A0A096NJY4_PAPAN Loading...

PH domain-containing protein

AlphaFold DB , UniProt , Accession A0A096NJY4, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 649 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	38.9	Very low	253 Å²	253	161.6 Å²	161.6	100%	1.246	89%	0.886	S	S	*	*				0	133.2	0	-79.3	179.2	179.7	0	0	108.6
2	G	36.5	Very low	38.2	Very low	74 Å²	74	154.3 Å²	154.3	76%	0.763	88%	0.875	S	S	*	*			trans	94	73.5	160.2	0	0	0	0	0	117.6
3	G	37.2	Very low	37.8	Very low	73 Å²	73	158.2 Å²	158.2	75%	0.753	87%	0.868	S	S	*	*			trans	-84.8	147.1	156.1	0	0	0	0	0	110.7
4	W	36.1	Very low	37.2	Very low	251 Å²	251	157.9 Å²	157.9	95%	0.951	86%	0.857	S	S	*	*			trans	-132.7	125.9	167	-83.5	67.9	0	0	0	111.2
5	K	39.5	Very low	36.8	Very low	206 Å²	206	151.9 Å²	151.9	90%	0.896	85%	0.846	S	S	*	*			trans	-74.6	157.5	177.9	-73.2	163	172.5	-89.7	0	111
6	G	35.4	Very low	37.9	Very low	69 Å²	69	150.4 Å²	150.4	71%	0.711	85%	0.846	S	S	*	*			trans	-63	-173.7	166.9	0	0	0	0	0	114
7	P	49.2	Very low	37.5	Very low	135 Å²	135	152.8 Å²	152.8	88%	0.877	85%	0.849	S	S	*	*				-155.1	155.8	80	37.6	-17.5	0	0	0	117.9
8	G	35	Very low	37.1	Very low	75 Å²	75	149.4 Å²	149.4	77%	0.773	84%	0.844	S	S	*	*				95.4	155.1	120.9	0	0	0	0	0	121.6
9	P	52.8	Low	36.9	Very low	132 Å²	132	153.3 Å²	153.3	86%	0.857	84%	0.843	S	S	*	*			trans	-114.7	170.7	-152.7	38.1	-23.1	0	0	0	114.7
10	R	34.5	Very low	36.7	Very low	256 Å²	256	156.1 Å²	156.1	97%	0.966	84%	0.841	S	S	*	*			trans	-137.2	132.7	164.4	-88.5	-170.1	177.6	-139.7	0.3	114.1
11	R	35.5	Very low	36.4	Very low	254 Å²	254	159.6 Å²	159.6	96%	0.958	84%	0.842	S	S	*	*			trans	-85.4	159.1	168.7	-101.8	178.8	-168.6	-110.2	2.4	111.5
12	G	30.8	Very low	36.1	Very low	73 Å²	73	152.2 Å²	152.2	75%	0.753	82%	0.821	S	S	*	*			trans	161.3	99.7	156.6	0	0	0	0	0	108.6
13	R	32.8	Very low	36	Very low	206 Å²	206	153.1 Å²	153.1	78%	0.777	82%	0.822	S	S	*	*				80.3	112.2	59	-152.7	-166.9	-134.7	-113	2.7	113.7
14	E	30.5	Very low	35.7	Very low	153 Å²	153	156.5 Å²	156.5	72%	0.715	82%	0.818	S	S	*	*			trans	56.6	144.1	147.6	-69.1	163.3	-171.1	0	0	119.3
15	G	30	Very low	35.6	Very low	68 Å²	68	154.8 Å²	154.8	70%	0.701	81%	0.811	S	S	*	*			cis	169.9	-152.2	17.4	0	0	0	0	0	107.9
16	P	55.2	Low	35.1	Very low	128 Å²	128	148.9 Å²	148.9	83%	0.831	81%	0.809	S	S	*	*				-126.5	-166.5	-102.9	39.3	-24.5	0	0	0	115.8
17	E	31.6	Very low	34.7	Very low	192 Å²	192	149.7 Å²	149.7	90%	0.897	82%	0.817	S	S	*	*			trans	116.2	141.8	163.5	-69.3	-166.6	159.5	0	0	116.1
18	A	30.3	Very low	33.8	Very low	92 Å²	92	147.3 Å²	147.3	76%	0.76	82%	0.817	S	S	*	*			cis	-164.2	149.9	-0.3	0	0	0	0	0	113.6
19	R	32.1	Very low	33.6	Very low	222 Å²	222	148 Å²	148	84%	0.838	82%	0.823	S	S	*	*			trans	-14.6	145.9	151.6	-81.1	175.7	173.6	-123.4	0.7	121.9
20	R	33.5	Very low	32.5	Very low	209 Å²	209	145.3 Å²	145.3	79%	0.789	82%	0.82	S	S	*	*				151.9	144.7	118.1	-96.6	179.3	-128.1	-112.2	4.5	109.4
21	R	30.1	Very low	32.8	Very low	231 Å²	231	139.8 Å²	139.8	87%	0.872	82%	0.815	S	S	*	*			cis	-167.4	164.9	40.8	-117.8	163.4	-150.2	-127.5	8.9	110.4
22	A	29.7	Very low	32.9	Very low	97 Å²	97	133.6 Å²	133.6	80%	0.802	81%	0.808	S	S	*	*			trans	-113.8	-179.4	178.5	0	0	0	0	0	112.4
23	A	33.8	Very low	33.2	Very low	94 Å²	94	134.1 Å²	134.1	78%	0.777	81%	0.805	S	S	*	*			trans	102	140.4	166.4	0	0	0	0	0	115.7
24	E	32.6	Very low	33.5	Very low	144 Å²	144	130.6 Å²	130.6	67%	0.673	81%	0.808	S	S	*	*			cis	-170.4	165.6	4.2	-124.3	-167.5	159.4	0	0	111.7
25	R	32.9	Very low	33.8	Very low	215 Å²	215	134.8 Å²	134.8	81%	0.811	82%	0.818	S	S	*	*			trans	66.4	127.1	149.8	-70.2	174.7	-155.9	-102.3	-12.4	125.2
26	G	28.5	Very low	34.5	Very low	82 Å²	82	137.2 Å²	137.2	85%	0.845	82%	0.824	S	S	*	*				136	103.1	115.4	0	0	0	0	0	120.6
27	G	28.3	Very low	33.8	Very low	86 Å²	86	137.1 Å²	137.1	89%	0.887	82%	0.823	S	S	*	*				98.8	122.7	126.2	0	0	0	0	0	122.8
28	G	28.9	Very low	33.8	Very low	85 Å²	85	133 Å²	133	88%	0.876	82%	0.822	S	S	*	*			trans	89.4	125.4	151.9	0	0	0	0	0	115.8
29	G	30.7	Very low	34.3	Very low	88 Å²	88	139.5 Å²	139.5	91%	0.907	83%	0.827	S	S	*	*			cis	108.9	99.1	29.3	0	0	0	0	0	109.1
30	G	30.8	Very low	34.3	Very low	77 Å²	77	138.6 Å²	138.6	79%	0.794	83%	0.829	S	S	*	*			trans	155.5	99.3	171.2	0	0	0	0	0	115.4
31	V	40.4	Very low	34.4	Very low	140 Å²	140	134.3 Å²	134.3	85%	0.848	83%	0.828	S	S	*	*			trans	-81.2	141.3	166.7	176.5	0	0	0	0	109.2
32	P	38	Very low	34.5	Very low	124 Å²	124	134.4 Å²	134.4	81%	0.805	83%	0.828	S	S	*	*			trans	-131.4	147.9	131.8	29	-13.4	0	0	0	112.9
33	A	37.3	Very low	34.7	Very low	84 Å²	84	135.2 Å²	135.2	69%	0.694	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-62.5	152.9	-174.5	0	0	0	0	0	114.6
34	P	37.9	Very low	34.9	Very low	131 Å²	131	136.8 Å²	136.8	85%	0.851	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-80.2	126.5	177	31.5	-29.9	0	0	0	111
35	R	38.2	Very low	34.8	Very low	241 Å²	241	136 Å²	136	91%	0.909	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-76.9	136	159.7	-74.3	178.1	162.9	-133.5	-2	108.7
36	S	44.2	Very low	34.6	Very low	120 Å²	120	131.1 Å²	131.1	84%	0.839	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-52.1	139.1	179.7	-34.1	0	0	0	0	113.2
37	P	39.3	Very low	34.9	Very low	126 Å²	126	134.9 Å²	134.9	82%	0.818	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-97.6	131.9	164.6	30.5	-21.1	0	0	0	111.9
38	A	31.7	Very low	35	Very low	104 Å²	104	139.3 Å²	139.3	86%	0.86	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-63.8	157	170.5	0	0	0	0	0	112.7
39	R	41.8	Very low	35.1	Very low	230 Å²	230	143.2 Å²	143.2	87%	0.868	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-74.1	132.2	-178	-167.2	-179.3	-177.2	-161.4	1.8	112.3
40	K	32.7	Very low	35.6	Very low	202 Å²	202	144.5 Å²	144.5	88%	0.878	83%	0.83	S	S	*	*			trans	167.7	167.6	149.7	-99.3	177.2	-174	-172.7	0	111.1
41	P	35.3	Very low	36.1	Very low	119 Å²	119	146.8 Å²	146.8	77%	0.773	83%	0.831	S	S	*	*				-119.5	165.3	-59.3	31.6	-12.6	0	0	0	112.1
42	R	30.7	Very low	36.9	Very low	233 Å²	233	144.3 Å²	144.3	88%	0.879	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75.9	144.5	179	-75.7	177.4	169.7	169.8	-3.2	112.8
43	P	34.4	Very low	37	Very low	115 Å²	115	150.2 Å²	150.2	75%	0.747	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-93.7	160.4	167.5	36.2	-30.5	0	0	0	112.6
44	P	37.8	Very low	36.5	Very low	126 Å²	126	149.8 Å²	149.8	82%	0.818	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-87.9	137.1	178.2	33.3	-30	0	0	0	112.6
45	S	30.2	Very low	36	Very low	129 Å²	129	148.7 Å²	148.7	90%	0.902	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-80	135.7	176.3	-75	0	0	0	0	112.6
46	C	30.2	Very low	35.8	Very low	111 Å²	111	141.4 Å²	141.4	75%	0.75	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-101.4	135.1	172.7	-87.7	0	0	0	0	112.3
47	L	33.6	Very low	35.1	Very low	162 Å²	162	143.8 Å²	143.8	85%	0.848	82%	0.821	S	S	*	*				60.3	113.7	128.7	-53.6	174.2	0	0	0	120.2
48	L	30.6	Very low	34.7	Very low	179 Å²	179	143.2 Å²	143.2	94%	0.937	82%	0.815	S	S	*	*			trans	-105.8	130	159.4	-78.4	158.8	0	0	0	109.1
49	L	32.2	Very low	35.1	Very low	166 Å²	166	143.7 Å²	143.7	87%	0.869	81%	0.81	S	S	*	*			trans	-86.3	153.3	171.4	-115.8	78.9	0	0	0	111.4
50	P	40.4	Very low	34.7	Very low	115 Å²	115	139.9 Å²	139.9	75%	0.747	81%	0.807	S	S	*	*			trans	-103.9	169.9	169.3	37	-28.3	0	0	0	114.9
51	P	41.3	Very low	35.1	Very low	125 Å²	125	137.7 Å²	137.7	81%	0.812	80%	0.804	S	S	*	*			trans	-101.3	-178.8	-169.6	41.3	-33	0	0	0	115.5
52	P	58	Low	35.5	Very low	89 Å²	89	136.6 Å²	136.6	58%	0.578	79%	0.791	S	S	*	*			trans	-117	173.7	-139.2	43.3	-36.6	0	0	0	120.2
53	W	39.3	Very low	36.4	Very low	248 Å²	248	131.1 Å²	131.1	94%	0.939	78%	0.779	S	S	*	*			trans	79.5	134.1	166.5	-56.3	-59.5	0	0	0	118.4
54	G	26.1	Very low	37.5	Very low	74 Å²	74	132 Å²	132	76%	0.763	77%	0.771	S	S	*	*			cis	-174.4	-174.7	5.4	0	0	0	0	0	113.3
55	A	27.2	Very low	39.4	Very low	109 Å²	109	127.7 Å²	127.7	90%	0.901	74%	0.74	S	S	*	*			trans	90.5	110.4	177.5	0	0	0	0	0	117.7
56	A	35.3	Very low	42.2	Very low	87 Å²	87	126.3 Å²	126.3	72%	0.719	72%	0.718	S	S	*	*			trans	-32.7	133.7	176	0	0	0	0	0	118.2
57	M	29.2	Very low	45	Very low	171 Å²	171	121.7 Å²	121.7	84%	0.842	69%	0.688	S	S	*	*				-155.8	119	113.5	-83.1	-50.7	162.7	0	0	109.4
58	T	31.7	Very low	47.7	Very low	113 Å²	113	119 Å²	119	69%	0.693	67%	0.667	S	S	*	*			trans	33.5	133	159.8	51.4	0	0	0	0	122.3	D60	T58-D60 PolarHBondContact O-N 3.26Å
59	P	39.6	Very low	50.6	Low	115 Å²	115	110.7 Å²	110.7	75%	0.747	62%	0.624	S	S	*	*			trans	-90	93.1	175.9	36.2	-28.3	0	0	0	111.5	L61	P59-L61 PolarHBondContact O-N 2.92Å
60	D	32.2	Very low	53.5	Low	149 Å²	149	104 Å²	104	80%	0.797	59%	0.591	S	S	*	*			trans	-90.8	80.6	165.7	-79.9	-10.1	0	0	0	110.1	T58	T58-D60 PolarHBondContact O-N 3.26Å
61	L	42.6	Very low	55.9	Low	156 Å²	156	98.8 Å²	98.8	82%	0.817	56%	0.556	S	S	*	*			trans	-93.4	86.5	166.7	-82.8	162.9	0	0	0	108.9	P59	P59-L61 PolarHBondContact O-N 2.92Å
62	L	43.3	Very low	58.1	Low	96 Å²	96	94.7 Å²	94.7	50%	0.503	53%	0.527	S	S	.	.	S	Bend	trans	-167.9	91.7	147.5	-116.3	111.4	0	0	0	111.1	F64 D100	L62-F64 WeakPolarHBondContact O-CD2 3.43Å; L62-F64 VanDerWaalsContact O-CE2 3.28Å; L62-F64 WeakPolarHBondContact O-CE2 3.31Å; L62-F64 WeakPolarHBondContact O-CG 3.15Å; L62-F64 PolarHBondContact O-N 3.44Å; L62-D100 HydrophobicContact CD2-CB 3.55Å
63	N	49.3	Very low	59	Low	119 Å²	119	93 Å²	93	64%	0.636	51%	0.513	S	S	*	.			trans	33.8	36	147.8	-51.6	-34.6	0	0	0	122	K65	N63-K65 PolarHBondContact O-N 3.25Å
64	F	56.7	Low	60.2	Low	132 Å²	132	87.4 Å²	87.4	58%	0.579	50%	0.498	S	S	*	.			trans	-76	85.5	174.9	-60.7	-64.7	0	0	0	111.9	L62	L62-F64 WeakPolarHBondContact O-CD2 3.43Å; L62-F64 VanDerWaalsContact O-CE2 3.28Å; L62-F64 WeakPolarHBondContact O-CE2 3.31Å; L62-F64 WeakPolarHBondContact O-CG 3.15Å; L62-F64 PolarHBondContact O-N 3.44Å
65	K	79.4	Confident	61.3	Low	36 Å²	36	86.7 Å²	86.7	16%	0.157	48%	0.48	C	S	.	.			trans	-82.3	119.3	169.3	-169.8	175.8	177.9	-169.8	0	109.4	N63 L98 N161 W162 A165	N63-K65 PolarHBondContact O-N 3.25Å; K65-L98 HydrophobicContact CB-CB 3.97Å; K65-L98 HydrophobicContact CB-CD2 3.99Å; K65-L98 VanDerWaalsContact O-CB 3.3Å; K65-L98 WeakPolarHBondContact O-CB 3.28Å; K65-L98 PolarHBondContact O-N 3.45Å; K65-N161 WeakPolarHBondContact CE-OD1 3.46Å; K65-N161 PolarHBondContact NZ-O 3.04Å; K65-N161 PolarHBondContact NZ-OD1 3.41Å; K65-W162 HydrophobicContact CB-CH2 4.26Å; K65-W162 HydrophobicContact CB-CZ3 4.2Å; K65-W162 HydrophobicContact CD-CD2 3.76Å; K65-W162 HydrophobicContact CD-CE3 3.76Å; K65-W162 HydrophobicContact CD-CG 4.37Å; K65-W162 HydrophobicContact CD-CH2 4.21Å; K65-W162 HydrophobicContact CD-CZ2 4.19Å; K65-W162 HydrophobicContact CD-CZ3 4Å; K65-W162 VanDerWaalsContact CE-CD2 3.47Å; K65-W162 HydrophobicContact CG-CD2 4.4Å; K65-W162 HydrophobicContact CG-CE3 4.25Å; K65-W162 HydrophobicContact CG-CH2 3.83Å; K65-W162 HydrophobicContact CG-CZ2 3.96Å; K65-W162 HydrophobicContact CG-CZ3 3.98Å; K65-W162 VanDerWaalsContact NZ-CD2 3.28Å; K65-W162 VanDerWaalsContact O-CH2 3.29Å; K65-W162 WeakPolarHBondContact O-CH2 3.46Å; K65-A165 HydrophobicContact CD-CB 3.72Å
66	K	88.9	Confident	61.9	Low	101 Å²	101	84.8 Å²	84.8	44%	0.439	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	151.6	176.4	-54.2	-172	-176	-173.9	0	111.5	W95 F96 V97 E112	K66-W95 HydrophobicContact CB-CH2 4.45Å; K66-W95 HydrophobicContact CB-CZ2 3.84Å; K66-W95 HydrophobicContact CD-CZ2 4.45Å; K66-F96 CarbonylContact C-O 3.58Å; K66-F96 WeakPolarHBondContact CA-O 3.29Å; K66-V97 HydrophobicContact CD-CG1 4.24Å; K66-V97 HydrophobicContact CD-CG2 4.04Å; K66-V97 HydrophobicContact CG-CB 4.36Å; K66-V97 HydrophobicContact CG-CG1 4.04Å; K66-V97 HydrophobicContact CG-CG2 4.04Å; K66-E112 WeakPolarHBondContact CE-OE1 3.31Å; K66-E112 IonicContact NZ-OE1 3.89Å; K66-E112 PolarHBondContact NZ-OE1 3Å
67	G	88.6	Confident	62.1	Low	13 Å²	13	89.4 Å²	89.4	13%	0.134	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.5	166.5	171.1	0	0	0	0	0	115.6	F96	G67-F96 PolarHBondContact N-O 2.8Å; G67-F96 WeakPolarHBondContact O-CB 3.29Å; G67-F96 PolarHBondContact O-N 3.3Å
68	W	90.6	Very high	62.7	Low	106 Å²	106	86.7 Å²	86.7	40%	0.402	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	130.3	179.8	-69.8	104	0	0	0	112.8	K93 H94 W95 R107 D108	W68-K93 HydrophobicContact CE3-CD 4.08Å; W68-K93 VanDerWaalsContact CE3-CE 3.5Å; W68-K93 HydrophobicContact CE3-CG 3.77Å; W68-K93 HydrophobicContact CZ3-CG 4.3Å; W68-H94 WeakPolarHBondContact CA-O 3.32Å; W68-H94 VanDerWaalsContact CE3-O 3.27Å; W68-W95 AromaticContact CD1-CE3 3.54Å; W68-W95 AromaticContact CD1-CZ3 3.48Å; W68-W95 VanDerWaalsContact CD1-CZ3 3.48Å; W68-W95 HydrophobicContact CD2-CB 4.47Å; W68-W95 AromaticContact CD2-CE3 3.72Å; W68-W95 HydrophobicContact CD2-CE3 3.72Å; W68-W95 HydrophobicContact CD2-CZ3 4.44Å; W68-W95 AromaticContact CE2-CE3 3.51Å; W68-W95 HydrophobicContact CE3-CB 4.14Å; W68-W95 HydrophobicContact CE3-CE3 4.49Å; W68-W95 AromaticContact CG-CE3 3.77Å; W68-W95 HydrophobicContact CG-CE3 3.77Å; W68-W95 HydrophobicContact CG-CZ3 4.12Å; W68-W95 HydrophobicContact CH2-CB 4.15Å; W68-W95 HydrophobicContact CZ2-CB 4.41Å; W68-W95 HydrophobicContact CZ2-CE3 4.17Å; W68-W95 HydrophobicContact CZ3-CB 3.99Å; W68-W95 AromaticContact NE1-CE3 3.35Å; W68-W95 VanDerWaalsContact NE1-CE3 3.35Å; W68-W95 AromaticContact NE1-CZ3 3.42Å; W68-R107 WeakPolarHBondContact CH2-O 3.49Å; W68-R107 WeakPolarHBondContact CZ3-O 3.41Å; W68-D108 HydrophobicContact CH2-CB 4.09Å
69	M	92.1	Very high	63.2	Low	5 Å²	5	86.1 Å²	86.1	3%	0.025	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	164.9	172.8	-46	-179.6	63.3	0	0	109.9	K93 H94 F96 F140 L151 A153 W162	M69-K93 WeakPolarHBondContact O-CA 3.39Å; M69-H94 PolarHBondContact N-O 3.25Å; M69-H94 PolarHBondContact O-N 2.81Å; M69-H94 VanDerWaalsContact O-O 3.09Å; M69-F96 HydrophobicContact CB-CD2 3.53Å; M69-F96 HydrophobicContact CB-CE2 3.65Å; M69-F96 HydrophobicContact CB-CG 4.37Å; M69-F96 HydrophobicContact CG-CD2 3.86Å; M69-F96 HydrophobicContact CG-CE2 4.46Å; M69-F96 HydrophobicContact CG-CG 4.34Å; M69-F96 WeakPolarHBondContact O-CE2 3.34Å; M69-F96 HydrophobicContact SD-CB 4.39Å; M69-F96 HydrophobicContact SD-CD2 4.32Å; M69-F96 HydrophobicContact SD-CG 4.27Å; M69-F140 HydrophobicContact CE-CD1 4.47Å; M69-F140 HydrophobicContact CE-CE1 3.14Å; M69-F140 HydrophobicContact CE-CZ 3.23Å; M69-F140 HydrophobicContact SD-CZ 4.44Å; M69-L151 HydrophobicContact CE-CB 4.39Å; M69-L151 HydrophobicContact CE-CD2 4.27Å; M69-L151 HydrophobicContact SD-CD2 4.43Å; M69-A153 HydrophobicContact CE-CB 4.36Å; M69-W162 HydrophobicContact CE-CB 4.19Å; M69-W162 HydrophobicContact CE-CD2 4.24Å; M69-W162 HydrophobicContact CE-CG 3.81Å; M69-W162 HydrophobicContact CG-CZ2 4.46Å; M69-W162 VanDerWaalsContact SD-CD1 3.58Å; M69-W162 HydrophobicContact SD-CD2 3.45Å; M69-W162 HydrophobicContact SD-CE3 4.05Å; M69-W162 HydrophobicContact SD-CG 3.66Å; M69-W162 HydrophobicContact SD-CH2 4.37Å; M69-W162 HydrophobicContact SD-CZ2 3.84Å; M69-W162 HydrophobicContact SD-CZ3 4.45Å; M69-W162 PolarHBondContact SD-NE1 3.23Å; M69-W162 VanDerWaalsContact SD-NE1 3.4Å
70	S	91.1	Very high	63.3	Low	25 Å²	25	85.4 Å²	85.4	18%	0.175	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.5	173.5	-63.6	0	0	0	0	110.4	K92 L151 S152	S70-K92 CarbonylContact C-O 3.52Å; S70-K92 WeakPolarHBondContact CA-O 3.38Å; S70-L151 CarbonylContact O-C 3.55Å; S70-L151 VanDerWaalsContact O-CA 3.3Å; S70-L151 WeakPolarHBondContact O-CA 3.38Å; S70-S152 WeakPolarHBondContact CB-OG 3.28Å; S70-S152 PolarHBondContact N-O 3.18Å; S70-S152 PolarHBondContact O-N 2.92Å
71	I	91.5	Very high	64.2	Low	5 Å²	5	84.8 Å²	84.8	3%	0.026	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	145.1	173.4	-170.4	164.8	0	0	0	109	K92 F96 Y105 I121 Y149 L151	I71-K92 PolarHBondContact N-O 3.33Å; I71-K92 PolarHBondContact O-N 3.07Å; I71-F96 HydrophobicContact CB-CZ 4.05Å; I71-F96 HydrophobicContact CG2-CZ 4.26Å; I71-Y105 HydrophobicContact CD1-CE1 4.46Å; I71-I121 HydrophobicContact CD1-CD1 4.2Å; I71-Y149 HydrophobicContact CD1-CD1 4.13Å; I71-L151 HydrophobicContact CB-CG 4.33Å; I71-L151 HydrophobicContact CD1-CG 4.45Å; I71-L151 HydrophobicContact CG1-CG 4.24Å
72	L	87.6	Confident	64.2	Low	39 Å²	39	81.6 Å²	81.6	20%	0.204	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	118.4	172.6	-172.4	64.5	0	0	0	108	E74 W91 T150	L72-E74 PolarHBondContact O-N 2.79Å; L72-W91 HydrophobicContact CB-CD2 4.37Å; L72-W91 HydrophobicContact CB-CE3 4.02Å; L72-W91 HydrophobicContact CB-CH2 3.93Å; L72-W91 HydrophobicContact CB-CZ2 4.28Å; L72-W91 HydrophobicContact CB-CZ3 3.79Å; L72-W91 HydrophobicContact CD1-CD2 3.95Å; L72-W91 HydrophobicContact CD1-CE3 4.44Å; L72-W91 HydrophobicContact CD1-CG 4.23Å; L72-W91 HydrophobicContact CD1-CZ2 4.1Å; L72-W91 HydrophobicContact CD2-CH2 4.46Å; L72-W91 HydrophobicContact CD2-CZ2 4.27Å; L72-W91 HydrophobicContact CG-CZ2 4.47Å; L72-T150 PolarHBondContact N-O 3.37Å
73	D	77.9	Confident	63.8	Low	53 Å²	53	84.6 Å²	84.6	28%	0.283	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-65.4	127.6	173.3	-74.6	-4.8	0	0	0	109.8	Q90 K92	D73-Q90 PolarHBondContact N-O 2.99Å; D73-K92 WeakPolarHBondContact OD2-CD 3.23Å; D73-K92 WeakPolarHBondContact OD2-CE 3.43Å; D73-K92 IonicContact OD2-NZ 2.83Å; D73-K92 PolarHBondContact OD2-NZ 3.39Å
74	E	63.7	Low	63.5	Low	131 Å²	131	85.7 Å²	85.7	61%	0.612	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-66.6	133.4	170.6	-81	-79.2	123.6	0	0	109.5	L72 G76	L72-E74 PolarHBondContact O-N 2.79Å; E74-G76 PolarHBondContact O-N 3.11Å
75	P	48.6	Very low	62.4	Low	59 Å²	59	85.6 Å²	85.6	38%	0.383	50%	0.5	S	S	.	.			trans	-70.6	110.5	165.3	28.7	-26.6	0	0	0	107.8
76	G	39.7	Very low	60.5	Low	69 Å²	69	90.3 Å²	90.3	71%	0.711	53%	0.533	S	S	*	.			trans	-52.3	150.9	173.2	0	0	0	0	0	112.3	E74	E74-G76 PolarHBondContact O-N 3.11Å
77	E	39.2	Very low	58.4	Low	185 Å²	185	89.6 Å²	89.6	86%	0.864	54%	0.54	S	S	*	.	S	Bend	trans	-41.1	152.7	178.3	-88.7	-160.8	159.9	0	0	114.9
78	P	42.7	Very low	56.5	Low	113 Å²	113	94.2 Å²	94.2	73%	0.734	57%	0.566	S	S	*	*			trans	-61.5	133.7	-165.5	24.9	-34.5	0	0	0	112
79	P	42.5	Very low	55.3	Low	102 Å²	102	91.9 Å²	91.9	66%	0.662	57%	0.566	S	S	*	*			trans	-65.3	141.2	167.3	27.6	-31	0	0	0	108.9
80	S	42.3	Very low	54.8	Low	99 Å²	99	97.6 Å²	97.6	69%	0.692	59%	0.593	S	S	*	*			trans	-42.8	149.4	158.6	-68.5	0	0	0	0	110.5	S82	S80-S82 VanDerWaalsContact C-N 3.29Å; S80-S82 PolarHBondContact O-N 2.81Å
81	P	49.9	Very low	54.5	Low	137 Å²	137	99.5 Å²	99.5	89%	0.89	60%	0.596	S	S	*	*	S	Bend	trans	-75.8	80.1	-161.1	33.3	-35.6	0	0	0	110.9
82	S	42.6	Very low	54.4	Low	89 Å²	89	103.5 Å²	103.5	62%	0.622	61%	0.613	S	S	*	*	S	Bend	trans	-166.2	113.2	164.7	46	0	0	0	0	109	S80	S80-S82 VanDerWaalsContact C-N 3.29Å; S80-S82 PolarHBondContact O-N 2.81Å
83	L	36.1	Very low	54.6	Low	159 Å²	159	107.8 Å²	107.8	83%	0.832	63%	0.63	S	S	*	*			trans	93.1	111.2	167.9	-57.8	152.1	0	0	0	115.7	T85	L83-T85 PolarHBondContact O-N 3.48Å
84	T	41.6	Very low	55.2	Low	142 Å²	142	105.9 Å²	105.9	87%	0.871	62%	0.62	S	S	*	*			trans	-66.2	111.9	177.9	44.9	0	0	0	0	112.2
85	T	33.1	Very low	56.5	Low	129 Å²	129	101.8 Å²	101.8	79%	0.791	60%	0.599	S	S	*	*			trans	-136.2	100.7	148.9	47.8	0	0	0	0	108.2	L83 S87	L83-T85 PolarHBondContact O-N 3.48Å; T85-S87 PolarHBondContact O-N 3.42Å
86	T	39.4	Very low	58.6	Low	136 Å²	136	99 Å²	99	83%	0.834	58%	0.58	S	S	*	*			trans	-56.4	95.9	165.3	28.2	0	0	0	0	109.1	T88	T86-T88 PolarHBondContact O-N 2.93Å; T86-T88 VanDerWaalsContact O-N 3.08Å
87	S	46	Very low	61	Low	85 Å²	85	96.1 Å²	96.1	59%	0.594	55%	0.549	S	S	*	.			trans	-70.4	97.7	167.6	-176.7	0	0	0	0	107.7	T85	T85-S87 PolarHBondContact O-N 3.42Å
88	T	49.3	Very low	63.4	Low	110 Å²	110	87.4 Å²	87.4	68%	0.675	51%	0.508	S	S	*	.			trans	-77	120.9	173	44.3	0	0	0	0	108	T86 Q90	T86-T88 PolarHBondContact O-N 2.93Å; T86-T88 VanDerWaalsContact O-N 3.08Å; T88-Q90 PolarHBondContact O-N 2.99Å
89	S	64.4	Low	65.4	Low	58 Å²	58	83.1 Å²	83.1	41%	0.406	48%	0.48	S	S	.	.			trans	-55.1	102.6	176.1	-54.6	0	0	0	0	110.2
90	Q	81.2	Confident	67.2	Low	124 Å²	124	83 Å²	83	58%	0.579	47%	0.474	S	S	*	.			trans	-101.7	134.9	-175.4	-173.9	176	74.9	0	0	109.8	D73 T88 K92	D73-Q90 PolarHBondContact N-O 2.99Å; T88-Q90 PolarHBondContact O-N 2.99Å; Q90-K92 PolarHBondContact O-N 2.88Å
91	W	85.9	Confident	69.1	Low	66 Å²	66	79.5 Å²	79.5	25%	0.25	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	119.4	173.7	-67.7	93.2	0	0	0	110.3	L72 V134 T150	L72-W91 HydrophobicContact CB-CD2 4.37Å; L72-W91 HydrophobicContact CB-CE3 4.02Å; L72-W91 HydrophobicContact CB-CH2 3.93Å; L72-W91 HydrophobicContact CB-CZ2 4.28Å; L72-W91 HydrophobicContact CB-CZ3 3.79Å; L72-W91 HydrophobicContact CD1-CD2 3.95Å; L72-W91 HydrophobicContact CD1-CE3 4.44Å; L72-W91 HydrophobicContact CD1-CG 4.23Å; L72-W91 HydrophobicContact CD1-CZ2 4.1Å; L72-W91 HydrophobicContact CD2-CH2 4.46Å; L72-W91 HydrophobicContact CD2-CZ2 4.27Å; L72-W91 HydrophobicContact CG-CZ2 4.47Å; W91-V134 HydrophobicContact CH2-CB 4.08Å; W91-V134 HydrophobicContact CH2-CG1 3.7Å; W91-V134 HydrophobicContact CZ2-CB 3.96Å; W91-V134 HydrophobicContact CZ2-CG1 3.96Å; W91-T150 HydrophobicContact CH2-CG2 3.81Å; W91-T150 HydrophobicContact CZ3-CG2 4.48Å
92	K	88.1	Confident	70.9	Confident	88 Å²	88	73.3 Å²	73.3	38%	0.383	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.2	175.9	-69.6	-176.8	-178.9	160.9	0	111	S70 I71 D73 Q90 H94	S70-K92 CarbonylContact C-O 3.52Å; S70-K92 WeakPolarHBondContact CA-O 3.38Å; I71-K92 PolarHBondContact N-O 3.33Å; I71-K92 PolarHBondContact O-N 3.07Å; D73-K92 WeakPolarHBondContact OD2-CD 3.23Å; D73-K92 WeakPolarHBondContact OD2-CE 3.43Å; D73-K92 IonicContact OD2-NZ 2.83Å; D73-K92 PolarHBondContact OD2-NZ 3.39Å; Q90-K92 PolarHBondContact O-N 2.88Å; K92-H94 WeakPolarHBondContact CB-CE1 3.49Å; K92-H94 PolarHBondContact O-ND1 2.87Å
93	K	91.8	Very high	73.3	Confident	129 Å²	129	69.1 Å²	69.1	56%	0.561	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	125.5	177.3	-174.6	-174.4	177.1	-166	0	109.1	W68 M69	W68-K93 HydrophobicContact CE3-CD 4.08Å; W68-K93 VanDerWaalsContact CE3-CE 3.5Å; W68-K93 HydrophobicContact CE3-CG 3.77Å; W68-K93 HydrophobicContact CZ3-CG 4.3Å; M69-K93 WeakPolarHBondContact O-CA 3.39Å
94	H	91.4	Very high	75.9	Confident	14 Å²	14	64 Å²	64	7%	0.065	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	158.3	178.1	-66.3	94.6	0	0	0	110.6	W68 M69 K92 F96 Y105 Y106 D118	W68-H94 WeakPolarHBondContact CA-O 3.32Å; W68-H94 VanDerWaalsContact CE3-O 3.27Å; M69-H94 PolarHBondContact N-O 3.25Å; M69-H94 PolarHBondContact O-N 2.81Å; M69-H94 VanDerWaalsContact O-O 3.09Å; K92-H94 WeakPolarHBondContact CB-CE1 3.49Å; K92-H94 PolarHBondContact O-ND1 2.87Å; H94-F96 HydrophobicContact CB-CD2 4.3Å; H94-F96 HydrophobicContact CB-CE2 3.7Å; H94-F96 HydrophobicContact CB-CZ 4.2Å; H94-F96 VanDerWaalsContact O-CD2 3.3Å; H94-F96 WeakPolarHBondContact O-CD2 3.45Å; H94-Y105 HydrophobicContact CB-CD2 4Å; H94-Y105 HydrophobicContact CB-CG 4.39Å; H94-Y105 AromaticContact CD2-CD2 3.78Å; H94-Y105 AromaticContact CG-CD2 3.76Å; H94-Y106 CarbonylContact C-O 3.51Å; H94-Y106 WeakPolarHBondContact CA-O 3.39Å; H94-Y106 WeakPolarHBondContact CB-O 3.34Å; H94-D118 IonicContact CD2-OD2 3.06Å; H94-D118 IonicContact NE2-OD2 3.99Å; H94-D118 PolarHBondContact NE2-OD2 3.43Å
