 3.17Å; K342-Q345 PolarHBondContact O-N 3.33Å; Q345-K347 VanDerWaalsContact C-N 3.32Å; Q345-K347 PolarHBondContact O-N 3.36Å; Q345-A348 PolarHBondContact O-N 3.35Å; Q345-I349 WeakPolarHBondContact O-CG1 3.34Å; Q345-I349 PolarHBondContact O-N 3.42Å
346	K	87.9	Confident	89	Confident	142 Å²	142	96.3 Å²	96.3	62%	0.617	46%	0.456	S	S	*	.	H	α-helix	trans	-59.3	-41.5	175.4	-75.6	175.6	-178.8	179	0	112.6	K342 L344 K350	K342-K346 VanDerWaalsContact O-CG 3.31Å; K342-K346 WeakPolarHBondContact O-CG 3.38Å; K342-K346 PolarHBondContact O-N 3.12Å; L344-K346 PolarHBondContact O-N 3.2Å; K346-K350 WeakPolarHBondContact O-CB 3.26Å; K346-K350 PolarHBondContact O-N 3.26Å; K346-K350 VanDerWaalsContact O-N 3.07Å
347	K	89.4	Confident	89.1	Confident	146 Å²	146	95.2 Å²	95.2	64%	0.635	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-39.7	176.5	-73.8	174	-176.4	177.8	0	111.6	D343 L344 Q345 K351	D343-K347 WeakPolarHBondContact O-CG 3.45Å; D343-K347 PolarHBondContact O-N 3.12Å; L344-K347 PolarHBondContact O-N 3.3Å; Q345-K347 VanDerWaalsContact C-N 3.32Å; Q345-K347 PolarHBondContact O-N 3.36Å; K347-K351 WeakPolarHBondContact O-CG 3.27Å; K347-K351 PolarHBondContact O-N 2.87Å
348	A	88.5	Confident	89.1	Confident	30 Å²	30	93.7 Å²	93.7	25%	0.248	44%	0.436	C	S	.	.	H	α-helix	trans	-66.9	-47.9	177.2	0	0	0	0	0	112	L344 Q345 K350 K351 E352 L389	L344-A348 PolarHBondContact O-N 3.42Å; Q345-A348 PolarHBondContact O-N 3.35Å; A348-K350 VanDerWaalsContact C-N 3.3Å; A348-K350 PolarHBondContact O-N 2.99Å; A348-K351 WeakPolarHBondContact O-CB 3.04Å; A348-K351 PolarHBondContact O-N 3.48Å; A348-K351 VanDerWaalsContact O-N 3.08Å; A348-E352 PolarHBondContact O-N 3.39Å; A348-E352 VanDerWaalsContact O-N 3.1Å; A348-L389 HydrophobicContact CB-CD1 3.81Å; A348-L389 HydrophobicContact CB-CD2 3.69Å; A348-L389 HydrophobicContact CB-CG 4.44Å
349	I	89.8	Confident	89	Confident	44 Å²	44	92.5 Å²	92.5	23%	0.226	43%	0.425	C	S	.	.	H	α-helix	trans	-59	-42.7	177.9	-69.3	170	0	0	0	110.8	Q345 K351 E352 R353 L389 L392	Q345-I349 WeakPolarHBondContact O-CG1 3.34Å; Q345-I349 PolarHBondContact O-N 3.42Å; I349-K351 VanDerWaalsContact C-N 3.29Å; I349-K351 PolarHBondContact O-N 3.47Å; I349-E352 PolarHBondContact O-N 3.08Å; I349-R353 HydrophobicContact CG2-CG 4.23Å; I349-R353 VanDerWaalsContact CG2-NE 3.35Å; I349-R353 WeakPolarHBondContact O-CG 3.12Å; I349-R353 PolarHBondContact O-N 3.32Å; I349-L389 HydrophobicContact CD1-CB 4.35Å; I349-L389 HydrophobicContact CG1-CB 3.72Å; I349-L389 HydrophobicContact CG1-CD1 4Å; I349-L389 HydrophobicContact CG1-CG 4.33Å; I349-L392 HydrophobicContact CG2-CD1 4.14Å
350	K	90.4	Very high	88.8	Confident	163 Å²	163	86 Å²	86	71%	0.709	40%	0.397	S	S	*	.	H	α-helix	trans	-59.9	-38.6	177.4	-172.6	176.4	179.5	179	0	112.5	K346 A348 Q354	K346-K350 WeakPolarHBondContact O-CB 3.26Å; K346-K350 PolarHBondContact O-N 3.26Å; K346-K350 VanDerWaalsContact O-N 3.07Å; A348-K350 VanDerWaalsContact C-N 3.3Å; A348-K350 PolarHBondContact O-N 2.99Å; K350-Q354 PolarHBondContact O-N 3.46Å
351	K	90.8	Very high	88.7	Confident	153 Å²	153	86.6 Å²	86.6	67%	0.665	40%	0.4	S	S	*	.	H	α-helix	trans	-66	-45.6	176.8	-73.8	177.5	176.8	-174.4	0	111.5	K347 A348 I349 Q354 K355	K347-K351 WeakPolarHBondContact O-CG 3.27Å; K347-K351 PolarHBondContact O-N 2.87Å; A348-K351 WeakPolarHBondContact O-CB 3.04Å; A348-K351 PolarHBondContact O-N 3.48Å; A348-K351 VanDerWaalsContact O-N 3.08Å; I349-K351 VanDerWaalsContact C-N 3.29Å; I349-K351 PolarHBondContact O-N 3.47Å; K351-Q354 PolarHBondContact O-N 3.22Å; K351-K355 PolarHBondContact O-N 2.95Å
352	E	91.9	Very high	88.7	Confident	33 Å²	33	86.4 Å²	86.4	15%	0.154	41%	0.407	C	S	.	.	H	α-helix	trans	-69.9	-38.4	-178.5	-65.4	-57.9	139.5	0	0	112.9	A348 I349 Q354 K355 L356 L389 L392 Q393 N396	A348-E352 PolarHBondContact O-N 3.39Å; A348-E352 VanDerWaalsContact O-N 3.1Å; I349-E352 PolarHBondContact O-N 3.08Å; E352-Q354 VanDerWaalsContact C-N 3.29Å; E352-Q354 PolarHBondContact O-N 3.48Å; E352-K355 WeakPolarHBondContact O-CB 3.24Å; E352-K355 PolarHBondContact O-N 3.11Å; E352-L356 PolarHBondContact O-N 2.64Å; E352-L389 HydrophobicContact CB-CD1 4.44Å; E352-L389 HydrophobicContact CG-CD1 3.8Å; E352-L392 HydrophobicContact CB-CB 3.85Å; E352-L392 HydrophobicContact CB-CD1 4.36Å; E352-Q393 HydrophobicContact CG-CG 3.72Å; E352-N396 PolarHBondContact O-ND2 3.09Å; E352-N396 PolarHBondContact OE2-ND2 2.66Å
353	R	92.9	Very high	88.6	Confident	65 Å²	65	82.6 Å²	82.6	25%	0.245	39%	0.389	C	S	.	.	H	α-helix	trans	-57.9	-43.2	171	-70.2	178	-177.1	-153.4	-6.7	111.7	I349 K355 L356 R357 C384 D385 L392	I349-R353 HydrophobicContact CG2-CG 4.23Å; I349-R353 VanDerWaalsContact CG2-NE 3.35Å; I349-R353 WeakPolarHBondContact O-CG 3.12Å; I349-R353 PolarHBondContact O-N 3.32Å; R353-K355 VanDerWaalsContact C-N 3.33Å; R353-K355 PolarHBondContact O-N 2.98Å; R353-L356 PolarHBondContact O-N 2.95Å; R353-R357 WeakPolarHBondContact O-CG 3.45Å; R353-R357 PolarHBondContact O-N 3Å; R353-R357 VanDerWaalsContact O-N 3.11Å; R353-C384 HydrophobicContact CB-CB 4.25Å; R353-C384 WeakPolarHBondContact CD-O 3.42Å; R353-C384 HydrophobicContact CG-CB 3.89Å; R353-C384 PolarHBondContact NE-O 3.25Å; R353-C384 PolarHBondContact NH2-O 3.31Å; R353-D385 IonicContact CZ-OD1 3.44Å; R353-D385 IonicContact NH1-OD1 2.72Å; R353-D385 PolarHBondContact NH1-OD1 2.81Å; R353-D385 PolarHBondContact NH2-O 2.83Å; R353-D385 IonicContact NH2-OD1 3.44Å; R353-L392 HydrophobicContact CG-CD1 3.82Å
354	Q	90.7	Very high	88.6	Confident	90 Å²	90	82.3 Å²	82.3	42%	0.421	39%	0.387	S	S	.	.	H	α-helix	trans	-65	-38.5	177.9	-171.4	60.4	46.5	0	0	112	K350 K351 E352 N358	K350-Q354 PolarHBondContact O-N 3.46Å; K351-Q354 PolarHBondContact O-N 3.22Å; E352-Q354 VanDerWaalsContact C-N 3.29Å; E352-Q354 PolarHBondContact O-N 3.48Å; Q354-N358 PolarHBondContact NE2-OD1 3.38Å; Q354-N358 WeakPolarHBondContact O-CB 3.48Å; Q354-N358 PolarHBondContact O-N 3.36Å; Q354-N358 PolarHBondContact O-OD1 2.91Å
355	K	90.8	Very high	88.5	Confident	75 Å²	75	77.8 Å²	77.8	33%	0.326	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-43.6	175.8	-172.4	178.9	176.1	-167.2	0	111.2	K351 E352 R353 R357 N358 S359 N396	K351-K355 PolarHBondContact O-N 2.95Å; E352-K355 WeakPolarHBondContact O-CB 3.24Å; E352-K355 PolarHBondContact O-N 3.11Å; R353-K355 VanDerWaalsContact C-N 3.33Å; R353-K355 PolarHBondContact O-N 2.98Å; K355-R357 PolarHBondContact O-N 3.47Å; K355-N358 PolarHBondContact O-N 3.37Å; K355-S359 PolarHBondContact O-N 2.89Å; K355-S359 PolarHBondContact O-OG 3.37Å; K355-S359 VanDerWaalsContact O-OG 3.13Å; K355-N396 HydrophobicContact CD-CB 3.9Å; K355-N396 HydrophobicContact CG-CB 4.25Å
356	L	90.8	Very high	88.4	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.8	-48.5	177.3	-179.7	58.2	0	0	0	112	E352 R353 N358 S359 C360 V380 L383 L392 L395 N396 L399 L411	E352-L356 PolarHBondContact O-N 2.64Å; R353-L356 PolarHBondContact O-N 2.95Å; L356-N358 VanDerWaalsContact C-N 3.34Å; L356-N358 PolarHBondContact O-N 3.44Å; L356-S359 PolarHBondContact O-N 2.89Å; L356-C360 PolarHBondContact O-N 2.73Å; L356-C360 PolarHBondContact O-SG 3.19Å; L356-V380 HydrophobicContact CG-CG1 4.25Å; L356-L383 HydrophobicContact CD2-CB 4.24Å; L356-L392 HydrophobicContact CD2-CD2 3.89Å; L356-L395 HydrophobicContact CD1-CD2 3.8Å; L356-L395 HydrophobicContact CD1-CG 4.11Å; L356-L395 HydrophobicContact CD2-CD2 4.09Å; L356-N396 WeakPolarHBondContact CA-OD1 3.45Å; L356-N396 VanDerWaalsContact CB-OD1 3.28Å; L356-N396 WeakPolarHBondContact CB-OD1 3.27Å; L356-N396 PolarHBondContact N-OD1 3.14Å; L356-L399 HydrophobicContact CD1-CD1 3.25Å; L356-L411 HydrophobicContact CD1-CD1 4.16Å
357	R	91.3	Very high	88.1	Confident	86 Å²	86	67.7 Å²	67.7	33%	0.325	32%	0.319	S	S	.	.	H	α-helix	trans	-57.5	-45.3	176	-70.3	171.9	178	167.7	0	112.1	R353 K355 K361 E381	R353-R357 WeakPolarHBondContact O-CG 3.45Å; R353-R357 PolarHBondContact O-N 3Å; R353-R357 VanDerWaalsContact O-N 3.11Å; K355-R357 PolarHBondContact O-N 3.47Å; R357-K361 WeakPolarHBondContact O-CB 3.22Å; R357-K361 PolarHBondContact O-N 3.33Å; R357-E381 IonicContact CZ-OE1 3.42Å; R357-E381 IonicContact CZ-OE2 2.56Å; R357-E381 IonicContact NE-OE1 3.76Å; R357-E381 PolarHBondContact NE-OE1 3.19Å; R357-E381 IonicContact NE-OE2 2.75Å; R357-E381 PolarHBondContact NE-OE2 3.36Å; R357-E381 IonicContact NH2-OE1 2.66Å; R357-E381 PolarHBondContact NH2-OE1 2.79Å; R357-E381 IonicContact NH2-OE2 3.38Å; R357-E381 PolarHBondContact NH2-OE2 3.48Å
358	N	88.8	Confident	87.5	Confident	83 Å²	83	67.1 Å²	67.1	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-42.1	-179.4	-70.1	-6.9	0	0	0	112.1	Q354 K355 L356 K361 T362	Q354-N358 PolarHBondContact NE2-OD1 3.38Å; Q354-N358 WeakPolarHBondContact O-CB 3.48Å; Q354-N358 PolarHBondContact O-N 3.36Å; Q354-N358 PolarHBondContact O-OD1 2.91Å; K355-N358 PolarHBondContact O-N 3.37Å; L356-N358 VanDerWaalsContact C-N 3.34Å; L356-N358 PolarHBondContact O-N 3.44Å; N358-K361 PolarHBondContact O-N 2.97Å; N358-T362 PolarHBondContact O-N 3.46Å; N358-T362 PolarHBondContact O-OG1 3.47Å
359	S	86.3	Confident	87.4	Confident	19 Å²	19	69.6 Å²	69.6	13%	0.133	33%	0.332	C	S	.	.	H	α-helix	trans	-62.2	-46.5	177.3	-61.7	0	0	0	0	111.5	K355 L356 K361 T362	K355-S359 PolarHBondContact O-N 2.89Å; K355-S359 PolarHBondContact O-OG 3.37Å; K355-S359 VanDerWaalsContact O-OG 3.13Å; L356-S359 PolarHBondContact O-N 2.89Å; S359-K361 PolarHBondContact O-N 2.69Å; S359-T362 WeakPolarHBondContact O-CB 3.33Å; S359-T362 PolarHBondContact O-N 3.1Å
360	C	86.6	Confident	87.1	Confident	0 Å²	0	73 Å²	73	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-39.6	178.3	-61.6	0	0	0	0	112.1	L356 T362 W363 H365 V380	L356-C360 PolarHBondContact O-N 2.73Å; L356-C360 PolarHBondContact O-SG 3.19Å; C360-T362 VanDerWaalsContact C-N 3.34Å; C360-T362 PolarHBondContact O-N 2.98Å; C360-W363 PolarHBondContact O-N 3.28Å; C360-H365 WeakPolarHBondContact O-CA 3.42Å; C360-H365 PolarHBondContact O-N 3.35Å; C360-V380 HydrophobicContact CB-CG2 4.18Å
361	K	87.4	Confident	86.7	Confident	152 Å²	152	68.5 Å²	68.5	66%	0.661	34%	0.341	S	S	*	.	H	α-helix	trans	-62.3	-39.1	175.8	-174.2	177.4	-179.5	178.3	0	112.6	R357 N358 S359 W363 N364	R357-K361 WeakPolarHBondContact O-CB 3.22Å; R357-K361 PolarHBondContact O-N 3.33Å; N358-K361 PolarHBondContact O-N 2.97Å; S359-K361 PolarHBondContact O-N 2.69Å; K361-W363 PolarHBondContact O-N 2.79Å; K361-N364 PolarHBondContact O-N 2.97Å; K361-N364 VanDerWaalsContact O-N 3.08Å
362	T	86.3	Confident	86.4	Confident	112 Å²	112	66.2 Å²	66.2	69%	0.687	33%	0.332	S	S	*	.	H	α-helix	trans	-60.8	-29.8	179.9	-56.6	0	0	0	0	112.2	N358 S359 C360	N358-T362 PolarHBondContact O-N 3.46Å; N358-T362 PolarHBondContact O-OG1 3.47Å; S359-T362 WeakPolarHBondContact O-CB 3.33Å; S359-T362 PolarHBondContact O-N 3.1Å; C360-T362 VanDerWaalsContact C-N 3.34Å; C360-T362 PolarHBondContact O-N 2.98Å
363	W	83.6	Confident	86	Confident	53 Å²	53	66.6 Å²	66.6	20%	0.201	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	20.5	178.2	-63.8	-27.2	0	0	0	113.9	C360 K361 H365 F366 L399 K404	C360-W363 PolarHBondContact O-N 3.28Å; K361-W363 PolarHBondContact O-N 2.79Å; W363-H365 PolarHBondContact O-N 3.26Å; W363-F366 HydrophobicContact CB-CD1 4.25Å; W363-F366 HydrophobicContact CB-CE1 4.25Å; W363-F366 AromaticContact CD2-CE1 3.95Å; W363-F366 HydrophobicContact CD2-CE1 3.95Å; W363-F366 HydrophobicContact CD2-CZ 4.29Å; W363-F366 HydrophobicContact CE3-CD1 4.12Å; W363-F366 AromaticContact CE3-CE1 3.06Å; W363-F366 HydrophobicContact CE3-CE1 3.06Å; W363-F366 HydrophobicContact CE3-CE2 4.18Å; W363-F366 AromaticContact CE3-CZ 3.14Å; W363-F366 HydrophobicContact CE3-CZ 3.14Å; W363-F366 HydrophobicContact CG-CE1 4.49Å; W363-F366 AromaticContact CZ3-CE1 3.48Å; W363-F366 HydrophobicContact CZ3-CE1 3.48Å; W363-F366 VanDerWaalsContact CZ3-CE1 3.48Å; W363-F366 AromaticContact CZ3-CZ 3.51Å; W363-F366 HydrophobicContact CZ3-CZ 3.51Å; W363-F366 PolarHBondContact O-N 3.03Å; W363-L399 HydrophobicContact CH2-CD2 4.5Å; W363-L399 WeakPolarHBondContact CH2-O 3.25Å; W363-L399 HydrophobicContact CZ3-CB 4.45Å; W363-L399 HydrophobicContact CZ3-CD2 3.7Å; W363-K404 HydrophobicContact CB-CD 4.48Å; W363-K404 HydrophobicContact CB-CG 4.24Å; W363-K404 HydrophobicContact CD2-CG 4.41Å; W363-K404 HydrophobicContact CG-CG 4.2Å
364	N	83.8	Confident	85.6	Confident	66 Å²	66	66.3 Å²	66.3	35%	0.353	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	53.5	33.3	-176.9	-163	31.3	0	0	0	113.1	K361 F366 S367 D368	K361-N364 PolarHBondContact O-N 2.97Å; K361-N364 VanDerWaalsContact O-N 3.08Å; N364-F366 PolarHBondContact O-N 3.48Å; N364-S367 PolarHBondContact ND2-O 3.18Å; N364-D368 PolarHBondContact ND2-OD1 2.96Å
365	H	84.9	Confident	85.4	Confident	28 Å²	28	68.6 Å²	68.6	13%	0.13	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	53.3	33.1	-173.6	-47.8	81.5	0	0	0	113.6	C360 W363 S367 R373 M376 M377	C360-H365 WeakPolarHBondContact O-CA 3.42Å; C360-H365 PolarHBondContact O-N 3.35Å; W363-H365 PolarHBondContact O-N 3.26Å; H365-S367 PolarHBondContact O-N 2.9Å; H365-R373 HydrophobicContact CB-CG 3.92Å; H365-M376 HydrophobicContact CB-CB 4.16Å; H365-M376 HydrophobicContact CB-CG 4.02Å; H365-M376 WeakPolarHBondContact O-CG 3.48Å; H365-M377 WeakPolarHBondContact CD2-CG 3.47Å; H365-M377 WeakPolarHBondContact NE2-CG 3.42Å
366	F	84.4	Confident	85.2	Confident	10 Å²	10	66.1 Å²	66.1	4%	0.044	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	61.3	15.1	171.2	-48.8	-89	0	0	0	116.3	W363 N364 L399 K404 K408 L411	W363-F366 HydrophobicContact CB-CD1 4.25Å; W363-F366 HydrophobicContact CB-CE1 4.25Å; W363-F366 AromaticContact CD2-CE1 3.95Å; W363-F366 HydrophobicContact CD2-CE1 3.95Å; W363-F366 HydrophobicContact CD2-CZ 4.29Å; W363-F366 HydrophobicContact CE3-CD1 4.12Å; W363-F366 AromaticContact CE3-CE1 3.06Å; W363-F366 HydrophobicContact CE3-CE1 3.06Å; W363-F366 HydrophobicContact CE3-CE2 4.18Å; W363-F366 AromaticContact CE3-CZ 3.14Å; W363-F366 HydrophobicContact CE3-CZ 3.14Å; W363-F366 HydrophobicContact CG-CE1 4.49Å; W363-F366 AromaticContact CZ3-CE1 3.48Å; W363-F366 HydrophobicContact CZ3-CE1 3.48Å; W363-F366 VanDerWaalsContact CZ3-CE1 3.48Å; W363-F366 AromaticContact CZ3-CZ 3.51Å; W363-F366 HydrophobicContact CZ3-CZ 3.51Å; W363-F366 PolarHBondContact O-N 3.03Å; N364-F366 PolarHBondContact O-N 3.48Å; F366-L399 HydrophobicContact CZ-CD2 4.14Å; F366-K404 HydrophobicContact CD1-CG 3.92Å; F366-K404 HydrophobicContact CE1-CG 4.3Å; F366-K404 VanDerWaalsContact CE1-O 3.31Å; F366-K404 WeakPolarHBondContact CE1-O 3.37Å; F366-K408 HydrophobicContact CB-CB 4.39Å; F366-K408 HydrophobicContact CB-CD 3.85Å; F366-K408 HydrophobicContact CB-CG 3.86Å; F366-K408 HydrophobicContact CD1-CB 3.51Å; F366-K408 HydrophobicContact CD1-CD 4.41Å; F366-K408 HydrophobicContact CD1-CG 3.94Å; F366-K408 HydrophobicContact CE1-CB 3.76Å; F366-K408 HydrophobicContact CG-CB 4.04Å; F366-K408 HydrophobicContact CG-CD 4.41Å; F366-K408 HydrophobicContact CG-CG 3.95Å; F366-K408 PolarHBondContact O-NZ 2.84Å; F366-L411 HydrophobicContact CD2-CD2 4.12Å; F366-L411 HydrophobicContact CE2-CD2 3.53Å; F366-L411 HydrophobicContact CZ-CD2 4.35Å
367	S	80.2	Confident	85	Confident	14 Å²	14	69.7 Å²	69.7	10%	0.098	35%	0.354	C	S	.	.			trans	-147	140.9	173	-174.8	0	0	0	0	112.2	N364 H365 N369 E372	N364-S367 PolarHBondContact ND2-O 3.18Å; H365-S367 PolarHBondContact O-N 2.9Å; S367-N369 PolarHBondContact OG-N 2.77Å; S367-N369 VanDerWaalsContact OG-N 3.14Å; S367-E372 WeakPolarHBondContact CB-OE2 3.28Å; S367-E372 WeakPolarHBondContact OG-CB 3.07Å; S367-E372 PolarHBondContact OG-OE2 3.39Å
368	D	77.3	Confident	84.9	Confident	133 Å²	133	70.9 Å²	70.9	71%	0.711	36%	0.363	S	S	*	.	S	Bend	trans	-90	-7.4	173.6	-59.7	-41.5	0	0	0	112	N364	N364-D368 PolarHBondContact ND2-OD1 2.96Å
369	N	85.9	Confident	84.9	Confident	82 Å²	82	68.1 Å²	68.1	44%	0.439	35%	0.347	S	S	.	.	S	Bend	trans	-84.6	128.7	173.3	-176.5	-16.4	0	0	0	110.6	S367 A371 E372 R373	S367-N369 PolarHBondContact OG-N 2.77Å; S367-N369 VanDerWaalsContact OG-N 3.14Å; N369-A371 VanDerWaalsContact C-N 3.33Å; N369-A371 PolarHBondContact O-N 2.89Å; N369-A371 PolarHBondContact OD1-N 3.38Å; N369-A371 VanDerWaalsContact OD1-N 3.08Å; N369-E372 HydrophobicContact CB-CB 4.26Å; N369-E372 HydrophobicContact CB-CG 4.24Å; N369-E372 PolarHBondContact O-N 2.69Å; N369-R373 WeakPolarHBondContact O-CB 3.12Å; N369-R373 PolarHBondContact O-N 3.44Å
370	E	83.6	Confident	85.1	Confident	115 Å²	115	67.3 Å²	67.3	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-53	-47.4	178.6	-169.3	67.7	-127.5	0	0	112.7	E372 R373 V374	E370-E372 PolarHBondContact O-N 3.07Å; E370-R373 PolarHBondContact O-N 3.4Å; E370-R373 IonicContact OE1-CZ 3.59Å; E370-R373 IonicContact OE1-NH2 3.8Å; E370-R373 PolarHBondContact OE1-NH2 3.15Å; E370-R373 IonicContact OE2-CZ 3.59Å; E370-R373 IonicContact OE2-NH1 3.99Å; E370-R373 IonicContact OE2-NH2 2.76Å; E370-R373 PolarHBondContact OE2-NH2 3.29Å; E370-V374 WeakPolarHBondContact O-CG2 3.37Å; E370-V374 PolarHBondContact O-N 3.38Å; E370-V374 VanDerWaalsContact O-N 3.08Å
371	A	83.6	Confident	85.3	Confident	70 Å²	70	70.7 Å²	70.7	58%	0.579	36%	0.357	S	S	*	.	H	α-helix	trans	-67.4	-39.3	-174.2	0	0	0	0	0	112.2	N369 K375	N369-A371 VanDerWaalsContact C-N 3.33Å; N369-A371 PolarHBondContact O-N 2.89Å; N369-A371 PolarHBondContact OD1-N 3.38Å; N369-A371 VanDerWaalsContact OD1-N 3.08Å; A371-K375 PolarHBondContact O-N 3.18Å
372	E	83.4	Confident	85.5	Confident	105 Å²	105	67.3 Å²	67.3	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-72.9	-35.7	178.6	-69.4	179.4	-177.5	0	0	112.1	S367 N369 E370 K375 M376	S367-E372 WeakPolarHBondContact CB-OE2 3.28Å; S367-E372 WeakPolarHBondContact OG-CB 3.07Å; S367-E372 PolarHBondContact OG-OE2 3.39Å; N369-E372 HydrophobicContact CB-CB 4.26Å; N369-E372 HydrophobicContact CB-CG 4.24Å; N369-E372 PolarHBondContact O-N 2.69Å; E370-E372 PolarHBondContact O-N 3.07Å; E372-K375 PolarHBondContact O-N 3.13Å; E372-M376 WeakPolarHBondContact O-CB 3.14Å; E372-M376 PolarHBondContact O-N 3.4Å
373	R	83.6	Confident	85.6	Confident	41 Å²	41	62 Å²	62	16%	0.155	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-43.6	174.7	175.2	164.9	75.9	-104.2	3.8	112	H365 N369 E370 K375 M376 M377	H365-R373 HydrophobicContact CB-CG 3.92Å; N369-R373 WeakPolarHBondContact O-CB 3.12Å; N369-R373 PolarHBondContact O-N 3.44Å; E370-R373 PolarHBondContact O-N 3.4Å; E370-R373 IonicContact OE1-CZ 3.59Å; E370-R373 IonicContact OE1-NH2 3.8Å; E370-R373 PolarHBondContact OE1-NH2 3.15Å; E370-R373 IonicContact OE2-CZ 3.59Å; E370-R373 IonicContact OE2-NH1 3.99Å; E370-R373 IonicContact OE2-NH2 2.76Å; E370-R373 PolarHBondContact OE2-NH2 3.29Å; R373-K375 VanDerWaalsContact C-N 3.34Å; R373-M376 PolarHBondContact O-N 2.94Å; R373-M377 HydrophobicContact CG-CE 4.33Å; R373-M377 WeakPolarHBondContact O-CG 3.42Å; R373-M377 PolarHBondContact O-N 3.35Å
374	V	85.6	Confident	85.9	Confident	59 Å²	59	59.5 Å²	59.5	36%	0.358	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-45.6	175.4	173.7	0	0	0	0	110.8	E370 M376 M377 E378	E370-V374 WeakPolarHBondContact O-CG2 3.37Å; E370-V374 PolarHBondContact O-N 3.38Å; E370-V374 VanDerWaalsContact O-N 3.08Å; V374-M376 VanDerWaalsContact C-N 3.34Å; V374-M376 PolarHBondContact O-N 3.42Å; V374-M377 HydrophobicContact CB-CE 4.34Å; V374-M377 HydrophobicContact CG2-CE 3.96Å; V374-M377 WeakPolarHBondContact O-CB 3.39Å; V374-M377 PolarHBondContact O-N 3.05Å; V374-E378 PolarHBondContact O-N 3.07Å; V374-E378 VanDerWaalsContact O-N 3.1Å