95	W	91.2	Very high	78.3	Confident	45 Å²	45	59 Å²	59	17%	0.17	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	112	172.8	179.1	-108.7	0	0	0	109.2	K66 W68 Y105 Y106 E112	K66-W95 HydrophobicContact CB-CH2 4.45Å; K66-W95 HydrophobicContact CB-CZ2 3.84Å; K66-W95 HydrophobicContact CD-CZ2 4.45Å; W68-W95 AromaticContact CD1-CE3 3.54Å; W68-W95 AromaticContact CD1-CZ3 3.48Å; W68-W95 VanDerWaalsContact CD1-CZ3 3.48Å; W68-W95 HydrophobicContact CD2-CB 4.47Å; W68-W95 AromaticContact CD2-CE3 3.72Å; W68-W95 HydrophobicContact CD2-CE3 3.72Å; W68-W95 HydrophobicContact CD2-CZ3 4.44Å; W68-W95 AromaticContact CE2-CE3 3.51Å; W68-W95 HydrophobicContact CE3-CB 4.14Å; W68-W95 HydrophobicContact CE3-CE3 4.49Å; W68-W95 AromaticContact CG-CE3 3.77Å; W68-W95 HydrophobicContact CG-CE3 3.77Å; W68-W95 HydrophobicContact CG-CZ3 4.12Å; W68-W95 HydrophobicContact CH2-CB 4.15Å; W68-W95 HydrophobicContact CZ2-CB 4.41Å; W68-W95 HydrophobicContact CZ2-CE3 4.17Å; W68-W95 HydrophobicContact CZ3-CB 3.99Å; W68-W95 AromaticContact NE1-CE3 3.35Å; W68-W95 VanDerWaalsContact NE1-CE3 3.35Å; W68-W95 AromaticContact NE1-CZ3 3.42Å; W95-Y105 CarbonylContact O-C 3.54Å; W95-Y105 VanDerWaalsContact O-CA 3.26Å; W95-Y105 WeakPolarHBondContact O-CA 3.4Å; W95-Y106 PolarHBondContact N-O 3.33Å; W95-Y106 PolarHBondContact O-N 3.41Å; W95-E112 PolarHBondContact NE1-OE2 3.36Å
96	F	91.8	Very high	81.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	139.9	-176.8	-73.4	-98.2	0	0	0	111.2	K66 G67 M69 I71 H94 L103 K104 Y105 L151 W162	K66-F96 CarbonylContact C-O 3.58Å; K66-F96 WeakPolarHBondContact CA-O 3.29Å; G67-F96 PolarHBondContact N-O 2.8Å; G67-F96 WeakPolarHBondContact O-CB 3.29Å; G67-F96 PolarHBondContact O-N 3.3Å; M69-F96 HydrophobicContact CB-CD2 3.53Å; M69-F96 HydrophobicContact CB-CE2 3.65Å; M69-F96 HydrophobicContact CB-CG 4.37Å; M69-F96 HydrophobicContact CG-CD2 3.86Å; M69-F96 HydrophobicContact CG-CE2 4.46Å; M69-F96 HydrophobicContact CG-CG 4.34Å; M69-F96 WeakPolarHBondContact O-CE2 3.34Å; M69-F96 HydrophobicContact SD-CB 4.39Å; M69-F96 HydrophobicContact SD-CD2 4.32Å; M69-F96 HydrophobicContact SD-CG 4.27Å; I71-F96 HydrophobicContact CB-CZ 4.05Å; I71-F96 HydrophobicContact CG2-CZ 4.26Å; H94-F96 HydrophobicContact CB-CD2 4.3Å; H94-F96 HydrophobicContact CB-CE2 3.7Å; H94-F96 HydrophobicContact CB-CZ 4.2Å; H94-F96 VanDerWaalsContact O-CD2 3.3Å; H94-F96 WeakPolarHBondContact O-CD2 3.45Å; F96-L103 HydrophobicContact CB-CD1 4.31Å; F96-L103 HydrophobicContact CD1-CD1 4.18Å; F96-L103 HydrophobicContact CD1-CD2 3.95Å; F96-L103 HydrophobicContact CD1-CG 3.93Å; F96-L103 HydrophobicContact CE1-CD2 4.39Å; F96-K104 CarbonylContact C-O 3.57Å; F96-K104 WeakPolarHBondContact CA-O 3.49Å; F96-Y105 HydrophobicContact CD1-CG 4.46Å; F96-Y105 VanDerWaalsContact CE1-CB 3.48Å; F96-Y105 AromaticContact CE1-CD1 3.84Å; F96-Y105 HydrophobicContact CE1-CD1 3.84Å; F96-Y105 AromaticContact CE1-CG 3.87Å; F96-Y105 HydrophobicContact CE1-CG 3.87Å; F96-Y105 HydrophobicContact CZ-CD1 4.35Å; F96-Y105 HydrophobicContact CZ-CG 4.07Å; F96-L151 HydrophobicContact CD1-CD2 4.11Å; F96-L151 HydrophobicContact CE1-CD2 3.53Å; F96-L151 HydrophobicContact CE2-CD2 4.4Å; F96-L151 HydrophobicContact CZ-CD2 3.72Å; F96-W162 HydrophobicContact CB-CH2 3.98Å; F96-W162 HydrophobicContact CB-CZ2 4.41Å
97	V	90.1	Very high	83.4	Confident	9 Å²	9	54.8 Å²	54.8	6%	0.055	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	113.8	176.8	179.6	0	0	0	0	108.3	K66 K104 Y106	K66-V97 HydrophobicContact CD-CG1 4.24Å; K66-V97 HydrophobicContact CD-CG2 4.04Å; K66-V97 HydrophobicContact CG-CB 4.36Å; K66-V97 HydrophobicContact CG-CG1 4.04Å; K66-V97 HydrophobicContact CG-CG2 4.04Å; V97-K104 PolarHBondContact N-O 3.09Å; V97-K104 PolarHBondContact O-N 2.96Å; V97-Y106 HydrophobicContact CB-CE2 4.17Å; V97-Y106 HydrophobicContact CG2-CD2 4.06Å; V97-Y106 HydrophobicContact CG2-CE2 3.83Å
98	L	90.3	Very high	85.2	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124.9	174.3	-176.5	61.8	0	0	0	109.7	K65 L103 L123 W162 A165 L166	K65-L98 HydrophobicContact CB-CB 3.97Å; K65-L98 HydrophobicContact CB-CD2 3.99Å; K65-L98 VanDerWaalsContact O-CB 3.3Å; K65-L98 WeakPolarHBondContact O-CB 3.28Å; K65-L98 PolarHBondContact O-N 3.45Å; L98-L103 HydrophobicContact CB-CD1 4.12Å; L98-L103 HydrophobicContact CD1-CD1 4.11Å; L98-L123 HydrophobicContact CD1-CD1 3.38Å; L98-W162 HydrophobicContact CB-CZ3 4.03Å; L98-A165 HydrophobicContact CD2-CB 3.7Å; L98-L166 HydrophobicContact CD1-CD2 3.72Å
99	T	85.4	Confident	86.6	Confident	23 Å²	23	51.2 Å²	51.2	14%	0.141	25%	0.245	C	C	.	.			trans	-107.2	-176.4	169.2	73.1	0	0	0	0	110.1	S101 S102	T99-S101 PolarHBondContact O-N 2.91Å; T99-S102 PolarHBondContact N-O 3.18Å; T99-S102 PolarHBondContact OG1-N 2.73Å; T99-S102 PolarHBondContact OG1-O 2.89Å; T99-S102 PolarHBondContact OG1-OG 2.91Å; T99-S102 VanDerWaalsContact OG1-OG 3.09Å
100	D	79.3	Confident	87.3	Confident	101 Å²	101	52.8 Å²	52.8	54%	0.54	25%	0.253	S	S	.	.	S	Bend	trans	-67.8	-22.9	179.1	68.1	-23.2	0	0	0	113.8	L62 T169	L62-D100 HydrophobicContact CD2-CB 3.55Å; D100-T169 WeakPolarHBondContact O-CG2 3.19Å
101	S	82.2	Confident	87.2	Confident	25 Å²	25	47.3 Å²	47.3	18%	0.175	23%	0.228	C	C	.	.	S	Bend	trans	-137.6	-11.7	-170.4	48.4	0	0	0	0	114.4	T99 L123 R124	T99-S101 PolarHBondContact O-N 2.91Å; S101-L123 WeakPolarHBondContact O-CB 3.39Å; S101-L123 PolarHBondContact O-N 2.75Å; S101-R124 PolarHBondContact OG-NH2 3.33Å
102	S	88.8	Confident	87	Confident	7 Å²	7	46 Å²	46	5%	0.049	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	158.4	176.8	69.2	0	0	0	0	113.2	T99 E120 I121	T99-S102 PolarHBondContact N-O 3.18Å; T99-S102 PolarHBondContact OG1-N 2.73Å; T99-S102 PolarHBondContact OG1-O 2.89Å; T99-S102 PolarHBondContact OG1-OG 2.91Å; T99-S102 VanDerWaalsContact OG1-OG 3.09Å; S102-E120 WeakPolarHBondContact CB-OE1 3.32Å; S102-E120 PolarHBondContact OG-OE1 3.3Å; S102-I121 CarbonylContact C-O 3.55Å; S102-I121 WeakPolarHBondContact CA-O 3.48Å
103	L	91.5	Very high	86.4	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	105.7	170.6	179.6	68.5	0	0	0	108.3	F96 L98 I121 L123 I142 L151 W162 L166	F96-L103 HydrophobicContact CB-CD1 4.31Å; F96-L103 HydrophobicContact CD1-CD1 4.18Å; F96-L103 HydrophobicContact CD1-CD2 3.95Å; F96-L103 HydrophobicContact CD1-CG 3.93Å; F96-L103 HydrophobicContact CE1-CD2 4.39Å; L98-L103 HydrophobicContact CB-CD1 4.12Å; L98-L103 HydrophobicContact CD1-CD1 4.11Å; L103-I121 HydrophobicContact CB-CB 4.29Å; L103-I121 HydrophobicContact CD2-CD1 4.34Å; L103-I121 PolarHBondContact N-O 3.43Å; L103-I121 PolarHBondContact O-N 2.96Å; L103-L123 HydrophobicContact CB-CD1 4.16Å; L103-L123 HydrophobicContact CB-CD2 4.2Å; L103-L123 HydrophobicContact CB-CG 4.25Å; L103-I142 HydrophobicContact CD2-CD1 3.7Å; L103-L151 HydrophobicContact CD2-CD2 4.46Å; L103-W162 HydrophobicContact CD1-CZ3 3.85Å; L103-L166 HydrophobicContact CB-CD2 4.48Å; L103-L166 HydrophobicContact CD2-CD2 4.06Å
104	K	91.3	Very high	85.5	Confident	50 Å²	50	46.4 Å²	46.4	22%	0.217	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	147.2	179.7	-63.3	-175.8	177.9	-173.7	0	110.5	F96 V97 Y106 E120	F96-K104 CarbonylContact C-O 3.57Å; F96-K104 WeakPolarHBondContact CA-O 3.49Å; V97-K104 PolarHBondContact N-O 3.09Å; V97-K104 PolarHBondContact O-N 2.96Å; K104-Y106 HydrophobicContact CB-CE2 3.93Å; K104-E120 WeakPolarHBondContact CE-OE1 3.26Å; K104-E120 HydrophobicContact CG-CB 4.41Å; K104-E120 HydrophobicContact CG-CG 4.01Å
105	Y	91.6	Very high	84.9	Confident	39 Å²	39	50.7 Å²	50.7	15%	0.153	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	141.5	172.7	65.1	-93	0	0	0	113.1	I71 H94 W95 F96 D118 G119	I71-Y105 HydrophobicContact CD1-CE1 4.46Å; H94-Y105 HydrophobicContact CB-CD2 4Å; H94-Y105 HydrophobicContact CB-CG 4.39Å; H94-Y105 AromaticContact CD2-CD2 3.78Å; H94-Y105 AromaticContact CG-CD2 3.76Å; W95-Y105 CarbonylContact O-C 3.54Å; W95-Y105 VanDerWaalsContact O-CA 3.26Å; W95-Y105 WeakPolarHBondContact O-CA 3.4Å; F96-Y105 HydrophobicContact CD1-CG 4.46Å; F96-Y105 VanDerWaalsContact CE1-CB 3.48Å; F96-Y105 AromaticContact CE1-CD1 3.84Å; F96-Y105 HydrophobicContact CE1-CD1 3.84Å; F96-Y105 AromaticContact CE1-CG 3.87Å; F96-Y105 HydrophobicContact CE1-CG 3.87Å; F96-Y105 HydrophobicContact CZ-CD1 4.35Å; F96-Y105 HydrophobicContact CZ-CG 4.07Å; Y105-D118 HydrophobicContact CD2-CB 3.95Å; Y105-D118 HydrophobicContact CE2-CB 3.9Å; Y105-D118 PolarHBondContact O-N 2.92Å; Y105-G119 VanDerWaalsContact CD1-O 3.29Å; Y105-G119 WeakPolarHBondContact CD1-O 3.49Å; Y105-G119 PolarHBondContact N-O 3.45Å; Y105-G119 PolarHBondContact O-N 3.2Å
106	Y	91.4	Very high	84.3	Confident	11 Å²	11	54.9 Å²	54.9	4%	0.043	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	160	-173.2	-57.6	-92.6	0	0	0	110.2	H94 W95 V97 K104 D108 E112 E116 L117	H94-Y106 CarbonylContact C-O 3.51Å; H94-Y106 WeakPolarHBondContact CA-O 3.39Å; H94-Y106 WeakPolarHBondContact CB-O 3.34Å; W95-Y106 PolarHBondContact N-O 3.33Å; W95-Y106 PolarHBondContact O-N 3.41Å; V97-Y106 HydrophobicContact CB-CE2 4.17Å; V97-Y106 HydrophobicContact CG2-CD2 4.06Å; V97-Y106 HydrophobicContact CG2-CE2 3.83Å; K104-Y106 HydrophobicContact CB-CE2 3.93Å; Y106-D108 VanDerWaalsContact C-N 3.35Å; Y106-E112 HydrophobicContact CD1-CB 4.33Å; Y106-E112 HydrophobicContact CD2-CB 4.23Å; Y106-E112 HydrophobicContact CD2-CG 4.43Å; Y106-E112 HydrophobicContact CE2-CB 4.45Å; Y106-E112 HydrophobicContact CE2-CG 4.22Å; Y106-E112 HydrophobicContact CG-CB 4.17Å; Y106-E116 WeakPolarHBondContact CD1-O 3.45Å; Y106-L117 HydrophobicContact CD1-CB 4.4Å; Y106-L117 HydrophobicContact CE1-CB 3.98Å
107	R	88.3	Confident	84	Confident	164 Å²	164	58.9 Å²	58.9	62%	0.619	31%	0.307	S	S	*	.	S	Bend	trans	-63.2	-43.7	174.6	-69.4	-173.9	-176.4	141.6	13.4	112	W68 D118	W68-R107 WeakPolarHBondContact CH2-O 3.49Å; W68-R107 WeakPolarHBondContact CZ3-O 3.41Å; R107-D118 VanDerWaalsContact CG-CG 3.47Å; R107-D118 WeakPolarHBondContact CG-OD2 3.42Å; R107-D118 IonicContact CZ-OD1 3.95Å; R107-D118 IonicContact CZ-OD2 2.86Å; R107-D118 IonicContact NE-OD1 2.74Å; R107-D118 PolarHBondContact NE-OD1 3.35Å; R107-D118 IonicContact NE-OD2 3.6Å; R107-D118 PolarHBondContact NE-OD2 3.43Å; R107-D118 IonicContact NH2-OD1 2.97Å; R107-D118 PolarHBondContact NH2-OD1 2.95Å; R107-D118 IonicContact NH2-OD2 2.73Å
108	D	85.1	Confident	83.6	Confident	64 Å²	64	61 Å²	61	34%	0.342	32%	0.317	S	S	.	.	S	Bend	trans	-156.8	178.9	-178.1	54.6	34.5	0	0	0	111.8	W68 Y106 T110 A111 E112	W68-D108 HydrophobicContact CH2-CB 4.09Å; Y106-D108 VanDerWaalsContact C-N 3.35Å; D108-T110 PolarHBondContact O-N 3.41Å; D108-T110 PolarHBondContact OD1-N 2.66Å; D108-T110 PolarHBondContact OD1-OG1 2.89Å; D108-T110 PolarHBondContact OD2-OG1 3.47Å; D108-A111 PolarHBondContact O-N 3.42Å; D108-A111 WeakPolarHBondContact OD1-CB 3.4Å; D108-A111 PolarHBondContact OD1-N 2.92Å; D108-E112 PolarHBondContact O-N 3.19Å
109	S	77.8	Confident	83.4	Confident	56 Å²	56	61.4 Å²	61.4	39%	0.392	32%	0.323	S	S	.	.	H	α-helix	trans	-65.8	-26.7	179.1	-167	0	0	0	0	112.4	E112 E113	S109-E112 WeakPolarHBondContact O-CB 3.46Å; S109-E112 PolarHBondContact O-N 3.4Å; S109-E113 PolarHBondContact O-N 2.96Å
110	T	79.3	Confident	83.6	Confident	91 Å²	91	64.8 Å²	64.8	56%	0.558	34%	0.337	S	S	*	.	H	α-helix	trans	-74.1	-35.6	177.9	37.4	0	0	0	0	112	D108 E112 E113 A114	D108-T110 PolarHBondContact O-N 3.41Å; D108-T110 PolarHBondContact OD1-N 2.66Å; D108-T110 PolarHBondContact OD1-OG1 2.89Å; D108-T110 PolarHBondContact OD2-OG1 3.47Å; T110-E112 VanDerWaalsContact C-N 3.29Å; T110-E112 PolarHBondContact O-N 3.38Å; T110-E113 PolarHBondContact O-N 2.91Å; T110-A114 PolarHBondContact O-N 2.84Å; T110-A114 VanDerWaalsContact O-N 3.14Å
111	A	79.1	Confident	84.1	Confident	9 Å²	9	60 Å²	60	7%	0.074	31%	0.311	C	S	.	.	H	α-helix	trans	-67.5	-29.1	172.9	0	0	0	0	0	112.4	D108 A114 D115 E116	D108-A111 PolarHBondContact O-N 3.42Å; D108-A111 WeakPolarHBondContact OD1-CB 3.4Å; D108-A111 PolarHBondContact OD1-N 2.92Å; A111-A114 PolarHBondContact O-N 2.66Å; A111-D115 PolarHBondContact O-N 2.9Å; A111-D115 VanDerWaalsContact O-N 3.11Å; A111-E116 HydrophobicContact CB-CB 4.4Å; A111-E116 PolarHBondContact O-N 3.39Å
112	E	82.4	Confident	84.3	Confident	40 Å²	40	62.4 Å²	62.4	19%	0.187	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-44.8	170.2	-176.8	-173.3	-170.5	0	0	111.4	K66 W95 Y106 D108 S109 T110 A114 D115	K66-E112 WeakPolarHBondContact CE-OE1 3.31Å; K66-E112 IonicContact NZ-OE1 3.89Å; K66-E112 PolarHBondContact NZ-OE1 3Å; W95-E112 PolarHBondContact NE1-OE2 3.36Å; Y106-E112 HydrophobicContact CD1-CB 4.33Å; Y106-E112 HydrophobicContact CD2-CB 4.23Å; Y106-E112 HydrophobicContact CD2-CG 4.43Å; Y106-E112 HydrophobicContact CE2-CB 4.45Å; Y106-E112 HydrophobicContact CE2-CG 4.22Å; Y106-E112 HydrophobicContact CG-CB 4.17Å; D108-E112 PolarHBondContact O-N 3.19Å; S109-E112 WeakPolarHBondContact O-CB 3.46Å; S109-E112 PolarHBondContact O-N 3.4Å; T110-E112 VanDerWaalsContact C-N 3.29Å; T110-E112 PolarHBondContact O-N 3.38Å; E112-A114 PolarHBondContact O-N 3.15Å; E112-D115 PolarHBondContact O-N 2.92Å; E112-D115 VanDerWaalsContact O-N 3.13Å
113	E	74.5	Confident	84.2	Confident	164 Å²	164	62.3 Å²	62.3	77%	0.766	32%	0.321	S	S	*	.	H	α-helix	trans	-65.9	-28.1	178.8	-68.6	178.8	179.3	0	0	112.8	S109 T110	S109-E113 PolarHBondContact O-N 2.96Å; T110-E113 PolarHBondContact O-N 2.91Å
114	A	73.1	Confident	83.8	Confident	61 Å²	61	71.3 Å²	71.3	50%	0.504	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-2.7	175.4	0	0	0	0	0	114.1	T110 A111 E112 E116	T110-A114 PolarHBondContact O-N 2.84Å; T110-A114 VanDerWaalsContact O-N 3.14Å; A111-A114 PolarHBondContact O-N 2.66Å; E112-A114 PolarHBondContact O-N 3.15Å; A114-E116 HydrophobicContact CB-CG 4.02Å; A114-E116 PolarHBondContact O-N 2.84Å
115	D	79.1	Confident	83.4	Confident	104 Å²	104	69.8 Å²	69.8	56%	0.556	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	31.6	-171.8	-156.8	31.7	0	0	0	114.4	A111 E112 L117	A111-D115 PolarHBondContact O-N 2.9Å; A111-D115 VanDerWaalsContact O-N 3.11Å; E112-D115 PolarHBondContact O-N 2.92Å; E112-D115 VanDerWaalsContact O-N 3.13Å; D115-L117 PolarHBondContact O-N 3.18Å
116	E	79.1	Confident	83.1	Confident	133 Å²	133	68.6 Å²	68.6	62%	0.621	35%	0.347	S	S	*	.			trans	-88.5	84.2	176.5	-68.3	-173.5	177.2	0	0	110.4	Y106 A111 A114	Y106-E116 WeakPolarHBondContact CD1-O 3.45Å; A111-E116 HydrophobicContact CB-CB 4.4Å; A111-E116 PolarHBondContact O-N 3.39Å; A114-E116 HydrophobicContact CB-CG 4.02Å; A114-E116 PolarHBondContact O-N 2.84Å
117	L	84.5	Confident	82.8	Confident	84 Å²	84	72.1 Å²	72.1	44%	0.44	37%	0.37	S	S	.	.			trans	-76.3	134.4	-176	67	104.4	0	0	0	113.5	Y106 D115	Y106-L117 HydrophobicContact CD1-CB 4.4Å; Y106-L117 HydrophobicContact CE1-CB 3.98Å; D115-L117 PolarHBondContact O-N 3.18Å
118	D	82.9	Confident	82.7	Confident	52 Å²	52	66.9 Å²	66.9	28%	0.278	36%	0.355	S	S	.	.	S	Bend	trans	-89.9	-22.2	175.8	-108.8	13.6	0	0	0	111.9	H94 Y105 R107	H94-D118 IonicContact CD2-OD2 3.06Å; H94-D118 IonicContact NE2-OD2 3.99Å; H94-D118 PolarHBondContact NE2-OD2 3.43Å; Y105-D118 HydrophobicContact CD2-CB 3.95Å; Y105-D118 HydrophobicContact CE2-CB 3.9Å; Y105-D118 PolarHBondContact O-N 2.92Å; R107-D118 VanDerWaalsContact CG-CG 3.47Å; R107-D118 WeakPolarHBondContact CG-OD2 3.42Å; R107-D118 IonicContact CZ-OD1 3.95Å; R107-D118 IonicContact CZ-OD2 2.86Å; R107-D118 IonicContact NE-OD1 2.74Å; R107-D118 PolarHBondContact NE-OD1 3.35Å; R107-D118 IonicContact NE-OD2 3.6Å; R107-D118 PolarHBondContact NE-OD2 3.43Å; R107-D118 IonicContact NH2-OD1 2.97Å; R107-D118 PolarHBondContact NH2-OD1 2.95Å; R107-D118 IonicContact NH2-OD2 2.73Å
119	G	86	Confident	83	Confident	11 Å²	11	63.9 Å²	63.9	11%	0.113	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.8	170.1	164.8	0	0	0	0	0	113.5	Y105	Y105-G119 VanDerWaalsContact CD1-O 3.29Å; Y105-G119 WeakPolarHBondContact CD1-O 3.49Å; Y105-G119 PolarHBondContact N-O 3.45Å; Y105-G119 PolarHBondContact O-N 3.2Å
120	E	89.4	Confident	83.5	Confident	94 Å²	94	63.1 Å²	63.1	44%	0.439	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	132.4	-174.6	-179.3	168.6	-153.5	0	0	109.9	S102 K104	S102-E120 WeakPolarHBondContact CB-OE1 3.32Å; S102-E120 PolarHBondContact OG-OE1 3.3Å; K104-E120 WeakPolarHBondContact CE-OE1 3.26Å; K104-E120 HydrophobicContact CG-CB 4.41Å; K104-E120 HydrophobicContact CG-CG 4.01Å
121	I	89	Confident	84	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.1	173.9	-59.4	169.3	0	0	0	107	I71 S102 L103 L123 I142 T144 Y149	I71-I121 HydrophobicContact CD1-CD1 4.2Å; S102-I121 CarbonylContact C-O 3.55Å; S102-I121 WeakPolarHBondContact CA-O 3.48Å; L103-I121 HydrophobicContact CB-CB 4.29Å; L103-I121 HydrophobicContact CD2-CD1 4.34Å; L103-I121 PolarHBondContact N-O 3.43Å; L103-I121 PolarHBondContact O-N 2.96Å; I121-L123 HydrophobicContact CG2-CD2 4.42Å; I121-L123 PolarHBondContact O-N 2.94Å; I121-I142 HydrophobicContact CD1-CD1 4.44Å; I121-I142 HydrophobicContact CG2-CG2 4.32Å; I121-T144 HydrophobicContact CG2-CG2 4.06Å; I121-Y149 HydrophobicContact CB-CE2 4.44Å; I121-Y149 HydrophobicContact CD1-CD1 3.96Å; I121-Y149 HydrophobicContact CD1-CD2 4.03Å; I121-Y149 HydrophobicContact CD1-CE1 4.48Å; I121-Y149 HydrophobicContact CD1-CG 3.69Å; I121-Y149 HydrophobicContact CG1-CD1 4.11Å; I121-Y149 HydrophobicContact CG1-CD2 4.05Å; I121-Y149 HydrophobicContact CG1-CE1 4.12Å; I121-Y149 HydrophobicContact CG1-CE2 4.08Å; I121-Y149 HydrophobicContact CG1-CG 4.05Å; I121-Y149 HydrophobicContact CG2-CD2 3.74Å; I121-Y149 HydrophobicContact CG2-CE2 3.75Å; I121-Y149 HydrophobicContact CG2-CG 4.49Å
122	D	87.3	Confident	84.4	Confident	74 Å²	74	68.7 Å²	68.7	40%	0.396	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	118.7	175.5	-174.4	5.5	0	0	0	109.9	R124 S125	D122-R124 VanDerWaalsContact OD1-CB 3.27Å; D122-R124 WeakPolarHBondContact OD1-CB 3.3Å; D122-R124 WeakPolarHBondContact OD1-CG 3.47Å; D122-R124 PolarHBondContact OD1-N 3.38Å; D122-S125 PolarHBondContact O-OG 2.93Å
123	L	86.8	Confident	84.5	Confident	6 Å²	6	71.4 Å²	71.4	3%	0.031	38%	0.375	C	S	.	.	S	Bend	trans	-85.8	-11.8	-179.8	-62.3	177.8	0	0	0	112	L98 S101 L103 I121 S125 C126 I142 L166 T169 V170	L98-L123 HydrophobicContact CD1-CD1 3.38Å; S101-L123 WeakPolarHBondContact O-CB 3.39Å; S101-L123 PolarHBondContact O-N 2.75Å; L103-L123 HydrophobicContact CB-CD1 4.16Å; L103-L123 HydrophobicContact CB-CD2 4.2Å; L103-L123 HydrophobicContact CB-CG 4.25Å; I121-L123 HydrophobicContact CG2-CD2 4.42Å; I121-L123 PolarHBondContact O-N 2.94Å; L123-S125 VanDerWaalsContact C-N 3.26Å; L123-S125 PolarHBondContact O-N 2.84Å; L123-C126 VanDerWaalsContact O-CB 3.25Å; L123-C126 WeakPolarHBondContact O-CB 3.45Å; L123-C126 PolarHBondContact O-N 2.89Å; L123-I142 HydrophobicContact CD2-CG2 4.47Å; L123-L166 HydrophobicContact CD1-CD2 3.85Å; L123-L166 HydrophobicContact CD2-CD2 3.85Å; L123-T169 HydrophobicContact CD1-CG2 3.96Å; L123-V170 HydrophobicContact CB-CG2 4.15Å; L123-V170 HydrophobicContact CD2-CG2 4.34Å
124	R	82.8	Confident	84.8	Confident	190 Å²	190	64.8 Å²	64.8	72%	0.717	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.7	173.8	-60.4	176.9	176.5	169.6	6.9	112.4	S101 D122	S101-R124 PolarHBondContact OG-NH2 3.33Å; D122-R124 VanDerWaalsContact OD1-CB 3.27Å; D122-R124 WeakPolarHBondContact OD1-CB 3.3Å; D122-R124 WeakPolarHBondContact OD1-CG 3.47Å; D122-R124 PolarHBondContact OD1-N 3.38Å
125	S	82.4	Confident	84.8	Confident	17 Å²	17	71.7 Å²	71.7	12%	0.119	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	2.5	174.8	68.4	0	0	0	0	112.8	D122 L123 T127 T144 K145	D122-S125 PolarHBondContact O-OG 2.93Å; L123-S125 VanDerWaalsContact C-N 3.26Å; L123-S125 PolarHBondContact O-N 2.84Å; S125-T127 PolarHBondContact O-N 2.73Å; S125-T144 CarbonylContact O-C 3.56Å; S125-T144 VanDerWaalsContact O-CA 3.32Å; S125-T144 WeakPolarHBondContact O-CA 3.44Å; S125-K145 PolarHBondContact O-N 3.39Å
126	C	85.9	Confident	84.2	Confident	14 Å²	14	75 Å²	75	10%	0.095	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	127	178.6	-171.8	0	0	0	0	111.1	L123 H143 V170	L123-C126 VanDerWaalsContact O-CB 3.25Å; L123-C126 WeakPolarHBondContact O-CB 3.45Å; L123-C126 PolarHBondContact O-N 2.89Å; C126-H143 CarbonylContact C-O 3.06Å; C126-H143 WeakPolarHBondContact CA-O 3.08Å; C126-H143 PolarHBondContact SG-O 3.26Å; C126-H143 VanDerWaalsContact SG-O 3.36Å; C126-V170 HydrophobicContact CB-CB 4.3Å; C126-V170 HydrophobicContact CB-CG1 3.72Å; C126-V170 HydrophobicContact CB-CG2 3.54Å; C126-V170 VanDerWaalsContact O-CG1 3.29Å; C126-V170 WeakPolarHBondContact O-CG1 3.36Å
127	T	85.1	Confident	84.6	Confident	85 Å²	85	72.5 Å²	72.5	52%	0.521	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-44.3	178.9	52.8	0	0	0	0	111.5	S125 H143 K145	S125-T127 PolarHBondContact O-N 2.73Å; T127-H143 PolarHBondContact N-O 3.42Å; T127-H143 WeakPolarHBondContact OG1-CB 3.4Å; T127-H143 PolarHBondContact OG1-O 3.39Å; T127-H143 VanDerWaalsContact OG1-O 3.1Å; T127-K145 HydrophobicContact CG2-CG 4.27Å
128	D	85.6	Confident	84.8	Confident	54 Å²	54	73.6 Å²	73.6	29%	0.289	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	161.7	176.9	-163.1	20.8	0	0	0	112.6	T130 H143	D128-T130 WeakPolarHBondContact OD2-CG2 3.38Å; D128-H143 WeakPolarHBondContact O-CB 3.48Å; D128-H143 PolarHBondContact O-N 3.34Å
129	V	90.1	Very high	85.2	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.012	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.6	172.6	-175	0	0	0	0	108.5	F140 Q141 I142 I163 L166 R167	V129-F140 HydrophobicContact CG1-CD2 3.86Å; V129-F140 HydrophobicContact CG1-CE2 4.43Å; V129-Q141 VanDerWaalsContact CA-O 3.32Å; V129-Q141 WeakPolarHBondContact CA-O 3.38Å; V129-I142 HydrophobicContact CG1-CG1 4.42Å; V129-I142 HydrophobicContact CG2-CG1 4.49Å; V129-I142 HydrophobicContact CG2-CG2 4.43Å; V129-I163 HydrophobicContact CG1-CB 4.41Å; V129-I163 HydrophobicContact CG1-CG1 4.11Å; V129-I163 HydrophobicContact CG1-CG2 4.17Å; V129-L166 HydrophobicContact CG1-CD1 4.41Å; V129-L166 HydrophobicContact CG2-CB 4.1Å; V129-R167 HydrophobicContact CB-CG 4.35Å; V129-R167 PolarHBondContact O-NE 2.87Å; V129-R167 PolarHBondContact O-NH2 3.22Å