375	K	86.6	Confident	86.2	Confident	138 Å²	138	61.1 Å²	61.1	60%	0.6	31%	0.309	S	S	*	.	H	α-helix	trans	-59.3	-43.9	175.8	-169.1	-179.9	-179.8	-173.9	0	112.1	A371 E372 R373 M377 E378 E379	A371-K375 PolarHBondContact O-N 3.18Å; E372-K375 PolarHBondContact O-N 3.13Å; R373-K375 VanDerWaalsContact C-N 3.34Å; K375-M377 PolarHBondContact O-N 3.05Å; K375-E378 PolarHBondContact O-N 3.3Å; K375-E379 WeakPolarHBondContact O-CG 3.29Å; K375-E379 PolarHBondContact O-N 3.08Å
376	M	85.9	Confident	86.4	Confident	23 Å²	23	65.4 Å²	65.4	11%	0.113	32%	0.324	C	S	.	.	H	α-helix	trans	-65.9	-36	177.9	-173.7	60.1	72.8	0	0	112.3	H365 E372 R373 V374 E379 V380 L411 E412 I415	H365-M376 HydrophobicContact CB-CB 4.16Å; H365-M376 HydrophobicContact CB-CG 4.02Å; H365-M376 WeakPolarHBondContact O-CG 3.48Å; E372-M376 WeakPolarHBondContact O-CB 3.14Å; E372-M376 PolarHBondContact O-N 3.4Å; R373-M376 PolarHBondContact O-N 2.94Å; V374-M376 VanDerWaalsContact C-N 3.34Å; V374-M376 PolarHBondContact O-N 3.42Å; M376-E379 PolarHBondContact O-N 3.18Å; M376-V380 HydrophobicContact CG-CG2 4.47Å; M376-V380 WeakPolarHBondContact O-CB 3.45Å; M376-V380 VanDerWaalsContact O-CG2 3.26Å; M376-V380 WeakPolarHBondContact O-CG2 3.29Å; M376-V380 PolarHBondContact O-N 2.97Å; M376-V380 HydrophobicContact SD-CG2 4.49Å; M376-L411 HydrophobicContact SD-CD2 3.67Å; M376-E412 HydrophobicContact CE-CG 4.25Å; M376-I415 HydrophobicContact CE-CD1 4.43Å; M376-I415 HydrophobicContact SD-CD1 3.71Å
377	M	87	Confident	86.7	Confident	75 Å²	75	65.5 Å²	65.5	37%	0.369	33%	0.325	S	S	.	.	H	α-helix	trans	-61.7	-43.2	173.2	-74.6	-173.1	-64.1	0	0	112	H365 R373 V374 K375 V380 E381	H365-M377 WeakPolarHBondContact CD2-CG 3.47Å; H365-M377 WeakPolarHBondContact NE2-CG 3.42Å; R373-M377 HydrophobicContact CG-CE 4.33Å; R373-M377 WeakPolarHBondContact O-CG 3.42Å; R373-M377 PolarHBondContact O-N 3.35Å; V374-M377 HydrophobicContact CB-CE 4.34Å; V374-M377 HydrophobicContact CG2-CE 3.96Å; V374-M377 WeakPolarHBondContact O-CB 3.39Å; V374-M377 PolarHBondContact O-N 3.05Å; K375-M377 PolarHBondContact O-N 3.05Å; M377-V380 PolarHBondContact O-N 3.17Å; M377-E381 WeakPolarHBondContact O-CG 3.48Å; M377-E381 PolarHBondContact O-N 3.17Å
378	E	87.7	Confident	87.2	Confident	111 Å²	111	72 Å²	72	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-42.6	175.7	-68.9	178.2	178.2	0	0	111.8	V374 K375 E381 K382	V374-E378 PolarHBondContact O-N 3.07Å; V374-E378 VanDerWaalsContact O-N 3.1Å; K375-E378 PolarHBondContact O-N 3.3Å; E378-E381 PolarHBondContact O-N 3.09Å; E378-K382 VanDerWaalsContact O-CG 3.32Å; E378-K382 WeakPolarHBondContact O-CG 3.43Å; E378-K382 PolarHBondContact O-N 2.82Å
379	E	89.6	Confident	87.8	Confident	24 Å²	24	67.5 Å²	67.5	11%	0.112	33%	0.33	C	S	.	.	H	α-helix	trans	-66.4	-38.4	176.8	-64.2	-54.2	139	0	0	112.3	K375 M376 E381 K382 L383 I415 N419	K375-E379 WeakPolarHBondContact O-CG 3.29Å; K375-E379 PolarHBondContact O-N 3.08Å; M376-E379 PolarHBondContact O-N 3.18Å; E379-E381 VanDerWaalsContact C-N 3.34Å; E379-E381 PolarHBondContact O-N 2.8Å; E379-K382 WeakPolarHBondContact O-CB 3.47Å; E379-K382 PolarHBondContact O-N 3.39Å; E379-K382 IonicContact OE1-NZ 3.79Å; E379-K382 PolarHBondContact OE1-NZ 3.03Å; E379-K382 IonicContact OE2-NZ 2.68Å; E379-L383 WeakPolarHBondContact O-CG 3.24Å; E379-L383 PolarHBondContact O-N 3.15Å; E379-I415 HydrophobicContact CB-CD1 3.52Å; E379-I415 HydrophobicContact CB-CG1 3.86Å; E379-I415 HydrophobicContact CB-CG2 4.09Å; E379-I415 HydrophobicContact CG-CD1 4.23Å; E379-I415 HydrophobicContact CG-CG2 3.92Å; E379-I415 VanDerWaalsContact OE2-CG2 3.31Å; E379-I415 WeakPolarHBondContact OE2-CG2 3.31Å; E379-N419 PolarHBondContact OE2-ND2 2.99Å
380	V	89.8	Confident	87.9	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.018	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-38	174.8	169.6	0	0	0	0	111.9	L356 C360 M376 M377 L383 C384 L411	L356-V380 HydrophobicContact CG-CG1 4.25Å; C360-V380 HydrophobicContact CB-CG2 4.18Å; M376-V380 HydrophobicContact CG-CG2 4.47Å; M376-V380 WeakPolarHBondContact O-CB 3.45Å; M376-V380 VanDerWaalsContact O-CG2 3.26Å; M376-V380 WeakPolarHBondContact O-CG2 3.29Å; M376-V380 PolarHBondContact O-N 2.97Å; M376-V380 HydrophobicContact SD-CG2 4.49Å; M377-V380 PolarHBondContact O-N 3.17Å; V380-L383 PolarHBondContact O-N 3.41Å; V380-C384 PolarHBondContact O-N 2.96Å; V380-C384 PolarHBondContact O-SG 2.86Å; V380-L411 HydrophobicContact CG2-CD1 4.5Å; V380-L411 HydrophobicContact CG2-CD2 3.9Å
381	E	91.8	Very high	88.2	Confident	71 Å²	71	63.6 Å²	63.6	33%	0.332	33%	0.325	S	S	.	.	H	α-helix	trans	-68.3	-39.8	174.3	-71.2	-57.3	140.4	0	0	111.9	R357 M377 E378 E379 L383 C384 D385	R357-E381 IonicContact CZ-OE1 3.42Å; R357-E381 IonicContact CZ-OE2 2.56Å; R357-E381 IonicContact NE-OE1 3.76Å; R357-E381 PolarHBondContact NE-OE1 3.19Å; R357-E381 IonicContact NE-OE2 2.75Å; R357-E381 PolarHBondContact NE-OE2 3.36Å; R357-E381 IonicContact NH2-OE1 2.66Å; R357-E381 PolarHBondContact NH2-OE1 2.79Å; R357-E381 IonicContact NH2-OE2 3.38Å; R357-E381 PolarHBondContact NH2-OE2 3.48Å; M377-E381 WeakPolarHBondContact O-CG 3.48Å; M377-E381 PolarHBondContact O-N 3.17Å; E378-E381 PolarHBondContact O-N 3.09Å; E379-E381 VanDerWaalsContact C-N 3.34Å; E379-E381 PolarHBondContact O-N 2.8Å; E381-L383 VanDerWaalsContact C-N 3.31Å; E381-L383 PolarHBondContact O-N 2.81Å; E381-C384 WeakPolarHBondContact O-CB 3.23Å; E381-C384 PolarHBondContact O-N 3.38Å; E381-D385 PolarHBondContact O-N 3.41Å
382	K	90.2	Very high	88.5	Confident	80 Å²	80	60.2 Å²	60.2	35%	0.348	30%	0.298	S	S	.	.	H	α-helix	trans	-58.9	-43.1	171.7	-70.6	171.5	-166.4	170.9	0	111.7	E378 E379 D385 R386	E378-K382 VanDerWaalsContact O-CG 3.32Å; E378-K382 WeakPolarHBondContact O-CG 3.43Å; E378-K382 PolarHBondContact O-N 2.82Å; E379-K382 WeakPolarHBondContact O-CB 3.47Å; E379-K382 PolarHBondContact O-N 3.39Å; E379-K382 IonicContact OE1-NZ 3.79Å; E379-K382 PolarHBondContact OE1-NZ 3.03Å; E379-K382 IonicContact OE2-NZ 2.68Å; K382-D385 PolarHBondContact O-N 3.47Å; K382-R386 WeakPolarHBondContact O-CB 3.45Å; K382-R386 WeakPolarHBondContact O-CG 3.21Å; K382-R386 PolarHBondContact O-N 3.44Å
383	L	89.9	Confident	88.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-43.8	174.7	-72.4	-173	0	0	0	111.9	L356 E379 V380 E381 D385 R386 L387 L395 L411 Q414 I415 I418	L356-L383 HydrophobicContact CD2-CB 4.24Å; E379-L383 WeakPolarHBondContact O-CG 3.24Å; E379-L383 PolarHBondContact O-N 3.15Å; V380-L383 PolarHBondContact O-N 3.41Å; E381-L383 VanDerWaalsContact C-N 3.31Å; E381-L383 PolarHBondContact O-N 2.81Å; L383-D385 PolarHBondContact O-N 2.92Å; L383-R386 PolarHBondContact O-N 2.92Å; L383-L387 HydrophobicContact CB-CD1 3.99Å; L383-L387 HydrophobicContact CB-CG 4.43Å; L383-L387 HydrophobicContact CD2-CD1 4.09Å; L383-L387 HydrophobicContact CD2-CG 4.26Å; L383-L387 HydrophobicContact CG-CD1 4.44Å; L383-L387 VanDerWaalsContact O-CB 3.25Å; L383-L387 WeakPolarHBondContact O-CB 3.24Å; L383-L387 WeakPolarHBondContact O-CG 3.38Å; L383-L387 PolarHBondContact O-N 3.31Å; L383-L395 HydrophobicContact CD1-CD2 4.06Å; L383-L411 HydrophobicContact CD1-CD1 3.42Å; L383-L411 VanDerWaalsContact CD1-CD1 3.42Å; L383-L411 HydrophobicContact CD1-CG 4.25Å; L383-Q414 HydrophobicContact CD1-CB 4.22Å; L383-Q414 HydrophobicContact CD2-CB 4.2Å; L383-I415 HydrophobicContact CD1-CG1 3.75Å; L383-I415 HydrophobicContact CD2-CG1 4.3Å; L383-I415 HydrophobicContact CG-CG1 4.01Å; L383-I418 HydrophobicContact CD2-CB 4Å; L383-I418 HydrophobicContact CD2-CG1 3.57Å; L383-I418 HydrophobicContact CD2-CG2 4.48Å
384	C	90.1	Very high	89.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.5	-44.8	175.4	-74.7	0	0	0	0	110.6	R353 V380 E381	R353-C384 HydrophobicContact CB-CB 4.25Å; R353-C384 WeakPolarHBondContact CD-O 3.42Å; R353-C384 HydrophobicContact CG-CB 3.89Å; R353-C384 PolarHBondContact NE-O 3.25Å; R353-C384 PolarHBondContact NH2-O 3.31Å; V380-C384 PolarHBondContact O-N 2.96Å; V380-C384 PolarHBondContact O-SG 2.86Å; E381-C384 WeakPolarHBondContact O-CB 3.23Å; E381-C384 PolarHBondContact O-N 3.38Å
385	D	89.1	Confident	89.2	Confident	100 Å²	100	57.9 Å²	57.9	54%	0.535	29%	0.292	S	S	.	.	H	α-helix	trans	-74.4	-33.2	-176.8	-77.6	-23.5	0	0	0	114.7	R353 E381 K382 L383	R353-D385 IonicContact CZ-OD1 3.44Å; R353-D385 IonicContact NH1-OD1 2.72Å; R353-D385 PolarHBondContact NH1-OD1 2.81Å; R353-D385 PolarHBondContact NH2-O 2.83Å; R353-D385 IonicContact NH2-OD1 3.44Å; E381-D385 PolarHBondContact O-N 3.41Å; K382-D385 PolarHBondContact O-N 3.47Å; L383-D385 PolarHBondContact O-N 2.92Å
386	R	89.8	Confident	89.4	Confident	119 Å²	119	51.3 Å²	51.3	45%	0.449	26%	0.264	S	S	.	.	H	α-helix	trans	-96.8	-30	-172.9	-67	-63.4	-165.4	138.3	2.9	114.8	K382 L383 I418 E425	K382-R386 WeakPolarHBondContact O-CB 3.45Å; K382-R386 WeakPolarHBondContact O-CG 3.21Å; K382-R386 PolarHBondContact O-N 3.44Å; L383-R386 PolarHBondContact O-N 2.92Å; R386-I418 HydrophobicContact CB-CD1 4.01Å; R386-I418 HydrophobicContact CB-CG2 4.04Å; R386-I418 HydrophobicContact CG-CG2 4.13Å; R386-E425 IonicContact CZ-OE2 4Å; R386-E425 IonicContact NH1-OE1 3.46Å; R386-E425 IonicContact NH1-OE2 2.99Å; R386-E425 PolarHBondContact NH1-OE2 2.87Å; R386-E425 IonicContact NH2-OE2 3.65Å
387	L	90.6	Very high	89.5	Confident	12 Å²	12	55.9 Å²	55.9	6%	0.063	29%	0.285	C	S	.	.			trans	-75.6	136	-178	-67	175.9	0	0	0	111.7	L383 L392 L395 I418	L383-L387 HydrophobicContact CB-CD1 3.99Å; L383-L387 HydrophobicContact CB-CG 4.43Å; L383-L387 HydrophobicContact CD2-CD1 4.09Å; L383-L387 HydrophobicContact CD2-CG 4.26Å; L383-L387 HydrophobicContact CG-CD1 4.44Å; L383-L387 VanDerWaalsContact O-CB 3.25Å; L383-L387 WeakPolarHBondContact O-CB 3.24Å; L383-L387 WeakPolarHBondContact O-CG 3.38Å; L383-L387 PolarHBondContact O-N 3.31Å; L387-L392 HydrophobicContact CB-CD2 3.76Å; L387-L392 HydrophobicContact CB-CG 3.65Å; L387-L392 HydrophobicContact CD1-CD2 3.96Å; L387-L395 HydrophobicContact CD1-CD2 3.84Å; L387-I418 HydrophobicContact CD2-CD1 3.87Å; L387-I418 HydrophobicContact CD2-CG1 4.02Å
388	E	90.2	Very high	89.5	Confident	149 Å²	149	54.4 Å²	54.4	70%	0.696	28%	0.28	S	S	*	.			trans	-73.8	165.9	171.2	-62.3	-172.2	171.5	0	0	111.4	A390 S391 L392	E388-A390 VanDerWaalsContact C-N 3.3Å; E388-A390 PolarHBondContact O-N 3.29Å; E388-S391 PolarHBondContact O-N 3.33Å; E388-S391 VanDerWaalsContact O-N 3.16Å; E388-L392 PolarHBondContact O-N 2.95Å
389	L	89.4	Confident	89.4	Confident	40 Å²	40	49.3 Å²	49.3	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-51.8	-47	-176	-179.4	58.4	0	0	0	112.7	A348 I349 E352 L392 Q393	A348-L389 HydrophobicContact CB-CD1 3.81Å; A348-L389 HydrophobicContact CB-CD2 3.69Å; A348-L389 HydrophobicContact CB-CG 4.44Å; I349-L389 HydrophobicContact CD1-CB 4.35Å; I349-L389 HydrophobicContact CG1-CB 3.72Å; I349-L389 HydrophobicContact CG1-CD1 4Å; I349-L389 HydrophobicContact CG1-CG 4.33Å; E352-L389 HydrophobicContact CB-CD1 4.44Å; E352-L389 HydrophobicContact CG-CD1 3.8Å; L389-L392 PolarHBondContact O-N 3.3Å; L389-Q393 HydrophobicContact CD1-CG 4.3Å; L389-Q393 VanDerWaalsContact O-CG 3.27Å; L389-Q393 WeakPolarHBondContact O-CG 3.5Å; L389-Q393 PolarHBondContact O-N 3.17Å
390	A	88.6	Confident	89.1	Confident	65 Å²	65	52.3 Å²	52.3	54%	0.537	28%	0.276	S	S	.	.	H	α-helix	trans	-64.4	-42.6	-177.7	0	0	0	0	0	112.2	E388 Q393 C394	E388-A390 VanDerWaalsContact C-N 3.3Å; E388-A390 PolarHBondContact O-N 3.29Å; A390-Q393 PolarHBondContact O-N 3.34Å; A390-C394 WeakPolarHBondContact O-CB 3.34Å; A390-C394 PolarHBondContact O-N 2.79Å
391	S	90	Very high	88.9	Confident	49 Å²	49	56.7 Å²	56.7	34%	0.343	31%	0.307	S	S	.	.	H	α-helix	trans	-69.3	-38.3	178.5	-51.3	0	0	0	0	111.9	E388 C394 L395	E388-S391 PolarHBondContact O-N 3.33Å; E388-S391 VanDerWaalsContact O-N 3.16Å; S391-C394 PolarHBondContact O-N 2.76Å; S391-L395 WeakPolarHBondContact O-CB 3.31Å; S391-L395 PolarHBondContact O-N 3.28Å
392	L	89.4	Confident	88.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-42.3	172.8	-75.5	170.8	0	0	0	111.8	I349 E352 R353 L356 L387 E388 L389 N396	I349-L392 HydrophobicContact CG2-CD1 4.14Å; E352-L392 HydrophobicContact CB-CB 3.85Å; E352-L392 HydrophobicContact CB-CD1 4.36Å; R353-L392 HydrophobicContact CG-CD1 3.82Å; L356-L392 HydrophobicContact CD2-CD2 3.89Å; L387-L392 HydrophobicContact CB-CD2 3.76Å; L387-L392 HydrophobicContact CB-CG 3.65Å; L387-L392 HydrophobicContact CD1-CD2 3.96Å; E388-L392 PolarHBondContact O-N 2.95Å; L389-L392 PolarHBondContact O-N 3.3Å; L392-N396 VanDerWaalsContact O-CB 3.25Å; L392-N396 WeakPolarHBondContact O-CB 3.34Å; L392-N396 VanDerWaalsContact O-CG 3.25Å; L392-N396 PolarHBondContact O-N 3.33Å; L392-N396 PolarHBondContact O-ND2 3.05Å
393	Q	89.9	Confident	88.1	Confident	74 Å²	74	56 Å²	56	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-50.3	176.7	-74.5	173.2	-32.4	0	0	111.3	E352 L389 A390 L395 N396 E397	E352-Q393 HydrophobicContact CG-CG 3.72Å; L389-Q393 HydrophobicContact CD1-CG 4.3Å; L389-Q393 VanDerWaalsContact O-CG 3.27Å; L389-Q393 WeakPolarHBondContact O-CG 3.5Å; L389-Q393 PolarHBondContact O-N 3.17Å; A390-Q393 PolarHBondContact O-N 3.34Å; Q393-L395 PolarHBondContact O-N 3.43Å; Q393-N396 PolarHBondContact O-N 3.3Å; Q393-E397 WeakPolarHBondContact O-CB 3.45Å; Q393-E397 WeakPolarHBondContact O-CG 3.42Å; Q393-E397 PolarHBondContact O-N 3.22Å
394	C	89.4	Confident	87.7	Confident	75 Å²	75	59.6 Å²	59.6	51%	0.507	33%	0.332	S	S	.	.	H	α-helix	trans	-59.2	-44.8	179.3	-177	0	0	0	0	112.2	A390 S391 E397 T398	A390-C394 WeakPolarHBondContact O-CB 3.34Å; A390-C394 PolarHBondContact O-N 2.79Å; S391-C394 PolarHBondContact O-N 2.76Å; C394-E397 PolarHBondContact O-N 2.92Å; C394-T398 PolarHBondContact O-N 2.75Å; C394-T398 VanDerWaalsContact O-N 3.07Å; C394-T398 PolarHBondContact O-OG1 3.03Å
395	L	88.7	Confident	87.4	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.037	36%	0.36	C	S	.	.	H	α-helix	trans	-64.7	-45	176.9	178.8	58.9	0	0	0	111.3	L356 L383 L387 S391 Q393 E397 T398 L399 L411 Q414	L356-L395 HydrophobicContact CD1-CD2 3.8Å; L356-L395 HydrophobicContact CD1-CG 4.11Å; L356-L395 HydrophobicContact CD2-CD2 4.09Å; L383-L395 HydrophobicContact CD1-CD2 4.06Å; L387-L395 HydrophobicContact CD1-CD2 3.84Å; S391-L395 WeakPolarHBondContact O-CB 3.31Å; S391-L395 PolarHBondContact O-N 3.28Å; Q393-L395 PolarHBondContact O-N 3.43Å; L395-E397 PolarHBondContact O-N 2.79Å; L395-T398 PolarHBondContact O-N 3.44Å; L395-L399 HydrophobicContact CD1-CD1 4.21Å; L395-L399 HydrophobicContact CD1-CG 4.23Å; L395-L399 HydrophobicContact CG-CD1 4.02Å; L395-L399 HydrophobicContact CG-CG 4.47Å; L395-L399 VanDerWaalsContact O-CG 3.26Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 3.05Å; L395-L411 HydrophobicContact CD1-CD1 4.38Å; L395-L411 HydrophobicContact CD2-CD1 3.95Å; L395-Q414 HydrophobicContact CD1-CG 4.02Å; L395-Q414 HydrophobicContact CD2-CB 4.41Å; L395-Q414 HydrophobicContact CD2-CG 4.26Å
396	N	89.7	Confident	87.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-40.8	178	-82	-31.2	0	0	0	112.9	E352 K355 L356 L392 Q393 L399 T400	E352-N396 PolarHBondContact O-ND2 3.09Å; E352-N396 PolarHBondContact OE2-ND2 2.66Å; K355-N396 HydrophobicContact CD-CB 3.9Å; K355-N396 HydrophobicContact CG-CB 4.25Å; L356-N396 WeakPolarHBondContact CA-OD1 3.45Å; L356-N396 VanDerWaalsContact CB-OD1 3.28Å; L356-N396 WeakPolarHBondContact CB-OD1 3.27Å; L356-N396 PolarHBondContact N-OD1 3.14Å; L392-N396 VanDerWaalsContact O-CB 3.25Å; L392-N396 WeakPolarHBondContact O-CB 3.34Å; L392-N396 VanDerWaalsContact O-CG 3.25Å; L392-N396 PolarHBondContact O-N 3.33Å; L392-N396 PolarHBondContact O-ND2 3.05Å; Q393-N396 PolarHBondContact O-N 3.3Å; N396-L399 PolarHBondContact O-N 2.83Å; N396-T400 WeakPolarHBondContact O-CG2 3.4Å; N396-T400 PolarHBondContact O-N 3.24Å; N396-T400 PolarHBondContact O-OG1 3.42Å; N396-T400 VanDerWaalsContact O-OG1 3.05Å
397	E	89.2	Confident	86.9	Confident	118 Å²	118	58.9 Å²	58.9	55%	0.551	34%	0.335	S	S	*	.	H	α-helix	trans	-58.2	-51	174.7	-77	172.4	-170.6	0	0	110.3	Q393 C394 L395 L399 T400 S401	Q393-E397 WeakPolarHBondContact O-CB 3.45Å; Q393-E397 WeakPolarHBondContact O-CG 3.42Å; Q393-E397 PolarHBondContact O-N 3.22Å; C394-E397 PolarHBondContact O-N 2.92Å; L395-E397 PolarHBondContact O-N 2.79Å; E397-L399 VanDerWaalsContact C-N 3.33Å; E397-L399 PolarHBondContact O-N 3.26Å; E397-T400 WeakPolarHBondContact CA-OG1 3.37Å; E397-T400 PolarHBondContact O-N 3.44Å; E397-T400 PolarHBondContact O-OG1 2.91Å; E397-S401 PolarHBondContact O-N 2.94Å; E397-S401 PolarHBondContact O-OG 3.09Å; E397-S401 VanDerWaalsContact O-OG 3.08Å
398	T	86.5	Confident	86.6	Confident	45 Å²	45	60.9 Å²	60.9	28%	0.276	34%	0.344	S	S	.	.	H	α-helix	trans	-57.1	-44.3	177.1	-54.2	0	0	0	0	112	C394 L395 T400 S401 C402 A410	C394-T398 PolarHBondContact O-N 2.75Å; C394-T398 VanDerWaalsContact O-N 3.07Å; C394-T398 PolarHBondContact O-OG1 3.03Å; L395-T398 PolarHBondContact O-N 3.44Å; T398-T400 VanDerWaalsContact C-N 3.27Å; T398-T400 PolarHBondContact O-N 3.28Å; T398-S401 PolarHBondContact O-N 3.39Å; T398-C402 VanDerWaalsContact O-CB 3.27Å; T398-C402 WeakPolarHBondContact O-CB 3.4Å; T398-C402 PolarHBondContact O-N 2.95Å; T398-C402 PolarHBondContact O-SG 2.93Å; T398-C402 VanDerWaalsContact O-SG 3.37Å; T398-A410 HydrophobicContact CG2-CB 3.79Å
399	L	85.4	Confident	86.5	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-28.8	177.5	-69.1	170.9	0	0	0	112.8	L356 W363 F366 L395 N396 E397 G407	L356-L399 HydrophobicContact CD1-CD1 3.25Å; W363-L399 HydrophobicContact CH2-CD2 4.5Å; W363-L399 WeakPolarHBondContact CH2-O 3.25Å; W363-L399 HydrophobicContact CZ3-CB 4.45Å; W363-L399 HydrophobicContact CZ3-CD2 3.7Å; F366-L399 HydrophobicContact CZ-CD2 4.14Å; L395-L399 HydrophobicContact CD1-CD1 4.21Å; L395-L399 HydrophobicContact CD1-CG 4.23Å; L395-L399 HydrophobicContact CG-CD1 4.02Å; L395-L399 HydrophobicContact CG-CG 4.47Å; L395-L399 VanDerWaalsContact O-CG 3.26Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 3.05Å; N396-L399 PolarHBondContact O-N 2.83Å; E397-L399 VanDerWaalsContact C-N 3.33Å; E397-L399 PolarHBondContact O-N 3.26Å; L399-G407 WeakPolarHBondContact CD2-O 3.46Å
400	T	84.4	Confident	86.3	Confident	87 Å²	87	55.7 Å²	55.7	53%	0.534	33%	0.332	S	S	.	.	H	α-helix	trans	-84.1	-25.2	177.9	51	0	0	0	0	114.2	N396 E397 T398	N396-T400 WeakPolarHBondContact O-CG2 3.4Å; N396-T400 PolarHBondContact O-N 3.24Å; N396-T400 PolarHBondContact O-OG1 3.42Å; N396-T400 VanDerWaalsContact O-OG1 3.05Å; E397-T400 WeakPolarHBondContact CA-OG1 3.37Å; E397-T400 PolarHBondContact O-N 3.44Å; E397-T400 PolarHBondContact O-OG1 2.91Å; T398-T400 VanDerWaalsContact C-N 3.27Å; T398-T400 PolarHBondContact O-N 3.28Å
401	S	84.6	Confident	86.3	Confident	95 Å²	95	52.6 Å²	52.6	66%	0.664	31%	0.306	S	S	*	.	H	α-helix	trans	-100.9	-0.9	-173.9	61	0	0	0	0	114.9	E397 T398	E397-S401 PolarHBondContact O-N 2.94Å; E397-S401 PolarHBondContact O-OG 3.09Å; E397-S401 VanDerWaalsContact O-OG 3.08Å; T398-S401 PolarHBondContact O-N 3.39Å