130	T	88.6	Confident	85.5	Confident	40 Å²	40	70.7 Å²	70.7	25%	0.245	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	150.3	-172.3	56.1	0	0	0	0	112.2	D128 F140 Q141	D128-T130 WeakPolarHBondContact OD2-CG2 3.38Å; T130-F140 CarbonylContact O-C 3.58Å; T130-F140 VanDerWaalsContact O-CA 3.25Å; T130-F140 WeakPolarHBondContact O-CA 3.33Å; T130-F140 VanDerWaalsContact O-CB 3.26Å; T130-F140 WeakPolarHBondContact O-CB 3.43Å; T130-Q141 PolarHBondContact N-O 2.91Å; T130-Q141 PolarHBondContact O-N 3.44Å
131	E	91.1	Very high	85.7	Confident	107 Å²	107	67.6 Å²	67.6	50%	0.5	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	133.2	172.2	-64.2	-163.8	163.3	0	0	109.7	R159 I163	E131-R159 VanDerWaalsContact CD-CZ 3.4Å; E131-R159 IonicContact OE1-CZ 2.61Å; E131-R159 IonicContact OE1-NE 3.5Å; E131-R159 IonicContact OE1-NH2 3.91Å; E131-R159 PolarHBondContact OE1-NH2 3.39Å; E131-R159 IonicContact OE2-CZ 2.65Å; E131-R159 VanDerWaalsContact OE2-CZ 3.29Å; E131-R159 IonicContact OE2-NH1 3.9Å; E131-R159 IonicContact OE2-NH2 3.95Å; E131-R159 PolarHBondContact OE2-NH2 2.93Å; E131-I163 HydrophobicContact CG-CD1 3.62Å
132	Y	87.8	Confident	85.8	Confident	110 Å²	110	67.5 Å²	67.5	43%	0.431	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.4	-177.2	-171.6	-102.2	0	0	0	110.3	V134 G139 Q141 T150	Y132-V134 HydrophobicContact CD1-CG1 3.59Å; Y132-V134 HydrophobicContact CE1-CG1 4.07Å; Y132-V134 PolarHBondContact O-N 2.96Å; Y132-G139 PolarHBondContact N-O 2.86Å; Y132-G139 VanDerWaalsContact N-O 3.13Å; Y132-G139 CarbonylContact O-C 3.6Å; Y132-G139 WeakPolarHBondContact O-CA 3.26Å; Y132-Q141 HydrophobicContact CD1-CG 4.24Å; Y132-Q141 HydrophobicContact CD2-CG 4.28Å; Y132-Q141 HydrophobicContact CG-CG 3.83Å; Y132-T150 HydrophobicContact CD1-CG2 3.99Å; Y132-T150 HydrophobicContact CE1-CG2 4.42Å
133	A	82.8	Confident	85.9	Confident	97 Å²	97	66.6 Å²	66.6	80%	0.802	32%	0.323	S	S	*	.			trans	-76.8	113.6	-179.8	0	0	0	0	0	109.7
134	V	82.1	Confident	85.9	Confident	25 Å²	25	67 Å²	67	15%	0.152	33%	0.325	C	S	.	.			trans	-112.9	152.8	178.6	-61.9	0	0	0	0	110.1	W91 Y132 R136 N137 T150	W91-V134 HydrophobicContact CH2-CB 4.08Å; W91-V134 HydrophobicContact CH2-CG1 3.7Å; W91-V134 HydrophobicContact CZ2-CB 3.96Å; W91-V134 HydrophobicContact CZ2-CG1 3.96Å; Y132-V134 HydrophobicContact CD1-CG1 3.59Å; Y132-V134 HydrophobicContact CE1-CG1 4.07Å; Y132-V134 PolarHBondContact O-N 2.96Å; V134-R136 VanDerWaalsContact CG2-O 3.31Å; V134-R136 WeakPolarHBondContact CG2-O 3.49Å; V134-R136 PolarHBondContact O-N 3.35Å; V134-N137 VanDerWaalsContact CG2-O 3.27Å; V134-N137 WeakPolarHBondContact CG2-O 3.37Å; V134-T150 HydrophobicContact CG1-CG2 3.98Å
135	Q	71.9	Confident	85.9	Confident	206 Å²	206	65.3 Å²	65.3	96%	0.963	32%	0.323	S	S	*	.	S	Bend	trans	-64.5	-26.6	179.9	-69.8	179.1	-9.3	0	0	113
136	R	67.6	Low	85.8	Confident	174 Å²	174	71.6 Å²	71.6	66%	0.657	36%	0.355	S	S	*	.	S	Bend	trans	-123.5	106.3	-175.3	-155	172.1	-174	146.5	-0.1	110	V134	V134-R136 VanDerWaalsContact CG2-O 3.31Å; V134-R136 WeakPolarHBondContact CG2-O 3.49Å; V134-R136 PolarHBondContact O-N 3.35Å
137	N	86	Confident	85.8	Confident	79 Å²	79	72.4 Å²	72.4	42%	0.422	36%	0.363	S	S	.	.	S	Bend	trans	67.8	-158.7	-179.5	-46.2	-60.1	0	0	0	115.5	V134 A153	V134-N137 VanDerWaalsContact CG2-O 3.27Å; V134-N137 WeakPolarHBondContact CG2-O 3.37Å; N137-A153 WeakPolarHBondContact CB-O 3.33Å
138	Y	89.4	Confident	85.9	Confident	108 Å²	108	70.9 Å²	70.9	42%	0.424	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	101.2	-172.2	-62.4	-88.1	0	0	0	110.5	A153 T155	Y138-A153 PolarHBondContact N-O 2.97Å; Y138-A153 PolarHBondContact O-N 3.16Å; Y138-T155 VanDerWaalsContact CD2-CA 3.46Å
139	G	90.4	Very high	86.1	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	156.5	-173.9	0	0	0	0	0	115	Y132 L151 R159	Y132-G139 PolarHBondContact N-O 2.86Å; Y132-G139 VanDerWaalsContact N-O 3.13Å; Y132-G139 CarbonylContact O-C 3.6Å; Y132-G139 WeakPolarHBondContact O-CA 3.26Å; G139-L151 CarbonylContact C-O 3.55Å; G139-L151 WeakPolarHBondContact CA-O 3.49Å; G139-R159 WeakPolarHBondContact O-CD 3.47Å
140	F	92.8	Very high	86.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	157.7	169	68.1	-79.3	0	0	0	109.7	M69 V129 T130 I142 L151 R159 W162 I163 L166	M69-F140 HydrophobicContact CE-CD1 4.47Å; M69-F140 HydrophobicContact CE-CE1 3.14Å; M69-F140 HydrophobicContact CE-CZ 3.23Å; M69-F140 HydrophobicContact SD-CZ 4.44Å; V129-F140 HydrophobicContact CG1-CD2 3.86Å; V129-F140 HydrophobicContact CG1-CE2 4.43Å; T130-F140 CarbonylContact O-C 3.58Å; T130-F140 VanDerWaalsContact O-CA 3.25Å; T130-F140 WeakPolarHBondContact O-CA 3.33Å; T130-F140 VanDerWaalsContact O-CB 3.26Å; T130-F140 WeakPolarHBondContact O-CB 3.43Å; F140-I142 HydrophobicContact CD2-CG1 4.29Å; F140-I142 HydrophobicContact CE2-CD1 4.16Å; F140-I142 HydrophobicContact CE2-CG1 3.95Å; F140-L151 HydrophobicContact CD1-CB 4.34Å; F140-L151 HydrophobicContact CE1-CB 3.77Å; F140-L151 HydrophobicContact CE2-CB 4.19Å; F140-L151 HydrophobicContact CE2-CD1 4.44Å; F140-L151 HydrophobicContact CZ-CB 3.68Å; F140-L151 HydrophobicContact CZ-CD2 4.16Å; F140-L151 HydrophobicContact CZ-CG 4.37Å; F140-L151 PolarHBondContact N-O 2.95Å; F140-L151 PolarHBondContact O-N 3.01Å; F140-L151 VanDerWaalsContact O-O 3.05Å; F140-R159 HydrophobicContact CB-CG 4.26Å; F140-R159 HydrophobicContact CD1-CG 3.81Å; F140-R159 HydrophobicContact CG-CG 4.36Å; F140-W162 HydrophobicContact CE1-CB 4.46Å; F140-W162 HydrophobicContact CZ-CB 4.13Å; F140-I163 HydrophobicContact CB-CD1 3.72Å; F140-I163 HydrophobicContact CB-CG1 3.91Å; F140-I163 HydrophobicContact CD2-CG1 3.97Å; F140-I163 HydrophobicContact CG-CD1 4.2Å; F140-I163 HydrophobicContact CG-CG1 3.87Å; F140-L166 HydrophobicContact CE2-CD1 3.65Å; F140-L166 HydrophobicContact CZ-CD1 4.31Å
141	Q	93.2	Very high	86.4	Confident	29 Å²	29	69.9 Å²	69.9	14%	0.136	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.2	-179.3	-74.8	179.6	-26.4	0	0	110.6	V129 T130 Y132 H143 V148 Y149 T150	V129-Q141 VanDerWaalsContact CA-O 3.32Å; V129-Q141 WeakPolarHBondContact CA-O 3.38Å; T130-Q141 PolarHBondContact N-O 2.91Å; T130-Q141 PolarHBondContact O-N 3.44Å; Y132-Q141 HydrophobicContact CD1-CG 4.24Å; Y132-Q141 HydrophobicContact CD2-CG 4.28Å; Y132-Q141 HydrophobicContact CG-CG 3.83Å; Q141-H143 PolarHBondContact OE1-NE2 3.3Å; Q141-V148 HydrophobicContact CB-CG1 4.08Å; Q141-V148 HydrophobicContact CG-CG1 4.11Å; Q141-Y149 CarbonylContact C-O 3.57Å; Q141-Y149 VanDerWaalsContact CA-O 3.27Å; Q141-Y149 WeakPolarHBondContact CA-O 3.35Å; Q141-T150 HydrophobicContact CG-CG2 4.05Å; Q141-T150 PolarHBondContact NE2-OG1 3.22Å; Q141-T150 VanDerWaalsContact NE2-OG1 3.09Å
142	I	92.5	Very high	86.5	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	113.7	169.7	-55.6	175.1	0	0	0	106.2	L103 I121 L123 V129 F140 T144 Y149 L151 L166	L103-I142 HydrophobicContact CD2-CD1 3.7Å; I121-I142 HydrophobicContact CD1-CD1 4.44Å; I121-I142 HydrophobicContact CG2-CG2 4.32Å; L123-I142 HydrophobicContact CD2-CG2 4.47Å; V129-I142 HydrophobicContact CG1-CG1 4.42Å; V129-I142 HydrophobicContact CG2-CG1 4.49Å; V129-I142 HydrophobicContact CG2-CG2 4.43Å; F140-I142 HydrophobicContact CD2-CG1 4.29Å; F140-I142 HydrophobicContact CE2-CD1 4.16Å; F140-I142 HydrophobicContact CE2-CG1 3.95Å; I142-T144 HydrophobicContact CG2-CG2 4.28Å; I142-Y149 PolarHBondContact N-O 3.2Å; I142-Y149 PolarHBondContact O-N 3.49Å; I142-L151 HydrophobicContact CD1-CD1 3.71Å; I142-L151 HydrophobicContact CG1-CD1 4.01Å; I142-L166 HydrophobicContact CD1-CD1 3.68Å; I142-L166 HydrophobicContact CD1-CD2 4.43Å; I142-L166 HydrophobicContact CG1-CD1 4.07Å
143	H	88.7	Confident	86.7	Confident	54 Å²	54	59.7 Å²	59.7	25%	0.25	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	117	178.7	-68	-159.9	0	0	0	107.3	C126 T127 D128 Q141	C126-H143 CarbonylContact C-O 3.06Å; C126-H143 WeakPolarHBondContact CA-O 3.08Å; C126-H143 PolarHBondContact SG-O 3.26Å; C126-H143 VanDerWaalsContact SG-O 3.36Å; T127-H143 PolarHBondContact N-O 3.42Å; T127-H143 WeakPolarHBondContact OG1-CB 3.4Å; T127-H143 PolarHBondContact OG1-O 3.39Å; T127-H143 VanDerWaalsContact OG1-O 3.1Å; D128-H143 WeakPolarHBondContact O-CB 3.48Å; D128-H143 PolarHBondContact O-N 3.34Å; Q141-H143 PolarHBondContact OE1-NE2 3.3Å
144	T	87.4	Confident	86.9	Confident	14 Å²	14	62 Å²	62	9%	0.086	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	170.4	171	65.7	0	0	0	0	109.7	I121 S125 I142 D146 A147 Y149	I121-T144 HydrophobicContact CG2-CG2 4.06Å; S125-T144 CarbonylContact O-C 3.56Å; S125-T144 VanDerWaalsContact O-CA 3.32Å; S125-T144 WeakPolarHBondContact O-CA 3.44Å; I142-T144 HydrophobicContact CG2-CG2 4.28Å; T144-D146 PolarHBondContact O-N 3.28Å; T144-A147 PolarHBondContact N-O 3.38Å; T144-A147 PolarHBondContact OG1-N 2.93Å; T144-A147 PolarHBondContact OG1-O 3.42Å; T144-Y149 HydrophobicContact CG2-CD2 4.14Å; T144-Y149 HydrophobicContact CG2-CE2 3.93Å
145	K	82.6	Confident	87.2	Confident	156 Å²	156	63.6 Å²	63.6	68%	0.678	31%	0.305	S	S	*	.	S	Bend	trans	-60.2	-30.2	176.8	-71.5	174.8	-174.7	175.7	0	112.8	S125 T127	S125-K145 PolarHBondContact O-N 3.39Å; T127-K145 HydrophobicContact CG2-CG 4.27Å
146	D	79.3	Confident	87.9	Confident	148 Å²	148	55.7 Å²	55.7	79%	0.791	27%	0.273	S	S	*	.	S	Bend	trans	-109.3	-24.4	-169.6	-53.2	-49.5	0	0	0	113	T144	T144-D146 PolarHBondContact O-N 3.28Å
147	A	85.6	Confident	88.8	Confident	31 Å²	31	49 Å²	49	26%	0.256	26%	0.258	S	S	.	.			trans	-154	162	-177.5	0	0	0	0	0	113.8	T144 Y149	T144-A147 PolarHBondContact N-O 3.38Å; T144-A147 PolarHBondContact OG1-N 2.93Å; T144-A147 PolarHBondContact OG1-O 3.42Å; A147-Y149 HydrophobicContact CB-CE2 3.94Å
148	V	88.9	Confident	88.8	Confident	54 Å²	54	48.5 Å²	48.5	33%	0.327	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.2	171	177.5	0	0	0	0	109.2	Q141	Q141-V148 HydrophobicContact CB-CG1 4.08Å; Q141-V148 HydrophobicContact CG-CG1 4.11Å
149	Y	90.1	Very high	89	Confident	64 Å²	64	45.1 Å²	45.1	25%	0.251	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	121.7	178.1	-59	-82.2	0	0	0	110	I71 I121 Q141 I142 T144 A147	I71-Y149 HydrophobicContact CD1-CD1 4.13Å; I121-Y149 HydrophobicContact CB-CE2 4.44Å; I121-Y149 HydrophobicContact CD1-CD1 3.96Å; I121-Y149 HydrophobicContact CD1-CD2 4.03Å; I121-Y149 HydrophobicContact CD1-CE1 4.48Å; I121-Y149 HydrophobicContact CD1-CG 3.69Å; I121-Y149 HydrophobicContact CG1-CD1 4.11Å; I121-Y149 HydrophobicContact CG1-CD2 4.05Å; I121-Y149 HydrophobicContact CG1-CE1 4.12Å; I121-Y149 HydrophobicContact CG1-CE2 4.08Å; I121-Y149 HydrophobicContact CG1-CG 4.05Å; I121-Y149 HydrophobicContact CG2-CD2 3.74Å; I121-Y149 HydrophobicContact CG2-CE2 3.75Å; I121-Y149 HydrophobicContact CG2-CG 4.49Å; Q141-Y149 CarbonylContact C-O 3.57Å; Q141-Y149 VanDerWaalsContact CA-O 3.27Å; Q141-Y149 WeakPolarHBondContact CA-O 3.35Å; I142-Y149 PolarHBondContact N-O 3.2Å; I142-Y149 PolarHBondContact O-N 3.49Å; T144-Y149 HydrophobicContact CG2-CD2 4.14Å; T144-Y149 HydrophobicContact CG2-CE2 3.93Å; A147-Y149 HydrophobicContact CB-CE2 3.94Å
150	T	91.6	Very high	88.9	Confident	10 Å²	10	51.6 Å²	51.6	6%	0.061	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.8	176.4	-54.1	0	0	0	0	110.1	L72 W91 Y132 V134 Q141	L72-T150 PolarHBondContact N-O 3.37Å; W91-T150 HydrophobicContact CH2-CG2 3.81Å; W91-T150 HydrophobicContact CZ3-CG2 4.48Å; Y132-T150 HydrophobicContact CD1-CG2 3.99Å; Y132-T150 HydrophobicContact CE1-CG2 4.42Å; V134-T150 HydrophobicContact CG1-CG2 3.98Å; Q141-T150 HydrophobicContact CG-CG2 4.05Å; Q141-T150 PolarHBondContact NE2-OG1 3.22Å; Q141-T150 VanDerWaalsContact NE2-OG1 3.09Å
151	L	92.8	Very high	88.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	154.1	178.1	-66.6	88.6	0	0	0	110.8	M69 S70 I71 F96 L103 G139 F140 I142	M69-L151 HydrophobicContact CE-CB 4.39Å; M69-L151 HydrophobicContact CE-CD2 4.27Å; M69-L151 HydrophobicContact SD-CD2 4.43Å; S70-L151 CarbonylContact O-C 3.55Å; S70-L151 VanDerWaalsContact O-CA 3.3Å; S70-L151 WeakPolarHBondContact O-CA 3.38Å; I71-L151 HydrophobicContact CB-CG 4.33Å; I71-L151 HydrophobicContact CD1-CG 4.45Å; I71-L151 HydrophobicContact CG1-CG 4.24Å; F96-L151 HydrophobicContact CD1-CD2 4.11Å; F96-L151 HydrophobicContact CE1-CD2 3.53Å; F96-L151 HydrophobicContact CE2-CD2 4.4Å; F96-L151 HydrophobicContact CZ-CD2 3.72Å; L103-L151 HydrophobicContact CD2-CD2 4.46Å; G139-L151 CarbonylContact C-O 3.55Å; G139-L151 WeakPolarHBondContact CA-O 3.49Å; F140-L151 HydrophobicContact CD1-CB 4.34Å; F140-L151 HydrophobicContact CE1-CB 3.77Å; F140-L151 HydrophobicContact CE2-CB 4.19Å; F140-L151 HydrophobicContact CE2-CD1 4.44Å; F140-L151 HydrophobicContact CZ-CB 3.68Å; F140-L151 HydrophobicContact CZ-CD2 4.16Å; F140-L151 HydrophobicContact CZ-CG 4.37Å; F140-L151 PolarHBondContact N-O 2.95Å; F140-L151 PolarHBondContact O-N 3.01Å; F140-L151 VanDerWaalsContact O-O 3.05Å; I142-L151 HydrophobicContact CD1-CD1 3.71Å; I142-L151 HydrophobicContact CG1-CD1 4.01Å
152	S	92.3	Very high	88.7	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.028	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.2	173.3	69.6	0	0	0	0	111.6	S70	S70-S152 WeakPolarHBondContact CB-OG 3.28Å; S70-S152 PolarHBondContact N-O 3.18Å; S70-S152 PolarHBondContact O-N 2.92Å
153	A	91.7	Very high	88.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	145.2	175.2	0	0	0	0	0	110.2	M69 N137 Y138 T155 I158 R159	M69-A153 HydrophobicContact CE-CB 4.36Å; N137-A153 WeakPolarHBondContact CB-O 3.33Å; Y138-A153 PolarHBondContact N-O 2.97Å; Y138-A153 PolarHBondContact O-N 3.16Å; A153-T155 PolarHBondContact O-N 2.99Å; A153-I158 HydrophobicContact CB-CB 4.1Å; A153-I158 HydrophobicContact CB-CG2 3.75Å; A153-R159 HydrophobicContact CB-CB 4.03Å
154	M	88.4	Confident	88.5	Confident	145 Å²	145	57 Å²	57	71%	0.714	29%	0.293	S	S	*	.	S	Bend	trans	-58.3	-30.7	-179.3	-115	173.9	72.6	0	0	113.6
155	T	87.1	Confident	88.5	Confident	58 Å²	58	57.3 Å²	57.3	36%	0.356	30%	0.297	S	S	.	.	S	Bend	trans	-134.6	154	-178.9	71.2	0	0	0	0	111.8	Y138 A153 G157 I158 R159	Y138-T155 VanDerWaalsContact CD2-CA 3.46Å; A153-T155 PolarHBondContact O-N 2.99Å; T155-G157 PolarHBondContact O-N 2.77Å; T155-I158 HydrophobicContact CG2-CD1 4.4Å; T155-I158 PolarHBondContact O-N 3.19Å; T155-I158 WeakPolarHBondContact OG1-CD1 3.42Å; T155-I158 VanDerWaalsContact OG1-CG1 3.24Å; T155-I158 WeakPolarHBondContact OG1-CG1 3.33Å; T155-I158 PolarHBondContact OG1-N 3.03Å; T155-R159 PolarHBondContact O-N 3.33Å
156	S	87.3	Confident	88.8	Confident	41 Å²	41	49.9 Å²	49.9	29%	0.287	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-28.5	176.4	61.6	0	0	0	0	112.8	R160	S156-R160 WeakPolarHBondContact O-CB 3.48Å; S156-R160 WeakPolarHBondContact O-CG 3.34Å; S156-R160 PolarHBondContact O-N 3.25Å; S156-R160 PolarHBondContact O-NE 3.09Å
157	G	85.9	Confident	89.1	Confident	33 Å²	33	47.7 Å²	47.7	34%	0.34	25%	0.245	S	C	.	.	H	α-helix	trans	-67.5	-47.7	174.3	0	0	0	0	0	112	T155 R159 R160 N161	T155-G157 PolarHBondContact O-N 2.77Å; G157-R159 VanDerWaalsContact C-N 3.34Å; G157-R159 PolarHBondContact O-N 2.92Å; G157-R160 PolarHBondContact O-N 3.08Å; G157-N161 WeakPolarHBondContact O-CB 3.39Å; G157-N161 PolarHBondContact O-N 2.95Å
158	I	87.4	Confident	89	Confident	68 Å²	68	53.2 Å²	53.2	35%	0.349	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-45.2	176.7	-66.8	167.9	0	0	0	109.8	A153 T155 N161 W162	A153-I158 HydrophobicContact CB-CB 4.1Å; A153-I158 HydrophobicContact CB-CG2 3.75Å; T155-I158 HydrophobicContact CG2-CD1 4.4Å; T155-I158 PolarHBondContact O-N 3.19Å; T155-I158 WeakPolarHBondContact OG1-CD1 3.42Å; T155-I158 VanDerWaalsContact OG1-CG1 3.24Å; T155-I158 WeakPolarHBondContact OG1-CG1 3.33Å; T155-I158 PolarHBondContact OG1-N 3.03Å; I158-N161 PolarHBondContact O-N 3.44Å; I158-W162 VanDerWaalsContact CG2-CD1 3.46Å; I158-W162 PolarHBondContact O-N 2.92Å
159	R	93.2	Very high	88.3	Confident	37 Å²	37	51.6 Å²	51.6	14%	0.14	25%	0.254	C	S	.	.	H	α-helix	trans	-53.4	-58	174.5	-176.4	-169.4	65.3	-178.2	9.4	111.8	E131 G139 F140 A153 T155 G157 N161 W162 I163	E131-R159 VanDerWaalsContact CD-CZ 3.4Å; E131-R159 IonicContact OE1-CZ 2.61Å; E131-R159 IonicContact OE1-NE 3.5Å; E131-R159 IonicContact OE1-NH2 3.91Å; E131-R159 PolarHBondContact OE1-NH2 3.39Å; E131-R159 IonicContact OE2-CZ 2.65Å; E131-R159 VanDerWaalsContact OE2-CZ 3.29Å; E131-R159 IonicContact OE2-NH1 3.9Å; E131-R159 IonicContact OE2-NH2 3.95Å; E131-R159 PolarHBondContact OE2-NH2 2.93Å; G139-R159 WeakPolarHBondContact O-CD 3.47Å; F140-R159 HydrophobicContact CB-CG 4.26Å; F140-R159 HydrophobicContact CD1-CG 3.81Å; F140-R159 HydrophobicContact CG-CG 4.36Å; A153-R159 HydrophobicContact CB-CB 4.03Å; T155-R159 PolarHBondContact O-N 3.33Å; G157-R159 VanDerWaalsContact C-N 3.34Å; G157-R159 PolarHBondContact O-N 2.92Å; R159-N161 VanDerWaalsContact C-N 3.27Å; R159-N161 PolarHBondContact O-N 3.26Å; R159-W162 PolarHBondContact O-N 3.36Å; R159-I163 HydrophobicContact CG-CD1 3.79Å; R159-I163 HydrophobicContact CG-CG1 4.36Å; R159-I163 WeakPolarHBondContact O-CG1 3.44Å; R159-I163 PolarHBondContact O-N 3.39Å
160	R	88.3	Confident	87.4	Confident	138 Å²	138	50.1 Å²	50.1	52%	0.521	25%	0.251	S	S	.	.	H	α-helix	trans	-56.5	-44	-178.3	-77.3	-176.6	-68.7	156.4	-4.4	111.5	S156 G157 W162 I163 E164	S156-R160 WeakPolarHBondContact O-CB 3.48Å; S156-R160 WeakPolarHBondContact O-CG 3.34Å; S156-R160 PolarHBondContact O-N 3.25Å; S156-R160 PolarHBondContact O-NE 3.09Å; G157-R160 PolarHBondContact O-N 3.08Å; R160-W162 VanDerWaalsContact C-N 3.29Å; R160-W162 PolarHBondContact O-N 3.36Å; R160-I163 PolarHBondContact O-N 2.94Å; R160-E164 WeakPolarHBondContact O-CB 3.5Å; R160-E164 WeakPolarHBondContact O-CG 3.4Å; R160-E164 PolarHBondContact O-N 3.44Å
161	N	90.4	Very high	85.9	Confident	86 Å²	86	57.3 Å²	57.3	46%	0.46	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-31.8	178.8	-171	-105	0	0	0	112.4	K65 G157 I158 R159 A165	K65-N161 WeakPolarHBondContact CE-OD1 3.46Å; K65-N161 PolarHBondContact NZ-O 3.04Å; K65-N161 PolarHBondContact NZ-OD1 3.41Å; G157-N161 WeakPolarHBondContact O-CB 3.39Å; G157-N161 PolarHBondContact O-N 2.95Å; I158-N161 PolarHBondContact O-N 3.44Å; R159-N161 VanDerWaalsContact C-N 3.27Å; R159-N161 PolarHBondContact O-N 3.26Å; N161-A165 WeakPolarHBondContact O-CB 3.49Å; N161-A165 PolarHBondContact O-N 2.74Å; N161-A165 VanDerWaalsContact O-N 3.16Å
162	W	90.9	Very high	83.7	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.015	31%	0.308	C	S	.	.	H	α-helix	trans	-75.7	-43.3	175.8	-83.1	108.2	0	0	0	111.5	K65 M69 F96 L98 L103 F140 I158 R159 R160 E164 A165 L166	K65-W162 HydrophobicContact CB-CH2 4.26Å; K65-W162 HydrophobicContact CB-CZ3 4.2Å; K65-W162 HydrophobicContact CD-CD2 3.76Å; K65-W162 HydrophobicContact CD-CE3 3.76Å; K65-W162 HydrophobicContact CD-CG 4.37Å; K65-W162 HydrophobicContact CD-CH2 4.21Å; K65-W162 HydrophobicContact CD-CZ2 4.19Å; K65-W162 HydrophobicContact CD-CZ3 4Å; K65-W162 VanDerWaalsContact CE-CD2 3.47Å; K65-W162 HydrophobicContact CG-CD2 4.4Å; K65-W162 HydrophobicContact CG-CE3 4.25Å; K65-W162 HydrophobicContact CG-CH2 3.83Å; K65-W162 HydrophobicContact CG-CZ2 3.96Å; K65-W162 HydrophobicContact CG-CZ3 3.98Å; K65-W162 VanDerWaalsContact NZ-CD2 3.28Å; K65-W162 VanDerWaalsContact O-CH2 3.29Å; K65-W162 WeakPolarHBondContact O-CH2 3.46Å; M69-W162 HydrophobicContact CE-CB 4.19Å; M69-W162 HydrophobicContact CE-CD2 4.24Å; M69-W162 HydrophobicContact CE-CG 3.81Å; M69-W162 HydrophobicContact CG-CZ2 4.46Å; M69-W162 VanDerWaalsContact SD-CD1 3.58Å; M69-W162 HydrophobicContact SD-CD2 3.45Å; M69-W162 HydrophobicContact SD-CE3 4.05Å; M69-W162 HydrophobicContact SD-CG 3.66Å; M69-W162 HydrophobicContact SD-CH2 4.37Å; M69-W162 HydrophobicContact SD-CZ2 3.84Å; M69-W162 HydrophobicContact SD-CZ3 4.45Å; M69-W162 PolarHBondContact SD-NE1 3.23Å; M69-W162 VanDerWaalsContact SD-NE1 3.4Å; F96-W162 HydrophobicContact CB-CH2 3.98Å; F96-W162 HydrophobicContact CB-CZ2 4.41Å; L98-W162 HydrophobicContact CB-CZ3 4.03Å; L103-W162 HydrophobicContact CD1-CZ3 3.85Å; F140-W162 HydrophobicContact CE1-CB 4.46Å; F140-W162 HydrophobicContact CZ-CB 4.13Å; I158-W162 VanDerWaalsContact CG2-CD1 3.46Å; I158-W162 PolarHBondContact O-N 2.92Å; R159-W162 PolarHBondContact O-N 3.36Å; R160-W162 VanDerWaalsContact C-N 3.29Å; R160-W162 PolarHBondContact O-N 3.36Å; W162-E164 VanDerWaalsContact C-N 3.29Å; W162-E164 PolarHBondContact O-N 2.9Å; W162-A165 PolarHBondContact O-N 2.93Å; W162-L166 WeakPolarHBondContact O-CB 3.35Å; W162-L166 VanDerWaalsContact O-CG 3.25Å; W162-L166 WeakPolarHBondContact O-CG 3.44Å; W162-L166 PolarHBondContact O-N 2.81Å
163	I	89.4	Confident	80.9	Confident	6 Å²	6	68.5 Å²	68.5	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-57.8	-44.1	173.9	-65.4	173.6	0	0	0	110.7	V129 E131 F140 R159 R160 R167	V129-I163 HydrophobicContact CG1-CB 4.41Å; V129-I163 HydrophobicContact CG1-CG1 4.11Å; V129-I163 HydrophobicContact CG1-CG2 4.17Å; E131-I163 HydrophobicContact CG-CD1 3.62Å; F140-I163 HydrophobicContact CB-CD1 3.72Å; F140-I163 HydrophobicContact CB-CG1 3.91Å; F140-I163 HydrophobicContact CD2-CG1 3.97Å; F140-I163 HydrophobicContact CG-CD1 4.2Å; F140-I163 HydrophobicContact CG-CG1 3.87Å; R159-I163 HydrophobicContact CG-CD1 3.79Å; R159-I163 HydrophobicContact CG-CG1 4.36Å; R159-I163 WeakPolarHBondContact O-CG1 3.44Å; R159-I163 PolarHBondContact O-N 3.39Å; R160-I163 PolarHBondContact O-N 2.94Å; I163-R167 HydrophobicContact CG2-CG 4.37Å; I163-R167 WeakPolarHBondContact O-CB 3.4Å; I163-R167 VanDerWaalsContact O-CG 3.26Å; I163-R167 WeakPolarHBondContact O-CG 3.49Å; I163-R167 PolarHBondContact O-N 3.17Å
164	E	88.3	Confident	78.1	Confident	101 Å²	101	73.6 Å²	73.6	47%	0.472	38%	0.383	S	S	.	.	H	α-helix	trans	-64	-44.2	177	-76.9	176.4	-169.1	0	0	112.6	R160 W162 R167 K168	R160-E164 WeakPolarHBondContact O-CB 3.5Å; R160-E164 WeakPolarHBondContact O-CG 3.4Å; R160-E164 PolarHBondContact O-N 3.44Å; W162-E164 VanDerWaalsContact C-N 3.29Å; W162-E164 PolarHBondContact O-N 2.9Å; E164-R167 PolarHBondContact O-N 2.85Å; E164-K168 WeakPolarHBondContact O-CB 3.27Å; E164-K168 VanDerWaalsContact O-CG 3.24Å; E164-K168 WeakPolarHBondContact O-CG 3.02Å; E164-K168 PolarHBondContact O-N 3.25Å
165	A	87.8	Confident	75.3	Confident	19 Å²	19	70.5 Å²	70.5	16%	0.157	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-42.5	178.6	0	0	0	0	0	111.7	K65 L98 N161 W162 K168 T169	K65-A165 HydrophobicContact CD-CB 3.72Å; L98-A165 HydrophobicContact CD2-CB 3.7Å; N161-A165 WeakPolarHBondContact O-CB 3.49Å; N161-A165 PolarHBondContact O-N 2.74Å; N161-A165 VanDerWaalsContact O-N 3.16Å; W162-A165 PolarHBondContact O-N 2.93Å; A165-K168 PolarHBondContact O-N 3.45Å; A165-T169 PolarHBondContact O-N 2.89Å; A165-T169 PolarHBondContact O-OG1 3.49Å
166	L	87.9	Confident	72.9	Confident	0 Å²	0	73 Å²	73	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-66.4	-45.7	176.9	-68.4	165.8	0	0	0	111.3	L98 L103 L123 V129 F140 I142 W162 K168 T169 V170	L98-L166 HydrophobicContact CD1-CD2 3.72Å; L103-L166 HydrophobicContact CB-CD2 4.48Å; L103-L166 HydrophobicContact CD2-CD2 4.06Å; L123-L166 HydrophobicContact CD1-CD2 3.85Å; L123-L166 HydrophobicContact CD2-CD2 3.85Å; V129-L166 HydrophobicContact CG1-CD1 4.41Å; V129-L166 HydrophobicContact CG2-CB 4.1Å; F140-L166 HydrophobicContact CE2-CD1 3.65Å; F140-L166 HydrophobicContact CZ-CD1 4.31Å; I142-L166 HydrophobicContact CD1-CD1 3.68Å; I142-L166 HydrophobicContact CD1-CD2 4.43Å; I142-L166 HydrophobicContact CG1-CD1 4.07Å; W162-L166 WeakPolarHBondContact O-CB 3.35Å; W162-L166 VanDerWaalsContact O-CG 3.25Å; W162-L166 WeakPolarHBondContact O-CG 3.44Å; W162-L166 PolarHBondContact O-N 2.81Å; L166-K168 VanDerWaalsContact C-N 3.29Å; L166-K168 PolarHBondContact O-N 3.23Å; L166-T169 PolarHBondContact O-N 3.5Å; L166-V170 WeakPolarHBondContact O-CB 3.29Å; L166-V170 VanDerWaalsContact O-CG2 3.23Å; L166-V170 WeakPolarHBondContact O-CG2 2.88Å; L166-V170 PolarHBondContact O-N 2.89Å
167	R	86.8	Confident	70.2	Confident	103 Å²	103	77.5 Å²	77.5	39%	0.389	42%	0.419	S	S	.	.	H	α-helix	trans	-60.7	-35.8	176.6	-76.2	176.6	177.1	174.1	-1.5	113.2	V129 I163 E164 T169 R171	V129-R167 HydrophobicContact CB-CG 4.35Å; V129-R167 PolarHBondContact O-NE 2.87Å; V129-R167 PolarHBondContact O-NH2 3.22Å; I163-R167 HydrophobicContact CG2-CG 4.37Å; I163-R167 WeakPolarHBondContact O-CB 3.4Å; I163-R167 VanDerWaalsContact O-CG 3.26Å; I163-R167 WeakPolarHBondContact O-CG 3.49Å; I163-R167 PolarHBondContact O-N 3.17Å; E164-R167 PolarHBondContact O-N 2.85Å; R167-T169 VanDerWaalsContact C-N 3.29Å; R167-R171 WeakPolarHBondContact O-CB 3.21Å; R167-R171 PolarHBondContact O-N 2.9Å
168	K	81.4	Confident	67.8	Low	147 Å²	147	82.2 Å²	82.2	64%	0.639	44%	0.44	S	S	*	.	H	α-helix	trans	-67.4	-29.7	175	-75	172.6	-177.8	180	0	112.8	E164 A165 L166	E164-K168 WeakPolarHBondContact O-CB 3.27Å; E164-K168 VanDerWaalsContact O-CG 3.24Å; E164-K168 WeakPolarHBondContact O-CG 3.02Å; E164-K168 PolarHBondContact O-N 3.25Å; A165-K168 PolarHBondContact O-N 3.45Å; L166-K168 VanDerWaalsContact C-N 3.29Å; L166-K168 PolarHBondContact O-N 3.23Å
169	T	75.6	Confident	65.5	Low	20 Å²	20	83.7 Å²	83.7	12%	0.123	45%	0.453	C	S	.	.	H	α-helix	trans	-85.4	-39.2	-179	-49.5	0	0	0	0	111.3	D100 L123 A165 L166 R167 P172	D100-T169 WeakPolarHBondContact O-CG2 3.19Å; L123-T169 HydrophobicContact CD1-CG2 3.96Å; A165-T169 PolarHBondContact O-N 2.89Å; A165-T169 PolarHBondContact O-OG1 3.49Å; L166-T169 PolarHBondContact O-N 3.5Å; R167-T169 VanDerWaalsContact C-N 3.29Å; T169-P172 WeakPolarHBondContact O-CD 2.98Å
170	V	70.6	Confident	62.5	Low	32 Å²	32	91.8 Å²	91.8	19%	0.194	49%	0.489	C	S	.	.	H	α-helix	trans	-75.9	-26	179.5	175.8	0	0	0	0	112.8	L123 C126 L166 P172	L123-V170 HydrophobicContact CB-CG2 4.15Å; L123-V170 HydrophobicContact CD2-CG2 4.34Å; C126-V170 HydrophobicContact CB-CB 4.3Å; C126-V170 HydrophobicContact CB-CG1 3.72Å; C126-V170 HydrophobicContact CB-CG2 3.54Å; C126-V170 VanDerWaalsContact O-CG1 3.29Å; C126-V170 WeakPolarHBondContact O-CG1 3.36Å; L166-V170 WeakPolarHBondContact O-CB 3.29Å; L166-V170 VanDerWaalsContact O-CG2 3.23Å; L166-V170 WeakPolarHBondContact O-CG2 2.88Å; L166-V170 PolarHBondContact O-N 2.89Å; V170-P172 VanDerWaalsContact O-CD 3.27Å; V170-P172 WeakPolarHBondContact O-CD 3.3Å
171	R	60.1	Low	59.8	Low	161 Å²	161	93.8 Å²	93.8	61%	0.608	51%	0.509	S	S	*	.			trans	-112.7	78.6	169	-62.3	-177.7	-175.4	151.3	5.8	109.5	R167 T173	R167-R171 WeakPolarHBondContact O-CB 3.21Å; R167-R171 PolarHBondContact O-N 2.9Å; R171-T173 PolarHBondContact O-N 3.37Å
172	P	47.7	Very low	56.9	Low	101 Å²	101	94.8 Å²	94.8	66%	0.656	52%	0.523	S	S	*	.			trans	-54	128.8	155.7	-11.4	25.4	0	0	0	105.9	T169 V170 S174	T169-P172 WeakPolarHBondContact O-CD 2.98Å; V170-P172 VanDerWaalsContact O-CD 3.27Å; V170-P172 WeakPolarHBondContact O-CD 3.3Å; P172-S174 PolarHBondContact O-N 3.44Å
173	T	33.4	Very low	54	Low	138 Å²	138	101.3 Å²	101.3	85%	0.847	56%	0.558	S	S	*	*			trans	-56.6	90	170.5	-56.9	0	0	0	0	107.9	R171 A175	R171-T173 PolarHBondContact O-N 3.37Å; T173-A175 PolarHBondContact O-N 2.99Å
174	S	32.9	Very low	51.1	Low	108 Å²	108	107 Å²	107	76%	0.755	60%	0.596	S	S	*	*			trans	-57.4	118.4	159.9	-174.7	0	0	0	0	105.3	P172	P172-S174 PolarHBondContact O-N 3.44Å
175	A	27.8	Very low	48.2	Very low	79 Å²	79	109.8 Å²	109.8	65%	0.653	62%	0.615	S	S	*	*			trans	-52.1	136.4	175.1	0	0	0	0	0	108.8	T173 D177	T173-A175 PolarHBondContact O-N 2.99Å; A175-D177 PolarHBondContact O-N 2.95Å
176	P	37.6	Very low	45.7	Very low	110 Å²	110	118.2 Å²	118.2	71%	0.714	65%	0.648	S	S	*	*			trans	-68.9	108.2	177.4	28.9	-30.5	0	0	0	107.6	V178	P176-V178 PolarHBondContact O-N 2.55Å
177	D	30	Very low	42.9	Very low	137 Å²	137	127.3 Å²	127.3	73%	0.733	69%	0.691	S	S	*	*			trans	-68.9	108	164.7	-171.8	-4.8	0	0	0	107.8	A175 T179	A175-D177 PolarHBondContact O-N 2.95Å; D177-T179 PolarHBondContact O-N 3.27Å; D177-T179 PolarHBondContact OD1-OG1 3.27Å
178	V	35.5	Very low	40.2	Very low	131 Å²	131	130.1 Å²	130.1	79%	0.794	71%	0.713	S	S	*	*			trans	-83.7	59.9	-178	-167.8	0	0	0	0	109.2	P176	P176-V178 PolarHBondContact O-N 2.55Å
179	T	39	Very low	37.5	Very low	99 Å²	99	128.9 Å²	128.9	61%	0.607	72%	0.718	S	S	*	*			trans	-148.8	73.8	165.4	51.1	0	0	0	0	110.8	D177	D177-T179 PolarHBondContact O-N 3.27Å; D177-T179 PolarHBondContact OD1-OG1 3.27Å
180	K	31.9	Very low	35.2	Very low	208 Å²	208	134.6 Å²	134.6	90%	0.904	75%	0.747	S	S	*	*			trans	170.3	84.8	149.1	-91.7	158	-161.2	-169.8	0	110.2
181	L	30.6	Very low	33.1	Very low	180 Å²	180	141.8 Å²	141.8	94%	0.942	78%	0.778	S	S	*	*			trans	-118.6	105.2	155.7	-84	170.9	0	0	0	107.8
182	S	30.2	Very low	31.4	Very low	106 Å²	106	140.2 Å²	140.2	74%	0.741	78%	0.782	S	S	*	*			trans	174.6	122.9	159.8	-107.2	0	0	0	0	104.4
183	D	29.8	Very low	30.5	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	79%	0.792	S	S	*	*			cis	-149.1	149.7	15.6	-62.5	-54.5	0	0	0	104.7
184	C	27.3	Very low	30	Very low	125 Å²	125	142.8 Å²	142.8	85%	0.845	79%	0.788	S	S	*	*				-176.4	121	73.8	43.7	0	0	0	0	109.9
185	N	28.2	Very low	29.9	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	79%	0.793	S	S	*	*			trans	-93.6	128.3	157.6	-102.5	-24.6	0	0	0	108.2
186	K	36	Very low	29.8	Very low	196 Å²	196	148.1 Å²	148.1	85%	0.852	80%	0.797	S	S	*	*			trans	169.1	117	156.2	-90.1	154.9	-167.3	-172	0	102.9
187	E	29.3	Very low	29.3	Very low	191 Å²	191	151.4 Å²	151.4	89%	0.893	80%	0.8	S	S	*	*				-170.9	136.8	61.9	50.2	-160.7	103.8	0	0	110.3
188	N	28.7	Very low	29.1	Very low	161 Å²	161	148.1 Å²	148.1	86%	0.861	80%	0.798	S	S	*	*			trans	-91.7	135.1	169.4	-121.2	-9.9	0	0	0	107.1
189	T	25.1	Very low	28.9	Very low	121 Å²	121	147.4 Å²	147.4	74%	0.742	80%	0.796	S	S	*	*			trans	-156.2	100.2	148.5	-70.1	0	0	0	0	111.7
190	L	28.3	Very low	28.4	Very low	140 Å²	140	150.2 Å²	150.2	73%	0.733	81%	0.807	S	S	*	*			trans	36.5	119.4	131	-49.1	170.3	0	0	0	119.7
191	H	26.7	Very low	28.3	Very low	184 Å²	184	150 Å²	150	85%	0.852	81%	0.806	S	S	*	*				-175.6	151.1	102.8	-106.4	61.2	0	0	0	114.6
192	N	24	Very low	28.1	Very low	128 Å²	128	145.7 Å²	145.7	68%	0.684	80%	0.796	S	S	*	*			trans	-100.8	156.7	-172.2	-148.7	19.9	0	0	0	109.9
193	Y	27.7	Very low	28	Very low	218 Å²	218	143.7 Å²	143.7	86%	0.855	79%	0.792	S	S	*	*			trans	33.9	139	161.9	-67.3	-81.3	0	0	0	122.5
194	G	22.8	Very low	28	Very low	74 Å²	74	145.4 Å²	145.4	76%	0.763	80%	0.796	S	S	*	*			trans	162.4	96	147.5	0	0	0	0	0	116.6
195	T	31.7	Very low	28	Very low	140 Å²	140	147.4 Å²	147.4	86%	0.859	79%	0.793	S	S	*	*			trans	-39.4	136	151.9	-57.2	0	0	0	0	111.8
196	Q	25.4	Very low	28	Very low	159 Å²	159	151.5 Å²	151.5	74%	0.743	80%	0.796	S	S	*	*			trans	-168.5	124.8	133.9	-77.7	-137.1	45	0	0	112.2
197	K	26.2	Very low	27.5	Very low	180 Å²	180	147 Å²	147	78%	0.783	80%	0.796	S	S	*	*			trans	52	123.4	134.6	-56.9	-158.3	179.1	-170.6	0	120.8
198	G	27.3	Very low	27.4	Very low	67 Å²	67	141.3 Å²	141.3	69%	0.691	79%	0.788	S	S	*	*			trans	-64.1	173	150.8	0	0	0	0	0	112.1
199	P	31.6	Very low	27.4	Very low	116 Å²	116	141.1 Å²	141.1	75%	0.753	79%	0.786	S	S	*	*				-148.9	151.6	87.5	33.8	-14.4	0	0	0	116.8
200	L	28.1	Very low	27.5	Very low	159 Å²	159	143.6 Å²	143.6	83%	0.832	79%	0.789	S	S	*	*			trans	42	126.4	131.8	-49.3	171.7	0	0	0	118.7
201	K	29.7	Very low	27.4	Very low	202 Å²	202	143.3 Å²	143.3	88%	0.878	79%	0.793	S	S	*	*				171.7	167.3	71.3	-100.2	-154.8	174.5	-178.7	0	106.3
202	A	26.5	Very low	27.3	Very low	90 Å²	90	140.3 Å²	140.3	74%	0.744	79%	0.787	S	S	*	*			cis	-178.4	159.5	-11.3	0	0	0	0	0	107.1
203	G	27.1	Very low	27.4	Very low	64 Å²	64	139.2 Å²	139.2	66%	0.66	79%	0.789	S	S	*	*			trans	141	75.8	167.8	0	0	0	0	0	111.9
204	E	30.2	Very low	27.4	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	80%	0.795	S	S	*	*				60.3	124.1	89.7	-82.9	-176.9	134.1	0	0	112.7
205	Q	28.4	Very low	27.6	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	80%	0.801	S	S	*	*			cis	-159.1	138.3	34.6	-91.3	153.8	74.4	0	0	108.4
206	R	27.3	Very low	27.4	Very low	246 Å²	246	138.5 Å²	138.5	93%	0.928	80%	0.795	S	S	*	*				81	109.4	77.4	-152.5	-175.3	-149.5	176	6.6	115.2
207	A	26.6	Very low	28.2	Very low	103 Å²	103	136.7 Å²	136.7	85%	0.851	80%	0.797	S	S	*	*			trans	-175	123.1	131.5	0	0	0	0	0	111
208	G	25.3	Very low	28.3	Very low	71 Å²	71	138.9 Å²	138.9	73%	0.732	80%	0.8	S	S	*	*			trans	-83.5	-166.3	167.9	0	0	0	0	0	111.7
209	I	29.2	Very low	28.5	Very low	156 Å²	156	144.9 Å²	144.9	80%	0.8	81%	0.807	S	S	*	*			cis	-163.1	151.5	3.1	-104.3	156	0	0	0	105.4
210	E	28.1	Very low	28.4	Very low	174 Å²	174	143.7 Å²	143.7	81%	0.813	81%	0.808	S	S	*	*			trans	8.3	145.8	155.6	-52.6	177.2	163.1	0	0	122
211	V	25.3	Very low	28.4	Very low	134 Å²	134	144.5 Å²	144.5	81%	0.812	81%	0.813	S	S	*	*				177.9	122.6	124.9	146.8	0	0	0	0	113
212	V	25.1	Very low	28.2	Very low	121 Å²	121	138.7 Å²	138.7	73%	0.733	81%	0.81	S	S	*	*			trans	66.6	119.8	137.6	179.1	0	0	0	0	123.3
213	S	25.9	Very low	28.2	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	81%	0.809	S	S	*	*			trans	13.5	135.7	132.5	-45.4	0	0	0	0	122.2
214	R	29	Very low	28.2	Very low	260 Å²	260	148.8 Å²	148.8	98%	0.981	82%	0.816	S	S	*	*				179.7	140	120.6	-110.3	-179.6	175.4	-164.2	-0.5	111.1
215	G	26.2	Very low	28.1	Very low	86 Å²	86	149.8 Å²	149.8	89%	0.887	82%	0.821	S	S	*	*			trans	160.7	70.3	162.4	0	0	0	0	0	117.7
216	G	26.3	Very low	28	Very low	71 Å²	71	145.8 Å²	145.8	73%	0.732	82%	0.816	S	S	*	*			trans	-146.9	176.2	147.5	0	0	0	0	0	107.5
217	P	42.2	Very low	28	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	81%	0.81	S	S	*	*			cis	-144.2	174.6	2.5	39.8	-19.1	0	0	0	116.4
218	R	29.4	Very low	27.9	Very low	227 Å²	227	142.2 Å²	142.2	86%	0.857	80%	0.8	S	S	*	*			trans	50.6	129.5	138.5	-73.3	-177.4	178.6	-155	0.5	124.8
219	K	32.3	Very low	28.2	Very low	192 Å²	192	148.2 Å²	148.2	84%	0.835	80%	0.802	S	S	*	*				66.7	129.9	127.2	-63.4	-89.1	-177.5	177.8	0	120.5
220	A	29.3	Very low	28.3	Very low	92 Å²	92	144.9 Å²	144.9	76%	0.76	79%	0.789	S	S	*	*				165.3	146.5	113.5	0	0	0	0	0	113.7
221	D	26.5	Very low	28.4	Very low	176 Å²	176	143.8 Å²	143.8	94%	0.941	78%	0.784	S	S	*	*			trans	27.5	146.8	150.9	-85.5	-38.2	0	0	0	124.9
222	G	26.8	Very low	28.6	Very low	80 Å²	80	144.2 Å²	144.2	83%	0.825	78%	0.781	S	S	*	*			trans	163.5	104.3	156.1	0	0	0	0	0	115.3
223	Q	25.6	Very low	29	Very low	154 Å²	154	143.8 Å²	143.8	72%	0.72	78%	0.783	S	S	*	*			trans	-103.4	153.2	-174.8	-156.1	-173.5	-28.1	0	0	111.3
224	R	27.5	Very low	29.5	Very low	211 Å²	211	144.8 Å²	144.8	80%	0.796	79%	0.787	S	S	*	*			trans	75.5	128.8	156.5	-47.5	-165.4	-177.8	-140.4	1.2	119.8
225	Q	27	Very low	29.6	Very low	199 Å²	199	139.9 Å²	139.9	93%	0.93	78%	0.78	S	S	*	*				-153.7	118.3	111.4	-113.8	167.7	4.5	0	0	110.6
226	A	28.2	Very low	29.6	Very low	83 Å²	83	141.7 Å²	141.7	69%	0.686	77%	0.774	S	S	*	*			trans	-100.2	-175.6	161.4	0	0	0	0	0	108
227	L	25.9	Very low	29.7	Very low	153 Å²	153	147.2 Å²	147.2	80%	0.801	78%	0.78	S	S	*	*			trans	101.9	133.4	173.9	-53.7	175.4	0	0	0	112.5
228	D	25.7	Very low	28.8	Very low	121 Å²	121	145.6 Å²	145.6	65%	0.647	78%	0.777	S	S	*	*			cis	-170.3	155.8	5.5	-129.5	-16.7	0	0	0	111.2
229	Y	31.7	Very low	29.5	Very low	198 Å²	198	140.4 Å²	140.4	78%	0.776	77%	0.773	S	S	*	*			trans	53.4	148.1	142.2	-104.2	-122.1	0	0	0	120.6
230	V	30.1	Very low	30.9	Very low	86 Å²	86	135.9 Å²	135.9	52%	0.521	76%	0.763	S	S	.	*			cis	179.5	132.7	-7	109.7	0	0	0	0	105.4
231	E	30.1	Very low	30.9	Very low	150 Å²	150	138.9 Å²	138.9	70%	0.701	76%	0.762	S	S	*	*				99.8	144.3	102.5	-149.2	-164.2	166.8	0	0	115
232	L	29.3	Very low	31	Very low	143 Å²	143	141 Å²	141	75%	0.749	76%	0.756	S	S	*	*			trans	88.8	107	159.1	-53.6	179.1	0	0	0	120.7
233	S	33.5	Very low	31.4	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	76%	0.755	S	S	*	*			trans	-61.1	160.8	153	-51.4	0	0	0	0	112.1
234	P	36.5	Very low	31.6	Very low	124 Å²	124	145.6 Å²	145.6	81%	0.805	76%	0.763	S	S	*	*				-142.5	160.6	101.1	30.1	-11.7	0	0	0	115.5
235	L	30.8	Very low	31.7	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	76%	0.761	S	S	*	*			trans	-55.2	149.7	174.4	-76.7	88.9	0	0	0	112.9
236	T	27	Very low	32.3	Very low	124 Å²	124	138.4 Å²	138.4	76%	0.761	76%	0.758	S	S	*	*				162	150.3	100.3	-44.8	0	0	0	0	110.7
237	Q	27.4	Very low	32.7	Very low	186 Å²	186	139 Å²	139	87%	0.869	76%	0.763	S	S	*	*			trans	109.9	113.5	154.5	-58.2	-174.5	33.9	0	0	118
238	A	24.9	Very low	33.2	Very low	88 Å²	88	143.2 Å²	143.2	73%	0.727	77%	0.769	S	S	*	*			trans	-92.2	-173.8	158.7	0	0	0	0	0	109.3
239	P	44.4	Very low	33.8	Very low	117 Å²	117	142.8 Å²	142.8	76%	0.76	77%	0.771	S	S	*	*			cis	-127.6	-139.7	-47.3	30.6	-7.7	0	0	0	109.3
240	P	60.7	Low	34.7	Very low	98 Å²	98	138.1 Å²	138.1	64%	0.636	76%	0.764	S	S	*	*				-117	178.3	-72.4	29.8	-10.8	0	0	0	113.4
241	Q	29.8	Very low	35.5	Very low	155 Å²	155	138.6 Å²	138.6	72%	0.724	76%	0.764	S	S	*	*			trans	156.2	138.3	131.2	-79.3	-76.1	-27.9	0	0	114.3
242	R	28.6	Very low	36.3	Very low	221 Å²	221	141.1 Å²	141.1	83%	0.834	77%	0.767	S	S	*	*			trans	71.2	111.3	155.3	-78.1	-178.7	-169.5	137.7	4.7	123.1
243	A	33.8	Very low	37.3	Very low	96 Å²	96	140.6 Å²	140.6	79%	0.793	76%	0.764	S	S	*	*				43.6	108.1	121.9	0	0	0	0	0	120.4
244	R	30.5	Very low	38.3	Very low	233 Å²	233	137.7 Å²	137.7	88%	0.879	75%	0.748	S	S	*	*				172.3	133.5	107.9	-123.6	172.8	163.8	137.9	-5.6	111.9
245	T	29.2	Very low	39.1	Very low	126 Å²	126	137.3 Å²	137.3	77%	0.773	73%	0.733	S	S	*	*			trans	56.3	132.8	153.5	46	0	0	0	0	121.5
246	P	41.2	Very low	40.6	Very low	133 Å²	133	135.2 Å²	135.2	86%	0.864	72%	0.719	S	S	*	*			trans	-92.4	132.6	-174.7	36.1	-30.2	0	0	0	112.4
247	A	36.2	Very low	42.5	Very low	96 Å²	96	134 Å²	134	79%	0.793	71%	0.705	S	S	*	*			trans	-147.5	131.2	157.3	0	0	0	0	0	110
248	R	36.4	Very low	44.4	Very low	242 Å²	242	131.5 Å²	131.5	91%	0.913	69%	0.693	S	S	*	*			trans	82.9	107	168.9	-67.5	178.9	168.2	149	-2.3	118.3
249	T	38.4	Very low	46.6	Very low	112 Å²	112	132.4 Å²	132.4	69%	0.687	69%	0.685	S	S	*	*			trans	-113.8	100.7	155.2	49.6	0	0	0	0	110.3
250	P	50.5	Low	48.1	Very low	99 Å²	99	132.2 Å²	132.2	64%	0.643	67%	0.674	S	S	*	*	S	Bend	trans	-86.7	-21.2	157	-2.9	21.3	0	0	0	112	R252 L253	P250-R252 PolarHBondContact O-N 3.11Å; P250-L253 PolarHBondContact O-N 3.48Å
251	D	46.4	Very low	49.1	Very low	97 Å²	97	133.9 Å²	133.9	52%	0.519	67%	0.668	S	S	.	*	H	α-helix	trans	-75.4	-20.4	-169.8	-164.2	50.9	0	0	0	114.3	K255	D251-K255 IonicContact OD2-NZ 3.93Å; D251-K255 PolarHBondContact OD2-NZ 2.92Å
252	R	46.9	Very low	51.4	Low	202 Å²	202	129.6 Å²	129.6	76%	0.762	65%	0.65	S	S	*	*	H	α-helix	trans	-78.9	-26.6	179.8	-143.5	177.1	-171.7	171.1	1.9	112.6	P250 Q256	P250-R252 PolarHBondContact O-N 3.11Å; R252-Q256 WeakPolarHBondContact O-CB 3.37Å; R252-Q256 PolarHBondContact O-N 3.13Å
253	L	49.7	Very low	53.6	Low	132 Å²	132	124.1 Å²	124.1	69%	0.691	64%	0.636	S	S	*	*	H	α-helix	trans	-77.4	-36.9	-179.9	-116	142.6	0	0	0	111.6	P250 Q256 E257	P250-L253 PolarHBondContact O-N 3.48Å; L253-Q256 PolarHBondContact O-N 3.36Å; L253-E257 WeakPolarHBondContact O-CB 3.41Å; L253-E257 PolarHBondContact O-N 3.3Å; L253-E257 VanDerWaalsContact O-N 3.08Å
254	A	55.8	Low	55.7	Low	53 Å²	53	122 Å²	122	44%	0.438	62%	0.619	S	S	.	*	H	α-helix	trans	-66.3	-42.1	176.4	0	0	0	0	0	112.3	E257 E258	A254-E257 PolarHBondContact O-N 2.91Å; A254-E258 WeakPolarHBondContact O-CB 3.38Å; A254-E258 PolarHBondContact O-N 3.01Å
255	K	53.3	Low	58.2	Low	115 Å²	115	116 Å²	116	50%	0.5	60%	0.601	S	S	.	*	H	α-helix	trans	-67	-35.9	177.1	-70.8	172.1	177.2	155.7	0	112.6	D251 L259	D251-K255 IonicContact OD2-NZ 3.93Å; D251-K255 PolarHBondContact OD2-NZ 2.92Å; K255-L259 WeakPolarHBondContact O-CB 3.37Å; K255-L259 WeakPolarHBondContact O-CD1 3.49Å; K255-L259 PolarHBondContact O-N 3.14Å; K255-L259 VanDerWaalsContact O-N 3.09Å
256	Q	60.4	Low	60.5	Low	115 Å²	115	116.1 Å²	116.1	54%	0.537	59%	0.587	S	S	.	*	H	α-helix	trans	-63.5	-45.4	174	-175.8	89.1	-3.7	0	0	111	R252 L253 E258 L259 E260	R252-Q256 WeakPolarHBondContact O-CB 3.37Å; R252-Q256 PolarHBondContact O-N 3.13Å; L253-Q256 PolarHBondContact O-N 3.36Å; Q256-E258 VanDerWaalsContact C-N 3.35Å; Q256-E258 PolarHBondContact O-N 3.27Å; Q256-L259 PolarHBondContact O-N 3.48Å; Q256-E260 WeakPolarHBondContact O-CG 3.39Å; Q256-E260 PolarHBondContact O-N 3.06Å
257	E	68.4	Low	61.9	Low	97 Å²	97	111.9 Å²	111.9	45%	0.453	56%	0.561	S	S	.	*	H	α-helix	trans	-71.3	-29.8	-178.8	-144.9	-170.9	-176.7	0	0	112.2	L253 A254 R261	L253-E257 WeakPolarHBondContact O-CB 3.41Å; L253-E257 PolarHBondContact O-N 3.3Å; L253-E257 VanDerWaalsContact O-N 3.08Å; A254-E257 PolarHBondContact O-N 2.91Å; E257-R261 VanDerWaalsContact C-NH1 3.27Å; E257-R261 WeakPolarHBondContact O-CG 3.25Å; E257-R261 PolarHBondContact O-N 3.08Å; E257-R261 VanDerWaalsContact O-N 3.17Å; E257-R261 PolarHBondContact O-NH1 2.9Å; E257-R261 VanDerWaalsContact O-NH1 3.08Å; E257-R261 IonicContact OE1-CZ 3.86Å; E257-R261 IonicContact OE1-NH2 3.67Å; E257-R261 PolarHBondContact OE1-NH2 3.25Å; E257-R261 IonicContact OE2-CZ 2.61Å; E257-R261 IonicContact OE2-NH1 3.97Å; E257-R261 IonicContact OE2-NH2 3.43Å; E257-R261 PolarHBondContact OE2-NH2 3.02Å
258	E	67.4	Low	63.9	Low	134 Å²	134	112 Å²	112	63%	0.626	55%	0.545	S	S	*	.	H	α-helix	trans	-68.8	-43.3	172.3	-167.4	173.4	-169.3	0	0	111.7	A254 Q256 E260 R261 D262	A254-E258 WeakPolarHBondContact O-CB 3.38Å; A254-E258 PolarHBondContact O-N 3.01Å; Q256-E258 VanDerWaalsContact C-N 3.35Å; Q256-E258 PolarHBondContact O-N 3.27Å; E258-E260 VanDerWaalsContact C-N 3.34Å; E258-E260 PolarHBondContact O-N 2.64Å; E258-R261 PolarHBondContact O-N 2.98Å; E258-D262 WeakPolarHBondContact O-CB 3.29Å; E258-D262 PolarHBondContact O-N 3.34Å
259	L	71.5	Confident	65.7	Low	108 Å²	108	105.3 Å²	105.3	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-61.8	-38	173.5	-87.3	153.8	0	0	0	112.8	K255 Q256 D262 L263	K255-L259 WeakPolarHBondContact O-CB 3.37Å; K255-L259 WeakPolarHBondContact O-CD1 3.49Å; K255-L259 PolarHBondContact O-N 3.14Å; K255-L259 VanDerWaalsContact O-N 3.09Å; Q256-L259 PolarHBondContact O-N 3.48Å; L259-D262 PolarHBondContact O-N 2.95Å; L259-L263 WeakPolarHBondContact O-CB 3.34Å; L259-L263 WeakPolarHBondContact O-CG 3.49Å; L259-L263 PolarHBondContact O-N 3.38Å
260	E	74.9	Confident	67.3	Low	112 Å²	112	107.5 Å²	107.5	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-68	-38.9	176.8	-76.4	176.4	-176.8	0	0	112.3	Q256 E258 A264	Q256-E260 WeakPolarHBondContact O-CG 3.39Å; Q256-E260 PolarHBondContact O-N 3.06Å; E258-E260 VanDerWaalsContact C-N 3.34Å; E258-E260 PolarHBondContact O-N 2.64Å; E260-A264 WeakPolarHBondContact O-CB 3.38Å; E260-A264 PolarHBondContact O-N 2.86Å
261	R	80.7	Confident	68.6	Low	134 Å²	134	109 Å²	109	51%	0.506	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-40.5	173.9	-71	179.6	-161.9	101	-6.2	111.8	E257 E258 A264 Q265	E257-R261 VanDerWaalsContact C-NH1 3.27Å; E257-R261 WeakPolarHBondContact O-CG 3.25Å; E257-R261 PolarHBondContact O-N 3.08Å; E257-R261 VanDerWaalsContact O-N 3.17Å; E257-R261 PolarHBondContact O-NH1 2.9Å; E257-R261 VanDerWaalsContact O-NH1 3.08Å; E257-R261 IonicContact OE1-CZ 3.86Å; E257-R261 IonicContact OE1-NH2 3.67Å; E257-R261 PolarHBondContact OE1-NH2 3.25Å; E257-R261 IonicContact OE2-CZ 2.61Å; E257-R261 IonicContact OE2-NH1 3.97Å; E257-R261 IonicContact OE2-NH2 3.43Å; E257-R261 PolarHBondContact OE2-NH2 3.02Å; E258-R261 PolarHBondContact O-N 2.98Å; R261-A264 PolarHBondContact O-N 2.97Å; R261-Q265 WeakPolarHBondContact O-CB 3.43Å; R261-Q265 PolarHBondContact O-N 2.88Å
262	D	79.4	Confident	69.9	Low	65 Å²	65	110.8 Å²	110.8	35%	0.348	52%	0.515	S	S	.	.	H	α-helix	trans	-67.2	-37.2	179	-152.7	46.7	0	0	0	111.8	E258 L259 R266	E258-D262 WeakPolarHBondContact O-CB 3.29Å; E258-D262 PolarHBondContact O-N 3.34Å; L259-D262 PolarHBondContact O-N 2.95Å; D262-R266 WeakPolarHBondContact O-CG 3.35Å; D262-R266 PolarHBondContact O-N 3.45Å; D262-R266 IonicContact OD2-CZ 2.87Å; D262-R266 IonicContact OD2-NH1 3.3Å; D262-R266 PolarHBondContact OD2-NH1 3.4Å; D262-R266 IonicContact OD2-NH2 2.67Å; D262-R266 PolarHBondContact OD2-NH2 3.25Å
263	L	74.4	Confident	70.8	Confident	105 Å²	105	110.6 Å²	110.6	55%	0.55	52%	0.515	S	S	.	.	H	α-helix	trans	-68.6	-40.6	172.4	-80.1	166.5	0	0	0	112.7	L259 Q265 R266 S267	L259-L263 WeakPolarHBondContact O-CB 3.34Å; L259-L263 WeakPolarHBondContact O-CG 3.49Å; L259-L263 PolarHBondContact O-N 3.38Å; L263-Q265 VanDerWaalsContact C-N 3.34Å; L263-R266 PolarHBondContact O-N 3.06Å; L263-S267 WeakPolarHBondContact O-CB 3.24Å; L263-S267 PolarHBondContact O-N 3.3Å
264	A	78.8	Confident	71	Confident	51 Å²	51	112.4 Å²	112.4	42%	0.421	52%	0.518	S	S	.	.	H	α-helix	trans	-62.2	-43.7	176	0	0	0	0	0	111.1	E260 R261 S267 E268	E260-A264 WeakPolarHBondContact O-CB 3.38Å; E260-A264 PolarHBondContact O-N 2.86Å; R261-A264 PolarHBondContact O-N 2.97Å; A264-S267 WeakPolarHBondContact O-CB 3.46Å; A264-S267 PolarHBondContact O-N 3.44Å; A264-S267 VanDerWaalsContact O-N 3.16Å; A264-S267 PolarHBondContact O-OG 3.03Å; A264-E268 PolarHBondContact O-N 3.24Å
265	Q	82.7	Confident	71.1	Confident	107 Å²	107	115.8 Å²	115.8	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-46.1	177.6	-169.5	171.6	-17.3	0	0	112.1	R261 L263 S267 E268 E269	R261-Q265 WeakPolarHBondContact O-CB 3.43Å; R261-Q265 PolarHBondContact O-N 2.88Å; L263-Q265 VanDerWaalsContact C-N 3.34Å; Q265-S267 PolarHBondContact O-N 2.86Å; Q265-E268 PolarHBondContact O-N 3.35Å; Q265-E268 VanDerWaalsContact O-N 3.14Å; Q265-E269 WeakPolarHBondContact O-CG 3.3Å; Q265-E269 PolarHBondContact O-N 3.21Å
266	R	76.1	Confident	70.9	Confident	129 Å²	129	113.6 Å²	113.6	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-26.9	173.1	-73.4	-169	-171.3	96.3	10.6	113.2	D262 L263 R270	D262-R266 WeakPolarHBondContact O-CG 3.35Å; D262-R266 PolarHBondContact O-N 3.45Å; D262-R266 IonicContact OD2-CZ 2.87Å; D262-R266 IonicContact OD2-NH1 3.3Å; D262-R266 PolarHBondContact OD2-NH1 3.4Å; D262-R266 IonicContact OD2-NH2 2.67Å; D262-R266 PolarHBondContact OD2-NH2 3.25Å; L263-R266 PolarHBondContact O-N 3.06Å; R266-R270 PolarHBondContact O-N 3.43Å; R266-R270 PolarHBondContact O-NE 3.21Å