402	C	80.8	Confident	86.2	Confident	45 Å²	45	54.3 Å²	54.3	30%	0.304	31%	0.309	S	S	.	.	S	Bend	trans	-124.1	168.9	-170.6	-65.2	0	0	0	0	113.3	T398 V406	T398-C402 VanDerWaalsContact O-CB 3.27Å; T398-C402 WeakPolarHBondContact O-CB 3.4Å; T398-C402 PolarHBondContact O-N 2.95Å; T398-C402 PolarHBondContact O-SG 2.93Å; T398-C402 VanDerWaalsContact O-SG 3.37Å; C402-V406 HydrophobicContact CB-CB 3.97Å; C402-V406 HydrophobicContact CB-CG1 3.76Å
403	T	84.1	Confident	86.3	Confident	93 Å²	93	60.1 Å²	60.1	57%	0.571	33%	0.334	S	S	*	.			trans	-75.2	161.9	174.5	60.7	0	0	0	0	111.2	E405 V406 G407	T403-E405 PolarHBondContact O-N 3.4Å; T403-V406 PolarHBondContact O-N 2.93Å; T403-V406 VanDerWaalsContact O-N 3.14Å; T403-V406 WeakPolarHBondContact OG1-CG2 3.49Å; T403-G407 PolarHBondContact O-N 2.65Å
404	K	82.3	Confident	86.3	Confident	76 Å²	76	58.5 Å²	58.5	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	-50.5	-42.6	-179.7	-174.7	-179.6	177.9	-173.4	0	112.7	W363 F366 K408	W363-K404 HydrophobicContact CB-CD 4.48Å; W363-K404 HydrophobicContact CB-CG 4.24Å; W363-K404 HydrophobicContact CD2-CG 4.41Å; W363-K404 HydrophobicContact CG-CG 4.2Å; F366-K404 HydrophobicContact CD1-CG 3.92Å; F366-K404 HydrophobicContact CE1-CG 4.3Å; F366-K404 VanDerWaalsContact CE1-O 3.31Å; F366-K404 WeakPolarHBondContact CE1-O 3.37Å; K404-K408 WeakPolarHBondContact O-CB 3.43Å; K404-K408 PolarHBondContact O-N 3.38Å
405	E	82.5	Confident	86.3	Confident	126 Å²	126	55.7 Å²	55.7	59%	0.589	31%	0.306	S	S	*	.	H	α-helix	trans	-71.1	-40.1	-178.7	-56.5	-50.4	138.7	0	0	113	T403 K408 A409	T403-E405 PolarHBondContact O-N 3.4Å; E405-K408 PolarHBondContact O-N 3.4Å; E405-A409 PolarHBondContact O-N 3.45Å; E405-A409 VanDerWaalsContact O-N 3.09Å
406	V	83.6	Confident	86.3	Confident	77 Å²	77	62.2 Å²	62.2	47%	0.467	34%	0.337	S	S	.	.	H	α-helix	trans	-71	-39.2	177.8	175.5	0	0	0	0	110.7	C402 T403 A409 A410	C402-V406 HydrophobicContact CB-CB 3.97Å; C402-V406 HydrophobicContact CB-CG1 3.76Å; T403-V406 PolarHBondContact O-N 2.93Å; T403-V406 VanDerWaalsContact O-N 3.14Å; T403-V406 WeakPolarHBondContact OG1-CG2 3.49Å; V406-A409 PolarHBondContact O-N 2.81Å; V406-A410 WeakPolarHBondContact O-CB 3.31Å; V406-A410 PolarHBondContact O-N 3.29Å
407	G	84.9	Confident	86.3	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-38	173.8	0	0	0	0	0	112.8	L399 T403 A410 L411	L399-G407 WeakPolarHBondContact CD2-O 3.46Å; T403-G407 PolarHBondContact O-N 2.65Å; G407-A410 PolarHBondContact O-N 2.94Å; G407-L411 WeakPolarHBondContact O-CB 3.43Å; G407-L411 PolarHBondContact O-N 3.26Å
408	K	85.7	Confident	86.4	Confident	55 Å²	55	61.1 Å²	61.1	24%	0.239	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-50.5	173.6	-171.4	-179.1	-179.2	164.4	0	111.2	F366 K404 E405 A410 L411 E412	F366-K408 HydrophobicContact CB-CB 4.39Å; F366-K408 HydrophobicContact CB-CD 3.85Å; F366-K408 HydrophobicContact CB-CG 3.86Å; F366-K408 HydrophobicContact CD1-CB 3.51Å; F366-K408 HydrophobicContact CD1-CD 4.41Å; F366-K408 HydrophobicContact CD1-CG 3.94Å; F366-K408 HydrophobicContact CE1-CB 3.76Å; F366-K408 HydrophobicContact CG-CB 4.04Å; F366-K408 HydrophobicContact CG-CD 4.41Å; F366-K408 HydrophobicContact CG-CG 3.95Å; F366-K408 PolarHBondContact O-NZ 2.84Å; K404-K408 WeakPolarHBondContact O-CB 3.43Å; K404-K408 PolarHBondContact O-N 3.38Å; E405-K408 PolarHBondContact O-N 3.4Å; K408-A410 VanDerWaalsContact C-N 3.33Å; K408-A410 PolarHBondContact O-N 2.59Å; K408-L411 PolarHBondContact O-N 3.43Å; K408-E412 WeakPolarHBondContact CE-OE1 3.47Å; K408-E412 HydrophobicContact CG-CG 4.44Å; K408-E412 WeakPolarHBondContact O-CB 3.36Å; K408-E412 WeakPolarHBondContact O-CG 3.46Å; K408-E412 PolarHBondContact O-N 3.21Å
409	A	86.4	Confident	86.5	Confident	55 Å²	55	61.8 Å²	61.8	46%	0.455	33%	0.333	S	S	.	.	H	α-helix	trans	-62.2	-39	179.5	0	0	0	0	0	112.5	E405 V406 K413	E405-A409 PolarHBondContact O-N 3.45Å; E405-A409 VanDerWaalsContact O-N 3.09Å; V406-A409 PolarHBondContact O-N 2.81Å; A409-K413 VanDerWaalsContact O-CB 3.27Å; A409-K413 WeakPolarHBondContact O-CB 3.4Å; A409-K413 PolarHBondContact O-N 3.38Å
410	A	86.8	Confident	86.7	Confident	24 Å²	24	64.6 Å²	64.6	20%	0.198	35%	0.346	C	S	.	.	H	α-helix	trans	-65.4	-39.7	175.8	0	0	0	0	0	112.3	T398 V406 G407 K408 Q414	T398-A410 HydrophobicContact CG2-CB 3.79Å; V406-A410 WeakPolarHBondContact O-CB 3.31Å; V406-A410 PolarHBondContact O-N 3.29Å; G407-A410 PolarHBondContact O-N 2.94Å; K408-A410 VanDerWaalsContact C-N 3.33Å; K408-A410 PolarHBondContact O-N 2.59Å; A410-Q414 WeakPolarHBondContact O-CG 3.37Å; A410-Q414 PolarHBondContact O-N 3.43Å; A410-Q414 VanDerWaalsContact O-N 3.16Å
411	L	88.6	Confident	86.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-68.2	-47.8	176.6	-170.2	70.8	0	0	0	111.5	L356 F366 M376 V380 L383 L395 G407 K408 K413 Q414 I415	L356-L411 HydrophobicContact CD1-CD1 4.16Å; F366-L411 HydrophobicContact CD2-CD2 4.12Å; F366-L411 HydrophobicContact CE2-CD2 3.53Å; F366-L411 HydrophobicContact CZ-CD2 4.35Å; M376-L411 HydrophobicContact SD-CD2 3.67Å; V380-L411 HydrophobicContact CG2-CD1 4.5Å; V380-L411 HydrophobicContact CG2-CD2 3.9Å; L383-L411 HydrophobicContact CD1-CD1 3.42Å; L383-L411 VanDerWaalsContact CD1-CD1 3.42Å; L383-L411 HydrophobicContact CD1-CG 4.25Å; L395-L411 HydrophobicContact CD1-CD1 4.38Å; L395-L411 HydrophobicContact CD2-CD1 3.95Å; G407-L411 WeakPolarHBondContact O-CB 3.43Å; G407-L411 PolarHBondContact O-N 3.26Å; K408-L411 PolarHBondContact O-N 3.43Å; L411-K413 VanDerWaalsContact C-N 3.3Å; L411-K413 PolarHBondContact O-N 2.58Å; L411-Q414 PolarHBondContact O-N 3.13Å; L411-Q414 VanDerWaalsContact O-N 3.12Å; L411-I415 HydrophobicContact CD2-CD1 4.48Å; L411-I415 HydrophobicContact CG-CD1 4.01Å; L411-I415 VanDerWaalsContact O-CG1 3.26Å; L411-I415 WeakPolarHBondContact O-CG1 3.44Å; L411-I415 PolarHBondContact O-N 3.47Å
412	E	87.9	Confident	87	Confident	85 Å²	85	63 Å²	63	40%	0.397	32%	0.324	S	S	.	.	H	α-helix	trans	-60.6	-39.2	177.9	-73.9	173.4	168.2	0	0	111.8	M376 K408 I415 E416	M376-E412 HydrophobicContact CE-CG 4.25Å; K408-E412 WeakPolarHBondContact CE-OE1 3.47Å; K408-E412 HydrophobicContact CG-CG 4.44Å; K408-E412 WeakPolarHBondContact O-CB 3.36Å; K408-E412 WeakPolarHBondContact O-CG 3.46Å; K408-E412 PolarHBondContact O-N 3.21Å; E412-I415 WeakPolarHBondContact O-CB 3.27Å; E412-I415 PolarHBondContact O-N 3.04Å; E412-E416 WeakPolarHBondContact O-CB 3.44Å; E412-E416 PolarHBondContact O-N 3.1Å
413	K	90.3	Very high	87.3	Confident	122 Å²	122	67.1 Å²	67.1	53%	0.53	33%	0.333	S	S	.	.	H	α-helix	trans	-60.3	-45.7	172.5	-177.2	-178.2	175	-172.7	0	112	A409 L411 I415 E416 E417	A409-K413 VanDerWaalsContact O-CB 3.27Å; A409-K413 WeakPolarHBondContact O-CB 3.4Å; A409-K413 PolarHBondContact O-N 3.38Å; L411-K413 VanDerWaalsContact C-N 3.3Å; L411-K413 PolarHBondContact O-N 2.58Å; K413-I415 VanDerWaalsContact C-N 3.32Å; K413-I415 PolarHBondContact O-N 3.5Å; K413-E416 PolarHBondContact O-N 3.2Å; K413-E417 WeakPolarHBondContact CE-OE1 3.42Å; K413-E417 WeakPolarHBondContact O-CG 3.42Å; K413-E417 PolarHBondContact O-N 2.99Å
414	Q	90.6	Very high	87.6	Confident	40 Å²	40	68 Å²	68	19%	0.187	33%	0.328	C	S	.	.	H	α-helix	trans	-65.6	-36.4	176.8	-73.9	-59	-60.1	0	0	112.3	L383 L395 A410 L411 E417 I418	L383-Q414 HydrophobicContact CD1-CB 4.22Å; L383-Q414 HydrophobicContact CD2-CB 4.2Å; L395-Q414 HydrophobicContact CD1-CG 4.02Å; L395-Q414 HydrophobicContact CD2-CB 4.41Å; L395-Q414 HydrophobicContact CD2-CG 4.26Å; A410-Q414 WeakPolarHBondContact O-CG 3.37Å; A410-Q414 PolarHBondContact O-N 3.43Å; A410-Q414 VanDerWaalsContact O-N 3.16Å; L411-Q414 PolarHBondContact O-N 3.13Å; L411-Q414 VanDerWaalsContact O-N 3.12Å; Q414-E417 PolarHBondContact NE2-OE2 2.98Å; Q414-E417 PolarHBondContact O-N 2.94Å; Q414-I418 WeakPolarHBondContact O-CB 3.38Å; Q414-I418 WeakPolarHBondContact O-CG1 2.9Å; Q414-I418 PolarHBondContact O-N 3.08Å
415	I	90	Very high	87.8	Confident	16 Å²	16	67.9 Å²	67.9	8%	0.082	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-45	174.3	-70	166.3	0	0	0	110.5	M376 E379 L383 L411 E412 K413 I418 N419	M376-I415 HydrophobicContact CE-CD1 4.43Å; M376-I415 HydrophobicContact SD-CD1 3.71Å; E379-I415 HydrophobicContact CB-CD1 3.52Å; E379-I415 HydrophobicContact CB-CG1 3.86Å; E379-I415 HydrophobicContact CB-CG2 4.09Å; E379-I415 HydrophobicContact CG-CD1 4.23Å; E379-I415 HydrophobicContact CG-CG2 3.92Å; E379-I415 VanDerWaalsContact OE2-CG2 3.31Å; E379-I415 WeakPolarHBondContact OE2-CG2 3.31Å; L383-I415 HydrophobicContact CD1-CG1 3.75Å; L383-I415 HydrophobicContact CD2-CG1 4.3Å; L383-I415 HydrophobicContact CG-CG1 4.01Å; L411-I415 HydrophobicContact CD2-CD1 4.48Å; L411-I415 HydrophobicContact CG-CD1 4.01Å; L411-I415 VanDerWaalsContact O-CG1 3.26Å; L411-I415 WeakPolarHBondContact O-CG1 3.44Å; L411-I415 PolarHBondContact O-N 3.47Å; E412-I415 WeakPolarHBondContact O-CB 3.27Å; E412-I415 PolarHBondContact O-N 3.04Å; K413-I415 VanDerWaalsContact C-N 3.32Å; K413-I415 PolarHBondContact O-N 3.5Å; I415-I418 PolarHBondContact O-N 2.77Å; I415-N419 VanDerWaalsContact CG2-ND2 3.29Å; I415-N419 WeakPolarHBondContact CG2-ND2 3.42Å; I415-N419 VanDerWaalsContact O-CB 3.3Å; I415-N419 WeakPolarHBondContact O-CB 3.08Å; I415-N419 VanDerWaalsContact O-CG 3.3Å; I415-N419 PolarHBondContact O-N 3.18Å; I415-N419 PolarHBondContact O-ND2 3.43Å
416	E	88.3	Confident	88	Confident	145 Å²	145	68.1 Å²	68.1	68%	0.678	33%	0.328	S	S	*	.	H	α-helix	trans	-64.6	-44.3	178.3	-170.5	169.4	-153.2	0	0	111.6	E412 K413 I418 N419 E420	E412-E416 WeakPolarHBondContact O-CB 3.44Å; E412-E416 PolarHBondContact O-N 3.1Å; K413-E416 PolarHBondContact O-N 3.2Å; E416-I418 PolarHBondContact O-N 3.35Å; E416-N419 PolarHBondContact O-N 3.49Å; E416-E420 WeakPolarHBondContact O-CB 3.36Å; E416-E420 PolarHBondContact O-N 2.95Å
417	E	89.8	Confident	88.1	Confident	87 Å²	87	69.7 Å²	69.7	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-60	-45	175.6	-74.7	173.7	-172.6	0	0	112.1	K413 Q414 E420 Q421	K413-E417 WeakPolarHBondContact CE-OE1 3.42Å; K413-E417 WeakPolarHBondContact O-CG 3.42Å; K413-E417 PolarHBondContact O-N 2.99Å; Q414-E417 PolarHBondContact NE2-OE2 2.98Å; Q414-E417 PolarHBondContact O-N 2.94Å; E417-E420 PolarHBondContact O-N 3.46Å; E417-Q421 WeakPolarHBondContact O-CB 3.14Å; E417-Q421 PolarHBondContact O-N 3.26Å
418	I	91.1	Very high	88.1	Confident	8 Å²	8	75 Å²	75	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-67.8	-39.8	177	-72.9	-58	0	0	0	111.9	L383 R386 L387 Q414 I415 E416 E420 Q421 I422	L383-I418 HydrophobicContact CD2-CB 4Å; L383-I418 HydrophobicContact CD2-CG1 3.57Å; L383-I418 HydrophobicContact CD2-CG2 4.48Å; R386-I418 HydrophobicContact CB-CD1 4.01Å; R386-I418 HydrophobicContact CB-CG2 4.04Å; R386-I418 HydrophobicContact CG-CG2 4.13Å; L387-I418 HydrophobicContact CD2-CD1 3.87Å; L387-I418 HydrophobicContact CD2-CG1 4.02Å; Q414-I418 WeakPolarHBondContact O-CB 3.38Å; Q414-I418 WeakPolarHBondContact O-CG1 2.9Å; Q414-I418 PolarHBondContact O-N 3.08Å; I415-I418 PolarHBondContact O-N 2.77Å; E416-I418 PolarHBondContact O-N 3.35Å; I418-E420 VanDerWaalsContact C-N 3.35Å; I418-Q421 PolarHBondContact O-N 2.88Å; I418-I422 HydrophobicContact CG2-CD1 3.75Å; I418-I422 HydrophobicContact CG2-CG1 4.35Å; I418-I422 WeakPolarHBondContact O-CB 3.5Å; I418-I422 VanDerWaalsContact O-CG1 3.25Å; I418-I422 WeakPolarHBondContact O-CG1 3.29Å; I418-I422 PolarHBondContact O-N 3.09Å
419	N	88.1	Confident	88	Confident	58 Å²	58	75 Å²	75	31%	0.31	37%	0.366	S	S	.	.	H	α-helix	trans	-67.1	-37.4	177.4	-77.9	-42.1	0	0	0	111.9	E379 I415 E416 I422 R423	E379-N419 PolarHBondContact OE2-ND2 2.99Å; I415-N419 VanDerWaalsContact CG2-ND2 3.29Å; I415-N419 WeakPolarHBondContact CG2-ND2 3.42Å; I415-N419 VanDerWaalsContact O-CB 3.3Å; I415-N419 WeakPolarHBondContact O-CB 3.08Å; I415-N419 VanDerWaalsContact O-CG 3.3Å; I415-N419 PolarHBondContact O-N 3.18Å; I415-N419 PolarHBondContact O-ND2 3.43Å; E416-N419 PolarHBondContact O-N 3.49Å; N419-I422 PolarHBondContact O-N 2.95Å; N419-R423 WeakPolarHBondContact O-CB 3.27Å; N419-R423 PolarHBondContact O-N 3.06Å
420	E	90.3	Very high	87.8	Confident	62 Å²	62	77.5 Å²	77.5	29%	0.29	37%	0.368	S	S	.	.	H	α-helix	trans	-63.5	-43	171	-177.7	61.1	-147.2	0	0	111.4	E416 E417 I418 R423 K424	E416-E420 WeakPolarHBondContact O-CB 3.36Å; E416-E420 PolarHBondContact O-N 2.95Å; E417-E420 PolarHBondContact O-N 3.46Å; I418-E420 VanDerWaalsContact C-N 3.35Å; E420-R423 PolarHBondContact O-N 2.93Å; E420-R423 IonicContact OE1-CZ 2.85Å; E420-R423 IonicContact OE1-NH2 2.74Å; E420-R423 PolarHBondContact OE1-NH2 3.01Å; E420-R423 IonicContact OE2-CZ 3.92Å; E420-R423 IonicContact OE2-NE 3.33Å; E420-R423 IonicContact OE2-NH1 3.87Å; E420-R423 PolarHBondContact OE2-NH1 2.92Å; E420-R423 IonicContact OE2-NH2 3.69Å; E420-R423 PolarHBondContact OE2-NH2 3.45Å; E420-K424 WeakPolarHBondContact O-CG 3.18Å; E420-K424 PolarHBondContact O-N 3.43Å; E420-K424 VanDerWaalsContact OE1-CE 3.27Å; E420-K424 WeakPolarHBondContact OE1-CE 3.2Å
421	Q	88	Confident	87.6	Confident	100 Å²	100	78.7 Å²	78.7	47%	0.467	38%	0.378	S	S	.	.	H	α-helix	trans	-63.2	-44.6	176.6	-174.3	174.8	-0.2	0	0	111.8	E417 I418 R423 K424 E425	E417-Q421 WeakPolarHBondContact O-CB 3.14Å; E417-Q421 PolarHBondContact O-N 3.26Å; I418-Q421 PolarHBondContact O-N 2.88Å; Q421-R423 VanDerWaalsContact C-N 3.3Å; Q421-R423 PolarHBondContact O-N 3.47Å; Q421-K424 PolarHBondContact O-N 2.71Å; Q421-E425 WeakPolarHBondContact O-CG 3.24Å; Q421-E425 PolarHBondContact O-N 3.22Å
422	I	88	Confident	87.2	Confident	50 Å²	50	87.1 Å²	87.1	26%	0.256	41%	0.409	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175.4	-69.5	166.4	0	0	0	110.7	I418 N419 E425 K426	I418-I422 HydrophobicContact CG2-CD1 3.75Å; I418-I422 HydrophobicContact CG2-CG1 4.35Å; I418-I422 WeakPolarHBondContact O-CB 3.5Å; I418-I422 VanDerWaalsContact O-CG1 3.25Å; I418-I422 WeakPolarHBondContact O-CG1 3.29Å; I418-I422 PolarHBondContact O-N 3.09Å; N419-I422 PolarHBondContact O-N 2.95Å; I422-E425 PolarHBondContact O-N 3.23Å; I422-K426 WeakPolarHBondContact O-CB 3.37Å; I422-K426 PolarHBondContact O-N 3.29Å
423	R	86.7	Confident	86.5	Confident	131 Å²	131	89.9 Å²	89.9	49%	0.494	42%	0.424	S	S	.	.	H	α-helix	trans	-62.3	-46	176.5	-166.5	178.4	76.5	-142.6	-0.7	111	N419 E420 Q421 K426 E427	N419-R423 WeakPolarHBondContact O-CB 3.27Å; N419-R423 PolarHBondContact O-N 3.06Å; E420-R423 PolarHBondContact O-N 2.93Å; E420-R423 IonicContact OE1-CZ 2.85Å; E420-R423 IonicContact OE1-NH2 2.74Å; E420-R423 PolarHBondContact OE1-NH2 3.01Å; E420-R423 IonicContact OE2-CZ 3.92Å; E420-R423 IonicContact OE2-NE 3.33Å; E420-R423 IonicContact OE2-NH1 3.87Å; E420-R423 PolarHBondContact OE2-NH1 2.92Å; E420-R423 IonicContact OE2-NH2 3.69Å; E420-R423 PolarHBondContact OE2-NH2 3.45Å; Q421-R423 VanDerWaalsContact C-N 3.3Å; Q421-R423 PolarHBondContact O-N 3.47Å; R423-K426 PolarHBondContact O-N 3.34Å; R423-E427 IonicContact NE-OE1 3.7Å; R423-E427 WeakPolarHBondContact O-CG 3.33Å; R423-E427 PolarHBondContact O-N 2.92Å
424	K	88.8	Confident	85.8	Confident	110 Å²	110	93.2 Å²	93.2	48%	0.478	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-46	175.4	-72.9	178	-178.2	172.5	0	112.5	E420 Q421 K426 E427 E428	E420-K424 WeakPolarHBondContact O-CG 3.18Å; E420-K424 PolarHBondContact O-N 3.43Å; E420-K424 VanDerWaalsContact OE1-CE 3.27Å; E420-K424 WeakPolarHBondContact OE1-CE 3.2Å; Q421-K424 PolarHBondContact O-N 2.71Å; K424-K426 VanDerWaalsContact C-N 3.27Å; K424-K426 PolarHBondContact O-N 2.68Å; K424-E427 PolarHBondContact O-N 3.03Å; K424-E428 WeakPolarHBondContact O-CB 3.28Å; K424-E428 WeakPolarHBondContact O-CG 3.21Å; K424-E428 PolarHBondContact O-N 2.75Å
425	E	88.2	Confident	84.6	Confident	74 Å²	74	97.8 Å²	97.8	35%	0.346	46%	0.455	S	S	.	.	H	α-helix	trans	-59.4	-39.2	176	-75.7	176.6	-174.4	0	0	111.8	R386 Q421 I422 A429	R386-E425 IonicContact CZ-OE2 4Å; R386-E425 IonicContact NH1-OE1 3.46Å; R386-E425 IonicContact NH1-OE2 2.99Å; R386-E425 PolarHBondContact NH1-OE2 2.87Å; R386-E425 IonicContact NH2-OE2 3.65Å; Q421-E425 WeakPolarHBondContact O-CG 3.24Å; Q421-E425 PolarHBondContact O-N 3.22Å; I422-E425 PolarHBondContact O-N 3.23Å; E425-A429 WeakPolarHBondContact O-CB 3.38Å; E425-A429 PolarHBondContact O-N 3.11Å
426	K	86.6	Confident	83.2	Confident	132 Å²	132	99.6 Å²	99.6	57%	0.574	47%	0.472	S	S	*	.	H	α-helix	trans	-67.7	-44.9	176.7	-171.9	-179.7	176.4	-173.6	0	111.6	I422 R423 K424 A429 E430	I422-K426 WeakPolarHBondContact O-CB 3.37Å; I422-K426 PolarHBondContact O-N 3.29Å; R423-K426 PolarHBondContact O-N 3.34Å; K424-K426 VanDerWaalsContact C-N 3.27Å; K424-K426 PolarHBondContact O-N 2.68Å; K426-A429 PolarHBondContact O-N 2.95Å; K426-E430 VanDerWaalsContact CE-OE1 3.24Å; K426-E430 WeakPolarHBondContact CE-OE1 3.46Å; K426-E430 WeakPolarHBondContact O-CB 3.27Å; K426-E430 VanDerWaalsContact O-CG 3.31Å; K426-E430 WeakPolarHBondContact O-CG 2.82Å; K426-E430 PolarHBondContact O-N 3.26Å
427	E	86.1	Confident	81.8	Confident	110 Å²	110	96 Å²	96	51%	0.514	46%	0.463	S	S	.	.	H	α-helix	trans	-62.3	-41.4	175	-74.6	173	-168.2	0	0	111.7	R423 K424 A431	R423-E427 IonicContact NE-OE1 3.7Å; R423-E427 WeakPolarHBondContact O-CG 3.33Å; R423-E427 PolarHBondContact O-N 2.92Å; K424-E427 PolarHBondContact O-N 3.03Å; E427-A431 WeakPolarHBondContact O-CB 3.45Å; E427-A431 PolarHBondContact O-N 3.5Å
428	E	84.5	Confident	80.2	Confident	110 Å²	110	100.2 Å²	100.2	51%	0.514	48%	0.48	S	S	.	.	H	α-helix	trans	-68.7	-39.2	175.9	-75.6	-175.6	-170.6	0	0	112.5	K424 A431 R432	K424-E428 WeakPolarHBondContact O-CB 3.28Å; K424-E428 WeakPolarHBondContact O-CG 3.21Å; K424-E428 PolarHBondContact O-N 2.75Å; E428-A431 PolarHBondContact O-N 2.95Å; E428-R432 WeakPolarHBondContact O-CB 3.13Å; E428-R432 WeakPolarHBondContact O-CG 3.38Å; E428-R432 PolarHBondContact O-N 2.89Å
429	A	82.2	Confident	78.3	Confident	56 Å²	56	105.3 Å²	105.3	46%	0.463	51%	0.507	S	S	.	.	H	α-helix	trans	-67.2	-42.1	175.2	0	0	0	0	0	111.3	E425 K426 A431 R432 M433	E425-A429 WeakPolarHBondContact O-CB 3.38Å; E425-A429 PolarHBondContact O-N 3.11Å; K426-A429 PolarHBondContact O-N 2.95Å; A429-A431 VanDerWaalsContact C-N 3.34Å; A429-R432 PolarHBondContact O-N 3.4Å; A429-M433 VanDerWaalsContact O-CB 3.25Å; A429-M433 WeakPolarHBondContact O-CB 3.27Å; A429-M433 PolarHBondContact O-N 3.06Å
430	E	83.1	Confident	76.3	Confident	108 Å²	108	107.8 Å²	107.8	51%	0.505	53%	0.525	S	S	.	.	H	α-helix	trans	-64.3	-38.3	172.8	-75.8	178.5	-169.5	0	0	111.4	K426 M433 R434	K426-E430 VanDerWaalsContact CE-OE1 3.24Å; K426-E430 WeakPolarHBondContact CE-OE1 3.46Å; K426-E430 WeakPolarHBondContact O-CB 3.27Å; K426-E430 VanDerWaalsContact O-CG 3.31Å; K426-E430 WeakPolarHBondContact O-CG 2.82Å; K426-E430 PolarHBondContact O-N 3.26Å; E430-M433 PolarHBondContact O-N 3.19Å; E430-R434 VanDerWaalsContact O-CB 3.32Å; E430-R434 WeakPolarHBondContact O-CB 3.49Å; E430-R434 PolarHBondContact O-N 3.07Å
431	A	82.1	Confident	73.9	Confident	48 Å²	48	113.8 Å²	113.8	40%	0.397	55%	0.553	S	S	.	*	H	α-helix	trans	-67.4	-42.1	173.8	0	0	0	0	0	112.4	E427 E428 A429 R434 Q435	E427-A431 WeakPolarHBondContact O-CB 3.45Å; E427-A431 PolarHBondContact O-N 3.5Å; E428-A431 PolarHBondContact O-N 2.95Å; A429-A431 VanDerWaalsContact C-N 3.34Å; A431-R434 PolarHBondContact O-N 2.78Å; A431-Q435 WeakPolarHBondContact O-CB 3.39Å; A431-Q435 WeakPolarHBondContact O-CG 3.38Å; A431-Q435 PolarHBondContact O-N 3.21Å