267	S	71	Confident	70.1	Confident	44 Å²	44	113.7 Å²	113.7	31%	0.308	54%	0.536	S	S	.	.	H	α-helix	trans	-74.6	-39.6	174.2	94.7	0	0	0	0	111.9	L263 A264 Q265 R270 R271	L263-S267 WeakPolarHBondContact O-CB 3.24Å; L263-S267 PolarHBondContact O-N 3.3Å; A264-S267 WeakPolarHBondContact O-CB 3.46Å; A264-S267 PolarHBondContact O-N 3.44Å; A264-S267 VanDerWaalsContact O-N 3.16Å; A264-S267 PolarHBondContact O-OG 3.03Å; Q265-S267 PolarHBondContact O-N 2.86Å; S267-R270 PolarHBondContact O-N 2.92Å; S267-R271 PolarHBondContact O-N 2.76Å
268	E	79.6	Confident	69	Low	100 Å²	100	116.1 Å²	116.1	47%	0.467	55%	0.552	S	S	.	*	H	α-helix	trans	-70.3	-38.2	176.7	-92.6	-172.8	165.5	0	0	112.3	A264 Q265 R271 K272	A264-E268 PolarHBondContact O-N 3.24Å; Q265-E268 PolarHBondContact O-N 3.35Å; Q265-E268 VanDerWaalsContact O-N 3.14Å; E268-R271 PolarHBondContact O-N 2.97Å; E268-R271 IonicContact OE1-NH1 3.49Å; E268-K272 WeakPolarHBondContact O-CB 3.27Å; E268-K272 WeakPolarHBondContact O-CG 3.37Å; E268-K272 PolarHBondContact O-N 3.44Å
269	E	73.9	Confident	67.7	Low	100 Å²	100	114.7 Å²	114.7	47%	0.467	56%	0.557	S	S	.	*	H	α-helix	trans	-62	-43.4	173.7	-74	175.9	-179.6	0	0	111.1	Q265 K272 W273	Q265-E269 WeakPolarHBondContact O-CG 3.3Å; Q265-E269 PolarHBondContact O-N 3.21Å; E269-K272 PolarHBondContact O-N 3.29Å; E269-W273 VanDerWaalsContact O-CD1 3.29Å; E269-W273 PolarHBondContact O-N 2.97Å
270	R	71.1	Confident	66.3	Low	158 Å²	158	120.7 Å²	120.7	60%	0.596	57%	0.573	S	S	*	*	H	α-helix	trans	-61.3	-44.2	172	-86.4	-176.3	-67.6	-161.2	0.9	112.1	R266 S267 K272 W273 F274	R266-R270 PolarHBondContact O-N 3.43Å; R266-R270 PolarHBondContact O-NE 3.21Å; S267-R270 PolarHBondContact O-N 2.92Å; R270-K272 VanDerWaalsContact C-N 3.33Å; R270-K272 PolarHBondContact O-N 3.35Å; R270-W273 WeakPolarHBondContact O-CB 3.4Å; R270-W273 PolarHBondContact O-N 2.99Å; R270-F274 WeakPolarHBondContact O-CD2 3.32Å; R270-F274 PolarHBondContact O-N 3.49Å; R270-F274 VanDerWaalsContact O-N 3.11Å
271	R	77.7	Confident	64.5	Low	130 Å²	130	121.8 Å²	121.8	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-60.6	-43.1	177.9	-166.6	-175.3	-57	128.9	6.9	111.5	S267 E268 F274 E275	S267-R271 PolarHBondContact O-N 2.76Å; E268-R271 PolarHBondContact O-N 2.97Å; E268-R271 IonicContact OE1-NH1 3.49Å; R271-F274 PolarHBondContact O-N 2.84Å; R271-E275 PolarHBondContact O-N 3.01Å
272	K	73.6	Confident	62.8	Low	135 Å²	135	121.2 Å²	121.2	59%	0.587	60%	0.601	S	S	*	*	H	α-helix	trans	-65.8	-35.6	175.8	-76.9	-180	178.6	174	0	112.7	E268 E269 R270 F274 E275 A276	E268-K272 WeakPolarHBondContact O-CB 3.27Å; E268-K272 WeakPolarHBondContact O-CG 3.37Å; E268-K272 PolarHBondContact O-N 3.44Å; E269-K272 PolarHBondContact O-N 3.29Å; R270-K272 VanDerWaalsContact C-N 3.33Å; R270-K272 PolarHBondContact O-N 3.35Å; K272-F274 VanDerWaalsContact C-N 3.3Å; K272-F274 PolarHBondContact O-N 2.87Å; K272-E275 PolarHBondContact O-N 3.36Å; K272-A276 WeakPolarHBondContact O-CB 3.45Å; K272-A276 PolarHBondContact O-N 2.98Å
273	W	66.1	Low	60.8	Low	199 Å²	199	127.4 Å²	127.4	75%	0.754	63%	0.628	S	S	*	*	H	α-helix	trans	-61.6	-38.8	171.9	-95.3	97.5	0	0	0	112.2	E269 R270 T277	E269-W273 VanDerWaalsContact O-CD1 3.29Å; E269-W273 PolarHBondContact O-N 2.97Å; R270-W273 WeakPolarHBondContact O-CB 3.4Å; R270-W273 PolarHBondContact O-N 2.99Å; W273-T277 PolarHBondContact O-OG1 3.44Å; W273-T277 VanDerWaalsContact O-OG1 3.08Å
274	F	54.8	Low	58.9	Low	170 Å²	170	129.1 Å²	129.1	75%	0.746	64%	0.642	S	S	*	*	H	α-helix	trans	-71.9	-38	175.2	-79.3	-73.7	0	0	0	112.7	R270 R271 K272	R270-F274 WeakPolarHBondContact O-CD2 3.32Å; R270-F274 PolarHBondContact O-N 3.49Å; R270-F274 VanDerWaalsContact O-N 3.11Å; R271-F274 PolarHBondContact O-N 2.84Å; K272-F274 VanDerWaalsContact C-N 3.3Å; K272-F274 PolarHBondContact O-N 2.87Å
275	E	57	Low	57.2	Low	123 Å²	123	132.2 Å²	132.2	58%	0.575	66%	0.658	S	S	*	*	H	α-helix	trans	-73.6	-33	176.7	-81.7	173.2	161.9	0	0	113.6	R271 K272 T277 D278	R271-E275 PolarHBondContact O-N 3.01Å; K272-E275 PolarHBondContact O-N 3.36Å; E275-T277 PolarHBondContact O-N 3.24Å; E275-D278 PolarHBondContact O-N 2.95Å
276	A	48.6	Very low	54.8	Low	70 Å²	70	132.3 Å²	132.3	58%	0.579	68%	0.677	S	S	*	*	H	α-helix	trans	-68.9	-19.3	-179.8	0	0	0	0	0	113.3	K272 D278	K272-A276 WeakPolarHBondContact O-CB 3.45Å; K272-A276 PolarHBondContact O-N 2.98Å; A276-D278 VanDerWaalsContact C-N 3.3Å
277	T	45.1	Very low	52.8	Low	117 Å²	117	129.7 Å²	129.7	72%	0.718	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-20	178.6	-53.5	0	0	0	0	112.1	W273 E275	W273-T277 PolarHBondContact O-OG1 3.44Å; W273-T277 VanDerWaalsContact O-OG1 3.08Å; E275-T277 PolarHBondContact O-N 3.24Å
278	D	44.7	Very low	51.1	Low	147 Å²	147	137.2 Å²	137.2	79%	0.786	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-1.7	-174.8	-146.6	15.9	0	0	0	113.7	E275 A276	E275-D278 PolarHBondContact O-N 2.95Å; A276-D278 VanDerWaalsContact C-N 3.3Å
279	S	39.7	Very low	49.3	Very low	105 Å²	105	136.4 Å²	136.4	73%	0.734	74%	0.738	S	S	*	*	S	Bend	trans	-104.1	10.5	-169.7	-62.3	0	0	0	0	115.6
280	R	43.3	Very low	47.4	Very low	234 Å²	234	138.7 Å²	138.7	88%	0.883	75%	0.753	S	S	*	*			trans	-123.3	80.5	-177.6	-156.4	175.5	-170	178.2	2.4	113.3
281	T	36.1	Very low	46.4	Very low	134 Å²	134	142.6 Å²	142.6	82%	0.822	77%	0.768	S	S	*	*			trans	-129.2	126.3	154.7	26.3	0	0	0	0	110.4
282	P	45	Very low	44.5	Very low	123 Å²	123	146 Å²	146	80%	0.799	78%	0.781	S	S	*	*			trans	-75.9	150.9	-176.5	-10.5	27	0	0	0	113.9
283	E	38.2	Very low	43.2	Very low	195 Å²	195	143.3 Å²	143.3	91%	0.911	79%	0.791	S	S	*	*			trans	-58.3	130.2	176.9	-61.8	-117.7	126.9	0	0	114.7
284	V	34	Very low	42	Very low	141 Å²	141	139.2 Å²	139.2	86%	0.855	78%	0.784	S	S	*	*			trans	-145	139.3	154.9	-178.5	0	0	0	0	108.5
285	P	42.4	Very low	41.6	Very low	116 Å²	116	135.6 Å²	135.6	75%	0.753	79%	0.794	S	S	*	*			trans	-97.1	155	-156.9	36.6	-33.3	0	0	0	115.8
286	A	33.9	Very low	41.1	Very low	108 Å²	108	132.4 Å²	132.4	89%	0.893	79%	0.788	S	S	*	*			trans	66.9	121.2	149.5	0	0	0	0	0	120.5
287	G	33.9	Very low	41.3	Very low	74 Å²	74	135 Å²	135	76%	0.763	80%	0.799	S	S	*	*			trans	150.1	90.1	152	0	0	0	0	0	116
288	E	34.5	Very low	41.9	Very low	203 Å²	203	133.9 Å²	133.9	95%	0.949	79%	0.788	S	S	*	*			trans	60.8	134.3	153.4	-64.3	-174.5	152.3	0	0	121.1
289	G	41.6	Very low	43.2	Very low	82 Å²	82	131 Å²	131	85%	0.845	78%	0.776	S	S	*	*			trans	-75.1	141.8	-167.9	0	0	0	0	0	115.4
290	L	34.9	Very low	44.6	Very low	149 Å²	149	133 Å²	133	78%	0.78	77%	0.774	S	S	*	*			trans	-146.3	127.4	150.6	-172.1	60.7	0	0	0	109.8	R292	L290-R292 PolarHBondContact O-N 3.4Å
291	R	49.9	Very low	46.1	Very low	240 Å²	240	127.2 Å²	127.2	91%	0.906	76%	0.761	S	S	*	*			trans	-55.5	120.9	171.9	-57.2	-158.7	-168.5	-165	6.5	110.5
292	R	37.4	Very low	48	Very low	201 Å²	201	125.6 Å²	125.6	76%	0.758	74%	0.744	S	S	*	*			trans	-143.1	93.5	152	-86.8	-176.5	-164.5	-145.5	3.2	108.5	L290 L294	L290-R292 PolarHBondContact O-N 3.4Å; R292-L294 HydrophobicContact CB-CD1 4.49Å; R292-L294 HydrophobicContact CB-CG 4.49Å; R292-L294 HydrophobicContact CG-CD1 4.03Å; R292-L294 HydrophobicContact CG-CG 4.46Å
293	G	45.4	Very low	49.1	Very low	78 Å²	78	125.3 Å²	125.3	80%	0.804	73%	0.732	S	S	*	*			trans	-79.5	115.3	146.9	0	0	0	0	0	105.8
294	L	42.8	Very low	51	Low	114 Å²	114	119.7 Å²	119.7	60%	0.597	71%	0.708	S	S	*	*			trans	-150.6	105.8	174	-75.4	-179.4	0	0	0	110.6	R292 A296	R292-L294 HydrophobicContact CB-CD1 4.49Å; R292-L294 HydrophobicContact CB-CG 4.49Å; R292-L294 HydrophobicContact CG-CD1 4.03Å; R292-L294 HydrophobicContact CG-CG 4.46Å; L294-A296 HydrophobicContact CB-CB 3.86Å; L294-A296 HydrophobicContact CD1-CB 4.08Å; L294-A296 HydrophobicContact CD2-CB 4.44Å; L294-A296 HydrophobicContact CG-CB 4.34Å; L294-A296 PolarHBondContact O-N 3.45Å; L294-A296 VanDerWaalsContact O-N 3.13Å
295	G	45.9	Very low	53.4	Low	93 Å²	93	121.1 Å²	121.1	96%	0.959	70%	0.698	S	S	*	*			trans	-70.4	73.4	134.7	0	0	0	0	0	108.2
296	A	46.6	Very low	55	Low	56 Å²	56	119.6 Å²	119.6	46%	0.463	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-88.5	137.7	167.8	0	0	0	0	0	108.3	L294 L298	L294-A296 HydrophobicContact CB-CB 3.86Å; L294-A296 HydrophobicContact CD1-CB 4.08Å; L294-A296 HydrophobicContact CD2-CB 4.44Å; L294-A296 HydrophobicContact CG-CB 4.34Å; L294-A296 PolarHBondContact O-N 3.45Å; L294-A296 VanDerWaalsContact O-N 3.13Å; A296-L298 PolarHBondContact O-N 3.5Å
297	P	51.4	Low	57.1	Low	124 Å²	124	117.3 Å²	117.3	81%	0.805	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-55	138.6	169.6	-19.5	31	0	0	0	109.9	T299	P297-T299 PolarHBondContact O-N 2.94Å
298	L	58.4	Low	59.7	Low	94 Å²	94	120.2 Å²	120.2	49%	0.492	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-49.2	135.6	173	-102.5	76.2	0	0	0	109.4	A296 Q302 L306	A296-L298 PolarHBondContact O-N 3.5Å; L298-Q302 HydrophobicContact CB-CB 4.43Å; L298-Q302 HydrophobicContact CD2-CB 3.89Å; L298-Q302 HydrophobicContact CG-CB 4.14Å; L298-L306 HydrophobicContact CD2-CD1 3.63Å
299	T	72.9	Confident	62.2	Low	86 Å²	86	116.5 Å²	116.5	53%	0.528	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-63.2	147	171.3	13	0	0	0	0	109.9	P297 D301 Q302 Q303	P297-T299 PolarHBondContact O-N 2.94Å; T299-D301 PolarHBondContact O-N 3.09Å; T299-D301 VanDerWaalsContact O-N 3.1Å; T299-Q302 WeakPolarHBondContact O-CA 3.37Å; T299-Q302 WeakPolarHBondContact O-CB 3.49Å; T299-Q302 PolarHBondContact O-N 3.36Å; T299-Q303 PolarHBondContact O-N 2.88Å; T299-Q303 VanDerWaalsContact O-N 3.11Å
300	E	69.2	Low	64.1	Low	149 Å²	149	117.4 Å²	117.4	70%	0.696	62%	0.621	S	S	*	*	H	α-helix	trans	-53.2	-34.5	-178.4	-161.8	169.1	-174.9	0	0	112.1	Q302 Q303 N304	E300-Q302 PolarHBondContact O-N 2.92Å; E300-Q303 PolarHBondContact O-N 2.96Å; E300-N304 WeakPolarHBondContact O-CB 3.26Å; E300-N304 PolarHBondContact O-N 3.46Å; E300-N304 PolarHBondContact O-ND2 3.46Å
301	D	73.2	Confident	66.6	Low	112 Å²	112	115.2 Å²	115.2	60%	0.599	61%	0.607	S	S	*	*	H	α-helix	trans	-64.7	-32.9	173.6	-67.3	-29.7	0	0	0	114.2	T299 R305	T299-D301 PolarHBondContact O-N 3.09Å; T299-D301 VanDerWaalsContact O-N 3.1Å; D301-R305 WeakPolarHBondContact O-CD 3.33Å; D301-R305 WeakPolarHBondContact O-CG 3.38Å; D301-R305 PolarHBondContact O-N 3.28Å
302	Q	75.8	Confident	68.4	Low	99 Å²	99	110 Å²	110	46%	0.463	59%	0.591	S	S	.	*	H	α-helix	trans	-76.5	-37	175.8	-66.1	-179.8	-21.8	0	0	110.7	L298 T299 E300 L306	L298-Q302 HydrophobicContact CB-CB 4.43Å; L298-Q302 HydrophobicContact CD2-CB 3.89Å; L298-Q302 HydrophobicContact CG-CB 4.14Å; T299-Q302 WeakPolarHBondContact O-CA 3.37Å; T299-Q302 WeakPolarHBondContact O-CB 3.49Å; T299-Q302 PolarHBondContact O-N 3.36Å; E300-Q302 PolarHBondContact O-N 2.92Å; Q302-L306 WeakPolarHBondContact O-CG 3.41Å; Q302-L306 PolarHBondContact O-N 2.97Å; Q302-L306 VanDerWaalsContact O-N 3.09Å
303	Q	69.8	Low	70.5	Confident	117 Å²	117	106.3 Å²	106.3	55%	0.547	58%	0.581	S	S	.	*	H	α-helix	trans	-69	-37.9	176.3	-168.7	167.4	0.3	0	0	111.9	T299 E300 L306 S307	T299-Q303 PolarHBondContact O-N 2.88Å; T299-Q303 VanDerWaalsContact O-N 3.11Å; E300-Q303 PolarHBondContact O-N 2.96Å; Q303-L306 PolarHBondContact O-N 2.74Å; Q303-S307 WeakPolarHBondContact O-CB 3.46Å; Q303-S307 PolarHBondContact O-N 3.22Å; Q303-S307 PolarHBondContact O-OG 3.15Å
304	N	76.9	Confident	71.8	Confident	78 Å²	78	109.7 Å²	109.7	42%	0.417	57%	0.569	S	S	.	*	H	α-helix	trans	-66.7	-43.2	174.9	-72.1	-20	0	0	0	111.5	E300 L306 S307 E308	E300-N304 WeakPolarHBondContact O-CB 3.26Å; E300-N304 PolarHBondContact O-N 3.46Å; E300-N304 PolarHBondContact O-ND2 3.46Å; N304-L306 PolarHBondContact O-N 2.96Å; N304-S307 PolarHBondContact O-N 2.81Å; N304-E308 WeakPolarHBondContact O-CB 3.38Å; N304-E308 WeakPolarHBondContact O-CG 3.3Å; N304-E308 PolarHBondContact O-N 3.47Å
305	R	84.1	Confident	73.4	Confident	171 Å²	171	108.2 Å²	108.2	65%	0.645	56%	0.559	S	S	*	*	H	α-helix	trans	-60.7	-42	174.8	-73.8	170.3	-164.4	-93.4	0.7	112.9	D301 E308 E309	D301-R305 WeakPolarHBondContact O-CD 3.33Å; D301-R305 WeakPolarHBondContact O-CG 3.38Å; D301-R305 PolarHBondContact O-N 3.28Å; R305-E308 PolarHBondContact O-N 3.34Å; R305-E309 PolarHBondContact O-N 2.83Å
306	L	77.8	Confident	74.9	Confident	83 Å²	83	107.9 Å²	107.9	44%	0.435	53%	0.533	S	S	.	.	H	α-helix	trans	-67.3	-38.1	175.9	-73.5	170.3	0	0	0	111.7	L298 Q302 Q303 N304 E309 I310	L298-L306 HydrophobicContact CD2-CD1 3.63Å; Q302-L306 WeakPolarHBondContact O-CG 3.41Å; Q302-L306 PolarHBondContact O-N 2.97Å; Q302-L306 VanDerWaalsContact O-N 3.09Å; Q303-L306 PolarHBondContact O-N 2.74Å; N304-L306 PolarHBondContact O-N 2.96Å; L306-E309 PolarHBondContact O-N 2.86Å; L306-I310 WeakPolarHBondContact O-CB 3.36Å; L306-I310 WeakPolarHBondContact O-CD1 3.29Å; L306-I310 WeakPolarHBondContact O-CG1 3.35Å; L306-I310 PolarHBondContact O-N 2.94Å
307	S	77.8	Confident	76	Confident	60 Å²	60	109.9 Å²	109.9	42%	0.42	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-41	176	-57.2	0	0	0	0	111.3	Q303 N304 I310 E311	Q303-S307 WeakPolarHBondContact O-CB 3.46Å; Q303-S307 PolarHBondContact O-N 3.22Å; Q303-S307 PolarHBondContact O-OG 3.15Å; N304-S307 PolarHBondContact O-N 2.81Å; S307-I310 PolarHBondContact O-N 3.37Å; S307-E311 WeakPolarHBondContact O-CB 3.48Å; S307-E311 PolarHBondContact O-N 2.84Å
308	E	88.5	Confident	76.8	Confident	136 Å²	136	111.2 Å²	111.2	64%	0.636	53%	0.53	S	S	*	.	H	α-helix	trans	-64	-38.7	173.4	-73	172.3	-175.2	0	0	112.2	N304 R305 K312	N304-E308 WeakPolarHBondContact O-CB 3.38Å; N304-E308 WeakPolarHBondContact O-CG 3.3Å; N304-E308 PolarHBondContact O-N 3.47Å; R305-E308 PolarHBondContact O-N 3.34Å; E308-K312 VanDerWaalsContact O-CB 3.26Å; E308-K312 WeakPolarHBondContact O-CB 3.5Å; E308-K312 PolarHBondContact O-N 3.4Å
309	E	85.7	Confident	77.4	Confident	124 Å²	124	115.1 Å²	115.1	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-67.5	-39.4	174.2	-85.7	-177.6	170.3	0	0	112.7	R305 L306 K312 K313	R305-E309 PolarHBondContact O-N 2.83Å; L306-E309 PolarHBondContact O-N 2.86Å; E309-K312 PolarHBondContact O-N 2.65Å; E309-K313 WeakPolarHBondContact O-CB 3.45Å; E309-K313 VanDerWaalsContact O-CG 3.23Å; E309-K313 WeakPolarHBondContact O-CG 3.42Å; E309-K313 PolarHBondContact O-N 2.67Å
310	I	82.3	Confident	76.5	Confident	102 Å²	102	116.1 Å²	116.1	52%	0.523	55%	0.545	S	S	.	.	H	α-helix	trans	-64.7	-44.8	175.4	-71.1	164.2	0	0	0	110.3	L306 S307 K312 K313 W314	L306-I310 WeakPolarHBondContact O-CB 3.36Å; L306-I310 WeakPolarHBondContact O-CD1 3.29Å; L306-I310 WeakPolarHBondContact O-CG1 3.35Å; L306-I310 PolarHBondContact O-N 2.94Å; S307-I310 PolarHBondContact O-N 3.37Å; I310-K312 VanDerWaalsContact C-N 3.34Å; I310-K312 PolarHBondContact O-N 3.32Å; I310-K313 PolarHBondContact O-N 2.89Å; I310-W314 PolarHBondContact O-N 2.82Å
311	E	88.1	Confident	75.5	Confident	103 Å²	103	114.9 Å²	114.9	48%	0.481	55%	0.55	S	S	.	.	H	α-helix	trans	-63.5	-41.3	177.9	-170.9	58.5	-136.7	0	0	111.1	S307 K313 W314 Q315	S307-E311 WeakPolarHBondContact O-CB 3.48Å; S307-E311 PolarHBondContact O-N 2.84Å; E311-K313 VanDerWaalsContact C-N 3.35Å; E311-K313 PolarHBondContact O-N 2.79Å; E311-W314 WeakPolarHBondContact O-CB 3.43Å; E311-W314 PolarHBondContact O-N 3.39Å; E311-Q315 WeakPolarHBondContact O-CG 3.42Å; E311-Q315 PolarHBondContact O-N 3.4Å; E311-Q315 PolarHBondContact OE1-NE2 3.19Å
312	K	87.6	Confident	74.1	Confident	131 Å²	131	117.5 Å²	117.5	57%	0.57	56%	0.563	S	S	*	*	H	α-helix	trans	-63.1	-39.8	173.6	-173.2	179.2	177.8	-178.6	0	112.1	E308 E309 I310 Q315 E316	E308-K312 VanDerWaalsContact O-CB 3.26Å; E308-K312 WeakPolarHBondContact O-CB 3.5Å; E308-K312 PolarHBondContact O-N 3.4Å; E309-K312 PolarHBondContact O-N 2.65Å; I310-K312 VanDerWaalsContact C-N 3.34Å; I310-K312 PolarHBondContact O-N 3.32Å; K312-Q315 PolarHBondContact O-N 2.89Å; K312-E316 WeakPolarHBondContact O-CG 3.3Å; K312-E316 PolarHBondContact O-N 3.36Å
313	K	81.2	Confident	72.8	Confident	123 Å²	123	124 Å²	124	54%	0.535	58%	0.583	S	S	.	*	H	α-helix	trans	-68.5	-34.9	175.5	-73.9	-74.2	165.1	-156.7	0	112.4	E309 I310 E311 E316 L317	E309-K313 WeakPolarHBondContact O-CB 3.45Å; E309-K313 VanDerWaalsContact O-CG 3.23Å; E309-K313 WeakPolarHBondContact O-CG 3.42Å; E309-K313 PolarHBondContact O-N 2.67Å; I310-K313 PolarHBondContact O-N 2.89Å; E311-K313 VanDerWaalsContact C-N 3.35Å; E311-K313 PolarHBondContact O-N 2.79Å; K313-E316 IonicContact NZ-OE1 2.88Å; K313-E316 IonicContact NZ-OE2 2.9Å; K313-E316 PolarHBondContact NZ-OE2 2.95Å; K313-E316 PolarHBondContact O-N 3.32Å; K313-L317 PolarHBondContact O-N 3.42Å
314	W	71.6	Confident	71.5	Confident	148 Å²	148	127.3 Å²	127.3	56%	0.561	60%	0.599	S	S	*	*	H	α-helix	trans	-63.3	-43.9	171.1	-97.9	120.3	0	0	0	112	I310 E311 E316 L317 E318	I310-W314 PolarHBondContact O-N 2.82Å; E311-W314 WeakPolarHBondContact O-CB 3.43Å; E311-W314 PolarHBondContact O-N 3.39Å; W314-E316 VanDerWaalsContact C-N 3.3Å; W314-E316 PolarHBondContact O-N 3.42Å; W314-L317 HydrophobicContact CE3-CB 4.35Å; W314-L317 HydrophobicContact CE3-CD1 4.15Å; W314-L317 HydrophobicContact CZ3-CD1 4.31Å; W314-L317 WeakPolarHBondContact O-CB 3.48Å; W314-L317 PolarHBondContact O-N 3.23Å; W314-L317 VanDerWaalsContact O-N 3.1Å; W314-E318 PolarHBondContact O-N 3.43Å
315	Q	76.8	Confident	69.7	Low	83 Å²	83	130.9 Å²	130.9	39%	0.388	62%	0.618	S	S	.	*	H	α-helix	trans	-69.1	-27.6	176.6	-71.4	158.1	10.2	0	0	112.8	E311 K312 K319	E311-Q315 WeakPolarHBondContact O-CG 3.42Å; E311-Q315 PolarHBondContact O-N 3.4Å; E311-Q315 PolarHBondContact OE1-NE2 3.19Å; K312-Q315 PolarHBondContact O-N 2.89Å; Q315-K319 VanDerWaalsContact O-CG 3.29Å; Q315-K319 WeakPolarHBondContact O-CG 3.37Å; Q315-K319 PolarHBondContact O-N 2.73Å
316	E	77.9	Confident	67.8	Low	87 Å²	87	132.4 Å²	132.4	41%	0.407	63%	0.629	S	S	.	*	H	α-helix	trans	-68.4	-37.1	169.1	-76.2	174	-170.2	0	0	111.8	K312 K313 W314 K319	K312-E316 WeakPolarHBondContact O-CG 3.3Å; K312-E316 PolarHBondContact O-N 3.36Å; K313-E316 IonicContact NZ-OE1 2.88Å; K313-E316 IonicContact NZ-OE2 2.9Å; K313-E316 PolarHBondContact NZ-OE2 2.95Å; K313-E316 PolarHBondContact O-N 3.32Å; W314-E316 VanDerWaalsContact C-N 3.3Å; W314-E316 PolarHBondContact O-N 3.42Å; E316-K319 PolarHBondContact O-N 3.43Å
317	L	69	Low	66.1	Low	98 Å²	98	139.7 Å²	139.7	51%	0.513	65%	0.651	S	S	.	*	H	α-helix	trans	-69.1	-39.1	175	-77.3	166.3	0	0	0	112.5	K313 W314 K319 L320	K313-L317 PolarHBondContact O-N 3.42Å; W314-L317 HydrophobicContact CE3-CB 4.35Å; W314-L317 HydrophobicContact CE3-CD1 4.15Å; W314-L317 HydrophobicContact CZ3-CD1 4.31Å; W314-L317 WeakPolarHBondContact O-CB 3.48Å; W314-L317 PolarHBondContact O-N 3.23Å; W314-L317 VanDerWaalsContact O-N 3.1Å; L317-K319 PolarHBondContact O-N 2.87Å; L317-L320 HydrophobicContact CD2-CD1 3.87Å; L317-L320 WeakPolarHBondContact O-CB 3.25Å; L317-L320 PolarHBondContact O-N 2.93Å
318	E	68.3	Low	64.3	Low	151 Å²	151	143 Å²	143	71%	0.706	67%	0.668	S	S	*	*	H	α-helix	trans	-68.6	-22.6	176.9	-72	-173.5	152.6	0	0	113.3	W314	W314-E318 PolarHBondContact O-N 3.43Å
319	K	71.1	Confident	62	Low	177 Å²	177	141.1 Å²	141.1	77%	0.77	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-5.2	175.8	-73.7	174.9	-175.4	175.6	0	113.7	Q315 E316 L317	Q315-K319 VanDerWaalsContact O-CG 3.29Å; Q315-K319 WeakPolarHBondContact O-CG 3.37Å; Q315-K319 PolarHBondContact O-N 2.73Å; E316-K319 PolarHBondContact O-N 3.43Å; L317-K319 PolarHBondContact O-N 2.87Å
320	L	53.6	Low	59.9	Low	106 Å²	106	142.8 Å²	142.8	56%	0.555	68%	0.68	S	S	*	*	S	Bend	trans	-71.4	128.8	171.6	-68.4	170.4	0	0	0	109.1	L317 L322	L317-L320 HydrophobicContact CD2-CD1 3.87Å; L317-L320 WeakPolarHBondContact O-CB 3.25Å; L317-L320 PolarHBondContact O-N 2.93Å; L320-L322 PolarHBondContact O-N 3.43Å
321	P	47.8	Very low	58.1	Low	123 Å²	123	143.7 Å²	143.7	80%	0.799	69%	0.69	S	S	*	*			trans	-62.2	106	175.3	-18.4	30.4	0	0	0	109.5	R323	P321-R323 PolarHBondContact O-N 3.42Å; P321-R323 VanDerWaalsContact O-N 3.08Å
322	L	45.1	Very low	55.9	Low	167 Å²	167	142.7 Å²	142.7	87%	0.874	70%	0.7	S	S	*	*			trans	-56.5	113.6	167.5	-81.1	148.3	0	0	0	107.6	L320 E324	L320-L322 PolarHBondContact O-N 3.43Å; L322-E324 PolarHBondContact O-N 2.92Å
323	R	48.2	Very low	53.8	Low	237 Å²	237	143.9 Å²	143.9	89%	0.894	71%	0.711	S	S	*	*			trans	-55.7	125.6	169.2	-73.6	-173.2	69.8	145.6	1	108.2	P321 N325	P321-R323 PolarHBondContact O-N 3.42Å; P321-R323 VanDerWaalsContact O-N 3.08Å; R323-N325 PolarHBondContact O-N 2.9Å
324	E	43.2	Very low	52.1	Low	185 Å²	185	145.5 Å²	145.5	86%	0.864	73%	0.725	S	S	*	*			trans	-59.1	94.4	174.1	-73.4	178	149.9	0	0	110.8	L322 K326	L322-E324 PolarHBondContact O-N 2.92Å; E324-K326 PolarHBondContact O-N 3.27Å
325	N	38.3	Very low	50.7	Low	154 Å²	154	145.9 Å²	145.9	82%	0.824	74%	0.738	S	S	*	*			trans	-75.9	108.7	152.2	-80.7	-13.6	0	0	0	106.6	R323 R327	R323-N325 PolarHBondContact O-N 2.9Å; N325-R327 PolarHBondContact O-N 2.97Å
326	K	44	Very low	49.2	Very low	203 Å²	203	150.7 Å²	150.7	88%	0.883	76%	0.761	S	S	*	*			trans	-46.6	108.5	-179	-65.5	178.2	-180	-179.7	0	110.5	E324 V328	E324-K326 PolarHBondContact O-N 3.27Å; K326-V328 PolarHBondContact O-N 3.44Å
327	R	42	Very low	47.6	Very low	235 Å²	235	151.1 Å²	151.1	89%	0.887	77%	0.773	S	S	*	*			trans	-65.8	122.7	163.4	-72.4	176.6	179.9	-175.9	-0.6	107.9	N325	N325-R327 PolarHBondContact O-N 2.97Å
328	V	40.7	Very low	46.3	Very low	129 Å²	129	158.4 Å²	158.4	78%	0.782	79%	0.794	S	S	*	*			trans	-82.8	119.6	154.7	-180	0	0	0	0	106.6	K326 L330	K326-V328 PolarHBondContact O-N 3.44Å; V328-L330 PolarHBondContact O-N 2.99Å
329	P	40.2	Very low	44.8	Very low	97 Å²	97	154.7 Å²	154.7	63%	0.63	80%	0.796	S	S	*	*			trans	-73.2	108.3	179.6	-15.3	30.1	0	0	0	111.5	T331	P329-T331 PolarHBondContact O-N 3.31Å
330	L	40.9	Very low	43.2	Very low	160 Å²	160	155.3 Å²	155.3	84%	0.838	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	66.3	162.2	-79.6	168.6	0	0	0	110	V328	V328-L330 PolarHBondContact O-N 2.99Å
331	T	44.4	Very low	42.8	Very low	120 Å²	120	161.2 Å²	161.2	74%	0.736	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	6.1	171.3	39.3	0	0	0	0	113.7	P329	P329-T331 PolarHBondContact O-N 3.31Å
332	A	41.6	Very low	42.8	Very low	83 Å²	83	166.9 Å²	166.9	69%	0.686	82%	0.822	S	S	*	*	S	Bend	trans	-92.2	-5.8	178.3	0	0	0	0	0	115.5
333	L	44.8	Very low	42.8	Very low	155 Å²	155	162.1 Å²	162.1	81%	0.812	81%	0.813	S	S	*	*	S	Bend	trans	-112.7	5.4	-173.6	-69.3	177.5	0	0	0	115.9
334	L	43.8	Very low	43.2	Very low	158 Å²	158	156.2 Å²	156.2	83%	0.827	81%	0.805	S	S	*	*	S	Bend	trans	-117.5	18.4	-177.3	-124.8	112.9	0	0	0	115.3
335	N	43.8	Very low	43.8	Very low	155 Å²	155	152.2 Å²	152.2	83%	0.829	80%	0.795	S	S	*	*	S	Bend	trans	-127.9	22.2	179.7	-146.8	28.4	0	0	0	115.9
336	Q	45.2	Very low	44.6	Very low	185 Å²	185	148.4 Å²	148.4	86%	0.864	78%	0.781	S	S	*	*	S	Bend	trans	-116.7	8.8	173.9	-69.8	-169.1	78.5	0	0	114.3
337	S	42.8	Very low	45.2	Very low	96 Å²	96	144.8 Å²	144.8	67%	0.671	77%	0.771	S	S	*	*	S	Bend	trans	-106.8	54.3	177.1	53.9	0	0	0	0	112.3
338	R	41.9	Very low	46.1	Very low	251 Å²	251	137.1 Å²	137.1	95%	0.947	75%	0.754	S	S	*	*	S	Bend	trans	179.8	111.1	154.4	-101.7	157.5	-166.6	-98.5	3.4	110.4
339	G	37	Very low	47.3	Very low	72 Å²	72	136.3 Å²	136.3	74%	0.742	74%	0.741	S	S	*	*			trans	150.4	79	166.7	0	0	0	0	0	114.8
340	E	37	Very low	48.9	Very low	191 Å²	191	135.7 Å²	135.7	89%	0.893	73%	0.73	S	S	*	*			trans	42	110.6	141.5	-65.9	177.8	127.1	0	0	120.9
341	R	46.6	Very low	50.4	Low	229 Å²	229	130.8 Å²	130.8	86%	0.864	71%	0.712	S	S	*	*				18.9	121.6	128.6	-62.7	-140	-71.6	-119.5	3.6	117.5
342	R	48	Very low	51.8	Low	243 Å²	243	130.1 Å²	130.1	92%	0.917	70%	0.704	S	S	*	*				157.3	105.7	106.3	-170.3	-176.3	-66.1	-126.5	7.3	111
343	G	45.3	Very low	53.6	Low	66 Å²	66	130.8 Å²	130.8	68%	0.68	69%	0.693	S	S	*	*			trans	160.5	135.1	168.3	0	0	0	0	0	111.9
344	P	56	Low	55.5	Low	113 Å²	113	129 Å²	129	73%	0.734	68%	0.679	S	S	*	*			trans	-75.1	144.3	-169.1	27.4	-29	0	0	0	113.1	S346	P344-S346 VanDerWaalsContact C-N 3.29Å; P344-S346 PolarHBondContact O-N 3.02Å
345	P	55.4	Low	57.3	Low	101 Å²	101	127.4 Å²	127.4	66%	0.656	67%	0.667	S	S	*	*	S	Bend	trans	-83.5	6.3	-175.3	34.5	-35.4	0	0	0	114.5	S348 H349	P345-S348 PolarHBondContact O-OG 2.87Å; P345-H349 PolarHBondContact O-N 3.21Å
346	S	54.6	Low	59.2	Low	75 Å²	75	123 Å²	123	52%	0.524	65%	0.646	S	S	.	*	H	α-helix	trans	-69.1	-43	-168.7	-148.7	0	0	0	0	112.3	P344 S348 H349 E350	P344-S346 VanDerWaalsContact C-N 3.29Å; P344-S346 PolarHBondContact O-N 3.02Å; S346-S348 PolarHBondContact O-N 3.39Å; S346-H349 PolarHBondContact O-N 3.35Å; S346-E350 WeakPolarHBondContact O-CB 3.35Å; S346-E350 PolarHBondContact O-N 3.01Å
347	D	57.9	Low	61.1	Low	126 Å²	126	120.3 Å²	120.3	67%	0.674	63%	0.633	S	S	*	*	H	α-helix	trans	-70.4	-32.4	-171.9	-64.8	-7.5	0	0	0	112.5	A351	D347-A351 WeakPolarHBondContact O-CB 3.45Å; D347-A351 PolarHBondContact O-N 3.44Å
348	S	59.8	Low	63.2	Low	75 Å²	75	118.5 Å²	118.5	52%	0.524	62%	0.623	S	S	.	*	H	α-helix	trans	-73.9	-38.9	176.8	49.2	0	0	0	0	112.7	P345 S346 L352	P345-S348 PolarHBondContact O-OG 2.87Å; S346-S348 PolarHBondContact O-N 3.39Å; S348-L352 WeakPolarHBondContact O-CB 3.41Å; S348-L352 WeakPolarHBondContact O-CD1 3.46Å; S348-L352 PolarHBondContact O-N 2.93Å; S348-L352 VanDerWaalsContact O-N 3.1Å
349	H	66.3	Low	65.1	Low	112 Å²	112	111 Å²	111	52%	0.519	60%	0.602	S	S	.	*	H	α-helix	trans	-70.2	-42	178	-171.3	-90	0	0	0	110.9	P345 S346 A351 L352 E353	P345-H349 PolarHBondContact O-N 3.21Å; S346-H349 PolarHBondContact O-N 3.35Å; H349-A351 PolarHBondContact O-N 3Å; H349-L352 PolarHBondContact O-N 3.28Å; H349-E353 IonicContact CE1-OE1 3.81Å; H349-E353 PolarHBondContact CE1-OE1 3.25Å; H349-E353 IonicContact CE1-OE2 2.72Å; H349-E353 VanDerWaalsContact ND1-CD 3.26Å; H349-E353 IonicContact ND1-OE1 3.89Å; H349-E353 IonicContact ND1-OE2 3.22Å; H349-E353 PolarHBondContact ND1-OE2 3.36Å; H349-E353 VanDerWaalsContact ND1-OE2 3.14Å; H349-E353 WeakPolarHBondContact O-CB 3.4Å; H349-E353 WeakPolarHBondContact O-CG 3.23Å; H349-E353 PolarHBondContact O-N 3.45Å
350	E	73.6	Confident	67.2	Low	83 Å²	83	115.8 Å²	115.8	39%	0.388	60%	0.597	S	S	.	*	H	α-helix	trans	-69.3	-33.6	179.2	-155.2	-171.7	151.7	0	0	112	S346 K354	S346-E350 WeakPolarHBondContact O-CB 3.35Å; S346-E350 PolarHBondContact O-N 3.01Å; E350-K354 WeakPolarHBondContact O-CB 3.37Å; E350-K354 WeakPolarHBondContact O-CG 3.27Å; E350-K354 PolarHBondContact O-N 3.46Å; E350-K354 WeakPolarHBondContact OE1-CE 3.46Å; E350-K354 IonicContact OE1-NZ 3.11Å; E350-K354 PolarHBondContact OE1-NZ 2.95Å
351	A	72.8	Confident	69.4	Low	57 Å²	57	109.7 Å²	109.7	47%	0.471	58%	0.58	S	S	.	*	H	α-helix	trans	-65.6	-45.3	171.7	0	0	0	0	0	111.9	D347 H349 K354 E355	D347-A351 WeakPolarHBondContact O-CB 3.45Å; D347-A351 PolarHBondContact O-N 3.44Å; H349-A351 PolarHBondContact O-N 3Å; A351-K354 PolarHBondContact O-N 3.27Å; A351-E355 WeakPolarHBondContact O-CB 3.37Å; A351-E355 PolarHBondContact O-N 3.42Å
352	L	73.6	Confident	71	Confident	107 Å²	107	104 Å²	104	56%	0.56	56%	0.563	S	S	*	*	H	α-helix	trans	-62.4	-41.4	174.5	-93.5	147.8	0	0	0	111.9	S348 H349 E355 V356	S348-L352 WeakPolarHBondContact O-CB 3.41Å; S348-L352 WeakPolarHBondContact O-CD1 3.46Å; S348-L352 PolarHBondContact O-N 2.93Å; S348-L352 VanDerWaalsContact O-N 3.1Å; H349-L352 PolarHBondContact O-N 3.28Å; L352-E355 PolarHBondContact O-N 3.01Å; L352-V356 WeakPolarHBondContact O-CB 3.28Å; L352-V356 WeakPolarHBondContact O-CG2 3.11Å; L352-V356 PolarHBondContact O-N 2.89Å
353	E	78.5	Confident	72.4	Confident	96 Å²	96	98.2 Å²	98.2	45%	0.449	55%	0.549	S	S	.	.	H	α-helix	trans	-65.8	-40.3	177	-78.7	-178.6	139.1	0	0	112.5	H349 V356 Q357	H349-E353 IonicContact CE1-OE1 3.81Å; H349-E353 PolarHBondContact CE1-OE1 3.25Å; H349-E353 IonicContact CE1-OE2 2.72Å; H349-E353 VanDerWaalsContact ND1-CD 3.26Å; H349-E353 IonicContact ND1-OE1 3.89Å; H349-E353 IonicContact ND1-OE2 3.22Å; H349-E353 PolarHBondContact ND1-OE2 3.36Å; H349-E353 VanDerWaalsContact ND1-OE2 3.14Å; H349-E353 WeakPolarHBondContact O-CB 3.4Å; H349-E353 WeakPolarHBondContact O-CG 3.23Å; H349-E353 PolarHBondContact O-N 3.45Å; E353-V356 PolarHBondContact O-N 3.42Å; E353-Q357 WeakPolarHBondContact O-CB 3.17Å; E353-Q357 WeakPolarHBondContact O-CG 3.34Å; E353-Q357 PolarHBondContact O-N 2.83Å
354	K	85.7	Confident	74	Confident	119 Å²	119	101 Å²	101	52%	0.517	55%	0.545	S	S	.	.	H	α-helix	trans	-66.5	-38.4	174.7	-76.1	173.7	-174.6	159.9	0	111.9	E350 A351 Q357 A358	E350-K354 WeakPolarHBondContact O-CB 3.37Å; E350-K354 WeakPolarHBondContact O-CG 3.27Å; E350-K354 PolarHBondContact O-N 3.46Å; E350-K354 WeakPolarHBondContact OE1-CE 3.46Å; E350-K354 IonicContact OE1-NZ 3.11Å; E350-K354 PolarHBondContact OE1-NZ 2.95Å; A351-K354 PolarHBondContact O-N 3.27Å; K354-Q357 PolarHBondContact O-N 2.91Å; K354-A358 WeakPolarHBondContact O-CB 3.29Å; K354-A358 PolarHBondContact O-N 3.21Å
355	E	81	Confident	74.9	Confident	124 Å²	124	98.3 Å²	98.3	58%	0.579	53%	0.532	S	S	*	.	H	α-helix	trans	-67.8	-41.3	176.2	-163.8	168.4	-158.8	0	0	111.4	A351 L352 Q357 A358 L359	A351-E355 WeakPolarHBondContact O-CB 3.37Å; A351-E355 PolarHBondContact O-N 3.42Å; L352-E355 PolarHBondContact O-N 3.01Å; E355-Q357 PolarHBondContact O-N 2.88Å; E355-A358 PolarHBondContact O-N 3.36Å; E355-L359 HydrophobicContact CG-CD1 4.47Å; E355-L359 WeakPolarHBondContact O-CB 3.25Å; E355-L359 VanDerWaalsContact O-CG 3.29Å; E355-L359 WeakPolarHBondContact O-CG 3.34Å; E355-L359 PolarHBondContact O-N 2.81Å
356	V	83.6	Confident	75.5	Confident	63 Å²	63	101.2 Å²	101.2	38%	0.382	53%	0.53	S	S	.	.	H	α-helix	trans	-63	-40.4	172.7	169.3	0	0	0	0	111.4	L352 E353 R360	L352-V356 WeakPolarHBondContact O-CB 3.28Å; L352-V356 WeakPolarHBondContact O-CG2 3.11Å; L352-V356 PolarHBondContact O-N 2.89Å; E353-V356 PolarHBondContact O-N 3.42Å; V356-R360 WeakPolarHBondContact O-CB 3.3Å; V356-R360 VanDerWaalsContact O-CG 3.27Å; V356-R360 WeakPolarHBondContact O-CG 3.2Å; V356-R360 PolarHBondContact O-N 3.39Å
357	Q	86.3	Confident	76.3	Confident	128 Å²	128	105.9 Å²	105.9	60%	0.598	54%	0.536	S	S	*	.	H	α-helix	trans	-68.3	-39.5	175.8	-77.5	173.7	7.3	0	0	112.3	E353 K354 E355 R360 A361	E353-Q357 WeakPolarHBondContact O-CB 3.17Å; E353-Q357 WeakPolarHBondContact O-CG 3.34Å; E353-Q357 PolarHBondContact O-N 2.83Å; K354-Q357 PolarHBondContact O-N 2.91Å; E355-Q357 PolarHBondContact O-N 2.88Å; Q357-R360 PolarHBondContact O-N 2.65Å; Q357-A361 WeakPolarHBondContact O-CB 3.43Å; Q357-A361 PolarHBondContact O-N 2.77Å
358	A	86.1	Confident	76.9	Confident	57 Å²	57	105.7 Å²	105.7	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-63.8	-43.9	175.2	0	0	0	0	0	111.8	K354 E355 R360 A361 Q362	K354-A358 WeakPolarHBondContact O-CB 3.29Å; K354-A358 PolarHBondContact O-N 3.21Å; E355-A358 PolarHBondContact O-N 3.36Å; A358-R360 VanDerWaalsContact C-N 3.35Å; A358-R360 PolarHBondContact O-N 3.1Å; A358-A361 PolarHBondContact O-N 3.31Å; A358-Q362 WeakPolarHBondContact O-CB 3.44Å; A358-Q362 PolarHBondContact O-N 2.93Å
359	L	82.6	Confident	76.9	Confident	94 Å²	94	108.8 Å²	108.8	49%	0.492	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-36.8	176.5	-72	170.2	0	0	0	112.3	E355 Q362 L363	E355-L359 HydrophobicContact CG-CD1 4.47Å; E355-L359 WeakPolarHBondContact O-CB 3.25Å; E355-L359 VanDerWaalsContact O-CG 3.29Å; E355-L359 WeakPolarHBondContact O-CG 3.34Å; E355-L359 PolarHBondContact O-N 2.81Å; L359-Q362 PolarHBondContact O-N 2.88Å; L359-L363 WeakPolarHBondContact O-CB 3.46Å; L359-L363 PolarHBondContact O-N 2.71Å
360	R	79.9	Confident	76.4	Confident	172 Å²	172	106.6 Å²	106.6	65%	0.649	55%	0.548	S	S	*	.	H	α-helix	trans	-65.6	-44.6	173.1	-76.3	175.6	-177.4	-175.7	2.7	112.1	V356 Q357 A358 Q362 L363 E364	V356-R360 WeakPolarHBondContact O-CB 3.3Å; V356-R360 VanDerWaalsContact O-CG 3.27Å; V356-R360 WeakPolarHBondContact O-CG 3.2Å; V356-R360 PolarHBondContact O-N 3.39Å; Q357-R360 PolarHBondContact O-N 2.65Å; A358-R360 VanDerWaalsContact C-N 3.35Å; A358-R360 PolarHBondContact O-N 3.1Å; R360-Q362 VanDerWaalsContact C-N 3.3Å; R360-Q362 PolarHBondContact O-N 2.86Å; R360-L363 PolarHBondContact O-N 2.91Å; R360-E364 PolarHBondContact O-N 2.86Å
361	A	84.7	Confident	75.5	Confident	63 Å²	63	109.3 Å²	109.3	52%	0.521	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-36.7	175.6	0	0	0	0	0	111.9	Q357 A358 E364 A365	Q357-A361 WeakPolarHBondContact O-CB 3.43Å; Q357-A361 PolarHBondContact O-N 2.77Å; A358-A361 PolarHBondContact O-N 3.31Å; A361-E364 PolarHBondContact O-N 2.89Å; A361-A365 WeakPolarHBondContact O-CB 3.3Å; A361-A365 PolarHBondContact O-N 2.89Å
362	Q	79.6	Confident	74	Confident	110 Å²	110	109.8 Å²	109.8	51%	0.514	57%	0.565	S	S	.	*	H	α-helix	trans	-66.3	-42	175.1	-162.7	174.9	5.9	0	0	111.3	A358 L359 R360 A365 W366	A358-Q362 WeakPolarHBondContact O-CB 3.44Å; A358-Q362 PolarHBondContact O-N 2.93Å; L359-Q362 PolarHBondContact O-N 2.88Å; R360-Q362 VanDerWaalsContact C-N 3.3Å; R360-Q362 PolarHBondContact O-N 2.86Å; Q362-A365 PolarHBondContact O-N 2.73Å; Q362-W366 PolarHBondContact O-N 3.01Å
363	L	76.9	Confident	72.8	Confident	121 Å²	121	110.4 Å²	110.4	63%	0.634	58%	0.575	S	S	*	*	H	α-helix	trans	-62	-41	173.2	-90.3	159.4	0	0	0	112.6	L359 R360 W366 R367	L359-L363 WeakPolarHBondContact O-CB 3.46Å; L359-L363 PolarHBondContact O-N 2.71Å; R360-L363 PolarHBondContact O-N 2.91Å; L363-W366 PolarHBondContact O-N 2.87Å; L363-R367 WeakPolarHBondContact O-CB 3.27Å; L363-R367 PolarHBondContact O-N 3.05Å
364	E	78.8	Confident	71.1	Confident	126 Å²	126	115.1 Å²	115.1	59%	0.589	60%	0.597	S	S	*	*	H	α-helix	trans	-69.7	-35.5	175.7	-70.1	-150.5	169.1	0	0	112.7	R360 A361 R367 L368	R360-E364 PolarHBondContact O-N 2.86Å; A361-E364 PolarHBondContact O-N 2.89Å; E364-R367 PolarHBondContact O-N 3.09Å; E364-L368 WeakPolarHBondContact O-CB 3.48Å; E364-L368 VanDerWaalsContact O-CG 3.3Å; E364-L368 WeakPolarHBondContact O-CG 3.39Å; E364-L368 PolarHBondContact O-N 2.88Å
365	A	75.9	Confident	68.8	Low	55 Å²	55	114.9 Å²	114.9	46%	0.455	61%	0.61	S	S	.	*	H	α-helix	trans	-62.9	-43	172	0	0	0	0	0	111.9	A361 Q362 R367 L368 Q369	A361-A365 WeakPolarHBondContact O-CB 3.3Å; A361-A365 PolarHBondContact O-N 2.89Å; Q362-A365 PolarHBondContact O-N 2.73Å; A365-R367 VanDerWaalsContact C-N 3.35Å; A365-L368 PolarHBondContact O-N 3.4Å; A365-Q369 VanDerWaalsContact O-CB 3.32Å; A365-Q369 WeakPolarHBondContact O-CB 3.3Å; A365-Q369 PolarHBondContact O-N 3.42Å
366	W	67.5	Low	66.6	Low	162 Å²	162	112.3 Å²	112.3	61%	0.614	61%	0.61	S	S	*	*	H	α-helix	trans	-64.4	-38.6	173.3	-77.7	114.4	0	0	0	112.4	Q362 L363 Q369 G370	Q362-W366 PolarHBondContact O-N 3.01Å; L363-W366 PolarHBondContact O-N 2.87Å; W366-Q369 PolarHBondContact O-N 3.25Å; W366-G370 PolarHBondContact O-N 3.46Å
367	R	72.3	Confident	64.9	Low	174 Å²	174	115.7 Å²	115.7	66%	0.657	63%	0.634	S	S	*	*	H	α-helix	trans	-65.3	-43.1	177.1	-164.9	179.6	-176.5	173	3.3	111.7	L363 E364 A365 G370 E371	L363-R367 WeakPolarHBondContact O-CB 3.27Å; L363-R367 PolarHBondContact O-N 3.05Å; E364-R367 PolarHBondContact O-N 3.09Å; A365-R367 VanDerWaalsContact C-N 3.35Å; R367-G370 PolarHBondContact O-N 3.08Å; R367-E371 PolarHBondContact O-N 3.34Å; R367-E371 VanDerWaalsContact O-N 3.07Å
368	L	68.8	Low	62.7	Low	121 Å²	121	120.5 Å²	120.5	63%	0.634	65%	0.646	S	S	*	*	H	α-helix	trans	-70.7	-29.5	176.1	-71	166	0	0	0	112.6	E364 A365 G370 E371	E364-L368 WeakPolarHBondContact O-CB 3.48Å; E364-L368 VanDerWaalsContact O-CG 3.3Å; E364-L368 WeakPolarHBondContact O-CG 3.39Å; E364-L368 PolarHBondContact O-N 2.88Å; A365-L368 PolarHBondContact O-N 3.4Å; L368-G370 VanDerWaalsContact C-N 3.34Å; L368-E371 PolarHBondContact O-N 2.95Å
369	Q	60.1	Low	60.4	Low	141 Å²	141	122.5 Å²	122.5	66%	0.659	66%	0.657	S	S	*	*	H	α-helix	trans	-73.1	-26.9	171.1	-166.1	170.1	3.1	0	0	112.3	A365 W366	A365-Q369 VanDerWaalsContact O-CB 3.32Å; A365-Q369 WeakPolarHBondContact O-CB 3.3Å; A365-Q369 PolarHBondContact O-N 3.42Å; W366-Q369 PolarHBondContact O-N 3.25Å
370	G	57.3	Low	58.5	Low	65 Å²	65	127.7 Å²	127.7	67%	0.67	68%	0.678	S	S	*	*	H	α-helix	trans	-79.4	-18.8	171.8	0	0	0	0	0	114.9	W366 R367 L368	W366-G370 PolarHBondContact O-N 3.46Å; R367-G370 PolarHBondContact O-N 3.08Å; L368-G370 VanDerWaalsContact C-N 3.34Å
371	E	54	Low	56.7	Low	141 Å²	141	127.9 Å²	127.9	66%	0.659	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	23.8	177.7	-75	-169.3	171.5	0	0	113.7	R367 L368	R367-E371 PolarHBondContact O-N 3.34Å; R367-E371 VanDerWaalsContact O-N 3.07Å; L368-E371 PolarHBondContact O-N 2.95Å
372	A	41.2	Very low	54.9	Low	67 Å²	67	132.3 Å²	132.3	55%	0.554	70%	0.702	S	S	*	*	S	Bend	trans	-74.5	121.5	162.7	0	0	0	0	0	109	Q374	A372-Q374 PolarHBondContact O-N 3.15Å
373	P	48.6	Very low	53.7	Low	120 Å²	120	130.1 Å²	130.1	78%	0.779	71%	0.708	S	S	*	*			trans	-68.4	105	-172.6	26	-32.3	0	0	0	110.3	S375	P373-S375 PolarHBondContact O-N 2.93Å
374	Q	43.4	Very low	52.6	Low	194 Å²	194	132.1 Å²	132.1	91%	0.907	71%	0.714	S	S	*	*			trans	-70.8	83.8	157.4	-72.6	-168.7	16.5	0	0	108	A372 A376	A372-Q374 PolarHBondContact O-N 3.15Å; Q374-A376 PolarHBondContact O-N 3.15Å
375	S	35.8	Very low	51.4	Low	114 Å²	114	130 Å²	130	80%	0.797	71%	0.706	S	S	*	*			trans	-66.1	92.4	164.2	55.4	0	0	0	0	109.7	P373	P373-S375 PolarHBondContact O-N 2.93Å
376	A	35.6	Very low	50.5	Low	70 Å²	70	131.3 Å²	131.3	58%	0.579	71%	0.71	S	S	*	*			trans	-170.5	129.8	150	0	0	0	0	0	109.7	Q374 R378	Q374-A376 PolarHBondContact O-N 3.15Å; A376-R378 PolarHBondContact O-N 3.03Å; A376-R378 VanDerWaalsContact O-N 3.07Å
377	P	48.6	Very low	49.6	Very low	135 Å²	135	129.9 Å²	129.9	88%	0.877	72%	0.721	S	S	*	*			trans	-72.3	106.1	173.6	30.4	-28.5	0	0	0	107.6
378	R	38.4	Very low	49.1	Very low	229 Å²	229	125.6 Å²	125.6	86%	0.864	73%	0.731	S	S	*	*			trans	-96.3	112.7	164.3	-74.4	-166.5	176.5	174.7	1.1	108.4	A376	A376-R378 PolarHBondContact O-N 3.03Å; A376-R378 VanDerWaalsContact O-N 3.07Å
379	S	39.3	Very low	48.8	Very low	99 Å²	99	128.8 Å²	128.8	69%	0.692	74%	0.736	S	S	*	*			trans	-14.8	138.3	159.5	-23.7	0	0	0	0	114.6	E381	S379-E381 VanDerWaalsContact C-N 3.29Å; S379-E381 PolarHBondContact O-N 3.4Å
380	Q	42.9	Very low	49.3	Very low	202 Å²	202	128.5 Å²	128.5	94%	0.944	74%	0.737	S	S	*	*			trans	-34.9	88.9	152.9	-175.6	175.2	8.8	0	0	111.2
381	E	40.2	Very low	50.2	Low	177 Å²	177	126.3 Å²	126.3	83%	0.827	71%	0.712	S	S	*	*			trans	-95.3	113.9	166.5	-89.6	-172.8	154.6	0	0	107.6	S379 G383	S379-E381 VanDerWaalsContact C-N 3.29Å; S379-E381 PolarHBondContact O-N 3.4Å; E381-G383 VanDerWaalsContact C-N 3.28Å; E381-G383 PolarHBondContact O-N 2.91Å
382	D	48.1	Very low	51.4	Low	156 Å²	156	126.1 Å²	126.1	83%	0.834	71%	0.711	S	S	*	*			trans	-57.9	87	170.9	-145.4	-1.1	0	0	0	108.6	H384	D382-H384 VanDerWaalsContact C-N 3.26Å; D382-H384 PolarHBondContact O-N 3.36Å
383	G	54.2	Low	53.3	Low	63 Å²	63	128 Å²	128	65%	0.649	71%	0.709	S	S	*	*			trans	-69.3	83.5	174.2	0	0	0	0	0	109.7	E381 I385	E381-G383 VanDerWaalsContact C-N 3.28Å; E381-G383 PolarHBondContact O-N 2.91Å; G383-I385 PolarHBondContact O-N 2.9Å
384	H	54.6	Low	54.8	Low	163 Å²	163	123.6 Å²	123.6	76%	0.755	68%	0.682	S	S	*	*			trans	-60.5	102.8	-179.9	-157.3	-62.9	0	0	0	110.2	D382	D382-H384 VanDerWaalsContact C-N 3.26Å; D382-H384 PolarHBondContact O-N 3.36Å
385	I	53	Low	56.7	Low	83 Å²	83	117.2 Å²	117.2	43%	0.426	66%	0.658	S	S	.	*			trans	-63.3	129.8	175.1	-60.2	147.9	0	0	0	108.1	G383 Y389	G383-I385 PolarHBondContact O-N 2.9Å; I385-Y389 WeakPolarHBondContact CG2-O 3.5Å
386	P	57.3	Low	59.1	Low	82 Å²	82	116.7 Å²	116.7	53%	0.532	64%	0.643	S	S	.	*			trans	-59.6	137.6	176.2	-23.2	33.1	0	0	0	111.2	G388 Y389	P386-G388 PolarHBondContact O-N 3.16Å; P386-Y389 PolarHBondContact O-N 3.44Å; P386-Y389 VanDerWaalsContact O-N 3.11Å
387	P	47.9	Very low	61.7	Low	132 Å²	132	119.9 Å²	119.9	86%	0.857	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	113.9	-179.8	-18.9	29.6	0	0	0	110.6
388	G	62.3	Low	63.6	Low	83 Å²	83	116.3 Å²	116.3	86%	0.856	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	112.6	-8.4	-179.7	0	0	0	0	0	115.7	P386	P386-G388 PolarHBondContact O-N 3.16Å
389	Y	61.6	Low	66.2	Low	188 Å²	188	109.5 Å²	109.5	74%	0.737	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-99.1	137.8	170.2	-90.8	-105.8	0	0	0	110.7	I385 P386	I385-Y389 WeakPolarHBondContact CG2-O 3.5Å; P386-Y389 PolarHBondContact O-N 3.44Å; P386-Y389 VanDerWaalsContact O-N 3.11Å
390	I	70.2	Confident	68.8	Low	135 Å²	135	107.3 Å²	107.3	69%	0.692	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.9	175.4	-57.3	172	0	0	0	107.5	A394	I390-A394 HydrophobicContact CG2-CB 3.66Å
391	S	76.8	Confident	71.2	Confident	19 Å²	19	103.8 Å²	103.8	13%	0.133	57%	0.57	C	S	.	*	P	Polyproline II helix	trans	-60	147.1	176.5	98.8	0	0	0	0	110.5	E393 A394 C395	S391-E393 WeakPolarHBondContact CB-OE2 3.47Å; S391-E393 PolarHBondContact O-N 2.98Å; S391-E393 PolarHBondContact OG-OE2 3.28Å; S391-A394 WeakPolarHBondContact O-CB 3.19Å; S391-A394 PolarHBondContact O-N 3.36Å; S391-A394 WeakPolarHBondContact OG-CB 3.46Å; S391-A394 PolarHBondContact OG-N 2.71Å; S391-A394 VanDerWaalsContact OG-N 3.11Å; S391-C395 PolarHBondContact O-N 2.61Å
392	Q	80	Confident	73.8	Confident	137 Å²	137	101.5 Å²	101.5	64%	0.64	56%	0.561	S	S	*	*	H	α-helix	trans	-56.6	-40.7	179.4	178.2	173.9	-19.4	0	0	111	A394 C395 E396	Q392-A394 VanDerWaalsContact C-N 3.28Å; Q392-A394 PolarHBondContact O-N 2.65Å; Q392-C395 WeakPolarHBondContact O-CB 3.49Å; Q392-C395 PolarHBondContact O-N 2.88Å; Q392-E396 HydrophobicContact CG-CG 4.46Å; Q392-E396 WeakPolarHBondContact CG-OE1 3.48Å; Q392-E396 PolarHBondContact NE2-OE1 2.67Å; Q392-E396 WeakPolarHBondContact O-CG 3.48Å; Q392-E396 PolarHBondContact O-N 2.91Å
393	E	81.3	Confident	76	Confident	108 Å²	108	100.5 Å²	100.5	51%	0.505	55%	0.551	S	S	.	*	H	α-helix	trans	-66	-30.6	178.2	-47.9	76.6	-167.5	0	0	112.1	S391 R397	S391-E393 WeakPolarHBondContact CB-OE2 3.47Å; S391-E393 PolarHBondContact O-N 2.98Å; S391-E393 PolarHBondContact OG-OE2 3.28Å; E393-R397 VanDerWaalsContact O-CB 3.32Å; E393-R397 WeakPolarHBondContact O-CB 3.34Å; E393-R397 VanDerWaalsContact O-CG 3.27Å; E393-R397 WeakPolarHBondContact O-CG 3.48Å; E393-R397 PolarHBondContact O-N 3.2Å; E393-R397 PolarHBondContact O-NE 3.21Å; E393-R397 VanDerWaalsContact O-NE 3.13Å
394	A	80.1	Confident	78	Confident	26 Å²	26	100.9 Å²	100.9	22%	0.215	54%	0.544	C	S	.	.	H	α-helix	trans	-75.9	-31.5	175.8	0	0	0	0	0	112.6	I390 S391 Q392 S398	I390-A394 HydrophobicContact CG2-CB 3.66Å; S391-A394 WeakPolarHBondContact O-CB 3.19Å; S391-A394 PolarHBondContact O-N 3.36Å; S391-A394 WeakPolarHBondContact OG-CB 3.46Å; S391-A394 PolarHBondContact OG-N 2.71Å; S391-A394 VanDerWaalsContact OG-N 3.11Å; Q392-A394 VanDerWaalsContact C-N 3.28Å; Q392-A394 PolarHBondContact O-N 2.65Å; A394-S398 PolarHBondContact O-N 2.82Å; A394-S398 PolarHBondContact O-OG 3.33Å
395	C	83.3	Confident	80	Confident	61 Å²	61	96.3 Å²	96.3	41%	0.412	53%	0.53	S	S	.	.	H	α-helix	trans	-69	-47.4	170.6	-169.5	0	0	0	0	111	S391 Q392 R397 S398 L399	S391-C395 PolarHBondContact O-N 2.61Å; Q392-C395 WeakPolarHBondContact O-CB 3.49Å; Q392-C395 PolarHBondContact O-N 2.88Å; C395-R397 PolarHBondContact O-N 3.17Å; C395-S398 PolarHBondContact O-N 3.43Å; C395-S398 PolarHBondContact O-OG 3.22Å; C395-L399 WeakPolarHBondContact O-CG 3.43Å; C395-L399 PolarHBondContact O-N 2.89Å
396	E	86.4	Confident	82.1	Confident	103 Å²	103	97.9 Å²	97.9	48%	0.481	54%	0.535	S	S	.	.	H	α-helix	trans	-62.1	-41.3	178.5	-71.7	170.9	-175.9	0	0	112	Q392 L399 A400	Q392-E396 HydrophobicContact CG-CG 4.46Å; Q392-E396 WeakPolarHBondContact CG-OE1 3.48Å; Q392-E396 PolarHBondContact NE2-OE1 2.67Å; Q392-E396 WeakPolarHBondContact O-CG 3.48Å; Q392-E396 PolarHBondContact O-N 2.91Å; E396-L399 PolarHBondContact O-N 2.94Å; E396-A400 WeakPolarHBondContact O-CB 3.47Å; E396-A400 PolarHBondContact O-N 3.48Å
397	R	89.7	Confident	83.9	Confident	137 Å²	137	98.9 Å²	98.9	52%	0.517	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-43.9	173.9	-80.3	-178.5	-83.7	101.2	-3	112.8	E393 C395 A400 E401	E393-R397 VanDerWaalsContact O-CB 3.32Å; E393-R397 WeakPolarHBondContact O-CB 3.34Å; E393-R397 VanDerWaalsContact O-CG 3.27Å; E393-R397 WeakPolarHBondContact O-CG 3.48Å; E393-R397 PolarHBondContact O-N 3.2Å; E393-R397 PolarHBondContact O-NE 3.21Å; E393-R397 VanDerWaalsContact O-NE 3.13Å; C395-R397 PolarHBondContact O-N 3.17Å; R397-A400 PolarHBondContact O-N 3.2Å; R397-E401 WeakPolarHBondContact O-CB 3.43Å; R397-E401 WeakPolarHBondContact O-CG 3.49Å; R397-E401 PolarHBondContact O-N 3.05Å
398	S	88.6	Confident	86.3	Confident	59 Å²	59	97.7 Å²	97.7	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-69.8	-33.8	-179.5	65.8	0	0	0	0	112.8	A394 C395 M402	A394-S398 PolarHBondContact O-N 2.82Å; A394-S398 PolarHBondContact O-OG 3.33Å; C395-S398 PolarHBondContact O-N 3.43Å; C395-S398 PolarHBondContact O-OG 3.22Å; S398-M402 WeakPolarHBondContact O-CB 3.29Å; S398-M402 PolarHBondContact O-N 3.44Å
399	L	91.9	Very high	88	Confident	87 Å²	87	97.4 Å²	97.4	46%	0.455	50%	0.498	S	S	.	.	H	α-helix	trans	-66.6	-45.4	171.5	-72	171.7	0	0	0	111.8	C395 E396 E401 M402 E403	C395-L399 WeakPolarHBondContact O-CG 3.43Å; C395-L399 PolarHBondContact O-N 2.89Å; E396-L399 PolarHBondContact O-N 2.94Å; L399-E401 VanDerWaalsContact C-N 3.34Å; L399-E401 PolarHBondContact O-N 2.92Å; L399-M402 WeakPolarHBondContact O-CB 3.49Å; L399-M402 PolarHBondContact O-N 3.42Å; L399-M402 VanDerWaalsContact O-N 3.17Å; L399-E403 WeakPolarHBondContact O-CB 3.47Å; L399-E403 WeakPolarHBondContact O-CG 3.33Å; L399-E403 PolarHBondContact O-N 3.33Å