432	R	80.8	Confident	72	Confident	177 Å²	177	117.6 Å²	117.6	67%	0.668	57%	0.568	S	S	*	*	H	α-helix	trans	-65.7	-38.1	173.6	-78.2	-179.2	-175.4	-177.4	5.9	111.7	E428 A429 Q435 A436	E428-R432 WeakPolarHBondContact O-CB 3.13Å; E428-R432 WeakPolarHBondContact O-CG 3.38Å; E428-R432 PolarHBondContact O-N 2.89Å; A429-R432 PolarHBondContact O-N 3.4Å; R432-Q435 PolarHBondContact O-N 3.17Å; R432-A436 WeakPolarHBondContact O-CB 3.19Å; R432-A436 PolarHBondContact O-N 3.33Å
433	M	73.9	Confident	69.5	Low	143 Å²	143	119.7 Å²	119.7	70%	0.704	59%	0.587	S	S	*	*	H	α-helix	trans	-70	-36.6	175.3	-164.2	-177.4	-81.6	0	0	111.3	A429 E430 A436 S437	A429-M433 VanDerWaalsContact O-CB 3.25Å; A429-M433 WeakPolarHBondContact O-CB 3.27Å; A429-M433 PolarHBondContact O-N 3.06Å; E430-M433 PolarHBondContact O-N 3.19Å; M433-A436 PolarHBondContact O-N 3.21Å; M433-S437 PolarHBondContact O-N 2.96Å; M433-S437 PolarHBondContact O-OG 2.98Å
434	R	75.4	Confident	67	Low	192 Å²	192	120.2 Å²	120.2	73%	0.725	61%	0.605	S	S	*	*	H	α-helix	trans	-65.6	-36.3	168.8	-88.9	179.2	165	178.9	-2	113.1	E430 A431 S437 K438	E430-R434 VanDerWaalsContact O-CB 3.32Å; E430-R434 WeakPolarHBondContact O-CB 3.49Å; E430-R434 PolarHBondContact O-N 3.07Å; A431-R434 PolarHBondContact O-N 2.78Å; R434-S437 VanDerWaalsContact CA-OG 3.3Å; R434-S437 WeakPolarHBondContact CA-OG 3.34Å; R434-S437 PolarHBondContact O-OG 2.73Å; R434-K438 WeakPolarHBondContact O-CB 2.98Å; R434-K438 PolarHBondContact O-N 3.11Å
435	Q	65.3	Low	64.4	Low	137 Å²	137	119.1 Å²	119.1	64%	0.64	63%	0.625	S	S	*	*	H	α-helix	trans	-70.6	-38.9	173.2	-79.1	-179	-7.7	0	0	111.6	A431 R432 K438 N439	A431-Q435 WeakPolarHBondContact O-CB 3.39Å; A431-Q435 WeakPolarHBondContact O-CG 3.38Å; A431-Q435 PolarHBondContact O-N 3.21Å; R432-Q435 PolarHBondContact O-N 3.17Å; Q435-K438 PolarHBondContact O-N 3.26Å; Q435-N439 WeakPolarHBondContact O-CB 3.39Å; Q435-N439 PolarHBondContact O-N 3.29Å
436	A	60.9	Low	61.6	Low	54 Å²	54	119.7 Å²	119.7	45%	0.446	65%	0.65	S	S	.	*	H	α-helix	trans	-67	-37.5	175.4	0	0	0	0	0	112.4	R432 M433 N439 T440	R432-A436 WeakPolarHBondContact O-CB 3.19Å; R432-A436 PolarHBondContact O-N 3.33Å; M433-A436 PolarHBondContact O-N 3.21Å; A436-N439 PolarHBondContact O-N 3.37Å; A436-T440 PolarHBondContact O-N 3.45Å; A436-T440 PolarHBondContact O-OG1 2.88Å
437	S	58.4	Low	58.8	Low	70 Å²	70	117.3 Å²	117.3	49%	0.49	66%	0.663	S	S	.	*	H	α-helix	trans	-71.3	-35.4	173.7	35.7	0	0	0	0	112.5	M433 R434 N439 T440	M433-S437 PolarHBondContact O-N 2.96Å; M433-S437 PolarHBondContact O-OG 2.98Å; R434-S437 VanDerWaalsContact CA-OG 3.3Å; R434-S437 WeakPolarHBondContact CA-OG 3.34Å; R434-S437 PolarHBondContact O-OG 2.73Å; S437-N439 VanDerWaalsContact C-N 3.28Å; S437-N439 PolarHBondContact O-N 2.97Å; S437-T440 PolarHBondContact O-N 3.41Å
438	K	56.3	Low	56.4	Low	175 Å²	175	115.9 Å²	115.9	76%	0.761	68%	0.678	S	S	*	*	H	α-helix	trans	-67.3	-22.8	168	-82.9	-178.6	174.9	178.5	0	114.1	R434 Q435	R434-K438 WeakPolarHBondContact O-CB 2.98Å; R434-K438 PolarHBondContact O-N 3.11Å; Q435-K438 PolarHBondContact O-N 3.26Å
439	N	51.1	Low	54	Low	115 Å²	115	118.8 Å²	118.8	62%	0.615	70%	0.697	S	S	*	*	H	α-helix	trans	-86.1	-9.7	174.7	-117.8	18.6	0	0	0	113.8	Q435 A436 S437	Q435-N439 WeakPolarHBondContact O-CB 3.39Å; Q435-N439 PolarHBondContact O-N 3.29Å; A436-N439 PolarHBondContact O-N 3.37Å; S437-N439 VanDerWaalsContact C-N 3.28Å; S437-N439 PolarHBondContact O-N 2.97Å
440	T	44.9	Very low	51.7	Low	110 Å²	110	119.4 Å²	119.4	68%	0.675	71%	0.709	S	S	*	*	H	α-helix	trans	-96	-10.5	-178.7	-44.5	0	0	0	0	113.2	A436 S437	A436-T440 PolarHBondContact O-N 3.45Å; A436-T440 PolarHBondContact O-OG1 2.88Å; S437-T440 PolarHBondContact O-N 3.41Å
441	E	39.8	Very low	49.8	Very low	188 Å²	188	119 Å²	119	88%	0.879	72%	0.718	S	S	*	*	S	Bend	trans	-99.6	9.6	166.3	-76.9	-171.3	155	0	0	113.8
442	K	48.2	Very low	48.5	Very low	180 Å²	180	124 Å²	124	78%	0.783	73%	0.731	S	S	*	*	S	Bend	trans	-139.9	44.2	174.6	-142.3	175.5	-170.3	177.9	0	112
443	S	37	Very low	47.7	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	73%	0.734	S	S	*	*			trans	-168.4	64.9	168.2	-75.1	0	0	0	0	112.2
444	T	33.8	Very low	47.7	Very low	143 Å²	143	117.7 Å²	117.7	88%	0.877	71%	0.71	S	S	*	*	S	Bend	trans	-116.5	110.2	149.1	31.7	0	0	0	0	107.9
445	G	33.3	Very low	47.9	Very low	87 Å²	87	110.5 Å²	110.5	90%	0.897	69%	0.689	S	S	*	*	S	Bend	trans	110.7	42.7	168.8	0	0	0	0	0	117
446	G	30.6	Very low	48.4	Very low	85 Å²	85	107.8 Å²	107.8	88%	0.876	68%	0.676	S	S	*	*			trans	-125.2	87	172.8	0	0	0	0	0	112.5
447	G	27.4	Very low	49.2	Very low	83 Å²	83	109.3 Å²	109.3	86%	0.856	68%	0.677	S	S	*	*			trans	-155.9	26.6	173.3	0	0	0	0	0	113.1
448	G	36.3	Very low	50.4	Low	80 Å²	80	106 Å²	106	83%	0.825	65%	0.654	S	S	*	*			trans	-102.6	97	171.7	0	0	0	0	0	109.7
449	N	34.2	Very low	51.8	Low	170 Å²	170	99 Å²	99	91%	0.909	62%	0.624	S	S	*	*			trans	-144.4	90.7	161.5	-155.8	19.2	0	0	0	111.1
450	G	33.9	Very low	53.1	Low	69 Å²	69	97.3 Å²	97.3	71%	0.711	61%	0.613	S	S	*	*			trans	-157.5	12.3	173.6	0	0	0	0	0	113.4	K452	G450-K452 VanDerWaalsContact C-N 3.27Å; G450-K452 PolarHBondContact O-N 3.16Å
451	S	42.9	Very low	55	Low	99 Å²	99	93.2 Å²	93.2	69%	0.692	59%	0.587	S	S	*	*			trans	-82.1	75.2	170.9	169.4	0	0	0	0	109.1	N453	S451-N453 PolarHBondContact O-N 2.97Å
452	K	53.8	Low	57.2	Low	155 Å²	155	84.4 Å²	84.4	67%	0.674	55%	0.545	S	S	*	.			trans	-65.6	104.7	168.8	-77.5	179.6	176.9	173.3	0	109.2	G450 W454 R494	G450-K452 VanDerWaalsContact C-N 3.27Å; G450-K452 PolarHBondContact O-N 3.16Å; K452-W454 PolarHBondContact O-N 3.4Å; K452-R494 PolarHBondContact O-NH1 3.1Å
453	N	63.7	Low	58.8	Low	138 Å²	138	78.7 Å²	78.7	74%	0.738	52%	0.523	S	S	*	.			trans	-1	105.4	168.1	-63.1	-7.5	0	0	0	115.8	S451 R494	S451-N453 PolarHBondContact O-N 2.97Å; N453-R494 PolarHBondContact O-NH2 2.83Å
454	W	75.1	Confident	61	Low	48 Å²	48	80.6 Å²	80.6	18%	0.182	52%	0.519	C	S	.	.			trans	-89.3	113.1	164.6	-73.2	80.6	0	0	0	108.1	K452 D458 L459 L462 M484 R494 D498 V499 K502	K452-W454 PolarHBondContact O-N 3.4Å; W454-D458 HydrophobicContact CE3-CB 4.05Å; W454-L459 HydrophobicContact CB-CD2 4.09Å; W454-L459 HydrophobicContact CB-CG 4.39Å; W454-L459 HydrophobicContact CE3-CD2 4.15Å; W454-L462 HydrophobicContact CH2-CD2 4.14Å; W454-L462 HydrophobicContact CZ3-CB 4.32Å; W454-L462 HydrophobicContact CZ3-CD2 3.77Å; W454-M484 HydrophobicContact CH2-CE 4.44Å; W454-M484 HydrophobicContact CH2-SD 4.4Å; W454-M484 HydrophobicContact CZ3-CE 3.71Å; W454-M484 HydrophobicContact CZ3-SD 4.13Å; W454-R494 HydrophobicContact CH2-CG 4.49Å; W454-D498 HydrophobicContact CZ2-CB 4.31Å; W454-V499 HydrophobicContact CH2-CG2 4.36Å; W454-K502 HydrophobicContact CD2-CB 4.28Å; W454-K502 HydrophobicContact CD2-CD 4.02Å; W454-K502 HydrophobicContact CD2-CG 3.68Å; W454-K502 HydrophobicContact CE3-CG 3.93Å; W454-K502 HydrophobicContact CG-CD 4.03Å; W454-K502 HydrophobicContact CG-CG 4.22Å; W454-K502 HydrophobicContact CH2-CB 3.78Å; W454-K502 HydrophobicContact CH2-CG 4.08Å; W454-K502 HydrophobicContact CZ2-CB 3.46Å; W454-K502 VanDerWaalsContact CZ2-CB 3.46Å; W454-K502 HydrophobicContact CZ2-CG 3.83Å; W454-K502 HydrophobicContact CZ3-CB 4.29Å; W454-K502 HydrophobicContact CZ3-CG 4.09Å
455	S	79.8	Confident	63.3	Low	41 Å²	41	73.8 Å²	73.8	29%	0.287	48%	0.478	S	S	.	.			trans	-72.1	159.7	172.8	60.6	0	0	0	0	110.7	D457 D458 L459	S455-D457 PolarHBondContact O-N 3.25Å; S455-D458 WeakPolarHBondContact O-CB 3.5Å; S455-D458 PolarHBondContact O-N 3.08Å; S455-D458 VanDerWaalsContact O-N 3.1Å; S455-D458 WeakPolarHBondContact OG-CB 3.5Å; S455-D458 VanDerWaalsContact OG-CG 3.29Å; S455-D458 PolarHBondContact OG-N 2.98Å; S455-D458 VanDerWaalsContact OG-N 3.16Å; S455-L459 WeakPolarHBondContact O-CG 3.32Å; S455-L459 PolarHBondContact O-N 2.92Å
456	E	75.6	Confident	65.7	Low	80 Å²	80	71.2 Å²	71.2	37%	0.374	45%	0.445	S	S	.	.	H	α-helix	trans	-56.4	-40	174.5	-171.1	58.6	-145.6	0	0	111.3	D458 L459 Q460	E456-D458 PolarHBondContact O-N 2.89Å; E456-L459 WeakPolarHBondContact O-CB 3.31Å; E456-L459 PolarHBondContact O-N 2.95Å; E456-Q460 WeakPolarHBondContact O-CG 3.23Å; E456-Q460 PolarHBondContact O-N 3.41Å
457	D	76.6	Confident	67.9	Low	86 Å²	86	73.1 Å²	73.1	46%	0.46	43%	0.434	S	S	.	.	H	α-helix	trans	-64.4	-38.5	176.2	-56.5	-17	0	0	0	112.2	S455 L459 Q460 L461	S455-D457 PolarHBondContact O-N 3.25Å; D457-L459 VanDerWaalsContact C-N 3.32Å; D457-L459 PolarHBondContact O-N 3.36Å; D457-Q460 PolarHBondContact O-N 3.48Å; D457-L461 VanDerWaalsContact O-CB 3.29Å; D457-L461 WeakPolarHBondContact O-CB 3.48Å; D457-L461 PolarHBondContact O-N 2.94Å
458	D	84.8	Confident	70.4	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.005	41%	0.411	C	S	.	.	H	α-helix	trans	-66.1	-35.5	174.9	-82.4	-7.4	0	0	0	111.3	W454 S455 E456 L462 M484 S488 S490 R494	W454-D458 HydrophobicContact CE3-CB 4.05Å; S455-D458 WeakPolarHBondContact O-CB 3.5Å; S455-D458 PolarHBondContact O-N 3.08Å; S455-D458 VanDerWaalsContact O-N 3.1Å; S455-D458 WeakPolarHBondContact OG-CB 3.5Å; S455-D458 VanDerWaalsContact OG-CG 3.29Å; S455-D458 PolarHBondContact OG-N 2.98Å; S455-D458 VanDerWaalsContact OG-N 3.16Å; E456-D458 PolarHBondContact O-N 2.89Å; D458-L462 VanDerWaalsContact O-CB 3.3Å; D458-L462 WeakPolarHBondContact O-CB 3.27Å; D458-L462 PolarHBondContact O-N 3.05Å; D458-M484 HydrophobicContact CB-CE 4.25Å; D458-M484 WeakPolarHBondContact O-CE 3.42Å; D458-S488 WeakPolarHBondContact OD1-CB 3.28Å; D458-S488 PolarHBondContact OD1-OG 2.82Å; D458-S490 PolarHBondContact OD1-OG 3.44Å; D458-S490 WeakPolarHBondContact OD2-CB 3.37Å; D458-S490 PolarHBondContact OD2-OG 3.12Å; D458-R494 IonicContact OD2-CZ 2.69Å; D458-R494 IonicContact OD2-NE 3.71Å; D458-R494 IonicContact OD2-NH2 2.75Å; D458-R494 PolarHBondContact OD2-NH2 3.17Å
459	L	84.4	Confident	72.6	Confident	28 Å²	28	68.6 Å²	68.6	15%	0.147	37%	0.372	C	S	.	.	H	α-helix	trans	-68.3	-44.1	176.7	-64.9	173.4	0	0	0	111.3	W454 S455 E456 D457 L461 L462 I463 K502 L506	W454-L459 HydrophobicContact CB-CD2 4.09Å; W454-L459 HydrophobicContact CB-CG 4.39Å; W454-L459 HydrophobicContact CE3-CD2 4.15Å; S455-L459 WeakPolarHBondContact O-CG 3.32Å; S455-L459 PolarHBondContact O-N 2.92Å; E456-L459 WeakPolarHBondContact O-CB 3.31Å; E456-L459 PolarHBondContact O-N 2.95Å; D457-L459 VanDerWaalsContact C-N 3.32Å; D457-L459 PolarHBondContact O-N 3.36Å; L459-L461 VanDerWaalsContact C-N 3.34Å; L459-L461 PolarHBondContact O-N 3Å; L459-L462 WeakPolarHBondContact O-CB 3.4Å; L459-L462 PolarHBondContact O-N 3.05Å; L459-I463 VanDerWaalsContact O-CG1 3.29Å; L459-I463 WeakPolarHBondContact O-CG1 3.46Å; L459-I463 PolarHBondContact O-N 3.17Å; L459-K502 HydrophobicContact CD2-CD 4.49Å; L459-K502 VanDerWaalsContact CD2-CE 3.45Å; L459-K502 HydrophobicContact CD2-CG 4.23Å; L459-L506 HydrophobicContact CD2-CD1 4.22Å
460	Q	77.9	Confident	74.7	Confident	80 Å²	80	64 Å²	64	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-62.6	-42.7	175.1	-69.4	179.4	12.8	0	0	111.7	E456 D457 L462 I463 K464	E456-Q460 WeakPolarHBondContact O-CG 3.23Å; E456-Q460 PolarHBondContact O-N 3.41Å; D457-Q460 PolarHBondContact O-N 3.48Å; Q460-L462 VanDerWaalsContact C-N 3.33Å; Q460-L462 PolarHBondContact O-N 3.2Å; Q460-I463 PolarHBondContact O-N 3.39Å; Q460-K464 WeakPolarHBondContact O-CB 3.41Å; Q460-K464 PolarHBondContact O-N 3.03Å
461	L	84.8	Confident	76.1	Confident	24 Å²	24	64.6 Å²	64.6	13%	0.126	35%	0.349	C	S	.	.	H	α-helix	trans	-64.8	-38.3	177.5	-171.6	65	0	0	0	111.7	D457 L459 A465 Y483 M484 H487	D457-L461 VanDerWaalsContact O-CB 3.29Å; D457-L461 WeakPolarHBondContact O-CB 3.48Å; D457-L461 PolarHBondContact O-N 2.94Å; L459-L461 VanDerWaalsContact C-N 3.34Å; L459-L461 PolarHBondContact O-N 3Å; L461-A465 WeakPolarHBondContact O-CB 3.4Å; L461-A465 PolarHBondContact O-N 2.79Å; L461-Y483 HydrophobicContact CD1-CD1 4.42Å; L461-Y483 HydrophobicContact CD1-CE1 3.69Å; L461-Y483 HydrophobicContact CG-CE1 4.39Å; L461-M484 HydrophobicContact CB-CE 4.42Å; L461-M484 HydrophobicContact CD2-CB 4.5Å; L461-M484 HydrophobicContact CG-CG 4.42Å; L461-H487 HydrophobicContact CD1-CB 3.78Å; L461-H487 VanDerWaalsContact CD2-C 3.46Å; L461-H487 HydrophobicContact CD2-CB 3.79Å; L461-H487 HydrophobicContact CG-CB 4.38Å
462	L	86.8	Confident	76.8	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-48.2	173.2	176.5	60.8	0	0	0	111.7	W454 D458 L459 Q460 K464 A465 V466 I480 M484 V499 K502 L506	W454-L462 HydrophobicContact CH2-CD2 4.14Å; W454-L462 HydrophobicContact CZ3-CB 4.32Å; W454-L462 HydrophobicContact CZ3-CD2 3.77Å; D458-L462 VanDerWaalsContact O-CB 3.3Å; D458-L462 WeakPolarHBondContact O-CB 3.27Å; D458-L462 PolarHBondContact O-N 3.05Å; L459-L462 WeakPolarHBondContact O-CB 3.4Å; L459-L462 PolarHBondContact O-N 3.05Å; Q460-L462 VanDerWaalsContact C-N 3.33Å; Q460-L462 PolarHBondContact O-N 3.2Å; L462-K464 VanDerWaalsContact C-N 3.35Å; L462-K464 PolarHBondContact O-N 3.17Å; L462-A465 PolarHBondContact O-N 3.17Å; L462-V466 HydrophobicContact CD1-CG2 4.03Å; L462-V466 HydrophobicContact CG-CG2 4.46Å; L462-V466 WeakPolarHBondContact O-CB 3.48Å; L462-V466 VanDerWaalsContact O-CG2 3.24Å; L462-V466 WeakPolarHBondContact O-CG2 3.45Å; L462-V466 PolarHBondContact O-N 3.4Å; L462-I480 HydrophobicContact CD1-CG2 3.99Å; L462-M484 HydrophobicContact CB-CE 3.89Å; L462-M484 HydrophobicContact CB-SD 3.71Å; L462-M484 HydrophobicContact CD1-SD 3.65Å; L462-M484 HydrophobicContact CG-SD 4.24Å; L462-V499 HydrophobicContact CD1-CG1 3.58Å; L462-K502 HydrophobicContact CD2-CB 3.95Å; L462-K502 HydrophobicContact CD2-CG 3.87Å; L462-L506 HydrophobicContact CD2-CD1 3.92Å
463	I	82.6	Confident	77.7	Confident	60 Å²	60	58 Å²	58	31%	0.308	33%	0.334	S	S	.	.	H	α-helix	trans	-60.2	-46.9	178.5	-67.9	164.5	0	0	0	110.1	L459 Q460 A465 V466 N467 L506	L459-I463 VanDerWaalsContact O-CG1 3.29Å; L459-I463 WeakPolarHBondContact O-CG1 3.46Å; L459-I463 PolarHBondContact O-N 3.17Å; Q460-I463 PolarHBondContact O-N 3.39Å; I463-A465 VanDerWaalsContact C-N 3.35Å; I463-A465 PolarHBondContact O-N 3.48Å; I463-V466 PolarHBondContact O-N 3.02Å; I463-N467 PolarHBondContact O-N 3.21Å; I463-N467 VanDerWaalsContact O-N 3.16Å; I463-L506 HydrophobicContact CG1-CD1 4.49Å
464	K	81.9	Confident	77.7	Confident	133 Å²	133	58.6 Å²	58.6	58%	0.578	34%	0.338	S	S	*	.	H	α-helix	trans	-59.5	-44.6	176.1	-173	175.6	-177.2	177.1	0	111.7	Q460 L462 N467 L468	Q460-K464 WeakPolarHBondContact O-CB 3.41Å; Q460-K464 PolarHBondContact O-N 3.03Å; L462-K464 VanDerWaalsContact C-N 3.35Å; L462-K464 PolarHBondContact O-N 3.17Å; K464-N467 PolarHBondContact O-N 2.95Å; K464-L468 VanDerWaalsContact O-CB 3.31Å; K464-L468 WeakPolarHBondContact O-CB 3.5Å; K464-L468 PolarHBondContact O-N 3.44Å
465	A	83.1	Confident	77.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-67.3	-39.2	179.9	0	0	0	0	0	112.4	L461 L462 I463 N467 L468 F469 I480 Y483	L461-A465 WeakPolarHBondContact O-CB 3.4Å; L461-A465 PolarHBondContact O-N 2.79Å; L462-A465 PolarHBondContact O-N 3.17Å; I463-A465 VanDerWaalsContact C-N 3.35Å; I463-A465 PolarHBondContact O-N 3.48Å; A465-N467 VanDerWaalsContact C-N 3.29Å; A465-N467 PolarHBondContact O-N 3.1Å; A465-L468 PolarHBondContact O-N 2.98Å; A465-F469 WeakPolarHBondContact O-CD2 3.11Å; A465-F469 PolarHBondContact O-N 2.94Å; A465-I480 HydrophobicContact CB-CG1 4.47Å; A465-I480 HydrophobicContact CB-CG2 3.77Å; A465-Y483 HydrophobicContact CB-CD1 3.55Å; A465-Y483 HydrophobicContact CB-CE1 3.93Å; A465-Y483 HydrophobicContact CB-CG 4.44Å
466	V	84.1	Confident	77.9	Confident	34 Å²	34	59.8 Å²	59.8	21%	0.206	35%	0.345	C	S	.	.	H	α-helix	trans	-62.9	-36.7	176.4	170.4	0	0	0	0	111.7	L462 I463 F469 R476 W477 I480 A503	L462-V466 HydrophobicContact CD1-CG2 4.03Å; L462-V466 HydrophobicContact CG-CG2 4.46Å; L462-V466 WeakPolarHBondContact O-CB 3.48Å; L462-V466 VanDerWaalsContact O-CG2 3.24Å; L462-V466 WeakPolarHBondContact O-CG2 3.45Å; L462-V466 PolarHBondContact O-N 3.4Å; I463-V466 PolarHBondContact O-N 3.02Å; V466-F469 CarbonylContact O-C 3.49Å; V466-F469 VanDerWaalsContact O-O 3.08Å; V466-R476 PolarHBondContact O-NH2 3.17Å; V466-W477 HydrophobicContact CG2-CZ3 4.28Å; V466-I480 HydrophobicContact CG2-CD1 4.07Å; V466-A503 HydrophobicContact CG2-CB 4.46Å
467	N	76.9	Confident	78.5	Confident	124 Å²	124	59.4 Å²	59.4	66%	0.663	34%	0.341	S	S	*	.	H	α-helix	trans	-74.1	-38.9	175	-70.9	-16.9	0	0	0	112.4	I463 K464 A465 F469	I463-N467 PolarHBondContact O-N 3.21Å; I463-N467 VanDerWaalsContact O-N 3.16Å; K464-N467 PolarHBondContact O-N 2.95Å; A465-N467 VanDerWaalsContact C-N 3.29Å; A465-N467 PolarHBondContact O-N 3.1Å; N467-F469 VanDerWaalsContact C-N 3.28Å; N467-F469 PolarHBondContact O-N 3.02Å
468	L	78.8	Confident	79	Confident	68 Å²	68	59.7 Å²	59.7	36%	0.356	34%	0.339	S	S	.	.	H	α-helix	trans	-67.5	-29.4	178.7	-168.5	66.5	0	0	0	112.7	K464 A465 P470 Y483	K464-L468 VanDerWaalsContact O-CB 3.31Å; K464-L468 WeakPolarHBondContact O-CB 3.5Å; K464-L468 PolarHBondContact O-N 3.44Å; A465-L468 PolarHBondContact O-N 2.98Å; L468-P470 WeakPolarHBondContact O-CD 2.98Å; L468-Y483 HydrophobicContact CD2-CD2 4.4Å; L468-Y483 HydrophobicContact CD2-CE2 3.79Å
469	F	83	Confident	78.9	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	34%	0.34	C	S	.	.	S	Bend	trans	-121.5	84.6	-179.8	-57	-73.6	0	0	0	110.6	A465 V466 N467 R476 V479 I480 Y483 K606	A465-F469 WeakPolarHBondContact O-CD2 3.11Å; A465-F469 PolarHBondContact O-N 2.94Å; V466-F469 CarbonylContact O-C 3.49Å; V466-F469 VanDerWaalsContact O-O 3.08Å; N467-F469 VanDerWaalsContact C-N 3.28Å; N467-F469 PolarHBondContact O-N 3.02Å; F469-R476 PolarHBondContact O-NE 3.44Å; F469-R476 PolarHBondContact O-NH2 3.46Å; F469-V479 HydrophobicContact CD1-CG1 3.66Å; F469-V479 HydrophobicContact CD2-CG1 4.24Å; F469-V479 HydrophobicContact CE1-CG1 3.52Å; F469-V479 HydrophobicContact CE2-CG1 4.16Å; F469-V479 HydrophobicContact CG-CG1 4.03Å; F469-V479 HydrophobicContact CZ-CG1 3.81Å; F469-I480 HydrophobicContact CB-CD1 4.37Å; F469-I480 HydrophobicContact CB-CG1 4.03Å; F469-I480 HydrophobicContact CD2-CG1 3.99Å; F469-I480 HydrophobicContact CG-CG1 4.37Å; F469-Y483 HydrophobicContact CE2-CD1 4.5Å; F469-Y483 AromaticContact CE2-CD2 3.89Å; F469-Y483 HydrophobicContact CE2-CD2 3.89Å; F469-Y483 AromaticContact CE2-CG 3.86Å; F469-Y483 HydrophobicContact CE2-CG 3.86Å; F469-Y483 HydrophobicContact CZ-CD2 4.16Å; F469-K606 HydrophobicContact CE1-CG 4.06Å
470	P	77.7	Confident	78.9	Confident	72 Å²	72	58.4 Å²	58.4	47%	0.468	33%	0.333	S	S	.	.			trans	-72	172.5	-176.4	29	-35.3	0	0	0	113.8	L468 G472 T473 R476	L468-P470 WeakPolarHBondContact O-CD 2.98Å; P470-G472 PolarHBondContact O-N 2.89Å; P470-T473 PolarHBondContact O-N 3.46Å; P470-T473 PolarHBondContact O-OG1 2.9Å; P470-R476 VanDerWaalsContact C-CZ 3.46Å
471	A	62.8	Low	79.4	Confident	83 Å²	83	54.8 Å²	54.8	69%	0.686	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	131.9	176.7	0	0	0	0	0	110.3	R476	A471-R476 VanDerWaalsContact N-NH1 3.19Å
472	G	58.1	Low	79.3	Confident	82 Å²	82	56.3 Å²	56.3	85%	0.845	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.9	-9.4	-172.4	0	0	0	0	0	114.7	P470 N474	P470-G472 PolarHBondContact O-N 2.89Å; G472-N474 PolarHBondContact O-N 3.25Å
473	T	73.2	Confident	79.2	Confident	33 Å²	33	57.7 Å²	57.7	20%	0.202	33%	0.33	C	S	.	.			trans	-72.1	123.2	170.4	-50.9	0	0	0	0	110.1	P470 S475 R476	P470-T473 PolarHBondContact O-N 3.46Å; P470-T473 PolarHBondContact O-OG1 2.9Å; T473-S475 PolarHBondContact O-N 3.07Å; T473-R476 WeakPolarHBondContact O-CB 3.17Å; T473-R476 PolarHBondContact O-N 2.65Å; T473-R476 VanDerWaalsContact O-N 3.1Å
474	N	63.5	Low	79.5	Confident	151 Å²	151	54.9 Å²	54.9	81%	0.807	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	132.9	174	-78	-22.5	0	0	0	110.6	G472 R476	G472-N474 PolarHBondContact O-N 3.25Å; N474-R476 PolarHBondContact O-N 3.02Å
475	S	79.3	Confident	79.7	Confident	63 Å²	63	51.2 Å²	51.2	44%	0.441	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	35.6	-175.9	-74.5	0	0	0	0	114.2	T473 W477 E478 V479	T473-S475 PolarHBondContact O-N 3.07Å; S475-W477 VanDerWaalsContact C-N 3.27Å; S475-W477 PolarHBondContact O-N 3.2Å; S475-E478 WeakPolarHBondContact CB-OE2 3.44Å; S475-E478 WeakPolarHBondContact O-CB 3.29Å; S475-E478 PolarHBondContact O-N 3.25Å; S475-E478 PolarHBondContact OG-OE2 3.35Å; S475-V479 PolarHBondContact O-N 2.85Å
476	R	80.2	Confident	79.5	Confident	51 Å²	51	55.9 Å²	55.9	19%	0.192	33%	0.326	C	S	.	.	H	α-helix	trans	-39.2	-50.5	-176.5	-176.1	179.6	-174.7	-178.5	5	114.2	V466 F469 P470 A471 T473 N474 V479 I480	V466-R476 PolarHBondContact O-NH2 3.17Å; F469-R476 PolarHBondContact O-NE 3.44Å; F469-R476 PolarHBondContact O-NH2 3.46Å; P470-R476 VanDerWaalsContact C-CZ 3.46Å; A471-R476 VanDerWaalsContact N-NH1 3.19Å; T473-R476 WeakPolarHBondContact O-CB 3.17Å; T473-R476 PolarHBondContact O-N 2.65Å; T473-R476 VanDerWaalsContact O-N 3.1Å; N474-R476 PolarHBondContact O-N 3.02Å; R476-V479 PolarHBondContact O-N 2.75Å; R476-I480 HydrophobicContact CG-CD1 3.77Å; R476-I480 VanDerWaalsContact O-CG1 3.25Å; R476-I480 WeakPolarHBondContact O-CG1 3.12Å; R476-I480 PolarHBondContact O-N 2.99Å
477	W	88.3	Confident	79.3	Confident	72 Å²	72	58.9 Å²	58.9	27%	0.273	34%	0.337	S	S	.	.	H	α-helix	trans	-73.3	-27.7	-175.1	-59.2	114.6	0	0	0	113.5	V466 S475 I480 A481 A496 V499 I500 A503	V466-W477 HydrophobicContact CG2-CZ3 4.28Å; S475-W477 VanDerWaalsContact C-N 3.27Å; S475-W477 PolarHBondContact O-N 3.2Å; W477-I480 HydrophobicContact CE3-CD1 3.92Å; W477-I480 HydrophobicContact CZ3-CD1 3.98Å; W477-A481 VanDerWaalsContact O-CB 3.29Å; W477-A481 WeakPolarHBondContact O-CB 3.43Å; W477-A481 PolarHBondContact O-N 3.01Å; W477-A496 HydrophobicContact CB-CB 4.03Å; W477-V499 HydrophobicContact CE3-CG1 3.88Å; W477-V499 HydrophobicContact CZ3-CG1 4.29Å; W477-I500 HydrophobicContact CD2-CB 3.79Å; W477-I500 HydrophobicContact CD2-CD1 4.2Å; W477-I500 HydrophobicContact CD2-CG1 3.85Å; W477-I500 HydrophobicContact CE3-CB 4.07Å; W477-I500 HydrophobicContact CE3-CG1 4.38Å; W477-I500 HydrophobicContact CG-CB 4Å; W477-I500 HydrophobicContact CG-CD1 4.13Å; W477-I500 HydrophobicContact CG-CG1 4.2Å; W477-I500 HydrophobicContact CH2-CG1 4.41Å; W477-I500 HydrophobicContact CZ2-CD1 4.37Å; W477-I500 HydrophobicContact CZ2-CG1 3.89Å; W477-A503 HydrophobicContact CH2-CB 3.78Å; W477-A503 HydrophobicContact CZ3-CB 3.67Å
478	E	86.2	Confident	79.7	Confident	91 Å²	91	54.1 Å²	54.1	43%	0.425	31%	0.314	S	S	.	.	H	α-helix	trans	-72.4	-40.5	172.3	-56	-176.9	141.9	0	0	110.8	S475 A481 N482 A496	S475-E478 WeakPolarHBondContact CB-OE2 3.44Å; S475-E478 WeakPolarHBondContact O-CB 3.29Å; S475-E478 PolarHBondContact O-N 3.25Å; S475-E478 PolarHBondContact OG-OE2 3.35Å; E478-A481 PolarHBondContact O-N 3.24Å; E478-N482 WeakPolarHBondContact O-CB 3.34Å; E478-N482 PolarHBondContact O-N 3.16Å; E478-A496 HydrophobicContact CG-CB 3.95Å
479	V	82.8	Confident	79.5	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-63.5	-45.4	175.7	177.3	0	0	0	0	110.9	F469 S475 R476 N482 Y483 V613	F469-V479 HydrophobicContact CD1-CG1 3.66Å; F469-V479 HydrophobicContact CD2-CG1 4.24Å; F469-V479 HydrophobicContact CE1-CG1 3.52Å; F469-V479 HydrophobicContact CE2-CG1 4.16Å; F469-V479 HydrophobicContact CG-CG1 4.03Å; F469-V479 HydrophobicContact CZ-CG1 3.81Å; S475-V479 PolarHBondContact O-N 2.85Å; R476-V479 PolarHBondContact O-N 2.75Å; V479-N482 PolarHBondContact O-N 2.82Å; V479-Y483 WeakPolarHBondContact O-CB 3.46Å; V479-Y483 PolarHBondContact O-N 3.48Å; V479-V613 HydrophobicContact CG2-CG2 4.22Å
480	I	85.1	Confident	79	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.9	-43.6	177	-67.4	169	0	0	0	110.6	L462 A465 V466 F469 R476 W477 N482 Y483 M484 V499	L462-I480 HydrophobicContact CD1-CG2 3.99Å; A465-I480 HydrophobicContact CB-CG1 4.47Å; A465-I480 HydrophobicContact CB-CG2 3.77Å; V466-I480 HydrophobicContact CG2-CD1 4.07Å; F469-I480 HydrophobicContact CB-CD1 4.37Å; F469-I480 HydrophobicContact CB-CG1 4.03Å; F469-I480 HydrophobicContact CD2-CG1 3.99Å; F469-I480 HydrophobicContact CG-CG1 4.37Å; R476-I480 HydrophobicContact CG-CD1 3.77Å; R476-I480 VanDerWaalsContact O-CG1 3.25Å; R476-I480 WeakPolarHBondContact O-CG1 3.12Å; R476-I480 PolarHBondContact O-N 2.99Å; W477-I480 HydrophobicContact CE3-CD1 3.92Å; W477-I480 HydrophobicContact CZ3-CD1 3.98Å; I480-N482 PolarHBondContact O-N 3.49Å; I480-Y483 PolarHBondContact O-N 3.43Å; I480-M484 HydrophobicContact CG2-CG 4.41Å; I480-M484 WeakPolarHBondContact O-CB 3.45Å; I480-M484 VanDerWaalsContact O-CG 3.3Å; I480-M484 WeakPolarHBondContact O-CG 3.29Å; I480-M484 PolarHBondContact O-N 2.88Å; I480-V499 HydrophobicContact CB-CG1 4.01Å; I480-V499 HydrophobicContact CG2-CG1 3.33Å
481	A	87.6	Confident	78.7	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.033	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-42.8	177.1	0	0	0	0	0	112.7	W477 E478 M484 N485 V499	W477-A481 VanDerWaalsContact O-CB 3.29Å; W477-A481 WeakPolarHBondContact O-CB 3.43Å; W477-A481 PolarHBondContact O-N 3.01Å; E478-A481 PolarHBondContact O-N 3.24Å; A481-M484 PolarHBondContact O-N 3.14Å; A481-N485 WeakPolarHBondContact O-CB 3.49Å; A481-N485 PolarHBondContact O-N 3.48Å; A481-N485 PolarHBondContact O-ND2 3.19Å; A481-N485 VanDerWaalsContact O-ND2 3.12Å; A481-V499 HydrophobicContact CB-CG2 3.83Å
482	N	84.1	Confident	79.4	Confident	56 Å²	56	56 Å²	56	30%	0.299	34%	0.339	S	S	.	.	H	α-helix	trans	-65	-44.5	175.5	-79	-11.6	0	0	0	112.2	E478 V479 I480 M484 N485 I486 V613	E478-N482 WeakPolarHBondContact O-CB 3.34Å; E478-N482 PolarHBondContact O-N 3.16Å; V479-N482 PolarHBondContact O-N 2.82Å; I480-N482 PolarHBondContact O-N 3.49Å; N482-M484 VanDerWaalsContact C-N 3.3Å; N482-M484 PolarHBondContact O-N 3.4Å; N482-N485 PolarHBondContact O-N 3.12Å; N482-I486 WeakPolarHBondContact O-CD1 3.05Å; N482-I486 VanDerWaalsContact O-CG1 3.28Å; N482-I486 WeakPolarHBondContact O-CG1 3.38Å; N482-I486 PolarHBondContact O-N 3.22Å; N482-V613 WeakPolarHBondContact ND2-CG2 3.33Å
483	Y	84.7	Confident	80.5	Confident	31 Å²	31	60.9 Å²	60.9	12%	0.122	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-45.1	174.8	-179.8	-89.6	0	0	0	111.1	L461 A465 L468 F469 V479 I480 N485 I486 H487	L461-Y483 HydrophobicContact CD1-CD1 4.42Å; L461-Y483 HydrophobicContact CD1-CE1 3.69Å; L461-Y483 HydrophobicContact CG-CE1 4.39Å; A465-Y483 HydrophobicContact CB-CD1 3.55Å; A465-Y483 HydrophobicContact CB-CE1 3.93Å; A465-Y483 HydrophobicContact CB-CG 4.44Å; L468-Y483 HydrophobicContact CD2-CD2 4.4Å; L468-Y483 HydrophobicContact CD2-CE2 3.79Å; F469-Y483 HydrophobicContact CE2-CD1 4.5Å; F469-Y483 AromaticContact CE2-CD2 3.89Å; F469-Y483 HydrophobicContact CE2-CD2 3.89Å; F469-Y483 AromaticContact CE2-CG 3.86Å; F469-Y483 HydrophobicContact CE2-CG 3.86Å; F469-Y483 HydrophobicContact CZ-CD2 4.16Å; V479-Y483 WeakPolarHBondContact O-CB 3.46Å; V479-Y483 PolarHBondContact O-N 3.48Å; I480-Y483 PolarHBondContact O-N 3.43Å; Y483-N485 PolarHBondContact O-N 3.08Å; Y483-I486 PolarHBondContact O-N 3.07Å; Y483-H487 AromaticContact CD2-CD2 3.57Å; Y483-H487 AromaticContact CD2-NE2 3.87Å; Y483-H487 AromaticContact CE2-CD2 3.44Å; Y483-H487 VanDerWaalsContact CE2-CD2 3.44Å; Y483-H487 WeakPolarHBondContact CE2-CD2 3.4Å; Y483-H487 AromaticContact CE2-NE2 3.57Å; Y483-H487 AromaticContact CG-CD2 3.94Å; Y483-H487 AromaticContact CZ-CD2 3.69Å; Y483-H487 WeakPolarHBondContact O-CB 3.33Å; Y483-H487 PolarHBondContact O-CD2 3.01Å; Y483-H487 PolarHBondContact O-N 2.92Å; Y483-H487 VanDerWaalsContact O-N 3.09Å
484	M	88.2	Confident	81	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.8	-42.6	174.9	-73.3	-161.3	72.2	0	0	112.7	W454 D458 L461 L462 I480 A481 N482 I486 H487 S488 V499	W454-M484 HydrophobicContact CH2-CE 4.44Å; W454-M484 HydrophobicContact CH2-SD 4.4Å; W454-M484 HydrophobicContact CZ3-CE 3.71Å; W454-M484 HydrophobicContact CZ3-SD 4.13Å; D458-M484 HydrophobicContact CB-CE 4.25Å; D458-M484 WeakPolarHBondContact O-CE 3.42Å; L461-M484 HydrophobicContact CB-CE 4.42Å; L461-M484 HydrophobicContact CD2-CB 4.5Å; L461-M484 HydrophobicContact CG-CG 4.42Å; L462-M484 HydrophobicContact CB-CE 3.89Å; L462-M484 HydrophobicContact CB-SD 3.71Å; L462-M484 HydrophobicContact CD1-SD 3.65Å; L462-M484 HydrophobicContact CG-SD 4.24Å; I480-M484 HydrophobicContact CG2-CG 4.41Å; I480-M484 WeakPolarHBondContact O-CB 3.45Å; I480-M484 VanDerWaalsContact O-CG 3.3Å; I480-M484 WeakPolarHBondContact O-CG 3.29Å; I480-M484 PolarHBondContact O-N 2.88Å; A481-M484 PolarHBondContact O-N 3.14Å; N482-M484 VanDerWaalsContact C-N 3.3Å; N482-M484 PolarHBondContact O-N 3.4Å; M484-I486 VanDerWaalsContact C-N 3.26Å; M484-I486 PolarHBondContact O-N 3.29Å; M484-H487 PolarHBondContact O-N 3.21Å; M484-S488 WeakPolarHBondContact O-CA 3.4Å; M484-S488 WeakPolarHBondContact O-CB 3.32Å; M484-S488 PolarHBondContact O-N 3.15Å; M484-V499 HydrophobicContact SD-CG2 4.04Å
485	N	86.2	Confident	82.1	Confident	57 Å²	57	56.2 Å²	56.2	31%	0.305	31%	0.313	S	S	.	.	H	α-helix	trans	-67.6	-24.9	179.7	-70.7	-28.8	0	0	0	113.8	A481 N482 Y483 K493 R494	A481-N485 WeakPolarHBondContact O-CB 3.49Å; A481-N485 PolarHBondContact O-N 3.48Å; A481-N485 PolarHBondContact O-ND2 3.19Å; A481-N485 VanDerWaalsContact O-ND2 3.12Å; N482-N485 PolarHBondContact O-N 3.12Å; Y483-N485 PolarHBondContact O-N 3.08Å; N485-K493 WeakPolarHBondContact OD1-CA 3.32Å; N485-R494 PolarHBondContact ND2-O 3.14Å; N485-R494 PolarHBondContact OD1-N 2.81Å
486	I	80	Confident	82.4	Confident	98 Å²	98	54.6 Å²	54.6	50%	0.503	30%	0.304	S	S	.	.	H	α-helix	trans	-82.1	-37.3	176.9	-68.1	164.9	0	0	0	110.9	N482 Y483 M484	N482-I486 WeakPolarHBondContact O-CD1 3.05Å; N482-I486 VanDerWaalsContact O-CG1 3.28Å; N482-I486 WeakPolarHBondContact O-CG1 3.38Å; N482-I486 PolarHBondContact O-N 3.22Å; Y483-I486 PolarHBondContact O-N 3.07Å; M484-I486 VanDerWaalsContact C-N 3.26Å; M484-I486 PolarHBondContact O-N 3.29Å
487	H	79.1	Confident	82.5	Confident	96 Å²	96	60.4 Å²	60.4	44%	0.444	33%	0.331	S	S	.	.	H	α-helix	trans	-105.5	-7	-169.7	-67.9	-70	0	0	0	114.4	L461 Y483 M484	L461-H487 HydrophobicContact CD1-CB 3.78Å; L461-H487 VanDerWaalsContact CD2-C 3.46Å; L461-H487 HydrophobicContact CD2-CB 3.79Å; L461-H487 HydrophobicContact CG-CB 4.38Å; Y483-H487 AromaticContact CD2-CD2 3.57Å; Y483-H487 AromaticContact CD2-NE2 3.87Å; Y483-H487 AromaticContact CE2-CD2 3.44Å; Y483-H487 VanDerWaalsContact CE2-CD2 3.44Å; Y483-H487 WeakPolarHBondContact CE2-CD2 3.4Å; Y483-H487 AromaticContact CE2-NE2 3.57Å; Y483-H487 AromaticContact CG-CD2 3.94Å; Y483-H487 AromaticContact CZ-CD2 3.69Å; Y483-H487 WeakPolarHBondContact O-CB 3.33Å; Y483-H487 PolarHBondContact O-CD2 3.01Å; Y483-H487 PolarHBondContact O-N 2.92Å; Y483-H487 VanDerWaalsContact O-N 3.09Å; M484-H487 PolarHBondContact O-N 3.21Å
488	S	84.3	Confident	82.3	Confident	25 Å²	25	60.3 Å²	60.3	18%	0.175	34%	0.335	C	S	.	.			trans	-79	133.4	176.4	174.3	0	0	0	0	111	D458 M484 S490	D458-S488 WeakPolarHBondContact OD1-CB 3.28Å; D458-S488 PolarHBondContact OD1-OG 2.82Å; M484-S488 WeakPolarHBondContact O-CA 3.4Å; M484-S488 WeakPolarHBondContact O-CB 3.32Å; M484-S488 PolarHBondContact O-N 3.15Å; S488-S490 PolarHBondContact OG-N 2.62Å; S488-S490 VanDerWaalsContact OG-N 3.07Å; S488-S490 PolarHBondContact OG-OG 3.08Å
489	S	75.7	Confident	82.2	Confident	100 Å²	100	56 Å²	56	70%	0.699	32%	0.315	S	S	*	.	S	Bend	trans	-86.3	-4.8	170.7	50.7	0	0	0	0	113	G491	S489-G491 VanDerWaalsContact C-N 3.26Å; S489-G491 PolarHBondContact O-N 3.47Å
490	S	73.1	Confident	82.3	Confident	41 Å²	41	57.9 Å²	57.9	29%	0.287	32%	0.324	S	S	.	.	S	Bend	trans	-76.9	-11.4	-173.7	76.2	0	0	0	0	113.8	D458 S488 V492	D458-S490 PolarHBondContact OD1-OG 3.44Å; D458-S490 WeakPolarHBondContact OD2-CB 3.37Å; D458-S490 PolarHBondContact OD2-OG 3.12Å; S488-S490 PolarHBondContact OG-N 2.62Å; S488-S490 VanDerWaalsContact OG-N 3.07Å; S488-S490 PolarHBondContact OG-OG 3.08Å; S490-V492 PolarHBondContact O-N 3Å; S490-V492 VanDerWaalsContact O-N 3.07Å
491	G	70.4	Confident	82.2	Confident	75 Å²	75	59.8 Å²	59.8	77%	0.773	34%	0.344	S	S	*	.			trans	68.3	-0	-178.2	0	0	0	0	0	114.4	S489	S489-G491 VanDerWaalsContact C-N 3.26Å; S489-G491 PolarHBondContact O-N 3.47Å
492	V	78.1	Confident	82.1	Confident	47 Å²	47	62.3 Å²	62.3	29%	0.285	35%	0.354	S	S	.	.			trans	-91.2	114.8	-179.3	-177	0	0	0	0	110	S490 R494	S490-V492 PolarHBondContact O-N 3Å; S490-V492 VanDerWaalsContact O-N 3.07Å; V492-R494 PolarHBondContact O-N 3.47Å
493	K	80.5	Confident	82	Confident	184 Å²	184	60.3 Å²	60.3	80%	0.8	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-69.2	121.7	173.4	-65.6	-170.9	179.5	-178.9	0	110.9	N485	N485-K493 WeakPolarHBondContact OD1-CA 3.32Å
494	R	84.5	Confident	81.8	Confident	11 Å²	11	64.5 Å²	64.5	4%	0.042	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-98.7	137.6	176.7	-53.7	-59.1	-178	174.7	0.3	110.9	K452 N453 W454 D458 N485 V492 V499	K452-R494 PolarHBondContact O-NH1 3.1Å; N453-R494 PolarHBondContact O-NH2 2.83Å; W454-R494 HydrophobicContact CH2-CG 4.49Å; D458-R494 IonicContact OD2-CZ 2.69Å; D458-R494 IonicContact OD2-NE 3.71Å; D458-R494 IonicContact OD2-NH2 2.75Å; D458-R494 PolarHBondContact OD2-NH2 3.17Å; N485-R494 PolarHBondContact ND2-O 3.14Å; N485-R494 PolarHBondContact OD1-N 2.81Å; V492-R494 PolarHBondContact O-N 3.47Å; R494-V499 HydrophobicContact CB-CG2 4.02Å
495	T	87	Confident	81.4	Confident	76 Å²	76	67.3 Å²	67.3	47%	0.466	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-95.2	163.9	172.1	70.7	0	0	0	0	111.1	K497 D498 V499	T495-K497 PolarHBondContact O-N 3.09Å; T495-K497 VanDerWaalsContact O-N 3.14Å; T495-K497 PolarHBondContact OG1-N 2.92Å; T495-D498 WeakPolarHBondContact CB-OD2 3.4Å; T495-D498 PolarHBondContact N-OD2 2.84Å; T495-D498 PolarHBondContact O-N 3.26Å; T495-D498 PolarHBondContact OG1-N 3.4Å; T495-D498 PolarHBondContact OG1-OD2 3.08Å; T495-V499 WeakPolarHBondContact O-CG2 3.39Å; T495-V499 PolarHBondContact O-N 2.87Å; T495-V499 VanDerWaalsContact O-N 3.09Å
496	A	84.4	Confident	80.8	Confident	29 Å²	29	66.2 Å²	66.2	24%	0.24	38%	0.378	C	S	.	.	H	α-helix	trans	-54.8	-31.9	174.1	0	0	0	0	0	112.7	W477 E478 I500	W477-A496 HydrophobicContact CB-CB 4.03Å; E478-A496 HydrophobicContact CG-CB 3.95Å; A496-I500 WeakPolarHBondContact O-CB 3.17Å; A496-I500 WeakPolarHBondContact O-CG2 3.35Å; A496-I500 PolarHBondContact O-N 3.48Å
497	K	81.6	Confident	80.1	Confident	173 Å²	173	68.5 Å²	68.5	75%	0.752	39%	0.387	S	S	*	.	H	α-helix	trans	-70.7	-37.2	177.7	-166	178.6	-179.1	-179.8	0	112.4	T495 I500 G501	T495-K497 PolarHBondContact O-N 3.09Å; T495-K497 VanDerWaalsContact O-N 3.14Å; T495-K497 PolarHBondContact OG1-N 2.92Å; K497-I500 VanDerWaalsContact O-CG2 3.31Å; K497-I500 WeakPolarHBondContact O-CG2 3.14Å; K497-G501 PolarHBondContact O-N 3.5Å; K497-G501 VanDerWaalsContact O-N 3.14Å
498	D	84.1	Confident	79.7	Confident	69 Å²	69	72.9 Å²	72.9	37%	0.369	41%	0.405	S	S	.	.	H	α-helix	trans	-69.9	-44.2	177.4	-54	-45.4	0	0	0	110.8	W454 T495 G501 K502	W454-D498 HydrophobicContact CZ2-CB 4.31Å; T495-D498 WeakPolarHBondContact CB-OD2 3.4Å; T495-D498 PolarHBondContact N-OD2 2.84Å; T495-D498 PolarHBondContact O-N 3.26Å; T495-D498 PolarHBondContact OG1-N 3.4Å; T495-D498 PolarHBondContact OG1-OD2 3.08Å; D498-G501 PolarHBondContact O-N 3.01Å; D498-K502 WeakPolarHBondContact O-CB 3.46Å; D498-K502 PolarHBondContact O-N 3.13Å
499	V	85.7	Confident	78.5	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-64.8	-48.1	-179.5	170.9	0	0	0	0	111.6	W454 L462 W477 I480 A481 M484 R494 T495 G501 K502 A503	W454-V499 HydrophobicContact CH2-CG2 4.36Å; L462-V499 HydrophobicContact CD1-CG1 3.58Å; W477-V499 HydrophobicContact CE3-CG1 3.88Å; W477-V499 HydrophobicContact CZ3-CG1 4.29Å; I480-V499 HydrophobicContact CB-CG1 4.01Å; I480-V499 HydrophobicContact CG2-CG1 3.33Å; A481-V499 HydrophobicContact CB-CG2 3.83Å; M484-V499 HydrophobicContact SD-CG2 4.04Å; R494-V499 HydrophobicContact CB-CG2 4.02Å; T495-V499 WeakPolarHBondContact O-CG2 3.39Å; T495-V499 PolarHBondContact O-N 2.87Å; T495-V499 VanDerWaalsContact O-N 3.09Å; V499-G501 VanDerWaalsContact C-N 3.33Å; V499-G501 PolarHBondContact O-N 2.95Å; V499-K502 PolarHBondContact O-N 3.46Å; V499-A503 VanDerWaalsContact O-CB 3.27Å; V499-A503 WeakPolarHBondContact O-CB 3.46Å; V499-A503 PolarHBondContact O-N 3.43Å
500	I	84.8	Confident	77.5	Confident	43 Å²	43	74.9 Å²	74.9	22%	0.221	41%	0.405	C	S	.	.	H	α-helix	trans	-65.1	-38.9	177.5	-168	176.7	0	0	0	111.5	W477 A496 K497 K504	W477-I500 HydrophobicContact CD2-CB 3.79Å; W477-I500 HydrophobicContact CD2-CD1 4.2Å; W477-I500 HydrophobicContact CD2-CG1 3.85Å; W477-I500 HydrophobicContact CE3-CB 4.07Å; W477-I500 HydrophobicContact CE3-CG1 4.38Å; W477-I500 HydrophobicContact CG-CB 4Å; W477-I500 HydrophobicContact CG-CD1 4.13Å; W477-I500 HydrophobicContact CG-CG1 4.2Å; W477-I500 HydrophobicContact CH2-CG1 4.41Å; W477-I500 HydrophobicContact CZ2-CD1 4.37Å; W477-I500 HydrophobicContact CZ2-CG1 3.89Å; A496-I500 WeakPolarHBondContact O-CB 3.17Å; A496-I500 WeakPolarHBondContact O-CG2 3.35Å; A496-I500 PolarHBondContact O-N 3.48Å; K497-I500 VanDerWaalsContact O-CG2 3.31Å; K497-I500 WeakPolarHBondContact O-CG2 3.14Å; I500-K504 HydrophobicContact CG1-CD 4.23Å; I500-K504 HydrophobicContact CG1-CG 4.47Å; I500-K504 WeakPolarHBondContact O-CB 3.32Å; I500-K504 WeakPolarHBondContact O-CG 3.35Å; I500-K504 PolarHBondContact O-N 3.14Å
501	G	82.6	Confident	76.6	Confident	40 Å²	40	77 Å²	77	41%	0.412	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-46.1	177.2	0	0	0	0	0	111.5	K497 D498 V499 S505	K497-G501 PolarHBondContact O-N 3.5Å; K497-G501 VanDerWaalsContact O-N 3.14Å; D498-G501 PolarHBondContact O-N 3.01Å; V499-G501 VanDerWaalsContact C-N 3.33Å; V499-G501 PolarHBondContact O-N 2.95Å; G501-S505 WeakPolarHBondContact O-CB 3.46Å; G501-S505 PolarHBondContact O-N 2.79Å
502	K	84.3	Confident	76	Confident	57 Å²	57	80.5 Å²	80.5	25%	0.248	41%	0.414	C	S	.	.	H	α-helix	trans	-71.4	-40.4	178.8	-164.7	66.7	171.7	174.8	0	112.8	W454 L459 L462 D498 V499 K504 S505 L506	W454-K502 HydrophobicContact CD2-CB 4.28Å; W454-K502 HydrophobicContact CD2-CD 4.02Å; W454-K502 HydrophobicContact CD2-CG 3.68Å; W454-K502 HydrophobicContact CE3-CG 3.93Å; W454-K502 HydrophobicContact CG-CD 4.03Å; W454-K502 HydrophobicContact CG-CG 4.22Å; W454-K502 HydrophobicContact CH2-CB 3.78Å; W454-K502 HydrophobicContact CH2-CG 4.08Å; W454-K502 HydrophobicContact CZ2-CB 3.46Å; W454-K502 VanDerWaalsContact CZ2-CB 3.46Å; W454-K502 HydrophobicContact CZ2-CG 3.83Å; W454-K502 HydrophobicContact CZ3-CB 4.29Å; W454-K502 HydrophobicContact CZ3-CG 4.09Å; L459-K502 HydrophobicContact CD2-CD 4.49Å; L459-K502 VanDerWaalsContact CD2-CE 3.45Å; L459-K502 HydrophobicContact CD2-CG 4.23Å; L462-K502 HydrophobicContact CD2-CB 3.95Å; L462-K502 HydrophobicContact CD2-CG 3.87Å; D498-K502 WeakPolarHBondContact O-CB 3.46Å; D498-K502 PolarHBondContact O-N 3.13Å; V499-K502 PolarHBondContact O-N 3.46Å; K502-K504 PolarHBondContact O-N 3.15Å; K502-S505 WeakPolarHBondContact O-CB 3.25Å; K502-S505 PolarHBondContact O-N 3.17Å; K502-L506 WeakPolarHBondContact O-CG 3.07Å; K502-L506 PolarHBondContact O-N 2.71Å