400	A	94	Very high	89.7	Confident	52 Å²	52	91.9 Å²	91.9	43%	0.43	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-38.4	176.8	0	0	0	0	0	112.4	E396 R397 E403 S404	E396-A400 WeakPolarHBondContact O-CB 3.47Å; E396-A400 PolarHBondContact O-N 3.48Å; R397-A400 PolarHBondContact O-N 3.2Å; A400-E403 PolarHBondContact O-N 3.16Å; A400-S404 WeakPolarHBondContact O-CB 3.27Å; A400-S404 PolarHBondContact O-N 3.48Å; A400-S404 PolarHBondContact O-OG 2.67Å; A400-S404 VanDerWaalsContact O-OG 3.1Å
401	E	93.9	Very high	91	Very high	129 Å²	129	88.5 Å²	88.5	60%	0.603	46%	0.461	S	S	*	.	H	α-helix	trans	-63.1	-42.8	172.3	-76.6	172.5	-161.9	0	0	111.6	R397 L399 S404 S405	R397-E401 WeakPolarHBondContact O-CB 3.43Å; R397-E401 WeakPolarHBondContact O-CG 3.49Å; R397-E401 PolarHBondContact O-N 3.05Å; L399-E401 VanDerWaalsContact C-N 3.34Å; L399-E401 PolarHBondContact O-N 2.92Å; E401-S404 WeakPolarHBondContact CA-OG 3.48Å; E401-S404 PolarHBondContact O-N 2.87Å; E401-S404 PolarHBondContact O-OG 3.11Å; E401-S405 WeakPolarHBondContact O-CB 3.46Å; E401-S405 PolarHBondContact O-N 3.02Å
402	M	94.6	Very high	92	Very high	129 Å²	129	92.2 Å²	92.2	64%	0.635	48%	0.476	S	S	*	.	H	α-helix	trans	-64.5	-43.8	175.7	-173.5	-176.5	-57.6	0	0	112.2	S398 L399 S405 H406	S398-M402 WeakPolarHBondContact O-CB 3.29Å; S398-M402 PolarHBondContact O-N 3.44Å; L399-M402 WeakPolarHBondContact O-CB 3.49Å; L399-M402 PolarHBondContact O-N 3.42Å; L399-M402 VanDerWaalsContact O-N 3.17Å; M402-S405 PolarHBondContact O-N 3.02Å; M402-H406 WeakPolarHBondContact O-CB 3.29Å; M402-H406 PolarHBondContact O-N 3.07Å
403	E	95.3	Very high	92.8	Very high	134 Å²	134	90.7 Å²	90.7	63%	0.626	47%	0.471	S	S	*	.	H	α-helix	trans	-63.1	-44.3	177	-74.7	175.1	176.8	0	0	111.3	L399 A400 H406 Q407	L399-E403 WeakPolarHBondContact O-CB 3.47Å; L399-E403 WeakPolarHBondContact O-CG 3.33Å; L399-E403 PolarHBondContact O-N 3.33Å; A400-E403 PolarHBondContact O-N 3.16Å; E403-H406 PolarHBondContact O-N 2.85Å; E403-Q407 VanDerWaalsContact O-CB 3.29Å; E403-Q407 WeakPolarHBondContact O-CB 3.45Å; E403-Q407 PolarHBondContact O-N 2.86Å
404	S	95.6	Very high	93.5	Very high	72 Å²	72	90.9 Å²	90.9	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-65.7	-39.3	176.2	65	0	0	0	0	112.5	A400 E401 Q407 Q408	A400-S404 WeakPolarHBondContact O-CB 3.27Å; A400-S404 PolarHBondContact O-N 3.48Å; A400-S404 PolarHBondContact O-OG 2.67Å; A400-S404 VanDerWaalsContact O-OG 3.1Å; E401-S404 WeakPolarHBondContact CA-OG 3.48Å; E401-S404 PolarHBondContact O-N 2.87Å; E401-S404 PolarHBondContact O-OG 3.11Å; S404-Q407 PolarHBondContact O-N 2.79Å; S404-Q408 WeakPolarHBondContact O-CB 3.39Å; S404-Q408 PolarHBondContact O-N 3.19Å
405	S	96.4	Very high	94.4	Very high	66 Å²	66	95.6 Å²	95.6	46%	0.462	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-44.1	173.7	-179.3	0	0	0	0	111.7	E401 M402 Q408 V409	E401-S405 WeakPolarHBondContact O-CB 3.46Å; E401-S405 PolarHBondContact O-N 3.02Å; M402-S405 PolarHBondContact O-N 3.02Å; S405-Q408 PolarHBondContact O-N 3.03Å; S405-V409 WeakPolarHBondContact O-CG2 3.45Å; S405-V409 PolarHBondContact O-N 3.31Å
406	H	96	Very high	95	Very high	116 Å²	116	96.7 Å²	96.7	54%	0.537	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-44.4	176.3	-176.7	64.5	0	0	0	111.6	M402 E403 Q408 V409 M410	M402-H406 WeakPolarHBondContact O-CB 3.29Å; M402-H406 PolarHBondContact O-N 3.07Å; E403-H406 PolarHBondContact O-N 2.85Å; H406-Q408 VanDerWaalsContact C-N 3.31Å; H406-Q408 PolarHBondContact O-N 3.42Å; H406-V409 PolarHBondContact O-N 2.88Å; H406-M410 WeakPolarHBondContact O-CG 3.5Å; H406-M410 PolarHBondContact O-N 3.46Å
407	Q	96.8	Very high	95.6	Very high	103 Å²	103	97 Å²	97	48%	0.481	49%	0.485	S	S	.	.	H	α-helix	trans	-58.8	-44.1	176.1	-174.9	61.5	26.6	0	0	111	E403 S404 V409 M410 E411	E403-Q407 VanDerWaalsContact O-CB 3.29Å; E403-Q407 WeakPolarHBondContact O-CB 3.45Å; E403-Q407 PolarHBondContact O-N 2.86Å; S404-Q407 PolarHBondContact O-N 2.79Å; Q407-V409 PolarHBondContact O-N 2.8Å; Q407-M410 PolarHBondContact O-N 3.48Å; Q407-E411 WeakPolarHBondContact O-CG 3.43Å; Q407-E411 PolarHBondContact O-N 2.88Å
408	Q	97.9	Very high	95.9	Very high	107 Å²	107	96 Å²	96	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-60.5	-46.2	175.4	-175.4	-179	-11.5	0	0	111.7	S404 S405 H406 M410 E411 E412	S404-Q408 WeakPolarHBondContact O-CB 3.39Å; S404-Q408 PolarHBondContact O-N 3.19Å; S405-Q408 PolarHBondContact O-N 3.03Å; H406-Q408 VanDerWaalsContact C-N 3.31Å; H406-Q408 PolarHBondContact O-N 3.42Å; Q408-M410 VanDerWaalsContact C-N 3.31Å; Q408-M410 PolarHBondContact O-N 3.03Å; Q408-E411 PolarHBondContact O-N 3.23Å; Q408-E412 HydrophobicContact CG-CG 4.48Å; Q408-E412 WeakPolarHBondContact CG-OE1 3.31Å; Q408-E412 PolarHBondContact NE2-OE1 2.77Å; Q408-E412 WeakPolarHBondContact O-CB 3.47Å; Q408-E412 WeakPolarHBondContact O-CG 3.31Å; Q408-E412 PolarHBondContact O-N 3.38Å
409	V	97.7	Very high	96.4	Very high	78 Å²	78	99.2 Å²	99.2	47%	0.473	49%	0.489	S	S	.	.	H	α-helix	trans	-61.4	-40.4	177.3	170.7	0	0	0	0	111.3	S405 H406 Q407 E412 L413	S405-V409 WeakPolarHBondContact O-CG2 3.45Å; S405-V409 PolarHBondContact O-N 3.31Å; H406-V409 PolarHBondContact O-N 2.88Å; Q407-V409 PolarHBondContact O-N 2.8Å; V409-E412 PolarHBondContact O-N 3.02Å; V409-L413 WeakPolarHBondContact O-CB 3.25Å; V409-L413 PolarHBondContact O-N 3.22Å
410	M	96.6	Very high	96.7	Very high	72 Å²	72	97.7 Å²	97.7	36%	0.355	48%	0.48	S	S	.	.	H	α-helix	trans	-65.9	-40.7	177.4	-71.1	-58.5	-66.1	0	0	112	H406 Q407 Q408 L413 Q414	H406-M410 WeakPolarHBondContact O-CG 3.5Å; H406-M410 PolarHBondContact O-N 3.46Å; Q407-M410 PolarHBondContact O-N 3.48Å; Q408-M410 VanDerWaalsContact C-N 3.31Å; Q408-M410 PolarHBondContact O-N 3.03Å; M410-L413 PolarHBondContact O-N 2.9Å; M410-Q414 VanDerWaalsContact O-CG 3.31Å; M410-Q414 WeakPolarHBondContact O-CG 3.36Å; M410-Q414 PolarHBondContact O-N 2.87Å
411	E	97.7	Very high	96.8	Very high	64 Å²	64	98.9 Å²	98.9	30%	0.299	48%	0.478	S	S	.	.	H	α-helix	trans	-68.1	-39.6	174.4	-69.3	-178	-163.6	0	0	112.5	Q407 Q408 L413 Q414 R415	Q407-E411 WeakPolarHBondContact O-CG 3.43Å; Q407-E411 PolarHBondContact O-N 2.88Å; Q408-E411 PolarHBondContact O-N 3.23Å; E411-L413 VanDerWaalsContact C-N 3.28Å; E411-L413 PolarHBondContact O-N 3.4Å; E411-Q414 PolarHBondContact O-N 2.87Å; E411-R415 VanDerWaalsContact CB-NH1 3.33Å; E411-R415 WeakPolarHBondContact O-CB 3.29Å; E411-R415 VanDerWaalsContact O-CG 3.31Å; E411-R415 WeakPolarHBondContact O-CG 3.15Å; E411-R415 PolarHBondContact O-N 2.93Å; E411-R415 IonicContact OE2-CZ 2.65Å; E411-R415 IonicContact OE2-NH1 3.72Å; E411-R415 PolarHBondContact OE2-NH1 3.3Å; E411-R415 IonicContact OE2-NH2 2.93Å; E411-R415 PolarHBondContact OE2-NH2 3.41Å
412	E	97.6	Very high	97	Very high	96 Å²	96	97.8 Å²	97.8	45%	0.449	47%	0.473	S	S	.	.	H	α-helix	trans	-61.5	-39.7	174.5	-76.2	175.3	-168.5	0	0	111.2	Q408 V409 R415 H416	Q408-E412 HydrophobicContact CG-CG 4.48Å; Q408-E412 WeakPolarHBondContact CG-OE1 3.31Å; Q408-E412 PolarHBondContact NE2-OE1 2.77Å; Q408-E412 WeakPolarHBondContact O-CB 3.47Å; Q408-E412 WeakPolarHBondContact O-CG 3.31Å; Q408-E412 PolarHBondContact O-N 3.38Å; V409-E412 PolarHBondContact O-N 3.02Å; E412-R415 PolarHBondContact O-N 3.49Å; E412-H416 WeakPolarHBondContact O-CB 3.32Å; E412-H416 PolarHBondContact O-N 2.77Å
413	L	97.8	Very high	97.2	Very high	105 Å²	105	97 Å²	97	55%	0.55	46%	0.463	S	S	.	.	H	α-helix	trans	-65.8	-42.5	174.5	-175.5	63.7	0	0	0	111.9	V409 M410 E411 H416 H417	V409-L413 WeakPolarHBondContact O-CB 3.25Å; V409-L413 PolarHBondContact O-N 3.22Å; M410-L413 PolarHBondContact O-N 2.9Å; E411-L413 VanDerWaalsContact C-N 3.28Å; E411-L413 PolarHBondContact O-N 3.4Å; L413-H416 WeakPolarHBondContact O-CB 3.4Å; L413-H416 PolarHBondContact O-N 3.29Å; L413-H417 PolarHBondContact O-N 3.48Å
414	Q	96.3	Very high	97.3	Very high	112 Å²	112	95.8 Å²	95.8	52%	0.523	46%	0.46	S	S	.	.	H	α-helix	trans	-61.6	-47.4	174.5	-74.8	171.8	-3.9	0	0	111.3	M410 E411 H416 H417 E418	M410-Q414 VanDerWaalsContact O-CG 3.31Å; M410-Q414 WeakPolarHBondContact O-CG 3.36Å; M410-Q414 PolarHBondContact O-N 2.87Å; E411-Q414 PolarHBondContact O-N 2.87Å; Q414-H416 VanDerWaalsContact C-N 3.26Å; Q414-H416 PolarHBondContact O-N 3.24Å; Q414-H417 WeakPolarHBondContact O-CB 3.25Å; Q414-H417 PolarHBondContact O-N 2.97Å; Q414-H417 VanDerWaalsContact O-N 3.13Å; Q414-E418 WeakPolarHBondContact O-CG 3.47Å; Q414-E418 PolarHBondContact O-N 2.95Å
415	R	98.2	Very high	97.4	Very high	125 Å²	125	97.7 Å²	97.7	47%	0.472	46%	0.461	S	S	.	.	H	α-helix	trans	-62.1	-33.4	175	-70.9	177.9	-175.3	106.9	8.5	112.1	E411 E412 R419	E411-R415 VanDerWaalsContact CB-NH1 3.33Å; E411-R415 WeakPolarHBondContact O-CB 3.29Å; E411-R415 VanDerWaalsContact O-CG 3.31Å; E411-R415 WeakPolarHBondContact O-CG 3.15Å; E411-R415 PolarHBondContact O-N 2.93Å; E411-R415 IonicContact OE2-CZ 2.65Å; E411-R415 IonicContact OE2-NH1 3.72Å; E411-R415 PolarHBondContact OE2-NH1 3.3Å; E411-R415 IonicContact OE2-NH2 2.93Å; E411-R415 PolarHBondContact OE2-NH2 3.41Å; E412-R415 PolarHBondContact O-N 3.49Å; R415-R419 WeakPolarHBondContact O-CG 3.27Å; R415-R419 PolarHBondContact O-N 2.92Å; R415-R419 PolarHBondContact O-NE 3.29Å
416	H	96.9	Very high	97.5	Very high	84 Å²	84	100.4 Å²	100.4	39%	0.389	47%	0.467	S	S	.	.	H	α-helix	trans	-67.2	-47.2	173.2	-175	-79.9	0	0	0	110.9	E412 L413 Q414 E418 R419 E420	E412-H416 WeakPolarHBondContact O-CB 3.32Å; E412-H416 PolarHBondContact O-N 2.77Å; L413-H416 WeakPolarHBondContact O-CB 3.4Å; L413-H416 PolarHBondContact O-N 3.29Å; Q414-H416 VanDerWaalsContact C-N 3.26Å; Q414-H416 PolarHBondContact O-N 3.24Å; H416-E418 VanDerWaalsContact C-N 3.34Å; H416-E418 PolarHBondContact O-N 3.47Å; H416-R419 WeakPolarHBondContact O-CB 3.2Å; H416-R419 PolarHBondContact O-N 2.98Å; H416-R419 VanDerWaalsContact O-N 3.17Å; H416-E420 IonicContact CE1-OE1 3.47Å; H416-E420 IonicContact CE1-OE2 3.58Å; H416-E420 IonicContact ND1-OE2 3.53Å; H416-E420 IonicContact NE2-OE2 3.14Å; H416-E420 WeakPolarHBondContact O-CG 3.26Å; H416-E420 PolarHBondContact O-N 2.73Å
417	H	97.2	Very high	97.5	Very high	111 Å²	111	100 Å²	100	51%	0.514	47%	0.465	S	S	.	.	H	α-helix	trans	-59.8	-42.3	177.3	-178.6	61.3	0	0	0	112.6	L413 Q414 R419 E420 L421	L413-H417 PolarHBondContact O-N 3.48Å; Q414-H417 WeakPolarHBondContact O-CB 3.25Å; Q414-H417 PolarHBondContact O-N 2.97Å; Q414-H417 VanDerWaalsContact O-N 3.13Å; H417-R419 VanDerWaalsContact C-N 3.32Å; H417-R419 PolarHBondContact O-N 3.34Å; H417-E420 WeakPolarHBondContact O-CB 3.21Å; H417-E420 PolarHBondContact O-N 3.33Å; H417-E420 VanDerWaalsContact O-N 3.16Å; H417-L421 WeakPolarHBondContact NE2-CD1 3.49Å; H417-L421 WeakPolarHBondContact O-CG 3.31Å; H417-L421 PolarHBondContact O-N 3.19Å
418	E	97.9	Very high	97.5	Very high	114 Å²	114	101.6 Å²	101.6	53%	0.533	47%	0.47	S	S	.	.	H	α-helix	trans	-60.7	-41.3	174.8	-74.3	174.4	179.7	0	0	112.1	Q414 H416 L421 Q422	Q414-E418 WeakPolarHBondContact O-CG 3.47Å; Q414-E418 PolarHBondContact O-N 2.95Å; H416-E418 VanDerWaalsContact C-N 3.34Å; H416-E418 PolarHBondContact O-N 3.47Å; E418-L421 PolarHBondContact O-N 2.9Å; E418-Q422 WeakPolarHBondContact O-CG 3.48Å; E418-Q422 PolarHBondContact O-N 3.13Å
419	R	98.3	Very high	97.5	Very high	127 Å²	127	102.6 Å²	102.6	48%	0.479	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-39.5	173.7	-74.4	177.1	-74.3	151.7	-6.4	111.9	R415 H416 H417 Q422 R423	R415-R419 WeakPolarHBondContact O-CG 3.27Å; R415-R419 PolarHBondContact O-N 2.92Å; R415-R419 PolarHBondContact O-NE 3.29Å; H416-R419 WeakPolarHBondContact O-CB 3.2Å; H416-R419 PolarHBondContact O-N 2.98Å; H416-R419 VanDerWaalsContact O-N 3.17Å; H417-R419 VanDerWaalsContact C-N 3.32Å; H417-R419 PolarHBondContact O-N 3.34Å; R419-Q422 PolarHBondContact O-N 2.87Å; R419-R423 WeakPolarHBondContact O-CG 3.43Å; R419-R423 PolarHBondContact O-N 3.24Å
420	E	97.3	Very high	97.5	Very high	56 Å²	56	102.8 Å²	102.8	26%	0.262	47%	0.467	S	S	.	.	H	α-helix	trans	-61.4	-45.9	174.4	-63.7	-40	-109.7	0	0	110.9	H416 H417 Q422 R423 L424	H416-E420 IonicContact CE1-OE1 3.47Å; H416-E420 IonicContact CE1-OE2 3.58Å; H416-E420 IonicContact ND1-OE2 3.53Å; H416-E420 IonicContact NE2-OE2 3.14Å; H416-E420 WeakPolarHBondContact O-CG 3.26Å; H416-E420 PolarHBondContact O-N 2.73Å; H417-E420 WeakPolarHBondContact O-CB 3.21Å; H417-E420 PolarHBondContact O-N 3.33Å; H417-E420 VanDerWaalsContact O-N 3.16Å; E420-Q422 VanDerWaalsContact C-N 3.34Å; E420-Q422 PolarHBondContact O-N 3.33Å; E420-R423 PolarHBondContact O-N 2.85Å; E420-R423 IonicContact OE1-CZ 2.77Å; E420-R423 IonicContact OE1-NH2 3.01Å; E420-R423 PolarHBondContact OE1-NH2 3.47Å; E420-R423 IonicContact OE2-CZ 3.88Å; E420-R423 IonicContact OE2-NH1 3.59Å; E420-R423 PolarHBondContact OE2-NH1 2.86Å; E420-R423 IonicContact OE2-NH2 3.34Å; E420-R423 PolarHBondContact OE2-NH2 2.93Å; E420-L424 WeakPolarHBondContact O-CB 3.26Å; E420-L424 WeakPolarHBondContact O-CG 3.49Å; E420-L424 PolarHBondContact O-N 3.29Å
421	L	97.4	Very high	97.6	Very high	76 Å²	76	104 Å²	104	40%	0.398	48%	0.475	S	S	.	.	H	α-helix	trans	-60.5	-44.4	179.5	-75.7	173.1	0	0	0	111.5	H417 E418 L424 Q425	H417-L421 WeakPolarHBondContact NE2-CD1 3.49Å; H417-L421 WeakPolarHBondContact O-CG 3.31Å; H417-L421 PolarHBondContact O-N 3.19Å; E418-L421 PolarHBondContact O-N 2.9Å; L421-L424 PolarHBondContact O-N 3.41Å; L421-Q425 WeakPolarHBondContact O-CB 3.45Å; L421-Q425 VanDerWaalsContact O-CG 3.25Å; L421-Q425 WeakPolarHBondContact O-CG 3.31Å; L421-Q425 PolarHBondContact O-N 2.72Å
422	Q	98.1	Very high	97.6	Very high	106 Å²	106	105.7 Å²	105.7	50%	0.495	49%	0.485	S	S	.	.	H	α-helix	trans	-63.3	-42	176.6	-73.1	173.4	-2.7	0	0	112	E418 R419 E420 Q425 Q426	E418-Q422 WeakPolarHBondContact O-CG 3.48Å; E418-Q422 PolarHBondContact O-N 3.13Å; R419-Q422 PolarHBondContact O-N 2.87Å; E420-Q422 VanDerWaalsContact C-N 3.34Å; E420-Q422 PolarHBondContact O-N 3.33Å; Q422-Q425 PolarHBondContact O-N 3.29Å; Q422-Q426 WeakPolarHBondContact O-CG 3.45Å; Q422-Q426 PolarHBondContact O-N 2.93Å
423	R	98.1	Very high	97.6	Very high	113 Å²	113	103.8 Å²	103.8	43%	0.426	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-45.1	176.2	-70.7	-156.5	-48.3	-83.8	8.2	111.9	R419 E420 Q425 Q426 E427	R419-R423 WeakPolarHBondContact O-CG 3.43Å; R419-R423 PolarHBondContact O-N 3.24Å; E420-R423 PolarHBondContact O-N 2.85Å; E420-R423 IonicContact OE1-CZ 2.77Å; E420-R423 IonicContact OE1-NH2 3.01Å; E420-R423 PolarHBondContact OE1-NH2 3.47Å; E420-R423 IonicContact OE2-CZ 3.88Å; E420-R423 IonicContact OE2-NH1 3.59Å; E420-R423 PolarHBondContact OE2-NH1 2.86Å; E420-R423 IonicContact OE2-NH2 3.34Å; E420-R423 PolarHBondContact OE2-NH2 2.93Å; R423-Q425 VanDerWaalsContact C-N 3.3Å; R423-Q425 PolarHBondContact O-N 3.03Å; R423-Q426 PolarHBondContact O-N 3.23Å; R423-E427 WeakPolarHBondContact O-CG 3.44Å; R423-E427 PolarHBondContact O-N 2.88Å
424	L	97.6	Very high	97.6	Very high	108 Å²	108	102.2 Å²	102.2	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-63.4	-35.8	177.3	-71.7	172.2	0	0	0	112.4	E420 L421 K428	E420-L424 WeakPolarHBondContact O-CB 3.26Å; E420-L424 WeakPolarHBondContact O-CG 3.49Å; E420-L424 PolarHBondContact O-N 3.29Å; L421-L424 PolarHBondContact O-N 3.41Å; L424-K428 WeakPolarHBondContact O-CB 3.21Å; L424-K428 PolarHBondContact O-N 3.42Å
425	Q	97.4	Very high	97.5	Very high	113 Å²	113	103 Å²	103	53%	0.528	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-45.9	173.7	-76.4	168.9	-12.9	0	0	111.5	L421 Q422 R423 K428 E429	L421-Q425 WeakPolarHBondContact O-CB 3.45Å; L421-Q425 VanDerWaalsContact O-CG 3.25Å; L421-Q425 WeakPolarHBondContact O-CG 3.31Å; L421-Q425 PolarHBondContact O-N 2.72Å; Q422-Q425 PolarHBondContact O-N 3.29Å; R423-Q425 VanDerWaalsContact C-N 3.3Å; R423-Q425 PolarHBondContact O-N 3.03Å; Q425-K428 WeakPolarHBondContact O-CB 3.38Å; Q425-K428 PolarHBondContact O-N 2.91Å; Q425-E429 WeakPolarHBondContact O-CG 3.47Å; Q425-E429 PolarHBondContact O-N 3.34Å
426	Q	98.2	Very high	97.5	Very high	122 Å²	122	101.6 Å²	101.6	57%	0.57	49%	0.485	S	S	*	.	H	α-helix	trans	-64.1	-42.8	177	-70.3	169.8	27.5	0	0	112	Q422 R423 K428 E429 W430	Q422-Q426 WeakPolarHBondContact O-CG 3.45Å; Q422-Q426 PolarHBondContact O-N 2.93Å; R423-Q426 PolarHBondContact O-N 3.23Å; Q426-K428 VanDerWaalsContact C-N 3.32Å; Q426-K428 PolarHBondContact O-N 3.37Å; Q426-E429 PolarHBondContact O-N 2.91Å; Q426-W430 VanDerWaalsContact O-CB 3.25Å; Q426-W430 WeakPolarHBondContact O-CB 3.47Å; Q426-W430 PolarHBondContact O-N 3.46Å
427	E	96.8	Very high	97.5	Very high	107 Å²	107	100.2 Å²	100.2	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-41.7	175.5	-75.3	175.4	-169.3	0	0	111.6	R423 W430 L431	R423-E427 WeakPolarHBondContact O-CG 3.44Å; R423-E427 PolarHBondContact O-N 2.88Å; E427-W430 PolarHBondContact O-N 2.85Å; E427-L431 WeakPolarHBondContact O-CB 3.37Å; E427-L431 VanDerWaalsContact O-CG 3.3Å; E427-L431 WeakPolarHBondContact O-CG 3.45Å; E427-L431 PolarHBondContact O-N 3.27Å
428	K	97.3	Very high	97.3	Very high	137 Å²	137	97.2 Å²	97.2	60%	0.596	48%	0.483	S	S	*	.	H	α-helix	trans	-61.6	-47.3	174.7	177.4	-167.4	167.2	-168.2	0	111.5	L424 Q425 Q426 W430 L431 L432	L424-K428 WeakPolarHBondContact O-CB 3.21Å; L424-K428 PolarHBondContact O-N 3.42Å; Q425-K428 WeakPolarHBondContact O-CB 3.38Å; Q425-K428 PolarHBondContact O-N 2.91Å; Q426-K428 VanDerWaalsContact C-N 3.32Å; Q426-K428 PolarHBondContact O-N 3.37Å; K428-W430 VanDerWaalsContact C-N 3.33Å; K428-L431 PolarHBondContact O-N 2.95Å; K428-L432 HydrophobicContact CG-CD1 4.16Å; K428-L432 VanDerWaalsContact O-CG 3.29Å; K428-L432 WeakPolarHBondContact O-CG 3.34Å; K428-L432 PolarHBondContact O-N 3.41Å
429	E	97.7	Very high	97.3	Very high	129 Å²	129	95.5 Å²	95.5	60%	0.603	48%	0.48	S	S	*	.	H	α-helix	trans	-63.5	-41.4	178.9	-73.8	173.1	-178.8	0	0	111.5	Q425 Q426 L432 A433	Q425-E429 WeakPolarHBondContact O-CG 3.47Å; Q425-E429 PolarHBondContact O-N 3.34Å; Q426-E429 PolarHBondContact O-N 2.91Å; E429-L432 PolarHBondContact O-N 3.14Å; E429-A433 PolarHBondContact O-N 2.83Å
430	W	97.8	Very high	97.2	Very high	82 Å²	82	92 Å²	92	31%	0.311	48%	0.479	S	S	.	.	H	α-helix	trans	-61.6	-46.8	175.9	-177.4	84.3	0	0	0	111.7	Q426 E427 K428 L432 A433 E434 Q638	Q426-W430 VanDerWaalsContact O-CB 3.25Å; Q426-W430 WeakPolarHBondContact O-CB 3.47Å; Q426-W430 PolarHBondContact O-N 3.46Å; E427-W430 PolarHBondContact O-N 2.85Å; K428-W430 VanDerWaalsContact C-N 3.33Å; W430-L432 VanDerWaalsContact C-N 3.34Å; W430-L432 PolarHBondContact O-N 3.4Å; W430-A433 WeakPolarHBondContact O-CB 3.42Å; W430-A433 PolarHBondContact O-N 2.95Å; W430-E434 HydrophobicContact CH2-CB 4.34Å; W430-E434 HydrophobicContact CH2-CG 4.31Å; W430-E434 PolarHBondContact O-N 3.2Å; W430-Q638 HydrophobicContact CH2-CB 4.45Å; W430-Q638 HydrophobicContact CH2-CG 3.89Å; W430-Q638 VanDerWaalsContact CH2-NE2 3.25Å; W430-Q638 HydrophobicContact CZ2-CB 3.65Å; W430-Q638 VanDerWaalsContact CZ2-CD 3.44Å; W430-Q638 HydrophobicContact CZ2-CG 3.46Å; W430-Q638 VanDerWaalsContact CZ2-CG 3.46Å
431	L	97.5	Very high	97.2	Very high	98 Å²	98	93 Å²	93	51%	0.513	49%	0.492	S	S	.	.	H	α-helix	trans	-62.4	-39.2	175.3	-74.4	169.9	0	0	0	112.5	E427 K428 A433 E434 E435	E427-L431 WeakPolarHBondContact O-CB 3.37Å; E427-L431 VanDerWaalsContact O-CG 3.3Å; E427-L431 WeakPolarHBondContact O-CG 3.45Å; E427-L431 PolarHBondContact O-N 3.27Å; K428-L431 PolarHBondContact O-N 2.95Å; L431-A433 VanDerWaalsContact C-N 3.33Å; L431-A433 PolarHBondContact O-N 2.91Å; L431-E434 PolarHBondContact O-N 3.18Å; L431-E435 WeakPolarHBondContact O-CG 3.24Å; L431-E435 PolarHBondContact O-N 2.9Å
432	L	98.3	Very high	97.1	Very high	99 Å²	99	91.9 Å²	91.9	52%	0.518	49%	0.493	S	S	.	.	H	α-helix	trans	-64.3	-38	175.9	-74.9	169.5	0	0	0	112.1	K428 E429 W430 T436	K428-L432 HydrophobicContact CG-CD1 4.16Å; K428-L432 VanDerWaalsContact O-CG 3.29Å; K428-L432 WeakPolarHBondContact O-CG 3.34Å; K428-L432 PolarHBondContact O-N 3.41Å; E429-L432 PolarHBondContact O-N 3.14Å; W430-L432 VanDerWaalsContact C-N 3.34Å; W430-L432 PolarHBondContact O-N 3.4Å; L432-T436 WeakPolarHBondContact O-CB 3.46Å; L432-T436 PolarHBondContact O-N 2.91Å; L432-T436 PolarHBondContact O-OG1 2.63Å
433	A	97.7	Very high	97	Very high	56 Å²	56	90.9 Å²	90.9	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-42.5	175.4	0	0	0	0	0	111.4	E429 W430 L431 T436 A437	E429-A433 PolarHBondContact O-N 2.83Å; W430-A433 WeakPolarHBondContact O-CB 3.42Å; W430-A433 PolarHBondContact O-N 2.95Å; L431-A433 VanDerWaalsContact C-N 3.33Å; L431-A433 PolarHBondContact O-N 2.91Å; A433-T436 WeakPolarHBondContact O-CB 3.39Å; A433-T436 PolarHBondContact O-N 3.16Å; A433-A437 WeakPolarHBondContact O-CB 3.44Å; A433-A437 PolarHBondContact O-N 3.37Å
434	E	96.9	Very high	96.9	Very high	71 Å²	71	92.2 Å²	92.2	33%	0.332	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-47.5	176.6	-175.7	62.6	-168.1	0	0	111.7	W430 L431 T436 A437 A438	W430-E434 HydrophobicContact CH2-CB 4.34Å; W430-E434 HydrophobicContact CH2-CG 4.31Å; W430-E434 PolarHBondContact O-N 3.2Å; L431-E434 PolarHBondContact O-N 3.18Å; E434-T436 VanDerWaalsContact C-N 3.28Å; E434-T436 PolarHBondContact O-N 3.05Å; E434-A437 PolarHBondContact O-N 2.92Å; E434-A437 VanDerWaalsContact O-N 3.17Å; E434-A438 WeakPolarHBondContact O-CB 3.42Å; E434-A438 PolarHBondContact O-N 3.36Å
435	E	94.6	Very high	96.8	Very high	129 Å²	129	90 Å²	90	60%	0.603	50%	0.498	S	S	*	.	H	α-helix	trans	-60.9	-37.8	175.3	-73.4	-65.1	149.1	0	0	111.9	L431 T439	L431-E435 WeakPolarHBondContact O-CG 3.24Å; L431-E435 PolarHBondContact O-N 2.9Å; E435-T439 WeakPolarHBondContact O-CB 3.26Å; E435-T439 PolarHBondContact O-N 3.03Å; E435-T439 PolarHBondContact O-OG1 3.34Å
436	T	97.9	Very high	96.8	Very high	95 Å²	95	89.7 Å²	89.7	58%	0.583	50%	0.499	S	S	*	.	H	α-helix	trans	-66	-42.5	175.4	-57.4	0	0	0	0	111.3	L432 A433 E434 T439 A440	L432-T436 WeakPolarHBondContact O-CB 3.46Å; L432-T436 PolarHBondContact O-N 2.91Å; L432-T436 PolarHBondContact O-OG1 2.63Å; A433-T436 WeakPolarHBondContact O-CB 3.39Å; A433-T436 PolarHBondContact O-N 3.16Å; E434-T436 VanDerWaalsContact C-N 3.28Å; E434-T436 PolarHBondContact O-N 3.05Å; T436-T439 PolarHBondContact O-N 2.96Å; T436-A440 WeakPolarHBondContact O-CB 3.33Å; T436-A440 PolarHBondContact O-N 3Å
437	A	97	Very high	96.7	Very high	55 Å²	55	90.1 Å²	90.1	46%	0.455	50%	0.498	S	S	.	.	H	α-helix	trans	-66.7	-43.5	177.3	0	0	0	0	0	111.9	A433 E434 T439 A440 S441	A433-A437 WeakPolarHBondContact O-CB 3.44Å; A433-A437 PolarHBondContact O-N 3.37Å; E434-A437 PolarHBondContact O-N 2.92Å; E434-A437 VanDerWaalsContact O-N 3.17Å; A437-T439 VanDerWaalsContact C-N 3.32Å; A437-T439 PolarHBondContact O-N 3.31Å; A437-A440 PolarHBondContact O-N 3.39Å; A437-S441 WeakPolarHBondContact O-CB 3.45Å; A437-S441 PolarHBondContact O-N 3.03Å