503	A	83.2	Confident	74.8	Confident	14 Å²	14	83 Å²	83	12%	0.116	42%	0.422	C	S	.	.	H	α-helix	trans	-61.4	-42.2	176.2	0	0	0	0	0	112.1	V466 W477 V499 L506 Q507	V466-A503 HydrophobicContact CG2-CB 4.46Å; W477-A503 HydrophobicContact CH2-CB 3.78Å; W477-A503 HydrophobicContact CZ3-CB 3.67Å; V499-A503 VanDerWaalsContact O-CB 3.27Å; V499-A503 WeakPolarHBondContact O-CB 3.46Å; V499-A503 PolarHBondContact O-N 3.43Å; A503-L506 PolarHBondContact O-N 3Å; A503-Q507 WeakPolarHBondContact O-CB 3.49Å; A503-Q507 PolarHBondContact O-N 2.71Å
504	K	80.4	Confident	73.5	Confident	120 Å²	120	77.5 Å²	77.5	52%	0.522	40%	0.398	S	S	.	.	H	α-helix	trans	-66	-36.7	174	-74.1	179.7	176.6	-177	0	112.5	I500 K502 Q507 K508	I500-K504 HydrophobicContact CG1-CD 4.23Å; I500-K504 HydrophobicContact CG1-CG 4.47Å; I500-K504 WeakPolarHBondContact O-CB 3.32Å; I500-K504 WeakPolarHBondContact O-CG 3.35Å; I500-K504 PolarHBondContact O-N 3.14Å; K502-K504 PolarHBondContact O-N 3.15Å; K504-Q507 PolarHBondContact O-N 3.26Å; K504-K508 WeakPolarHBondContact O-CG 3.47Å; K504-K508 PolarHBondContact O-N 3.01Å
505	S	79.4	Confident	72.2	Confident	59 Å²	59	81.8 Å²	81.8	41%	0.413	42%	0.422	S	S	.	.	H	α-helix	trans	-63.8	-41.6	173.7	170.8	0	0	0	0	112	G501 K502 Q507 K508	G501-S505 WeakPolarHBondContact O-CB 3.46Å; G501-S505 PolarHBondContact O-N 2.79Å; K502-S505 WeakPolarHBondContact O-CB 3.25Å; K502-S505 PolarHBondContact O-N 3.17Å; S505-Q507 VanDerWaalsContact C-N 3.33Å; S505-K508 PolarHBondContact O-N 2.84Å
506	L	73.6	Confident	70.9	Confident	33 Å²	33	82 Å²	82	17%	0.173	42%	0.42	C	S	.	.	H	α-helix	trans	-68.7	-32.7	175.5	-69.9	172.2	0	0	0	111.9	L459 L462 I463 K502 A503 K508 L509 K514	L459-L506 HydrophobicContact CD2-CD1 4.22Å; L462-L506 HydrophobicContact CD2-CD1 3.92Å; I463-L506 HydrophobicContact CG1-CD1 4.49Å; K502-L506 WeakPolarHBondContact O-CG 3.07Å; K502-L506 PolarHBondContact O-N 2.71Å; A503-L506 PolarHBondContact O-N 3Å; L506-K508 VanDerWaalsContact C-N 3.27Å; L506-K508 PolarHBondContact O-N 3.36Å; L506-L509 HydrophobicContact CD2-CD1 4.02Å; L506-L509 PolarHBondContact O-N 3.4Å; L506-K514 WeakPolarHBondContact O-CE 3.49Å; L506-K514 PolarHBondContact O-NZ 3.48Å
507	Q	66.3	Low	69.5	Low	147 Å²	147	83.7 Å²	83.7	69%	0.687	43%	0.425	S	S	*	.	H	α-helix	trans	-65.5	-30.1	177.7	-160.3	171.6	7.3	0	0	112.6	A503 K504 S505 L509 K514	A503-Q507 WeakPolarHBondContact O-CB 3.49Å; A503-Q507 PolarHBondContact O-N 2.71Å; K504-Q507 PolarHBondContact O-N 3.26Å; S505-Q507 VanDerWaalsContact C-N 3.33Å; Q507-L509 VanDerWaalsContact C-N 3.3Å; Q507-L509 PolarHBondContact O-N 3.4Å; Q507-K514 PolarHBondContact O-NZ 3.42Å
508	K	70.4	Confident	68.1	Low	188 Å²	188	79.2 Å²	79.2	82%	0.817	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-7.5	176.8	-71.3	-178.2	177.7	-170.9	0	115.1	K504 S505 L506	K504-K508 WeakPolarHBondContact O-CG 3.47Å; K504-K508 PolarHBondContact O-N 3.01Å; S505-K508 PolarHBondContact O-N 2.84Å; L506-K508 VanDerWaalsContact C-N 3.27Å; L506-K508 PolarHBondContact O-N 3.36Å
509	L	57.9	Low	67.3	Low	60 Å²	60	82.4 Å²	82.4	31%	0.314	42%	0.42	S	S	.	.	S	Bend	trans	-80.4	141.4	174.3	-64.9	168.9	0	0	0	110.7	L506 Q507 K514	L506-L509 HydrophobicContact CD2-CD1 4.02Å; L506-L509 PolarHBondContact O-N 3.4Å; Q507-L509 VanDerWaalsContact C-N 3.3Å; Q507-L509 PolarHBondContact O-N 3.4Å; L509-K514 VanDerWaalsContact O-CE 3.23Å; L509-K514 WeakPolarHBondContact O-CE 3.45Å; L509-K514 PolarHBondContact O-NZ 3.37Å
510	D	55.1	Low	66.4	Low	107 Å²	107	89.8 Å²	89.8	57%	0.572	45%	0.452	S	S	*	.			trans	-55	137.7	-180	-141	-40.1	0	0	0	110.6	H512 Q513 K514	D510-H512 PolarHBondContact O-N 2.86Å; D510-H512 VanDerWaalsContact O-N 3.14Å; D510-Q513 HydrophobicContact CB-CG 4.19Å; D510-Q513 WeakPolarHBondContact O-CB 3.49Å; D510-Q513 PolarHBondContact O-N 2.96Å; D510-K514 PolarHBondContact O-N 2.87Å
511	P	55	Low	64.6	Low	86 Å²	86	88.5 Å²	88.5	56%	0.558	45%	0.448	S	S	*	.	H	α-helix	trans	-51.9	-36.7	-177.8	-30.6	38.2	0	0	0	114.4	Q513 K514 D515	P511-Q513 VanDerWaalsContact C-N 3.3Å; P511-Q513 PolarHBondContact O-N 3.32Å; P511-K514 PolarHBondContact O-N 3.03Å; P511-D515 PolarHBondContact O-N 3.47Å
512	H	57.4	Low	63	Low	147 Å²	147	92.4 Å²	92.4	68%	0.681	45%	0.454	S	S	*	.	H	α-helix	trans	-63.6	-32.4	177	-116.6	-68.4	0	0	0	113.5	D510 D516	D510-H512 PolarHBondContact O-N 2.86Å; D510-H512 VanDerWaalsContact O-N 3.14Å; H512-D516 PolarHBondContact O-N 3.44Å
513	Q	53	Low	61.8	Low	99 Å²	99	93.9 Å²	93.9	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-76.2	-27.7	178.2	-66	178.4	-21.1	0	0	112.1	D510 P511 I517	D510-Q513 HydrophobicContact CB-CG 4.19Å; D510-Q513 WeakPolarHBondContact O-CB 3.49Å; D510-Q513 PolarHBondContact O-N 2.96Å; P511-Q513 VanDerWaalsContact C-N 3.3Å; P511-Q513 PolarHBondContact O-N 3.32Å; Q513-I517 VanDerWaalsContact O-CD1 3.31Å; Q513-I517 WeakPolarHBondContact O-CD1 3.39Å; Q513-I517 WeakPolarHBondContact O-CG1 3.43Å; Q513-I517 PolarHBondContact O-N 3.36Å; Q513-I517 VanDerWaalsContact O-N 3.16Å
514	K	53.8	Low	60.3	Low	69 Å²	69	98.5 Å²	98.5	30%	0.3	48%	0.482	S	S	.	.	H	α-helix	trans	-69.6	-37.6	175	-68.9	173.1	178.8	141.1	0	111.5	L506 Q507 L509 D510 P511 N518	L506-K514 WeakPolarHBondContact O-CE 3.49Å; L506-K514 PolarHBondContact O-NZ 3.48Å; Q507-K514 PolarHBondContact O-NZ 3.42Å; L509-K514 VanDerWaalsContact O-CE 3.23Å; L509-K514 WeakPolarHBondContact O-CE 3.45Å; L509-K514 PolarHBondContact O-NZ 3.37Å; D510-K514 PolarHBondContact O-N 2.87Å; P511-K514 PolarHBondContact O-N 3.03Å; K514-N518 PolarHBondContact O-N 3.13Å; K514-N518 VanDerWaalsContact O-N 3.13Å; K514-N518 PolarHBondContact O-ND2 2.89Å
515	D	56.9	Low	58.6	Low	102 Å²	102	98.9 Å²	98.9	55%	0.545	48%	0.484	S	S	.	.	H	α-helix	trans	-71.2	-38.1	176.9	-67.9	-23	0	0	0	111.9	P511 I517 N518 K519	P511-D515 PolarHBondContact O-N 3.47Å; D515-I517 PolarHBondContact O-N 3.21Å; D515-N518 PolarHBondContact O-N 3.23Å; D515-K519 VanDerWaalsContact O-CB 3.3Å; D515-K519 WeakPolarHBondContact O-CB 3.44Å; D515-K519 PolarHBondContact O-N 2.76Å
516	D	59.9	Low	57.4	Low	80 Å²	80	102.7 Å²	102.7	43%	0.428	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-35.1	175.2	-80.3	-18.5	0	0	0	113.2	H512 K520	H512-D516 PolarHBondContact O-N 3.44Å; D516-K520 WeakPolarHBondContact O-CB 3.14Å; D516-K520 VanDerWaalsContact O-CG 3.32Å; D516-K520 WeakPolarHBondContact O-CG 3.38Å; D516-K520 PolarHBondContact O-N 2.97Å
517	I	54.5	Low	56.5	Low	65 Å²	65	109.7 Å²	109.7	33%	0.333	52%	0.522	S	S	.	.	H	α-helix	trans	-68.7	-44.7	174.6	-68.1	163.9	0	0	0	110.1	Q513 D515 K519 K520 A521	Q513-I517 VanDerWaalsContact O-CD1 3.31Å; Q513-I517 WeakPolarHBondContact O-CD1 3.39Å; Q513-I517 WeakPolarHBondContact O-CG1 3.43Å; Q513-I517 PolarHBondContact O-N 3.36Å; Q513-I517 VanDerWaalsContact O-N 3.16Å; D515-I517 PolarHBondContact O-N 3.21Å; I517-K519 VanDerWaalsContact C-N 3.32Å; I517-K519 PolarHBondContact O-N 3.42Å; I517-K520 PolarHBondContact O-N 2.95Å; I517-A521 WeakPolarHBondContact O-CB 3.36Å; I517-A521 PolarHBondContact O-N 2.94Å
518	N	52.3	Low	55.5	Low	78 Å²	78	109 Å²	109	42%	0.417	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-36.3	175.7	-74.6	-26.6	0	0	0	112.5	K514 D515 F522	K514-N518 PolarHBondContact O-N 3.13Å; K514-N518 VanDerWaalsContact O-N 3.13Å; K514-N518 PolarHBondContact O-ND2 2.89Å; D515-N518 PolarHBondContact O-N 3.23Å; N518-F522 PolarHBondContact O-N 3.07Å; N518-F522 VanDerWaalsContact O-N 3.12Å
519	K	67.2	Low	54.3	Low	136 Å²	136	107.3 Å²	107.3	59%	0.591	51%	0.513	S	S	*	.	H	α-helix	trans	-71	-46.1	178.4	-168.6	175.3	-179.3	-179.1	0	112.2	D515 I517 A521 F522 D523	D515-K519 VanDerWaalsContact O-CB 3.3Å; D515-K519 WeakPolarHBondContact O-CB 3.44Å; D515-K519 PolarHBondContact O-N 2.76Å; I517-K519 VanDerWaalsContact C-N 3.32Å; I517-K519 PolarHBondContact O-N 3.42Å; K519-A521 VanDerWaalsContact C-N 3.27Å; K519-A521 PolarHBondContact O-N 2.79Å; K519-F522 PolarHBondContact O-N 3.03Å; K519-F522 VanDerWaalsContact O-N 3.17Å; K519-D523 PolarHBondContact O-N 3.48Å
520	K	66.5	Low	53.4	Low	155 Å²	155	107.1 Å²	107.1	67%	0.674	53%	0.526	S	S	*	.	H	α-helix	trans	-62.9	-34	176.2	-75.7	174.3	-179.6	171.9	0	112.5	D516 I517 K524	D516-K520 WeakPolarHBondContact O-CB 3.14Å; D516-K520 VanDerWaalsContact O-CG 3.32Å; D516-K520 WeakPolarHBondContact O-CG 3.38Å; D516-K520 PolarHBondContact O-N 2.97Å; I517-K520 PolarHBondContact O-N 2.95Å; K520-K524 PolarHBondContact O-N 2.92Å
521	A	47.3	Very low	52.3	Low	17 Å²	17	108.2 Å²	108.2	14%	0.14	54%	0.536	C	S	.	.	H	α-helix	trans	-66.4	-42.4	172.7	0	0	0	0	0	113.1	I517 K519 K524 F525	I517-A521 WeakPolarHBondContact O-CB 3.36Å; I517-A521 PolarHBondContact O-N 2.94Å; K519-A521 VanDerWaalsContact C-N 3.27Å; K519-A521 PolarHBondContact O-N 2.79Å; A521-K524 PolarHBondContact O-N 3.31Å; A521-F525 PolarHBondContact O-N 3.2Å; A521-F525 VanDerWaalsContact O-N 3.12Å
522	F	47.9	Very low	51.2	Low	122 Å²	122	110.5 Å²	110.5	54%	0.535	55%	0.548	S	S	.	.	H	α-helix	trans	-66.2	-38.9	177.9	-168.6	-99.8	0	0	0	112.5	N518 K519 F525 K526	N518-F522 PolarHBondContact O-N 3.07Å; N518-F522 VanDerWaalsContact O-N 3.12Å; K519-F522 PolarHBondContact O-N 3.03Å; K519-F522 VanDerWaalsContact O-N 3.17Å; F522-F525 PolarHBondContact O-N 3.19Å; F522-K526 HydrophobicContact CE1-CD 4.16Å; F522-K526 PolarHBondContact O-N 2.81Å; F522-K526 VanDerWaalsContact O-N 3.08Å
523	D	59	Low	50.2	Low	87 Å²	87	109 Å²	109	47%	0.465	55%	0.551	S	S	.	*	H	α-helix	trans	-68.1	-34.5	176.9	-71.5	-25.7	0	0	0	112.1	K519 K527	K519-D523 PolarHBondContact O-N 3.48Å; D523-K527 WeakPolarHBondContact O-CB 3.22Å; D523-K527 PolarHBondContact O-N 3.39Å; D523-K527 VanDerWaalsContact O-N 3.15Å
524	K	52.2	Low	49.2	Very low	112 Å²	112	113.7 Å²	113.7	49%	0.487	57%	0.573	S	S	.	*	H	α-helix	trans	-68.1	-40.1	174.6	-163.2	-176.7	177.7	-144.3	0	112	K520 A521 K527 E528	K520-K524 PolarHBondContact O-N 2.92Å; A521-K524 PolarHBondContact O-N 3.31Å; K524-K527 PolarHBondContact O-N 3.42Å; K524-E528 VanDerWaalsContact CE-OE1 3.23Å; K524-E528 WeakPolarHBondContact CE-OE1 3.46Å; K524-E528 IonicContact NZ-OE1 3.85Å; K524-E528 PolarHBondContact O-N 3.05Å
525	F	44.7	Very low	48.1	Very low	128 Å²	128	114.7 Å²	114.7	56%	0.561	59%	0.594	S	S	*	*	H	α-helix	trans	-63.9	-40.3	175.1	-177.3	-97.6	0	0	0	112.7	A521 F522 K527 H529	A521-F525 PolarHBondContact O-N 3.2Å; A521-F525 VanDerWaalsContact O-N 3.12Å; F522-F525 PolarHBondContact O-N 3.19Å; F525-K527 VanDerWaalsContact C-N 3.28Å; F525-K527 PolarHBondContact O-N 2.78Å; F525-H529 AromaticContact CE2-CD2 3.74Å; F525-H529 AromaticContact CZ-CD2 3.98Å; F525-H529 PolarHBondContact O-N 3.14Å
526	K	54.9	Low	46.8	Very low	138 Å²	138	117.5 Å²	117.5	60%	0.6	61%	0.609	S	S	*	*	H	α-helix	trans	-63	-34.2	172.6	-89.5	-171.9	172.7	-179.1	0	112.8	F522 G530	F522-K526 HydrophobicContact CE1-CD 4.16Å; F522-K526 PolarHBondContact O-N 2.81Å; F522-K526 VanDerWaalsContact O-N 3.08Å; K526-G530 PolarHBondContact O-N 2.81Å
527	K	54.2	Low	45.5	Very low	181 Å²	181	121.2 Å²	121.2	79%	0.787	63%	0.629	S	S	*	*	H	α-helix	trans	-77.7	-31.3	-177	-153.5	174.8	-173.7	177.4	0	113.2	D523 K524 F525	D523-K527 WeakPolarHBondContact O-CB 3.22Å; D523-K527 PolarHBondContact O-N 3.39Å; D523-K527 VanDerWaalsContact O-N 3.15Å; K524-K527 PolarHBondContact O-N 3.42Å; F525-K527 VanDerWaalsContact C-N 3.28Å; F525-K527 PolarHBondContact O-N 2.78Å
528	E	44.4	Very low	44.1	Very low	132 Å²	132	123.2 Å²	123.2	62%	0.617	66%	0.655	S	S	*	*	H	α-helix	trans	-84.4	-17.9	179.9	-73.4	178.2	-179.1	0	0	113.7	K524	K524-E528 VanDerWaalsContact CE-OE1 3.23Å; K524-E528 WeakPolarHBondContact CE-OE1 3.46Å; K524-E528 IonicContact NZ-OE1 3.85Å; K524-E528 PolarHBondContact O-N 3.05Å
529	H	46.1	Very low	43.2	Very low	152 Å²	152	124 Å²	124	70%	0.704	67%	0.673	S	S	*	*	S	Bend	trans	-114.8	7.6	178	-80.7	-55.8	0	0	0	115.5	F525	F525-H529 AromaticContact CE2-CD2 3.74Å; F525-H529 AromaticContact CZ-CD2 3.98Å; F525-H529 PolarHBondContact O-N 3.14Å
530	G	38.4	Very low	41.8	Very low	56 Å²	56	123.5 Å²	123.5	58%	0.577	68%	0.683	S	S	*	*			trans	-104.5	86.2	176.4	0	0	0	0	0	112.6	K526	K526-G530 PolarHBondContact O-N 2.81Å
531	V	31.7	Very low	40	Very low	130 Å²	130	122 Å²	122	79%	0.788	69%	0.693	S	S	*	*			trans	-126.2	111	164.8	-177.5	0	0	0	0	109.1
532	V	32.4	Very low	39.4	Very low	134 Å²	134	130.2 Å²	130.2	81%	0.812	73%	0.728	S	S	*	*			trans	-131.6	135.2	153.7	-173.8	0	0	0	0	107.3
533	P	36.8	Very low	38.4	Very low	116 Å²	116	136.1 Å²	136.1	75%	0.753	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-73.5	155.9	-178.5	-9.2	26.2	0	0	0	113
534	Q	32.2	Very low	36.9	Very low	198 Å²	198	141.9 Å²	141.9	93%	0.925	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-71	148.6	-177.8	-155.1	170.7	-0.7	0	0	112.5
535	A	31.6	Very low	36	Very low	89 Å²	89	145.6 Å²	145.6	74%	0.736	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-80.7	157.9	-171.6	0	0	0	0	0	114.7
536	D	29.2	Very low	35.3	Very low	161 Å²	161	142.6 Å²	142.6	86%	0.861	79%	0.793	S	S	*	*			trans	-137.5	151.3	152.3	-104	-27.9	0	0	0	111.9
537	N	31.1	Very low	34.8	Very low	158 Å²	158	142.5 Å²	142.5	85%	0.845	81%	0.806	S	S	*	*			trans	-81.1	144.4	-155.9	-71.1	-88.1	0	0	0	116.6
538	A	27	Very low	33.7	Very low	107 Å²	107	144.2 Å²	144.2	88%	0.884	81%	0.809	S	S	*	*			trans	176.7	139.7	132.7	0	0	0	0	0	111.5
539	A	31.8	Very low	33.5	Very low	95 Å²	95	146.7 Å²	146.7	79%	0.785	82%	0.823	S	S	*	*			trans	-107.9	179.3	175.6	0	0	0	0	0	110.7
540	P	38.7	Very low	33.2	Very low	125 Å²	125	145.9 Å²	145.9	81%	0.812	82%	0.824	S	S	*	*			cis	-132.3	158.9	-20.7	36.3	-19.4	0	0	0	113.9
541	S	27.7	Very low	33.7	Very low	125 Å²	125	152 Å²	152	87%	0.874	84%	0.835	S	S	*	*			trans	-170.6	138.2	143.5	-158.6	0	0	0	0	112.7
542	E	34.8	Very low	35.5	Very low	188 Å²	188	149.3 Å²	149.3	88%	0.879	82%	0.819	S	S	*	*			trans	-70.5	132.7	-174	-59.2	175.2	149.4	0	0	113.7
543	R	28.5	Very low	37.8	Very low	246 Å²	246	148.3 Å²	148.3	93%	0.928	82%	0.815	S	S	*	*			trans	-167.8	111.1	138.2	-131	171	-178.4	168.8	1	114.5
544	F	27.8	Very low	40.1	Very low	208 Å²	208	145.5 Å²	145.5	91%	0.912	79%	0.79	S	S	*	*			trans	52.8	114	145.6	-148.6	-100.4	0	0	0	120.1
545	E	31.9	Very low	42.9	Very low	190 Å²	190	139.5 Å²	139.5	89%	0.888	77%	0.766	S	S	*	*			trans	-60.1	142.8	177.6	-64.1	-179.5	152.6	0	0	114.9
546	G	30.4	Very low	45.4	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	77%	0.769	S	S	*	*			trans	-148.7	124	155.8	0	0	0	0	0	108.6
547	P	43.9	Very low	48.2	Very low	136 Å²	136	141.1 Å²	141.1	88%	0.883	76%	0.762	S	S	*	*			trans	-79.9	142.6	-163.9	29	-33	0	0	0	113.9
548	Y	31.9	Very low	51.1	Low	217 Å²	217	135.1 Å²	135.1	85%	0.851	73%	0.73	S	S	*	*			trans	-48.4	154.2	171	-110.6	-117.6	0	0	0	114.3	D550	Y548-D550 PolarHBondContact O-N 3.25Å
549	M	39.3	Very low	54.1	Low	183 Å²	183	131.3 Å²	131.3	90%	0.901	69%	0.693	S	S	*	*			trans	-69.3	112.2	171.1	-68.6	-121.8	153.4	0	0	111
550	D	41.1	Very low	57	Low	135 Å²	135	133.8 Å²	133.8	72%	0.722	69%	0.687	S	S	*	*			trans	-80.5	116.4	175.2	-80.8	-33.7	0	0	0	112.2	Y548 T552	Y548-D550 PolarHBondContact O-N 3.25Å; D550-T552 HydrophobicContact CB-CG2 4.24Å; D550-T552 PolarHBondContact O-N 3.49Å
551	F	47.4	Very low	59.5	Low	184 Å²	184	131.2 Å²	131.2	81%	0.807	67%	0.665	S	S	*	*			trans	-88.5	79	157.7	-98.7	-91.6	0	0	0	108.9	P553	F551-P553 WeakPolarHBondContact O-CD 3.39Å
552	T	71.3	Confident	62.7	Low	75 Å²	75	125.2 Å²	125.2	46%	0.46	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-84.7	120	171.4	42.6	0	0	0	0	110.5	D550 R587	D550-T552 HydrophobicContact CB-CG2 4.24Å; D550-T552 PolarHBondContact O-N 3.49Å; T552-R587 PolarHBondContact O-NH1 3.33Å; T552-R587 PolarHBondContact O-NH2 2.88Å; T552-R587 PolarHBondContact OG1-NH1 3.4Å
553	P	79.1	Confident	65.4	Low	113 Å²	113	120.4 Å²	120.4	73%	0.734	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-62	143.9	176.1	-21.4	33	0	0	0	112.3	F551 T555 R587	F551-P553 WeakPolarHBondContact O-CD 3.39Å; P553-T555 PolarHBondContact O-N 3.1Å; P553-R587 VanDerWaalsContact C-NH2 3.3Å; P553-R587 PolarHBondContact O-NH2 2.89Å
554	W	86	Confident	68.5	Low	57 Å²	57	114.1 Å²	114.1	22%	0.216	58%	0.582	C	S	.	*	P	Polyproline II helix	trans	-68.8	126.2	177.7	-79.3	79.1	0	0	0	111.4	E558 L562 V584 R587 D591 R595	W554-E558 HydrophobicContact CE3-CB 3.7Å; W554-E558 HydrophobicContact CZ3-CB 3.95Å; W554-L562 HydrophobicContact CH2-CB 4.31Å; W554-L562 HydrophobicContact CH2-CD1 4.4Å; W554-L562 HydrophobicContact CH2-CD2 3.71Å; W554-L562 HydrophobicContact CH2-CG 4.35Å; W554-L562 HydrophobicContact CZ2-CD2 4.29Å; W554-L562 HydrophobicContact CZ3-CB 3.91Å; W554-L562 HydrophobicContact CZ3-CD2 3.84Å; W554-L562 HydrophobicContact CZ3-CG 4.38Å; W554-V584 HydrophobicContact CH2-CG1 4.34Å; W554-V584 HydrophobicContact CZ3-CG1 4.06Å; W554-R587 HydrophobicContact CH2-CB 4.16Å; W554-R587 HydrophobicContact CH2-CG 3.81Å; W554-R587 HydrophobicContact CZ2-CG 4.17Å; W554-R587 HydrophobicContact CZ3-CG 4.1Å; W554-D591 HydrophobicContact CZ2-CB 4.32Å; W554-R595 HydrophobicContact CD2-CB 4.47Å; W554-R595 HydrophobicContact CD2-CG 3.91Å; W554-R595 HydrophobicContact CE3-CG 4.44Å; W554-R595 HydrophobicContact CG-CG 4.34Å; W554-R595 HydrophobicContact CH2-CB 4.3Å; W554-R595 HydrophobicContact CH2-CG 4.38Å; W554-R595 HydrophobicContact CZ2-CB 3.52Å; W554-R595 HydrophobicContact CZ2-CG 3.82Å
555	T	90.1	Very high	71.7	Confident	71 Å²	71	104.3 Å²	104.3	44%	0.436	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-80.3	161.2	171.7	74.5	0	0	0	0	111.1	P553 E557 E558 Q559	P553-T555 PolarHBondContact O-N 3.1Å; T555-E557 PolarHBondContact O-N 3.23Å; T555-E558 PolarHBondContact N-OE2 2.86Å; T555-E558 PolarHBondContact O-N 3.48Å; T555-E558 VanDerWaalsContact OG1-CG 3.27Å; T555-E558 WeakPolarHBondContact OG1-CG 3.42Å; T555-E558 PolarHBondContact OG1-N 2.95Å; T555-E558 PolarHBondContact OG1-OE2 2.9Å; T555-Q559 WeakPolarHBondContact O-CB 3.33Å; T555-Q559 PolarHBondContact O-N 3.22Å
556	T	85.3	Confident	74.6	Confident	128 Å²	128	96.6 Å²	96.6	79%	0.785	50%	0.504	S	S	*	.	H	α-helix	trans	-60	-34.5	176.9	-49.9	0	0	0	0	112.2	K560	T556-K560 WeakPolarHBondContact O-CB 3.5Å; T556-K560 PolarHBondContact O-N 3.48Å; T556-K560 VanDerWaalsContact O-N 3.08Å
557	E	87.8	Confident	77.5	Confident	156 Å²	156	101.7 Å²	101.7	73%	0.729	51%	0.508	S	S	*	.	H	α-helix	trans	-72	-47.5	179.7	-64.4	-179	175.9	0	0	111.5	T555 Q559 K560 L561	T555-E557 PolarHBondContact O-N 3.23Å; E557-Q559 VanDerWaalsContact C-N 3.3Å; E557-Q559 PolarHBondContact O-N 3.08Å; E557-K560 PolarHBondContact O-N 3.1Å; E557-L561 WeakPolarHBondContact O-CG 3.47Å; E557-L561 PolarHBondContact O-N 3.35Å
558	E	90.8	Very high	79.8	Confident	33 Å²	33	99.3 Å²	99.3	15%	0.154	49%	0.491	C	S	.	.	H	α-helix	trans	-59.5	-41.5	174.8	-68.5	173.5	134.1	0	0	111.6	W554 T555 K560 L561 L562 V584 R587	W554-E558 HydrophobicContact CE3-CB 3.7Å; W554-E558 HydrophobicContact CZ3-CB 3.95Å; T555-E558 PolarHBondContact N-OE2 2.86Å; T555-E558 PolarHBondContact O-N 3.48Å; T555-E558 VanDerWaalsContact OG1-CG 3.27Å; T555-E558 WeakPolarHBondContact OG1-CG 3.42Å; T555-E558 PolarHBondContact OG1-N 2.95Å; T555-E558 PolarHBondContact OG1-OE2 2.9Å; E558-K560 PolarHBondContact O-N 2.85Å; E558-L561 PolarHBondContact O-N 3.46Å; E558-L562 WeakPolarHBondContact O-CB 3.06Å; E558-L562 PolarHBondContact O-N 2.88Å; E558-V584 HydrophobicContact CB-CG1 4.35Å; E558-R587 IonicContact OE1-CZ 2.72Å; E558-R587 IonicContact OE1-NE 3.78Å; E558-R587 PolarHBondContact OE1-NE 2.8Å; E558-R587 IonicContact OE1-NH2 2.64Å; E558-R587 PolarHBondContact OE1-NH2 3.38Å; E558-R587 IonicContact OE2-CZ 2.95Å; E558-R587 IonicContact OE2-NE 3.77Å; E558-R587 PolarHBondContact OE2-NE 3.33Å; E558-R587 IonicContact OE2-NH2 2.69Å; E558-R587 PolarHBondContact OE2-NH2 3.41Å
559	Q	90.7	Very high	82.8	Confident	26 Å²	26	92.1 Å²	92.1	12%	0.121	46%	0.463	C	S	.	.	H	α-helix	trans	-63.2	-41.5	177.3	179.8	66.5	38.5	0	0	111.4	T555 E557 L562 E563	T555-Q559 WeakPolarHBondContact O-CB 3.33Å; T555-Q559 PolarHBondContact O-N 3.22Å; E557-Q559 VanDerWaalsContact C-N 3.3Å; E557-Q559 PolarHBondContact O-N 3.08Å; Q559-L562 PolarHBondContact O-N 2.98Å; Q559-E563 PolarHBondContact NE2-OE1 3.37Å; Q559-E563 WeakPolarHBondContact O-CG 3.47Å; Q559-E563 PolarHBondContact O-N 3.44Å
560	K	91.8	Very high	85.2	Confident	148 Å²	148	86.9 Å²	86.9	64%	0.643	44%	0.442	S	S	*	.	H	α-helix	trans	-65.2	-41.2	177	-171.7	-179.2	178.5	-174.5	0	111.6	T556 E557 E558 E563 Q564	T556-K560 WeakPolarHBondContact O-CB 3.5Å; T556-K560 PolarHBondContact O-N 3.48Å; T556-K560 VanDerWaalsContact O-N 3.08Å; E557-K560 PolarHBondContact O-N 3.1Å; E558-K560 PolarHBondContact O-N 2.85Å; K560-E563 PolarHBondContact O-N 2.83Å; K560-Q564 WeakPolarHBondContact O-CB 3.31Å; K560-Q564 PolarHBondContact O-N 3.23Å
561	L	93	Very high	87.4	Confident	70 Å²	70	85.5 Å²	85.5	37%	0.366	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-43.5	175.1	-70.9	173.3	0	0	0	111.6	E557 E558 E563 Q564 A565 V584	E557-L561 WeakPolarHBondContact O-CG 3.47Å; E557-L561 PolarHBondContact O-N 3.35Å; E558-L561 PolarHBondContact O-N 3.46Å; L561-E563 PolarHBondContact O-N 3.26Å; L561-Q564 PolarHBondContact O-N 3.19Å; L561-A565 VanDerWaalsContact O-CB 3.3Å; L561-A565 WeakPolarHBondContact O-CB 3.26Å; L561-A565 PolarHBondContact O-N 2.85Å; L561-V584 HydrophobicContact CB-CG2 4.09Å
562	L	93.4	Very high	89.3	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-60.4	-45.7	175.6	179.3	67.1	0	0	0	111.6	W554 E558 Q559 A565 L566 I580 V584 C592 R595 L599	W554-L562 HydrophobicContact CH2-CB 4.31Å; W554-L562 HydrophobicContact CH2-CD1 4.4Å; W554-L562 HydrophobicContact CH2-CD2 3.71Å; W554-L562 HydrophobicContact CH2-CG 4.35Å; W554-L562 HydrophobicContact CZ2-CD2 4.29Å; W554-L562 HydrophobicContact CZ3-CB 3.91Å; W554-L562 HydrophobicContact CZ3-CD2 3.84Å; W554-L562 HydrophobicContact CZ3-CG 4.38Å; E558-L562 WeakPolarHBondContact O-CB 3.06Å; E558-L562 PolarHBondContact O-N 2.88Å; Q559-L562 PolarHBondContact O-N 2.98Å; L562-A565 PolarHBondContact O-N 3.47Å; L562-L566 HydrophobicContact CD1-CD1 4.26Å; L562-L566 HydrophobicContact CD1-CG 4.38Å; L562-L566 HydrophobicContact CG-CD1 3.95Å; L562-L566 HydrophobicContact CG-CG 4.5Å; L562-L566 WeakPolarHBondContact O-CB 3.07Å; L562-L566 WeakPolarHBondContact O-CD1 3.27Å; L562-L566 WeakPolarHBondContact O-CG 3.37Å; L562-L566 PolarHBondContact O-N 3.33Å; L562-I580 HydrophobicContact CD1-CG2 3.68Å; L562-V584 HydrophobicContact CB-CG2 4.1Å; L562-V584 HydrophobicContact CD1-CG2 4.42Å; L562-C592 HydrophobicContact CD1-CB 3.87Å; L562-R595 HydrophobicContact CD2-CB 3.88Å; L562-R595 HydrophobicContact CD2-CG 3.56Å; L562-L599 HydrophobicContact CD2-CD1 4.33Å
563	E	93	Very high	90.1	Very high	86 Å²	86	82 Å²	82	40%	0.402	43%	0.427	S	S	.	.	H	α-helix	trans	-65.1	-38.2	178.2	-74.3	176.4	-165.2	0	0	112.7	Q559 K560 L561 K567	Q559-E563 PolarHBondContact NE2-OE1 3.37Å; Q559-E563 WeakPolarHBondContact O-CG 3.47Å; Q559-E563 PolarHBondContact O-N 3.44Å; K560-E563 PolarHBondContact O-N 2.83Å; L561-E563 PolarHBondContact O-N 3.26Å; E563-K567 WeakPolarHBondContact O-CG 3.35Å; E563-K567 PolarHBondContact O-N 2.83Å
564	Q	93.7	Very high	90.5	Very high	114 Å²	114	81.3 Å²	81.3	53%	0.533	42%	0.422	S	S	.	.	H	α-helix	trans	-65.5	-47.8	173.9	-175.9	174.2	-8.7	0	0	110.8	K560 L561 L566 K567 T568	K560-Q564 WeakPolarHBondContact O-CB 3.31Å; K560-Q564 PolarHBondContact O-N 3.23Å; L561-Q564 PolarHBondContact O-N 3.19Å; Q564-L566 VanDerWaalsContact C-N 3.31Å; Q564-L566 PolarHBondContact O-N 3.4Å; Q564-K567 WeakPolarHBondContact O-CB 3.41Å; Q564-K567 PolarHBondContact O-N 3.47Å; Q564-K567 VanDerWaalsContact O-N 3.1Å; Q564-T568 PolarHBondContact O-N 3.05Å; Q564-T568 PolarHBondContact O-OG1 3.48Å
565	A	93.9	Very high	90.7	Very high	3 Å²	3	84.9 Å²	84.9	3%	0.025	44%	0.441	C	S	.	.	H	α-helix	trans	-60.6	-39.1	177.7	0	0	0	0	0	112.3	L561 L562 K567 T568 Y569 I580 A583	L561-A565 VanDerWaalsContact O-CB 3.3Å; L561-A565 WeakPolarHBondContact O-CB 3.26Å; L561-A565 PolarHBondContact O-N 2.85Å; L562-A565 PolarHBondContact O-N 3.47Å; A565-K567 VanDerWaalsContact C-N 3.29Å; A565-K567 PolarHBondContact O-N 2.98Å; A565-T568 PolarHBondContact O-N 3.28Å; A565-Y569 HydrophobicContact CB-CD2 4.41Å; A565-Y569 VanDerWaalsContact O-CD2 3.26Å; A565-Y569 WeakPolarHBondContact O-CD2 3.3Å; A565-Y569 PolarHBondContact O-N 3.32Å; A565-I580 HydrophobicContact CB-CB 4.43Å; A565-I580 HydrophobicContact CB-CG1 4.25Å; A565-I580 HydrophobicContact CB-CG2 4.16Å; A565-A583 HydrophobicContact CB-CB 3.75Å
566	L	92.9	Very high	90.8	Very high	27 Å²	27	82.9 Å²	82.9	14%	0.141	43%	0.426	C	S	.	.	H	α-helix	trans	-65.7	-29.5	176.1	-76.3	167.3	0	0	0	113.4	L562 Q564 W577 I580 Y596	L562-L566 HydrophobicContact CD1-CD1 4.26Å; L562-L566 HydrophobicContact CD1-CG 4.38Å; L562-L566 HydrophobicContact CG-CD1 3.95Å; L562-L566 HydrophobicContact CG-CG 4.5Å; L562-L566 WeakPolarHBondContact O-CB 3.07Å; L562-L566 WeakPolarHBondContact O-CD1 3.27Å; L562-L566 WeakPolarHBondContact O-CG 3.37Å; L562-L566 PolarHBondContact O-N 3.33Å; Q564-L566 VanDerWaalsContact C-N 3.31Å; Q564-L566 PolarHBondContact O-N 3.4Å; L566-W577 HydrophobicContact CD2-CH2 4.13Å; L566-W577 HydrophobicContact CD2-CZ3 4.22Å; L566-I580 HydrophobicContact CD2-CD1 3.73Å; L566-I580 HydrophobicContact CG-CD1 4.47Å; L566-Y596 HydrophobicContact CD1-CD2 3.74Å; L566-Y596 HydrophobicContact CD1-CE2 4.41Å; L566-Y596 HydrophobicContact CD2-CD2 3.59Å; L566-Y596 HydrophobicContact CD2-CE2 3.9Å; L566-Y596 HydrophobicContact CD2-CG 4.4Å; L566-Y596 HydrophobicContact CG-CD2 4.35Å
567	K	92.2	Very high	91.2	Very high	174 Å²	174	79.4 Å²	79.4	76%	0.757	40%	0.398	S	S	*	.	H	α-helix	trans	-76.9	-41.4	172.9	-72	173.9	-175.8	174.4	0	111.6	E563 Q564 A565	E563-K567 WeakPolarHBondContact O-CG 3.35Å; E563-K567 PolarHBondContact O-N 2.83Å; Q564-K567 WeakPolarHBondContact O-CB 3.41Å; Q564-K567 PolarHBondContact O-N 3.47Å; Q564-K567 VanDerWaalsContact O-N 3.1Å; A565-K567 VanDerWaalsContact C-N 3.29Å; A565-K567 PolarHBondContact O-N 2.98Å
568	T	92.1	Very high	91.5	Very high	85 Å²	85	76.2 Å²	76.2	52%	0.521	38%	0.383	S	S	.	.	H	α-helix	trans	-68.3	-36.9	-179.8	-54.2	0	0	0	0	112.2	Q564 A565 P570	Q564-T568 PolarHBondContact O-N 3.05Å; Q564-T568 PolarHBondContact O-OG1 3.48Å; A565-T568 PolarHBondContact O-N 3.28Å; T568-P570 WeakPolarHBondContact O-CD 3.26Å
569	Y	93.6	Very high	91.6	Very high	66 Å²	66	78.1 Å²	78.1	26%	0.259	39%	0.391	S	S	.	.	S	Bend	trans	-111.7	89.3	-178.6	-54.3	-61.4	0	0	0	111.1	A565 T573 R576 K579 I580	A565-Y569 HydrophobicContact CB-CD2 4.41Å; A565-Y569 VanDerWaalsContact O-CD2 3.26Å; A565-Y569 WeakPolarHBondContact O-CD2 3.3Å; A565-Y569 PolarHBondContact O-N 3.32Å; Y569-T573 HydrophobicContact CD1-CG2 4.18Å; Y569-R576 PolarHBondContact O-NE 2.89Å; Y569-R576 PolarHBondContact O-NH2 3.23Å; Y569-K579 HydrophobicContact CD1-CB 4.16Å; Y569-K579 HydrophobicContact CD1-CD 4.19Å; Y569-K579 HydrophobicContact CD2-CB 4.03Å; Y569-K579 HydrophobicContact CE1-CB 3.99Å; Y569-K579 HydrophobicContact CE1-CD 4.01Å; Y569-K579 HydrophobicContact CE2-CB 3.85Å; Y569-K579 WeakPolarHBondContact CE2-O 2.96Å; Y569-K579 HydrophobicContact CG-CB 4.17Å; Y569-I580 HydrophobicContact CD2-CG1 3.89Å; Y569-I580 HydrophobicContact CG-CG1 4.48Å
570	P	89.4	Confident	91.7	Very high	73 Å²	73	76.9 Å²	76.9	47%	0.474	39%	0.385	S	S	.	.			trans	-67.2	172.4	177.8	27.3	-35.2	0	0	0	113	T568 N572 T573 R576	T568-P570 WeakPolarHBondContact O-CD 3.26Å; P570-N572 PolarHBondContact O-N 2.78Å; P570-N572 VanDerWaalsContact O-N 3.09Å; P570-T573 WeakPolarHBondContact CD-OG1 3.32Å; P570-T573 WeakPolarHBondContact O-CB 3.42Å; P570-T573 PolarHBondContact O-N 2.91Å; P570-T573 VanDerWaalsContact O-N 3.08Å; P570-T573 PolarHBondContact O-OG1 3.14Å; P570-T573 VanDerWaalsContact O-OG1 3.1Å; P570-R576 WeakPolarHBondContact O-CD 3.24Å; P570-R576 PolarHBondContact O-NE 2.66Å
571	V	87.3	Confident	91.8	Very high	107 Å²	107	70.7 Å²	70.7	65%	0.648	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-29.9	-172.6	-178.5	0	0	0	0	113.3	T573	V571-T573 VanDerWaalsContact C-N 3.3Å; V571-T573 PolarHBondContact O-N 3.29Å
572	N	87.8	Confident	91.8	Very high	154 Å²	154	75 Å²	75	82%	0.824	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	1.3	-176.2	-61	-10.3	0	0	0	113.7	P570 P574	P570-N572 PolarHBondContact O-N 2.78Å; P570-N572 VanDerWaalsContact O-N 3.09Å; N572-P574 WeakPolarHBondContact O-CD 2.86Å
573	T	88.8	Confident	91.7	Very high	31 Å²	31	76.8 Å²	76.8	19%	0.19	39%	0.394	C	S	.	.	S	Bend	trans	-73.7	124	-179.9	-57.5	0	0	0	0	110.6	Y569 P570 V571 E575 R576 K579	Y569-T573 HydrophobicContact CD1-CG2 4.18Å; P570-T573 WeakPolarHBondContact CD-OG1 3.32Å; P570-T573 WeakPolarHBondContact O-CB 3.42Å; P570-T573 PolarHBondContact O-N 2.91Å; P570-T573 VanDerWaalsContact O-N 3.08Å; P570-T573 PolarHBondContact O-OG1 3.14Å; P570-T573 VanDerWaalsContact O-OG1 3.1Å; V571-T573 VanDerWaalsContact C-N 3.3Å; V571-T573 PolarHBondContact O-N 3.29Å; T573-E575 PolarHBondContact O-N 3.31Å; T573-R576 WeakPolarHBondContact O-CB 3.25Å; T573-R576 PolarHBondContact O-N 3.49Å; T573-K579 HydrophobicContact CG2-CD 4.16Å
574	P	86.8	Confident	91.7	Very high	98 Å²	98	72.7 Å²	72.7	64%	0.636	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	138.5	171	-21.8	32.8	0	0	0	110.6	N572 R576	N572-P574 WeakPolarHBondContact O-CD 2.86Å; P574-R576 PolarHBondContact O-N 3Å; P574-R576 VanDerWaalsContact O-N 3.13Å
575	E	90.1	Very high	91.4	Very high	133 Å²	133	72 Å²	72	62%	0.621	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	28.2	-179	-64.2	170.3	178.6	0	0	113.6	T573 W577 E578 K579	T573-E575 PolarHBondContact O-N 3.31Å; E575-W577 PolarHBondContact O-N 2.98Å; E575-E578 HydrophobicContact CB-CB 4.4Å; E575-E578 WeakPolarHBondContact O-CB 3.5Å; E575-E578 PolarHBondContact O-N 3.01Å; E575-K579 PolarHBondContact O-N 3.18Å
576	R	93.6	Very high	90.9	Very high	29 Å²	29	75.4 Å²	75.4	11%	0.109	42%	0.416	C	S	.	.	H	α-helix	trans	-39.9	-48.8	-177.4	-179.4	179.9	-171.8	-155.2	-0.6	114.1	Y569 P570 T573 P574 K579 I580	Y569-R576 PolarHBondContact O-NE 2.89Å; Y569-R576 PolarHBondContact O-NH2 3.23Å; P570-R576 WeakPolarHBondContact O-CD 3.24Å; P570-R576 PolarHBondContact O-NE 2.66Å; T573-R576 WeakPolarHBondContact O-CB 3.25Å; T573-R576 PolarHBondContact O-N 3.49Å; P574-R576 PolarHBondContact O-N 3Å; P574-R576 VanDerWaalsContact O-N 3.13Å; R576-K579 PolarHBondContact O-N 3.22Å; R576-I580 HydrophobicContact CG-CD1 3.64Å; R576-I580 HydrophobicContact CG-CG1 4.46Å; R576-I580 WeakPolarHBondContact O-CB 3.21Å; R576-I580 WeakPolarHBondContact O-CD1 3.28Å; R576-I580 WeakPolarHBondContact O-CG1 3.46Å; R576-I580 PolarHBondContact O-N 2.9Å
577	W	93.8	Very high	90.7	Very high	54 Å²	54	75 Å²	75	21%	0.205	41%	0.413	C	S	.	.	H	α-helix	trans	-74.4	-25.1	-174.2	-70.7	116.2	0	0	0	113.9	L566 E575 I580 A581 K589 M593 Y596	L566-W577 HydrophobicContact CD2-CH2 4.13Å; L566-W577 HydrophobicContact CD2-CZ3 4.22Å; E575-W577 PolarHBondContact O-N 2.98Å; W577-I580 HydrophobicContact CD2-CD1 4.4Å; W577-I580 HydrophobicContact CE3-CB 4.42Å; W577-I580 HydrophobicContact CE3-CD1 3.81Å; W577-I580 HydrophobicContact CE3-CG2 4.39Å; W577-I580 HydrophobicContact CZ3-CD1 3.89Å; W577-I580 HydrophobicContact CZ3-CG2 4.44Å; W577-A581 WeakPolarHBondContact O-CB 3.19Å; W577-A581 PolarHBondContact O-N 3.45Å; W577-A581 VanDerWaalsContact O-N 3.13Å; W577-K589 HydrophobicContact CB-CD 4.21Å; W577-K589 HydrophobicContact CB-CG 3.75Å; W577-M593 HydrophobicContact CB-CG 4.43Å; W577-M593 HydrophobicContact CB-SD 4.43Å; W577-M593 HydrophobicContact CD2-CG 3.39Å; W577-M593 HydrophobicContact CD2-SD 4.16Å; W577-M593 HydrophobicContact CE3-CG 3.53Å; W577-M593 HydrophobicContact CG-CG 3.81Å; W577-M593 HydrophobicContact CG-SD 3.96Å; W577-M593 HydrophobicContact CH2-CG 4.31Å; W577-M593 HydrophobicContact CZ2-CG 4.18Å; W577-M593 HydrophobicContact CZ3-CG 4Å; W577-Y596 AromaticContact CH2-CD1 3.58Å; W577-Y596 HydrophobicContact CH2-CD1 3.58Å; W577-Y596 HydrophobicContact CH2-CD2 4.11Å; W577-Y596 HydrophobicContact CH2-CE1 4.24Å; W577-Y596 AromaticContact CH2-CG 3.49Å; W577-Y596 HydrophobicContact CH2-CG 3.49Å; W577-Y596 VanDerWaalsContact CH2-CG 3.49Å; W577-Y596 AromaticContact CZ2-CD1 3.87Å; W577-Y596 HydrophobicContact CZ2-CD1 3.87Å; W577-Y596 HydrophobicContact CZ2-CE1 4.23Å; W577-Y596 HydrophobicContact CZ2-CG 4.25Å; W577-Y596 HydrophobicContact CZ3-CG 4.43Å
578	E	93.3	Very high	90.7	Very high	89 Å²	89	70.4 Å²	70.4	42%	0.416	40%	0.399	S	S	.	.	H	α-helix	trans	-72	-46.1	172.8	-76.9	151.2	-147.7	0	0	110	E575 I580 A581 E582 K589	E575-E578 HydrophobicContact CB-CB 4.4Å; E575-E578 WeakPolarHBondContact O-CB 3.5Å; E575-E578 PolarHBondContact O-N 3.01Å; E578-I580 VanDerWaalsContact C-N 3.31Å; E578-I580 PolarHBondContact O-N 3.09Å; E578-A581 PolarHBondContact O-N 2.82Å; E578-A581 VanDerWaalsContact O-N 3.17Å; E578-E582 PolarHBondContact O-N 3.44Å; E578-K589 HydrophobicContact CG-CD 4.09Å; E578-K589 IonicContact OE1-NZ 2.66Å; E578-K589 PolarHBondContact OE1-NZ 3.43Å
579	K	91.8	Very high	90.7	Very high	74 Å²	74	70.2 Å²	70.2	32%	0.322	39%	0.391	S	S	.	.	H	α-helix	trans	-63.4	-34.1	175.2	-64.6	-179.8	178	168.6	0	113.5	Y569 T573 E575 R576 A583	Y569-K579 HydrophobicContact CD1-CB 4.16Å; Y569-K579 HydrophobicContact CD1-CD 4.19Å; Y569-K579 HydrophobicContact CD2-CB 4.03Å; Y569-K579 HydrophobicContact CE1-CB 3.99Å; Y569-K579 HydrophobicContact CE1-CD 4.01Å; Y569-K579 HydrophobicContact CE2-CB 3.85Å; Y569-K579 WeakPolarHBondContact CE2-O 2.96Å; Y569-K579 HydrophobicContact CG-CB 4.17Å; T573-K579 HydrophobicContact CG2-CD 4.16Å; E575-K579 PolarHBondContact O-N 3.18Å; R576-K579 PolarHBondContact O-N 3.22Å; K579-A583 PolarHBondContact O-N 3.35Å
580	I	93.8	Very high	90.5	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-68.7	-42.8	174.2	-71.5	165.8	0	0	0	111.1	L562 A565 L566 Y569 R576 W577 E578 E582 A583 V584 C592	L562-I580 HydrophobicContact CD1-CG2 3.68Å; A565-I580 HydrophobicContact CB-CB 4.43Å; A565-I580 HydrophobicContact CB-CG1 4.25Å; A565-I580 HydrophobicContact CB-CG2 4.16Å; L566-I580 HydrophobicContact CD2-CD1 3.73Å; L566-I580 HydrophobicContact CG-CD1 4.47Å; Y569-I580 HydrophobicContact CD2-CG1 3.89Å; Y569-I580 HydrophobicContact CG-CG1 4.48Å; R576-I580 HydrophobicContact CG-CD1 3.64Å; R576-I580 HydrophobicContact CG-CG1 4.46Å; R576-I580 WeakPolarHBondContact O-CB 3.21Å; R576-I580 WeakPolarHBondContact O-CD1 3.28Å; R576-I580 WeakPolarHBondContact O-CG1 3.46Å; R576-I580 PolarHBondContact O-N 2.9Å; W577-I580 HydrophobicContact CD2-CD1 4.4Å; W577-I580 HydrophobicContact CE3-CB 4.42Å; W577-I580 HydrophobicContact CE3-CD1 3.81Å; W577-I580 HydrophobicContact CE3-CG2 4.39Å; W577-I580 HydrophobicContact CZ3-CD1 3.89Å; W577-I580 HydrophobicContact CZ3-CG2 4.44Å; E578-I580 VanDerWaalsContact C-N 3.31Å; E578-I580 PolarHBondContact O-N 3.09Å; I580-E582 VanDerWaalsContact C-N 3.34Å; I580-A583 PolarHBondContact O-N 3.32Å; I580-V584 PolarHBondContact O-N 2.99Å; I580-C592 HydrophobicContact CG2-CB 4.08Å
581	A	93.8	Very high	90.5	Very high	18 Å²	18	74 Å²	74	15%	0.149	40%	0.404	C	S	.	.	H	α-helix	trans	-66.3	-38.3	179.1	0	0	0	0	0	111.7	W577 E578 A583 V584 K589	W577-A581 WeakPolarHBondContact O-CB 3.19Å; W577-A581 PolarHBondContact O-N 3.45Å; W577-A581 VanDerWaalsContact O-N 3.13Å; E578-A581 PolarHBondContact O-N 2.82Å; E578-A581 VanDerWaalsContact O-N 3.17Å; A581-A583 PolarHBondContact O-N 3.06Å; A581-V584 CarbonylContact O-C 3.45Å; A581-V584 PolarHBondContact O-N 3.22Å; A581-V584 VanDerWaalsContact O-N 3.09Å; A581-K589 HydrophobicContact CB-CB 4.25Å
582	E	93.1	Very high	90.6	Very high	161 Å²	161	68.9 Å²	68.9	75%	0.752	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-31.9	175.2	-168.7	174.9	-167.7	0	0	112.5	E578 I580 V584	E578-E582 PolarHBondContact O-N 3.44Å; I580-E582 VanDerWaalsContact C-N 3.34Å; E582-V584 VanDerWaalsContact C-N 3.3Å; E582-V584 PolarHBondContact O-N 2.95Å
583	A	91.4	Very high	90.7	Very high	36 Å²	36	64.3 Å²	64.3	30%	0.298	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.9	176.4	0	0	0	0	0	114.4	A565 K579 I580 A581	A565-A583 HydrophobicContact CB-CB 3.75Å; K579-A583 PolarHBondContact O-N 3.35Å; I580-A583 PolarHBondContact O-N 3.32Å; A581-A583 PolarHBondContact O-N 3.06Å
584	V	92.8	Very high	90.7	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.36	C	S	.	.	S	Bend	trans	-126.3	82.8	177.9	-171	0	0	0	0	109.3	W554 E558 L561 L562 I580 A581 E582 G586 R587	W554-V584 HydrophobicContact CH2-CG1 4.34Å; W554-V584 HydrophobicContact CZ3-CG1 4.06Å; E558-V584 HydrophobicContact CB-CG1 4.35Å; L561-V584 HydrophobicContact CB-CG2 4.09Å; L562-V584 HydrophobicContact CB-CG2 4.1Å; L562-V584 HydrophobicContact CD1-CG2 4.42Å; I580-V584 PolarHBondContact O-N 2.99Å; A581-V584 CarbonylContact O-C 3.45Å; A581-V584 PolarHBondContact O-N 3.22Å; A581-V584 VanDerWaalsContact O-N 3.09Å; E582-V584 VanDerWaalsContact C-N 3.3Å; E582-V584 PolarHBondContact O-N 2.95Å; V584-G586 PolarHBondContact O-N 3.05Å; V584-R587 HydrophobicContact CB-CB 4.38Å; V584-R587 HydrophobicContact CG1-CB 3.86Å; V584-R587 HydrophobicContact CG1-CG 3.77Å; V584-R587 PolarHBondContact O-N 2.79Å
585	P	86.6	Confident	90.9	Very high	100 Å²	100	66.1 Å²	66.1	65%	0.649	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	135.9	179.9	-24.6	34.3	0	0	0	111.7
586	G	84.4	Confident	90.9	Very high	75 Å²	75	63.3 Å²	63.3	77%	0.773	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-3.4	-179.3	0	0	0	0	0	115.4	V584	V584-G586 PolarHBondContact O-N 3.05Å
587	R	88	Confident	90.7	Very high	19 Å²	19	68.8 Å²	68.8	7%	0.072	35%	0.35	C	S	.	.			trans	-117.8	133.7	175.7	-62.8	-62.6	179	165.3	2.3	111.8	T552 P553 W554 E558 V584 D591	T552-R587 PolarHBondContact O-NH1 3.33Å; T552-R587 PolarHBondContact O-NH2 2.88Å; T552-R587 PolarHBondContact OG1-NH1 3.4Å; P553-R587 VanDerWaalsContact C-NH2 3.3Å; P553-R587 PolarHBondContact O-NH2 2.89Å; W554-R587 HydrophobicContact CH2-CB 4.16Å; W554-R587 HydrophobicContact CH2-CG 3.81Å; W554-R587 HydrophobicContact CZ2-CG 4.17Å; W554-R587 HydrophobicContact CZ3-CG 4.1Å; E558-R587 IonicContact OE1-CZ 2.72Å; E558-R587 IonicContact OE1-NE 3.78Å; E558-R587 PolarHBondContact OE1-NE 2.8Å; E558-R587 IonicContact OE1-NH2 2.64Å; E558-R587 PolarHBondContact OE1-NH2 3.38Å; E558-R587 IonicContact OE2-CZ 2.95Å; E558-R587 IonicContact OE2-NE 3.77Å; E558-R587 PolarHBondContact OE2-NE 3.33Å; E558-R587 IonicContact OE2-NH2 2.69Å; E558-R587 PolarHBondContact OE2-NH2 3.41Å; V584-R587 HydrophobicContact CB-CB 4.38Å; V584-R587 HydrophobicContact CG1-CB 3.86Å; V584-R587 HydrophobicContact CG1-CG 3.77Å; V584-R587 PolarHBondContact O-N 2.79Å; R587-D591 HydrophobicContact CB-CB 4.35Å
588	T	91.6	Very high	90.2	Very high	76 Å²	76	69.5 Å²	69.5	47%	0.466	36%	0.356	S	S	.	.			trans	-78.7	164.6	178	72.5	0	0	0	0	111.3	K590 D591 C592	T588-K590 PolarHBondContact O-N 2.96Å; T588-K590 PolarHBondContact OG1-N 3.42Å; T588-D591 WeakPolarHBondContact CB-OD2 3.46Å; T588-D591 PolarHBondContact N-OD2 3.22Å; T588-D591 PolarHBondContact O-N 3.25Å; T588-D591 VanDerWaalsContact OG1-CG 3.23Å; T588-D591 PolarHBondContact OG1-N 3.43Å; T588-D591 PolarHBondContact OG1-OD2 3Å; T588-C592 PolarHBondContact O-N 2.95Å; T588-C592 PolarHBondContact O-SG 2.84Å; T588-C592 VanDerWaalsContact O-SG 3.4Å
589	K	92.5	Very high	89.8	Confident	81 Å²	81	66.9 Å²	66.9	35%	0.352	34%	0.344	S	S	.	.	H	α-helix	trans	-47.9	-41.8	168.3	-170.3	-174.4	-178	171.2	0	112	W577 E578 A581 M593	W577-K589 HydrophobicContact CB-CD 4.21Å; W577-K589 HydrophobicContact CB-CG 3.75Å; E578-K589 HydrophobicContact CG-CD 4.09Å; E578-K589 IonicContact OE1-NZ 2.66Å; E578-K589 PolarHBondContact OE1-NZ 3.43Å; A581-K589 HydrophobicContact CB-CB 4.25Å; K589-M593 HydrophobicContact CD-CE 4.5Å; K589-M593 HydrophobicContact CG-CE 4Å; K589-M593 WeakPolarHBondContact O-CB 3.17Å; K589-M593 WeakPolarHBondContact O-CE 3.09Å; K589-M593 VanDerWaalsContact O-CG 3.29Å; K589-M593 WeakPolarHBondContact O-CG 3.37Å; K589-M593 PolarHBondContact O-N 3.48Å; K589-M593 VanDerWaalsContact O-N 3.07Å
590	K	89.7	Confident	89.5	Confident	165 Å²	165	66.5 Å²	66.5	72%	0.717	35%	0.348	S	S	*	.	H	α-helix	trans	-67.2	-40.3	-179.6	-70.6	-176.5	-179.3	175.9	0	111.8	T588 M593 K594	T588-K590 PolarHBondContact O-N 2.96Å; T588-K590 PolarHBondContact OG1-N 3.42Å; K590-M593 HydrophobicContact CG-CE 4.26Å; K590-M593 PolarHBondContact O-N 2.97Å; K590-K594 WeakPolarHBondContact O-CB 3.2Å; K590-K594 PolarHBondContact O-N 3.08Å
591	D	88.8	Confident	88.8	Confident	54 Å²	54	73.1 Å²	73.1	29%	0.289	38%	0.379	S	S	.	.	H	α-helix	trans	-66.8	-44.7	179.3	-55.6	-43.4	0	0	0	111.3	W554 R587 T588 M593 K594 R595	W554-D591 HydrophobicContact CZ2-CB 4.32Å; R587-D591 HydrophobicContact CB-CB 4.35Å; T588-D591 WeakPolarHBondContact CB-OD2 3.46Å; T588-D591 PolarHBondContact N-OD2 3.22Å; T588-D591 PolarHBondContact O-N 3.25Å; T588-D591 VanDerWaalsContact OG1-CG 3.23Å; T588-D591 PolarHBondContact OG1-N 3.43Å; T588-D591 PolarHBondContact OG1-OD2 3Å; D591-M593 VanDerWaalsContact C-N 3.34Å; D591-M593 PolarHBondContact O-N 3.15Å; D591-K594 PolarHBondContact O-N 2.82Å; D591-R595 WeakPolarHBondContact O-CB 3.3Å; D591-R595 PolarHBondContact O-N 3.24Å
592	C	91.4	Very high	88	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-61.1	-42.4	176.4	-63.8	0	0	0	0	111.7	L562 I580 T588 Y596	L562-C592 HydrophobicContact CD1-CB 3.87Å; I580-C592 HydrophobicContact CG2-CB 4.08Å; T588-C592 PolarHBondContact O-N 2.95Å; T588-C592 PolarHBondContact O-SG 2.84Å; T588-C592 VanDerWaalsContact O-SG 3.4Å; C592-Y596 WeakPolarHBondContact O-CB 3.24Å; C592-Y596 PolarHBondContact O-N 3.26Å
593	M	89.4	Confident	87.3	Confident	58 Å²	58	73 Å²	73	29%	0.286	38%	0.382	S	S	.	.	H	α-helix	trans	-65.4	-42.8	176.2	-75.8	-173.6	-61.8	0	0	112.6	W577 K589 K590 D591 Y596 K597	W577-M593 HydrophobicContact CB-CG 4.43Å; W577-M593 HydrophobicContact CB-SD 4.43Å; W577-M593 HydrophobicContact CD2-CG 3.39Å; W577-M593 HydrophobicContact CD2-SD 4.16Å; W577-M593 HydrophobicContact CE3-CG 3.53Å; W577-M593 HydrophobicContact CG-CG 3.81Å; W577-M593 HydrophobicContact CG-SD 3.96Å; W577-M593 HydrophobicContact CH2-CG 4.31Å; W577-M593 HydrophobicContact CZ2-CG 4.18Å; W577-M593 HydrophobicContact CZ3-CG 4Å; K589-M593 HydrophobicContact CD-CE 4.5Å; K589-M593 HydrophobicContact CG-CE 4Å; K589-M593 WeakPolarHBondContact O-CB 3.17Å; K589-M593 WeakPolarHBondContact O-CE 3.09Å; K589-M593 VanDerWaalsContact O-CG 3.29Å; K589-M593 WeakPolarHBondContact O-CG 3.37Å; K589-M593 PolarHBondContact O-N 3.48Å; K589-M593 VanDerWaalsContact O-N 3.07Å; K590-M593 HydrophobicContact CG-CE 4.26Å; K590-M593 PolarHBondContact O-N 2.97Å; D591-M593 VanDerWaalsContact C-N 3.34Å; D591-M593 PolarHBondContact O-N 3.15Å; M593-Y596 PolarHBondContact O-N 3.33Å; M593-K597 WeakPolarHBondContact O-CG 3.05Å; M593-K597 PolarHBondContact O-N 3.48Å; M593-K597 VanDerWaalsContact O-N 3.11Å
594	K	88.3	Confident	86.7	Confident	105 Å²	105	78.8 Å²	78.8	46%	0.457	40%	0.4	S	S	.	.	H	α-helix	trans	-62.8	-48.4	177.7	-176.6	-178.9	175.3	-174.3	0	110.5	K590 D591 Y596 K597 E598	K590-K594 WeakPolarHBondContact O-CB 3.2Å; K590-K594 PolarHBondContact O-N 3.08Å; D591-K594 PolarHBondContact O-N 2.82Å; K594-Y596 VanDerWaalsContact C-N 3.33Å; K594-Y596 PolarHBondContact O-N 3.17Å; K594-K597 WeakPolarHBondContact O-CB 3.43Å; K594-K597 PolarHBondContact O-N 2.8Å; K594-K597 VanDerWaalsContact O-N 3.15Å; K594-E598 PolarHBondContact O-N 3.48Å
595	R	90.1	Very high	85.8	Confident	62 Å²	62	81 Å²	81	23%	0.234	42%	0.419	C	S	.	.	H	α-helix	trans	-63	-38.5	179	-171.1	58.6	175.3	168.7	-2.8	112.6	W554 L562 D591 E598 L599	W554-R595 HydrophobicContact CD2-CB 4.47Å; W554-R595 HydrophobicContact CD2-CG 3.91Å; W554-R595 HydrophobicContact CE3-CG 4.44Å; W554-R595 HydrophobicContact CG-CG 4.34Å; W554-R595 HydrophobicContact CH2-CB 4.3Å; W554-R595 HydrophobicContact CH2-CG 4.38Å; W554-R595 HydrophobicContact CZ2-CB 3.52Å; W554-R595 HydrophobicContact CZ2-CG 3.82Å; L562-R595 HydrophobicContact CD2-CB 3.88Å; L562-R595 HydrophobicContact CD2-CG 3.56Å; D591-R595 WeakPolarHBondContact O-CB 3.3Å; D591-R595 PolarHBondContact O-N 3.24Å; R595-E598 WeakPolarHBondContact CD-OE2 3.49Å; R595-E598 IonicContact CZ-OE2 3.4Å; R595-E598 IonicContact NH1-OE2 3.81Å; R595-E598 PolarHBondContact NH1-OE2 3.27Å; R595-E598 PolarHBondContact O-N 3.05Å; R595-L599 HydrophobicContact CG-CD1 4.41Å; R595-L599 WeakPolarHBondContact O-CG 3.35Å; R595-L599 PolarHBondContact O-N 3.43Å
596	Y	91.1	Very high	85.3	Confident	73 Å²	73	80.3 Å²	80.3	29%	0.286	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-42.2	173.5	174.8	-101.9	0	0	0	112.8	L566 W577 C592 M593 K594 E598 L599 V600	L566-Y596 HydrophobicContact CD1-CD2 3.74Å; L566-Y596 HydrophobicContact CD1-CE2 4.41Å; L566-Y596 HydrophobicContact CD2-CD2 3.59Å; L566-Y596 HydrophobicContact CD2-CE2 3.9Å; L566-Y596 HydrophobicContact CD2-CG 4.4Å; L566-Y596 HydrophobicContact CG-CD2 4.35Å; W577-Y596 AromaticContact CH2-CD1 3.58Å; W577-Y596 HydrophobicContact CH2-CD1 3.58Å; W577-Y596 HydrophobicContact CH2-CD2 4.11Å; W577-Y596 HydrophobicContact CH2-CE1 4.24Å; W577-Y596 AromaticContact CH2-CG 3.49Å; W577-Y596 HydrophobicContact CH2-CG 3.49Å; W577-Y596 VanDerWaalsContact CH2-CG 3.49Å; W577-Y596 AromaticContact CZ2-CD1 3.87Å; W577-Y596 HydrophobicContact CZ2-CD1 3.87Å; W577-Y596 HydrophobicContact CZ2-CE1 4.23Å; W577-Y596 HydrophobicContact CZ2-CG 4.25Å; W577-Y596 HydrophobicContact CZ3-CG 4.43Å; C592-Y596 WeakPolarHBondContact O-CB 3.24Å; C592-Y596 PolarHBondContact O-N 3.26Å; M593-Y596 PolarHBondContact O-N 3.33Å; K594-Y596 VanDerWaalsContact C-N 3.33Å; K594-Y596 PolarHBondContact O-N 3.17Å; Y596-E598 VanDerWaalsContact C-N 3.34Å; Y596-E598 PolarHBondContact O-N 3.12Å; Y596-L599 PolarHBondContact O-N 3.18Å; Y596-V600 HydrophobicContact CD1-CG2 4.13Å; Y596-V600 HydrophobicContact CD2-CG2 4.39Å; Y596-V600 HydrophobicContact CE1-CG2 3.7Å; Y596-V600 HydrophobicContact CE2-CG2 4.01Å; Y596-V600 HydrophobicContact CG-CG2 4.46Å; Y596-V600 WeakPolarHBondContact O-CG2 3.44Å; Y596-V600 PolarHBondContact O-N 2.93Å
597	K	88.8	Confident	85	Confident	145 Å²	145	83.2 Å²	83.2	63%	0.63	40%	0.397	S	S	*	.	H	α-helix	trans	-59.8	-45	176.1	-73.2	178.9	-178.4	-178	0	111.5	M593 K594 L599 V600 E601	M593-K597 WeakPolarHBondContact O-CG 3.05Å; M593-K597 PolarHBondContact O-N 3.48Å; M593-K597 VanDerWaalsContact O-N 3.11Å; K594-K597 WeakPolarHBondContact O-CB 3.43Å; K594-K597 PolarHBondContact O-N 2.8Å; K594-K597 VanDerWaalsContact O-N 3.15Å; K597-L599 VanDerWaalsContact C-N 3.33Å; K597-L599 PolarHBondContact O-N 3.45Å; K597-V600 PolarHBondContact O-N 3.47Å; K597-E601 PolarHBondContact O-N 2.92Å
598	E	84.4	Confident	84.3	Confident	68 Å²	68	84.3 Å²	84.3	32%	0.318	41%	0.41	S	S	.	.	H	α-helix	trans	-58.8	-43.3	175.6	-65.9	169.8	-173.4	0	0	111.8	K594 R595 Y596 E601 M602	K594-E598 PolarHBondContact O-N 3.48Å; R595-E598 WeakPolarHBondContact CD-OE2 3.49Å; R595-E598 IonicContact CZ-OE2 3.4Å; R595-E598 IonicContact NH1-OE2 3.81Å; R595-E598 PolarHBondContact NH1-OE2 3.27Å; R595-E598 PolarHBondContact O-N 3.05Å; Y596-E598 VanDerWaalsContact C-N 3.34Å; Y596-E598 PolarHBondContact O-N 3.12Å; E598-E601 PolarHBondContact O-N 3.02Å; E598-M602 WeakPolarHBondContact O-CG 3.36Å; E598-M602 PolarHBondContact O-N 3.39Å
599	L	84.8	Confident	83.4	Confident	34 Å²	34	81 Å²	81	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-63.3	-41.9	176.7	-68.5	164.1	0	0	0	112	L562 R595 Y596 K597 M602 V603	L562-L599 HydrophobicContact CD2-CD1 4.33Å; R595-L599 HydrophobicContact CG-CD1 4.41Å; R595-L599 WeakPolarHBondContact O-CG 3.35Å; R595-L599 PolarHBondContact O-N 3.43Å; Y596-L599 PolarHBondContact O-N 3.18Å; K597-L599 VanDerWaalsContact C-N 3.33Å; K597-L599 PolarHBondContact O-N 3.45Å; L599-M602 HydrophobicContact CD2-CE 3.65Å; L599-M602 HydrophobicContact CG-CE 4.29Å; L599-M602 PolarHBondContact O-N 3.33Å; L599-V603 WeakPolarHBondContact O-CG2 3.44Å; L599-V603 PolarHBondContact O-N 2.91Å
600	V	85.1	Confident	82.6	Confident	67 Å²	67	80.7 Å²	80.7	41%	0.406	39%	0.39	S	S	.	.	H	α-helix	trans	-62.2	-43.3	176.6	170	0	0	0	0	111.1	Y596 K597 V603 K604	Y596-V600 HydrophobicContact CD1-CG2 4.13Å; Y596-V600 HydrophobicContact CD2-CG2 4.39Å; Y596-V600 HydrophobicContact CE1-CG2 3.7Å; Y596-V600 HydrophobicContact CE2-CG2 4.01Å; Y596-V600 HydrophobicContact CG-CG2 4.46Å; Y596-V600 WeakPolarHBondContact O-CG2 3.44Å; Y596-V600 PolarHBondContact O-N 2.93Å; K597-V600 PolarHBondContact O-N 3.47Å; V600-V603 PolarHBondContact O-N 2.9Å; V600-K604 WeakPolarHBondContact O-CB 3.27Å; V600-K604 PolarHBondContact O-N 3.22Å
601	E	79.1	Confident	81.9	Confident	138 Å²	138	78.4 Å²	78.4	65%	0.645	38%	0.382	S	S	*	.	H	α-helix	trans	-64	-43.3	176.5	-71.3	-169.6	135	0	0	112	K597 E598 V603 K604 A605	K597-E601 PolarHBondContact O-N 2.92Å; E598-E601 PolarHBondContact O-N 3.02Å; E601-V603 PolarHBondContact O-N 3.25Å; E601-K604 PolarHBondContact O-N 3.08Å; E601-A605 WeakPolarHBondContact O-CB 3.36Å; E601-A605 PolarHBondContact O-N 3.39Å
602	M	75.8	Confident	81.2	Confident	97 Å²	97	80.9 Å²	80.9	48%	0.478	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-42.5	175	-74.8	-170	-69.3	0	0	112.4	E598 L599 A605 K606	E598-M602 WeakPolarHBondContact O-CG 3.36Å; E598-M602 PolarHBondContact O-N 3.39Å; L599-M602 HydrophobicContact CD2-CE 3.65Å; L599-M602 HydrophobicContact CG-CE 4.29Å; L599-M602 PolarHBondContact O-N 3.33Å; M602-A605 PolarHBondContact O-N 3.17Å; M602-K606 WeakPolarHBondContact O-CB 3.32Å; M602-K606 PolarHBondContact O-N 3.03Å
603	V	80	Confident	80.4	Confident	79 Å²	79	81.6 Å²	81.6	48%	0.479	40%	0.396	S	S	.	.	H	α-helix	trans	-66.5	-39.7	176.5	171.4	0	0	0	0	111.3	L599 V600 E601 K606 K607	L599-V603 WeakPolarHBondContact O-CG2 3.44Å; L599-V603 PolarHBondContact O-N 2.91Å; V600-V603 PolarHBondContact O-N 2.9Å; E601-V603 PolarHBondContact O-N 3.25Å; V603-K606 PolarHBondContact O-N 3.49Å; V603-K607 PolarHBondContact O-N 3.31Å
604	K	78.3	Confident	79.5	Confident	158 Å²	158	83.7 Å²	83.7	69%	0.687	41%	0.408	S	S	*	.	H	α-helix	trans	-64	-43.9	176.8	-170.5	179.2	179.7	-176.4	0	111.3	V600 E601 K607 A608	V600-K604 WeakPolarHBondContact O-CB 3.27Å; V600-K604 PolarHBondContact O-N 3.22Å; E601-K604 PolarHBondContact O-N 3.08Å; K604-K607 PolarHBondContact O-N 3.28Å; K604-A608 WeakPolarHBondContact O-CB 3.45Å; K604-A608 PolarHBondContact O-N 2.8Å
605	A	73.1	Confident	78.8	Confident	47 Å²	47	82.6 Å²	82.6	39%	0.388	41%	0.407	S	S	.	.	H	α-helix	trans	-61.5	-43.7	174.6	0	0	0	0	0	111.7	E601 M602 K607 A608 A609	E601-A605 WeakPolarHBondContact O-CB 3.36Å; E601-A605 PolarHBondContact O-N 3.39Å; M602-A605 PolarHBondContact O-N 3.17Å; A605-K607 PolarHBondContact O-N 3.06Å; A605-A608 PolarHBondContact O-N 3.39Å; A605-A609 WeakPolarHBondContact O-CB 3.25Å; A605-A609 PolarHBondContact O-N 3.35Å
606	K	77.3	Confident	77.6	Confident	85 Å²	85	82.1 Å²	82.1	37%	0.37	42%	0.416	S	S	.	.	H	α-helix	trans	-59.4	-45.7	175.8	-172.9	173.2	-176.9	172.8	0	112.3	F469 M602 V603 Q610	F469-K606 HydrophobicContact CE1-CG 4.06Å; M602-K606 WeakPolarHBondContact O-CB 3.32Å; M602-K606 PolarHBondContact O-N 3.03Å; V603-K606 PolarHBondContact O-N 3.49Å; K606-Q610 WeakPolarHBondContact O-CG 3.38Å; K606-Q610 PolarHBondContact O-N 2.88Å
607	K	78.1	Confident	76.4	Confident	137 Å²	137	81.5 Å²	81.5	60%	0.596	42%	0.423	S	S	*	.	H	α-helix	trans	-65.9	-44.6	177.6	-77.3	-174.2	176.7	-175.8	0	112.3	V603 K604 A605 A609 Q610 E611	V603-K607 PolarHBondContact O-N 3.31Å; K604-K607 PolarHBondContact O-N 3.28Å; A605-K607 PolarHBondContact O-N 3.06Å; K607-A609 VanDerWaalsContact C-N 3.33Å; K607-A609 PolarHBondContact O-N 3.24Å; K607-Q610 PolarHBondContact O-N 3.19Å; K607-E611 WeakPolarHBondContact O-CB 3.29Å; K607-E611 PolarHBondContact O-N 3.3Å
608	A	72.4	Confident	75.6	Confident	42 Å²	42	83.3 Å²	83.3	35%	0.347	43%	0.426	S	S	.	.	H	α-helix	trans	-60.3	-42.4	178.9	0	0	0	0	0	111.9	K604 A605 E611 Q612	K604-A608 WeakPolarHBondContact O-CB 3.45Å; K604-A608 PolarHBondContact O-N 2.8Å; A605-A608 PolarHBondContact O-N 3.39Å; A608-E611 PolarHBondContact O-N 2.87Å; A608-Q612 VanDerWaalsContact O-CG 3.3Å; A608-Q612 WeakPolarHBondContact O-CG 3.49Å; A608-Q612 PolarHBondContact O-N 3.39Å
609	A	73.8	Confident	74.4	Confident	6 Å²	6	84 Å²	84	5%	0.05	44%	0.443	C	S	.	.	H	α-helix	trans	-63.8	-41	176.1	0	0	0	0	0	112.4	A605 K607 V613	A605-A609 WeakPolarHBondContact O-CB 3.25Å; A605-A609 PolarHBondContact O-N 3.35Å; K607-A609 VanDerWaalsContact C-N 3.33Å; K607-A609 PolarHBondContact O-N 3.24Å; A609-V613 WeakPolarHBondContact O-CG2 3.34Å; A609-V613 PolarHBondContact O-N 3.02Å
610	Q	74.6	Confident	72.9	Confident	74 Å²	74	91.2 Å²	91.2	35%	0.346	47%	0.473	S	S	.	.	H	α-helix	trans	-66.6	-41.9	176.6	-73.8	177.6	-24.9	0	0	112.4	K606 K607 V613 L614	K606-Q610 WeakPolarHBondContact O-CG 3.38Å; K606-Q610 PolarHBondContact O-N 2.88Å; K607-Q610 PolarHBondContact O-N 3.19Å; Q610-V613 PolarHBondContact O-N 3.45Å; Q610-L614 PolarHBondContact O-N 3.44Å
611	E	76.4	Confident	70.8	Confident	118 Å²	118	99.7 Å²	99.7	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-68	-37.1	-179.5	-170.9	168.9	-160.5	0	0	112.2	K607 A608 V613 L614 N615	K607-E611 WeakPolarHBondContact O-CB 3.29Å; K607-E611 PolarHBondContact O-N 3.3Å; A608-E611 PolarHBondContact O-N 2.87Å; E611-V613 VanDerWaalsContact C-N 3.31Å; E611-V613 PolarHBondContact O-N 2.83Å; E611-L614 PolarHBondContact O-N 3.43Å; E611-N615 WeakPolarHBondContact O-CB 3.45Å; E611-N615 VanDerWaalsContact O-CG 3.27Å; E611-N615 PolarHBondContact O-N 3.18Å; E611-N615 PolarHBondContact O-ND2 2.79Å
612	Q	72.7	Confident	70.4	Confident	105 Å²	105	97.8 Å²	97.8	49%	0.491	50%	0.497	S	S	.	.	H	α-helix	trans	-61.8	-37.9	172.9	-74.7	177.8	6.3	0	0	112.4	A608 A616	A608-Q612 VanDerWaalsContact O-CG 3.3Å; A608-Q612 WeakPolarHBondContact O-CG 3.49Å; A608-Q612 PolarHBondContact O-N 3.39Å; Q612-A616 VanDerWaalsContact O-CB 3.3Å; Q612-A616 WeakPolarHBondContact O-CB 3.4Å; Q612-A616 PolarHBondContact O-N 3.28Å
613	V	74.5	Confident	70.1	Confident	16 Å²	16	97.8 Å²	97.8	10%	0.097	50%	0.498	C	S	.	.	H	α-helix	trans	-69.2	-42.3	175.4	174.2	0	0	0	0	111.3	V479 N482 A609 Q610 E611 N615 A616 S617	V479-V613 HydrophobicContact CG2-CG2 4.22Å; N482-V613 WeakPolarHBondContact ND2-CG2 3.33Å; A609-V613 WeakPolarHBondContact O-CG2 3.34Å; A609-V613 PolarHBondContact O-N 3.02Å; Q610-V613 PolarHBondContact O-N 3.45Å; E611-V613 VanDerWaalsContact C-N 3.31Å; E611-V613 PolarHBondContact O-N 2.83Å; V613-N615 PolarHBondContact O-N 3.24Å; V613-A616 PolarHBondContact O-N 3.31Å; V613-S617 PolarHBondContact O-N 2.95Å; V613-S617 PolarHBondContact O-OG 3.37Å; V613-S617 VanDerWaalsContact O-OG 3.11Å
614	L	71.8	Confident	69.6	Low	102 Å²	102	98.8 Å²	98.8	53%	0.534	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-41.1	174.6	-76.7	164.8	0	0	0	112.2	Q610 E611 S617 R618	Q610-L614 PolarHBondContact O-N 3.44Å; E611-L614 PolarHBondContact O-N 3.43Å; L614-S617 WeakPolarHBondContact CA-OG 3.3Å; L614-S617 PolarHBondContact O-N 3.31Å; L614-S617 PolarHBondContact O-OG 3.19Å; L614-R618 WeakPolarHBondContact O-CG 3.49Å; L614-R618 PolarHBondContact O-N 3.1Å
615	N	72	Confident	69.1	Low	81 Å²	81	95.4 Å²	95.4	43%	0.433	49%	0.488	S	S	.	.	H	α-helix	trans	-69.8	-38.2	177	-70.6	-20.8	0	0	0	112.1	E611 V613 S617 R618 A619	E611-N615 WeakPolarHBondContact O-CB 3.45Å; E611-N615 VanDerWaalsContact O-CG 3.27Å; E611-N615 PolarHBondContact O-N 3.18Å; E611-N615 PolarHBondContact O-ND2 2.79Å; V613-N615 PolarHBondContact O-N 3.24Å; N615-S617 PolarHBondContact O-N 2.94Å; N615-R618 PolarHBondContact O-N 3.39Å; N615-A619 WeakPolarHBondContact O-CB 3.28Å; N615-A619 PolarHBondContact O-N 2.89Å
616	A	65.4	Low	68.8	Low	52 Å²	52	98.4 Å²	98.4	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-67	-33.7	175.4	0	0	0	0	0	113.1	Q612 V613	Q612-A616 VanDerWaalsContact O-CB 3.3Å; Q612-A616 WeakPolarHBondContact O-CB 3.4Å; Q612-A616 PolarHBondContact O-N 3.28Å; V613-A616 PolarHBondContact O-N 3.31Å
617	S	66.2	Low	68.3	Low	61 Å²	61	99.3 Å²	99.3	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-74.8	-33.5	174.6	58.3	0	0	0	0	113.1	V613 L614 N615 K620	V613-S617 PolarHBondContact O-N 2.95Å; V613-S617 PolarHBondContact O-OG 3.37Å; V613-S617 VanDerWaalsContact O-OG 3.11Å; L614-S617 WeakPolarHBondContact CA-OG 3.3Å; L614-S617 PolarHBondContact O-N 3.31Å; L614-S617 PolarHBondContact O-OG 3.19Å; N615-S617 PolarHBondContact O-N 2.94Å; S617-K620 PolarHBondContact O-N 3.34Å
618	R	71.5	Confident	67.6	Low	183 Å²	183	96.6 Å²	96.6	69%	0.691	50%	0.496	S	S	*	.	H	α-helix	trans	-69.2	-31.2	171.9	-76.9	177.6	176.4	179.7	-1.8	113.4	L614 N615 K620 K621	L614-R618 WeakPolarHBondContact O-CG 3.49Å; L614-R618 PolarHBondContact O-N 3.1Å; N615-R618 PolarHBondContact O-N 3.39Å; R618-K620 VanDerWaalsContact C-N 3.28Å; R618-K620 PolarHBondContact O-N 2.93Å; R618-K621 VanDerWaalsContact O-OXT 3.11Å
619	A	59.4	Low	67.2	Low	83 Å²	83	100.8 Å²	100.8	69%	0.686	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.4	177.6	0	0	0	0	0	114.1	N615	N615-A619 WeakPolarHBondContact O-CB 3.28Å; N615-A619 PolarHBondContact O-N 2.89Å
620	K	53.2	Low	66.6	Low	184 Å²	184	108.7 Å²	108.7	80%	0.8	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-9	177.1	-76.8	-177.4	178.3	-179.8	0	113.7	S617 R618	S617-K620 PolarHBondContact O-N 3.34Å; R618-K620 VanDerWaalsContact C-N 3.28Å; R618-K620 PolarHBondContact O-N 2.93Å
621	K	41.9	Very low	65.9	Low	245 Å²	245	111.8 Å²	111.8	100%	1.065	56%	0.564	S	S	*	*			trans	-97.9	0	166.9	-76.9	-174.4	175.5	-174.7	0	108.1	R618	R618-K621 VanDerWaalsContact O-OXT 3.11Å

Retrieved 621 of 621 residues in 1417.1 ms (Link to these results)

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