438	A	93.3	Very high	96.7	Very high	49 Å²	49	90.9 Å²	90.9	41%	0.405	50%	0.5	S	S	.	.	H	α-helix	trans	-59.6	-43.2	174	0	0	0	0	0	111.3	E434 S441 A442	E434-A438 WeakPolarHBondContact O-CB 3.42Å; E434-A438 PolarHBondContact O-N 3.36Å; A438-S441 PolarHBondContact O-N 3.13Å; A438-A442 WeakPolarHBondContact O-CB 2.94Å; A438-A442 PolarHBondContact O-N 3.02Å
439	T	97.6	Very high	96.7	Very high	77 Å²	77	86.9 Å²	86.9	47%	0.472	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-42.8	175.7	-58.7	0	0	0	0	111.8	E435 T436 A437 A442 I443	E435-T439 WeakPolarHBondContact O-CB 3.26Å; E435-T439 PolarHBondContact O-N 3.03Å; E435-T439 PolarHBondContact O-OG1 3.34Å; T436-T439 PolarHBondContact O-N 2.96Å; A437-T439 VanDerWaalsContact C-N 3.32Å; A437-T439 PolarHBondContact O-N 3.31Å; T439-A442 PolarHBondContact O-N 3.3Å; T439-I443 HydrophobicContact CG2-CD1 4.17Å; T439-I443 WeakPolarHBondContact O-CG1 3.41Å; T439-I443 PolarHBondContact O-N 3.24Å
440	A	96.4	Very high	96.6	Very high	55 Å²	55	88.7 Å²	88.7	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-62.1	-44.2	176.2	0	0	0	0	0	111.9	T436 A437 I443 E444	T436-A440 WeakPolarHBondContact O-CB 3.33Å; T436-A440 PolarHBondContact O-N 3Å; A437-A440 PolarHBondContact O-N 3.39Å; A440-I443 PolarHBondContact O-N 3.18Å; A440-E444 PolarHBondContact O-N 3.08Å
441	S	97.2	Very high	96.5	Very high	76 Å²	76	91.1 Å²	91.1	53%	0.531	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-42.3	175.9	-176.8	0	0	0	0	112	A437 A438 I443 E444 A445	A437-S441 WeakPolarHBondContact O-CB 3.45Å; A437-S441 PolarHBondContact O-N 3.03Å; A438-S441 PolarHBondContact O-N 3.13Å; S441-I443 VanDerWaalsContact C-N 3.35Å; S441-I443 PolarHBondContact O-N 3.33Å; S441-E444 PolarHBondContact O-N 3.03Å; S441-A445 WeakPolarHBondContact O-CB 3.35Å; S441-A445 PolarHBondContact O-N 3.37Å
442	A	95.8	Very high	96.3	Very high	53 Å²	53	90 Å²	90	44%	0.438	50%	0.502	S	S	.	.	H	α-helix	trans	-60.7	-43.4	175	0	0	0	0	0	111.9	A438 T439 A445 M446	A438-A442 WeakPolarHBondContact O-CB 2.94Å; A438-A442 PolarHBondContact O-N 3.02Å; T439-A442 PolarHBondContact O-N 3.3Å; A442-A445 PolarHBondContact O-N 3.24Å; A442-M446 WeakPolarHBondContact O-CG 3.14Å; A442-M446 PolarHBondContact O-N 3.49Å
443	I	95.8	Very high	96	Very high	84 Å²	84	89.1 Å²	89.1	43%	0.431	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-41	176.2	-67.6	167	0	0	0	111.1	T439 A440 S441 M446 K447	T439-I443 HydrophobicContact CG2-CD1 4.17Å; T439-I443 WeakPolarHBondContact O-CG1 3.41Å; T439-I443 PolarHBondContact O-N 3.24Å; A440-I443 PolarHBondContact O-N 3.18Å; S441-I443 VanDerWaalsContact C-N 3.35Å; S441-I443 PolarHBondContact O-N 3.33Å; I443-M446 PolarHBondContact O-N 3.45Å; I443-K447 HydrophobicContact CG2-CD 4.28Å; I443-K447 WeakPolarHBondContact O-CG 3.4Å; I443-K447 PolarHBondContact O-N 3.01Å
444	E	96.4	Very high	95.9	Very high	142 Å²	142	91.9 Å²	91.9	66%	0.664	50%	0.501	S	S	*	.	H	α-helix	trans	-66.2	-42.1	177.8	-170	172.8	-177.3	0	0	111.9	A440 S441 M446 K447 K448	A440-E444 PolarHBondContact O-N 3.08Å; S441-E444 PolarHBondContact O-N 3.03Å; E444-M446 VanDerWaalsContact C-N 3.32Å; E444-M446 PolarHBondContact O-N 3.09Å; E444-K447 PolarHBondContact O-N 2.86Å; E444-K448 WeakPolarHBondContact O-CB 3.24Å; E444-K448 PolarHBondContact O-N 2.98Å
445	A	96.3	Very high	95.6	Very high	60 Å²	60	91.3 Å²	91.3	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-59.5	-43	173.1	0	0	0	0	0	111.6	S441 A442 K448 A449	S441-A445 WeakPolarHBondContact O-CB 3.35Å; S441-A445 PolarHBondContact O-N 3.37Å; A442-A445 PolarHBondContact O-N 3.24Å; A445-K448 PolarHBondContact O-N 3.04Å; A445-A449 WeakPolarHBondContact O-CB 3.5Å; A445-A449 PolarHBondContact O-N 3.39Å
446	M	96.6	Very high	95.5	Very high	108 Å²	108	90.4 Å²	90.4	53%	0.532	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-46.2	174.3	-72.1	-177.8	75.7	0	0	111.8	A442 I443 E444 K448 A449 Y450	A442-M446 WeakPolarHBondContact O-CG 3.14Å; A442-M446 PolarHBondContact O-N 3.49Å; I443-M446 PolarHBondContact O-N 3.45Å; E444-M446 VanDerWaalsContact C-N 3.32Å; E444-M446 PolarHBondContact O-N 3.09Å; M446-K448 VanDerWaalsContact C-N 3.32Å; M446-K448 PolarHBondContact O-N 3.02Å; M446-A449 PolarHBondContact O-N 3.33Å; M446-Y450 HydrophobicContact CE-CE2 4.33Å; M446-Y450 WeakPolarHBondContact O-CD2 3.44Å; M446-Y450 PolarHBondContact O-N 3.14Å
447	K	96.7	Very high	95	Very high	130 Å²	130	89.9 Å²	89.9	57%	0.565	49%	0.487	S	S	*	.	H	α-helix	trans	-58.6	-44.3	176.6	-75.8	173.2	179.3	175.3	0	111.6	I443 E444 Y450 Q451	I443-K447 HydrophobicContact CG2-CD 4.28Å; I443-K447 WeakPolarHBondContact O-CG 3.4Å; I443-K447 PolarHBondContact O-N 3.01Å; E444-K447 PolarHBondContact O-N 2.86Å; K447-Y450 PolarHBondContact O-N 3.06Å; K447-Q451 VanDerWaalsContact O-CG 3.32Å; K447-Q451 WeakPolarHBondContact O-CG 3.48Å; K447-Q451 PolarHBondContact O-N 2.92Å
448	K	96.8	Very high	94.4	Very high	124 Å²	124	92.3 Å²	92.3	54%	0.539	49%	0.492	S	S	.	.	H	α-helix	trans	-63.3	-45.1	177	-174.3	178.7	176.7	-176.9	0	111.5	E444 A445 M446 Y450 Q451 E452	E444-K448 WeakPolarHBondContact O-CB 3.24Å; E444-K448 PolarHBondContact O-N 2.98Å; A445-K448 PolarHBondContact O-N 3.04Å; M446-K448 VanDerWaalsContact C-N 3.32Å; M446-K448 PolarHBondContact O-N 3.02Å; K448-Y450 VanDerWaalsContact C-N 3.31Å; K448-Y450 PolarHBondContact O-N 3.26Å; K448-Q451 WeakPolarHBondContact O-CB 3.11Å; K448-Q451 PolarHBondContact O-N 3.4Å; K448-E452 WeakPolarHBondContact CE-OE1 3.45Å; K448-E452 WeakPolarHBondContact O-CG 3.42Å; K448-E452 PolarHBondContact O-N 3.02Å
449	A	96.1	Very high	93.8	Very high	52 Å²	52	93.5 Å²	93.5	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-59.5	-42	175.9	0	0	0	0	0	112	A445 M446 E452 E453	A445-A449 WeakPolarHBondContact O-CB 3.5Å; A445-A449 PolarHBondContact O-N 3.39Å; M446-A449 PolarHBondContact O-N 3.33Å; A449-E452 PolarHBondContact O-N 2.85Å; A449-E453 PolarHBondContact O-N 3.27Å
450	Y	95.3	Very high	93	Very high	167 Å²	167	94.7 Å²	94.7	66%	0.655	50%	0.496	S	S	*	.	H	α-helix	trans	-65	-41.5	174.3	-78.7	-61.4	0	0	0	112.9	M446 K447 K448 E452 E453 L454	M446-Y450 HydrophobicContact CE-CE2 4.33Å; M446-Y450 WeakPolarHBondContact O-CD2 3.44Å; M446-Y450 PolarHBondContact O-N 3.14Å; K447-Y450 PolarHBondContact O-N 3.06Å; K448-Y450 VanDerWaalsContact C-N 3.31Å; K448-Y450 PolarHBondContact O-N 3.26Å; Y450-E452 VanDerWaalsContact C-N 3.34Å; Y450-E453 PolarHBondContact O-N 3.2Å; Y450-L454 WeakPolarHBondContact O-CB 3.35Å; Y450-L454 PolarHBondContact O-N 3.49Å
451	Q	95.7	Very high	92	Very high	134 Å²	134	95.6 Å²	95.6	63%	0.626	50%	0.496	S	S	*	.	H	α-helix	trans	-62.6	-42.1	174.9	-74.4	172.4	-7.1	0	0	111.7	K447 K448 L454 S455	K447-Q451 VanDerWaalsContact O-CG 3.32Å; K447-Q451 WeakPolarHBondContact O-CG 3.48Å; K447-Q451 PolarHBondContact O-N 2.92Å; K448-Q451 WeakPolarHBondContact O-CB 3.11Å; K448-Q451 PolarHBondContact O-N 3.4Å; Q451-L454 PolarHBondContact O-N 3.2Å; Q451-S455 WeakPolarHBondContact O-CB 3.33Å; Q451-S455 PolarHBondContact O-N 3.33Å
452	E	94.3	Very high	91	Very high	73 Å²	73	101.1 Å²	101.1	34%	0.341	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-45.5	175	-74.1	177.2	-165.4	0	0	111.2	K448 A449 Y450 L454 S455 R456	K448-E452 WeakPolarHBondContact CE-OE1 3.45Å; K448-E452 WeakPolarHBondContact O-CG 3.42Å; K448-E452 PolarHBondContact O-N 3.02Å; A449-E452 PolarHBondContact O-N 2.85Å; Y450-E452 VanDerWaalsContact C-N 3.34Å; E452-L454 PolarHBondContact O-N 3.42Å; E452-S455 WeakPolarHBondContact CA-OG 2.93Å; E452-S455 PolarHBondContact O-N 2.92Å; E452-S455 VanDerWaalsContact O-N 3.15Å; E452-S455 PolarHBondContact O-OG 3.44Å; E452-R456 WeakPolarHBondContact O-CG 3.38Å; E452-R456 PolarHBondContact O-N 2.84Å; E452-R456 IonicContact OE2-NH2 3.8Å; E452-R456 PolarHBondContact OE2-NH2 3.44Å
453	E	92.2	Very high	89.4	Confident	82 Å²	82	101.2 Å²	101.2	38%	0.383	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-42	177.9	-161.9	59.5	-152.3	0	0	111.8	A449 Y450 S455 R456 E457	A449-E453 PolarHBondContact O-N 3.27Å; Y450-E453 PolarHBondContact O-N 3.2Å; E453-S455 VanDerWaalsContact C-N 3.3Å; E453-S455 PolarHBondContact O-N 2.89Å; E453-R456 WeakPolarHBondContact O-CB 3.38Å; E453-R456 PolarHBondContact O-N 2.97Å; E453-R456 IonicContact OE2-CZ 2.66Å; E453-R456 IonicContact OE2-NH1 3.2Å; E453-R456 PolarHBondContact OE2-NH1 3.36Å; E453-E457 PolarHBondContact O-N 2.9Å
454	L	94.7	Very high	87.7	Confident	113 Å²	113	102.3 Å²	102.3	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-59.6	-42.5	173.2	-175.8	63.5	0	0	0	111.3	Y450 Q451 E452 E457 L458	Y450-L454 WeakPolarHBondContact O-CB 3.35Å; Y450-L454 PolarHBondContact O-N 3.49Å; Q451-L454 PolarHBondContact O-N 3.2Å; E452-L454 PolarHBondContact O-N 3.42Å; L454-E457 PolarHBondContact O-N 3.49Å; L454-L458 HydrophobicContact CG-CD1 4.33Å; L454-L458 WeakPolarHBondContact O-CB 3.29Å; L454-L458 VanDerWaalsContact O-CG 3.29Å; L454-L458 WeakPolarHBondContact O-CG 3.36Å; L454-L458 PolarHBondContact O-N 3.49Å
455	S	91.8	Very high	86	Confident	59 Å²	59	103.5 Å²	103.5	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-66.4	-35.7	176.9	79	0	0	0	0	112.8	Q451 E452 E453 S459	Q451-S455 WeakPolarHBondContact O-CB 3.33Å; Q451-S455 PolarHBondContact O-N 3.33Å; E452-S455 WeakPolarHBondContact CA-OG 2.93Å; E452-S455 PolarHBondContact O-N 2.92Å; E452-S455 VanDerWaalsContact O-N 3.15Å; E452-S455 PolarHBondContact O-OG 3.44Å; E453-S455 VanDerWaalsContact C-N 3.3Å; E453-S455 PolarHBondContact O-N 2.89Å; S455-S459 WeakPolarHBondContact O-CB 3.36Å; S455-S459 PolarHBondContact O-N 3.45Å; S455-S459 PolarHBondContact O-OG 3.3Å
456	R	92.4	Very high	84.2	Confident	111 Å²	111	107 Å²	107	42%	0.419	52%	0.52	S	S	.	.	H	α-helix	trans	-65.3	-45.1	173.6	-73.1	-179.7	-161.1	107.5	11.8	110.7	E452 E453 S459 K460	E452-R456 WeakPolarHBondContact O-CG 3.38Å; E452-R456 PolarHBondContact O-N 2.84Å; E452-R456 IonicContact OE2-NH2 3.8Å; E452-R456 PolarHBondContact OE2-NH2 3.44Å; E453-R456 WeakPolarHBondContact O-CB 3.38Å; E453-R456 PolarHBondContact O-N 2.97Å; E453-R456 IonicContact OE2-CZ 2.66Å; E453-R456 IonicContact OE2-NH1 3.2Å; E453-R456 PolarHBondContact OE2-NH1 3.36Å; R456-S459 CarbonylContact O-C 3.52Å; R456-S459 WeakPolarHBondContact O-CB 3.28Å; R456-S459 PolarHBondContact O-N 2.9Å; R456-K460 WeakPolarHBondContact O-CG 3.36Å; R456-K460 PolarHBondContact O-N 3.24Å
457	E	86.9	Confident	82.7	Confident	83 Å²	83	103.7 Å²	103.7	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-65.8	-39.1	176.8	-73.1	-55.1	136.4	0	0	112.6	E453 L454 S459 K460 T461	E453-E457 PolarHBondContact O-N 2.9Å; L454-E457 PolarHBondContact O-N 3.49Å; E457-S459 VanDerWaalsContact C-N 3.29Å; E457-S459 PolarHBondContact O-N 3.13Å; E457-K460 PolarHBondContact O-N 2.94Å; E457-K460 WeakPolarHBondContact OE1-CD 3.34Å; E457-K460 IonicContact OE1-NZ 3.58Å; E457-K460 PolarHBondContact OE1-NZ 2.88Å; E457-T461 PolarHBondContact O-N 3.41Å; E457-T461 PolarHBondContact O-OG1 3.02Å
458	L	84.9	Confident	81.3	Confident	106 Å²	106	101.9 Å²	101.9	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-63.5	-36.5	171.3	-72.3	174	0	0	0	112	L454 T461 R462	L454-L458 HydrophobicContact CG-CD1 4.33Å; L454-L458 WeakPolarHBondContact O-CB 3.29Å; L454-L458 VanDerWaalsContact O-CG 3.29Å; L454-L458 WeakPolarHBondContact O-CG 3.36Å; L454-L458 PolarHBondContact O-N 3.49Å; L458-T461 VanDerWaalsContact CA-OG1 3.29Å; L458-T461 WeakPolarHBondContact CA-OG1 3.46Å; L458-T461 PolarHBondContact O-OG1 3.47Å; L458-R462 VanDerWaalsContact O-CB 3.31Å; L458-R462 WeakPolarHBondContact O-CB 3.38Å; L458-R462 PolarHBondContact O-N 2.86Å
459	S	80.5	Confident	80.1	Confident	75 Å²	75	101.2 Å²	101.2	52%	0.524	52%	0.518	S	S	.	.	H	α-helix	trans	-70.4	-38.6	174.9	-59.1	0	0	0	0	111.9	S455 R456 E457 R462 S463	S455-S459 WeakPolarHBondContact O-CB 3.36Å; S455-S459 PolarHBondContact O-N 3.45Å; S455-S459 PolarHBondContact O-OG 3.3Å; R456-S459 CarbonylContact O-C 3.52Å; R456-S459 WeakPolarHBondContact O-CB 3.28Å; R456-S459 PolarHBondContact O-N 2.9Å; E457-S459 VanDerWaalsContact C-N 3.29Å; E457-S459 PolarHBondContact O-N 3.13Å; S459-R462 PolarHBondContact O-N 3.41Å; S459-S463 VanDerWaalsContact O-CB 3.32Å; S459-S463 WeakPolarHBondContact O-CB 3.49Å; S459-S463 PolarHBondContact O-N 3.39Å
460	K	80.6	Confident	79.3	Confident	101 Å²	101	100.5 Å²	100.5	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-47.1	173	-72.9	172.3	-168.6	170	0	110.8	R456 E457 R462 S463 L464	R456-K460 WeakPolarHBondContact O-CG 3.36Å; R456-K460 PolarHBondContact O-N 3.24Å; E457-K460 PolarHBondContact O-N 2.94Å; E457-K460 WeakPolarHBondContact OE1-CD 3.34Å; E457-K460 IonicContact OE1-NZ 3.58Å; E457-K460 PolarHBondContact OE1-NZ 2.88Å; K460-R462 PolarHBondContact O-N 3.49Å; K460-S463 CarbonylContact O-C 3.44Å; K460-S463 WeakPolarHBondContact O-CA 3.37Å; K460-S463 WeakPolarHBondContact O-CB 3.36Å; K460-S463 PolarHBondContact O-N 2.92Å; K460-S463 VanDerWaalsContact O-N 3.11Å; K460-L464 VanDerWaalsContact O-CG 3.28Å; K460-L464 WeakPolarHBondContact O-CG 3.49Å; K460-L464 PolarHBondContact O-N 2.89Å
461	T	75.7	Confident	78.5	Confident	75 Å²	75	96.6 Å²	96.6	46%	0.46	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-37.1	176.4	44.3	0	0	0	0	112.6	E457 L458 S463 L464 Q465	E457-T461 PolarHBondContact O-N 3.41Å; E457-T461 PolarHBondContact O-OG1 3.02Å; L458-T461 VanDerWaalsContact CA-OG1 3.29Å; L458-T461 WeakPolarHBondContact CA-OG1 3.46Å; L458-T461 PolarHBondContact O-OG1 3.47Å; T461-S463 VanDerWaalsContact C-N 3.34Å; T461-L464 PolarHBondContact O-N 3.1Å; T461-Q465 PolarHBondContact O-N 3.48Å
462	R	74.7	Confident	77.8	Confident	192 Å²	192	98.8 Å²	98.8	73%	0.725	51%	0.508	S	S	*	.	H	α-helix	trans	-65	-35.6	169.8	-176.2	179.6	-74.6	-169.8	-2.6	112.5	L458 S459 K460 Q465 Q466	L458-R462 VanDerWaalsContact O-CB 3.31Å; L458-R462 WeakPolarHBondContact O-CB 3.38Å; L458-R462 PolarHBondContact O-N 2.86Å; S459-R462 PolarHBondContact O-N 3.41Å; K460-R462 PolarHBondContact O-N 3.49Å; R462-Q465 VanDerWaalsContact O-CB 3.31Å; R462-Q465 WeakPolarHBondContact O-CB 3.38Å; R462-Q465 PolarHBondContact O-N 2.9Å; R462-Q466 PolarHBondContact O-N 3.48Å
463	S	62.4	Low	77.3	Confident	54 Å²	54	102.6 Å²	102.6	38%	0.378	52%	0.524	S	S	.	.	H	α-helix	trans	-69.4	-40.7	173.9	-176.4	0	0	0	0	111.7	S459 K460 T461 Q465 Q466	S459-S463 VanDerWaalsContact O-CB 3.32Å; S459-S463 WeakPolarHBondContact O-CB 3.49Å; S459-S463 PolarHBondContact O-N 3.39Å; K460-S463 CarbonylContact O-C 3.44Å; K460-S463 WeakPolarHBondContact O-CA 3.37Å; K460-S463 WeakPolarHBondContact O-CB 3.36Å; K460-S463 PolarHBondContact O-N 2.92Å; K460-S463 VanDerWaalsContact O-N 3.11Å; T461-S463 VanDerWaalsContact C-N 3.34Å; S463-Q465 PolarHBondContact O-N 3.4Å; S463-Q466 WeakPolarHBondContact O-CA 3.48Å; S463-Q466 WeakPolarHBondContact O-CB 3.33Å; S463-Q466 PolarHBondContact O-N 2.74Å
464	L	61.8	Low	76.9	Confident	107 Å²	107	104 Å²	104	56%	0.56	53%	0.53	S	S	*	.	H	α-helix	trans	-64.1	-21.3	170.5	-66.2	174	0	0	0	112.5	K460 T461 Q466 L471	K460-L464 VanDerWaalsContact O-CG 3.28Å; K460-L464 WeakPolarHBondContact O-CG 3.49Å; K460-L464 PolarHBondContact O-N 2.89Å; T461-L464 PolarHBondContact O-N 3.1Å; L464-Q466 VanDerWaalsContact C-N 3.29Å; L464-Q466 CarbonylContact C-O 3.58Å; L464-L471 HydrophobicContact CD2-CD1 3.47Å; L464-L471 VanDerWaalsContact CD2-CD1 3.47Å; L464-L471 HydrophobicContact CD2-CD2 4.45Å
465	Q	60	Low	76.6	Confident	167 Å²	167	104.5 Å²	104.5	78%	0.78	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-13.9	171.8	-161.5	161.4	54.5	0	0	112.5	T461 R462 S463 G467	T461-Q465 PolarHBondContact O-N 3.48Å; R462-Q465 VanDerWaalsContact O-CB 3.31Å; R462-Q465 WeakPolarHBondContact O-CB 3.38Å; R462-Q465 PolarHBondContact O-N 2.9Å; S463-Q465 PolarHBondContact O-N 3.4Å; Q465-G467 PolarHBondContact O-N 2.83Å
466	Q	58.6	Low	76.7	Confident	134 Å²	134	107.4 Å²	107.4	63%	0.626	54%	0.536	S	S	*	.	S	Bend	trans	-69.5	109.6	153	-53.1	-179.3	-1.6	0	0	105.7	R462 S463 L464	R462-Q466 PolarHBondContact O-N 3.48Å; S463-Q466 WeakPolarHBondContact O-CA 3.48Å; S463-Q466 WeakPolarHBondContact O-CB 3.33Å; S463-Q466 PolarHBondContact O-N 2.74Å; L464-Q466 VanDerWaalsContact C-N 3.29Å; L464-Q466 CarbonylContact C-O 3.58Å
467	G	64.9	Low	76.7	Confident	39 Å²	39	104.9 Å²	104.9	40%	0.402	54%	0.536	S	S	.	.			trans	-50.1	168.3	-165.6	0	0	0	0	0	116.3	Q465 D469 G470	Q465-G467 PolarHBondContact O-N 2.83Å; G467-D469 PolarHBondContact O-N 3.17Å; G467-G470 PolarHBondContact O-N 2.97Å
468	P	67	Low	77	Confident	92 Å²	92	104.3 Å²	104.3	60%	0.597	54%	0.535	S	S	*	.	H	α-helix	trans	-52.8	-21	-171.2	20.5	-33.6	0	0	0	115.3	R472	P468-R472 WeakPolarHBondContact O-CG 3.46Å; P468-R472 PolarHBondContact O-N 3.31Å
469	D	72.6	Confident	77.5	Confident	110 Å²	110	101.6 Å²	101.6	59%	0.588	52%	0.523	S	S	*	.	H	α-helix	trans	-70.6	-30.3	177.5	-62	-34	0	0	0	113.9	G467 K473	G467-D469 PolarHBondContact O-N 3.17Å; D469-K473 WeakPolarHBondContact O-CB 3.34Å; D469-K473 VanDerWaalsContact O-CG 3.23Å; D469-K473 WeakPolarHBondContact O-CG 3.46Å; D469-K473 PolarHBondContact O-N 3.45Å; D469-K473 VanDerWaalsContact O-N 3.07Å
470	G	77.5	Confident	78.3	Confident	36 Å²	36	101.7 Å²	101.7	37%	0.371	52%	0.515	S	S	.	.	H	α-helix	trans	-67.9	-46	177	0	0	0	0	0	111.9	G467 K473 Q474	G467-G470 PolarHBondContact O-N 2.97Å; G470-K473 PolarHBondContact O-N 3.01Å; G470-Q474 PolarHBondContact O-N 3.45Å
471	L	79.2	Confident	79	Confident	85 Å²	85	98.5 Å²	98.5	45%	0.445	51%	0.508	S	S	.	.	H	α-helix	trans	-65.8	-40.4	176.9	-65.4	166.7	0	0	0	112.2	L464 Q474 H475	L464-L471 HydrophobicContact CD2-CD1 3.47Å; L464-L471 VanDerWaalsContact CD2-CD1 3.47Å; L464-L471 HydrophobicContact CD2-CD2 4.45Å; L471-Q474 PolarHBondContact O-N 3.08Å; L471-H475 WeakPolarHBondContact O-CB 3.3Å; L471-H475 PolarHBondContact O-N 3.4Å
472	R	80.2	Confident	80.1	Confident	181 Å²	181	100.1 Å²	100.1	68%	0.683	51%	0.513	S	S	*	.	H	α-helix	trans	-61.8	-43.1	174.9	-78.6	178.4	-179	-88.5	-0	111.6	P468 Q476	P468-R472 WeakPolarHBondContact O-CG 3.46Å; P468-R472 PolarHBondContact O-N 3.31Å; R472-Q476 VanDerWaalsContact O-CB 3.28Å; R472-Q476 WeakPolarHBondContact O-CB 3.4Å; R472-Q476 PolarHBondContact O-N 3.01Å
473	K	84.9	Confident	81.1	Confident	153 Å²	153	97.5 Å²	97.5	67%	0.665	51%	0.507	S	S	*	.	H	α-helix	trans	-65.8	-41	177.5	-74.5	173.6	-176.9	-179.8	0	112.4	D469 G470 Q476 S477	D469-K473 WeakPolarHBondContact O-CB 3.34Å; D469-K473 VanDerWaalsContact O-CG 3.23Å; D469-K473 WeakPolarHBondContact O-CG 3.46Å; D469-K473 PolarHBondContact O-N 3.45Å; D469-K473 VanDerWaalsContact O-N 3.07Å; G470-K473 PolarHBondContact O-N 3.01Å; K473-Q476 WeakPolarHBondContact O-CB 3.39Å; K473-Q476 PolarHBondContact O-N 3.08Å; K473-S477 WeakPolarHBondContact O-CB 3.42Å; K473-S477 PolarHBondContact O-N 3.37Å
474	Q	84	Confident	82.8	Confident	110 Å²	110	101.4 Å²	101.4	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-49.5	175.9	-173.9	61.5	30.9	0	0	111.2	G470 L471 Q476 S477 D478	G470-Q474 PolarHBondContact O-N 3.45Å; L471-Q474 PolarHBondContact O-N 3.08Å; Q474-Q476 VanDerWaalsContact C-N 3.29Å; Q474-Q476 PolarHBondContact O-N 2.9Å; Q474-S477 WeakPolarHBondContact O-CB 3.34Å; Q474-S477 PolarHBondContact O-N 3.33Å; Q474-S477 VanDerWaalsContact O-N 3.09Å; Q474-D478 PolarHBondContact NE2-OD1 3.09Å; Q474-D478 VanDerWaalsContact O-CG 3.22Å; Q474-D478 PolarHBondContact O-N 3.14Å
475	H	87.5	Confident	84.5	Confident	124 Å²	124	102 Å²	102	57%	0.574	51%	0.513	S	S	*	.	H	α-helix	trans	-59.9	-39.8	177.2	-178.5	64.6	0	0	0	112.3	L471 D478 V479	L471-H475 WeakPolarHBondContact O-CB 3.3Å; L471-H475 PolarHBondContact O-N 3.4Å; H475-D478 PolarHBondContact O-N 2.94Å; H475-V479 WeakPolarHBondContact O-CB 3.34Å; H475-V479 VanDerWaalsContact O-CG2 3.26Å; H475-V479 WeakPolarHBondContact O-CG2 3.46Å; H475-V479 PolarHBondContact O-N 3.14Å
476	Q	93.4	Very high	86.3	Confident	121 Å²	121	99.9 Å²	99.9	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-59.5	-46.8	174.1	-167.7	95.4	26.8	0	0	111	R472 K473 Q474 V479 E480	R472-Q476 VanDerWaalsContact O-CB 3.28Å; R472-Q476 WeakPolarHBondContact O-CB 3.4Å; R472-Q476 PolarHBondContact O-N 3.01Å; K473-Q476 WeakPolarHBondContact O-CB 3.39Å; K473-Q476 PolarHBondContact O-N 3.08Å; Q474-Q476 VanDerWaalsContact C-N 3.29Å; Q474-Q476 PolarHBondContact O-N 2.9Å; Q476-V479 PolarHBondContact O-N 3.45Å; Q476-E480 WeakPolarHBondContact O-CB 3.36Å; Q476-E480 VanDerWaalsContact O-CG 3.3Å; Q476-E480 WeakPolarHBondContact O-CG 3.32Å; Q476-E480 PolarHBondContact O-N 3.27Å
477	S	93.5	Very high	88.1	Confident	58 Å²	58	99 Å²	99	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-62.3	-42.7	177.6	-176.2	0	0	0	0	112.2	K473 Q474 E480 A481	K473-S477 WeakPolarHBondContact O-CB 3.42Å; K473-S477 PolarHBondContact O-N 3.37Å; Q474-S477 WeakPolarHBondContact O-CB 3.34Å; Q474-S477 PolarHBondContact O-N 3.33Å; Q474-S477 VanDerWaalsContact O-N 3.09Å; S477-E480 PolarHBondContact O-N 2.95Å; S477-A481 WeakPolarHBondContact O-CB 3.39Å; S477-A481 PolarHBondContact O-N 3.47Å
478	D	93.1	Very high	89.7	Confident	71 Å²	71	100.4 Å²	100.4	38%	0.38	50%	0.503	S	S	.	.	H	α-helix	trans	-66.5	-42.4	179.5	-62.6	-18.1	0	0	0	111.2	Q474 H475 E480 A481 L482	Q474-D478 PolarHBondContact NE2-OD1 3.09Å; Q474-D478 VanDerWaalsContact O-CG 3.22Å; Q474-D478 PolarHBondContact O-N 3.14Å; H475-D478 PolarHBondContact O-N 2.94Å; D478-E480 VanDerWaalsContact C-N 3.31Å; D478-E480 PolarHBondContact O-N 2.86Å; D478-A481 PolarHBondContact O-N 3.29Å; D478-L482 WeakPolarHBondContact O-CG 3.48Å; D478-L482 PolarHBondContact O-N 2.92Å
479	V	96.3	Very high	91.2	Very high	49 Å²	49	101.1 Å²	101.1	30%	0.297	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-39	174.9	169.7	0	0	0	0	111.1	H475 Q476 K483	H475-V479 WeakPolarHBondContact O-CB 3.34Å; H475-V479 VanDerWaalsContact O-CG2 3.26Å; H475-V479 WeakPolarHBondContact O-CG2 3.46Å; H475-V479 PolarHBondContact O-N 3.14Å; Q476-V479 PolarHBondContact O-N 3.45Å; V479-K483 HydrophobicContact CG1-CD 4.28Å; V479-K483 WeakPolarHBondContact O-CB 3.47Å; V479-K483 VanDerWaalsContact O-CG 3.26Å; V479-K483 WeakPolarHBondContact O-CG 3.41Å; V479-K483 PolarHBondContact O-N 2.91Å
480	E	96.1	Very high	92.4	Very high	77 Å²	77	99.3 Å²	99.3	36%	0.36	50%	0.497	S	S	.	.	H	α-helix	trans	-68	-38.2	174.7	-74.2	176.3	-163.9	0	0	112.5	Q476 S477 D478 K483 R484	Q476-E480 WeakPolarHBondContact O-CB 3.36Å; Q476-E480 VanDerWaalsContact O-CG 3.3Å; Q476-E480 WeakPolarHBondContact O-CG 3.32Å; Q476-E480 PolarHBondContact O-N 3.27Å; S477-E480 PolarHBondContact O-N 2.95Å; D478-E480 VanDerWaalsContact C-N 3.31Å; D478-E480 PolarHBondContact O-N 2.86Å; E480-K483 PolarHBondContact O-N 2.93Å; E480-R484 VanDerWaalsContact C-NH1 3.31Å; E480-R484 WeakPolarHBondContact O-CG 3.46Å; E480-R484 PolarHBondContact O-N 3.48Å; E480-R484 VanDerWaalsContact O-N 3.09Å; E480-R484 PolarHBondContact O-NH1 2.97Å; E480-R484 IonicContact OE2-NH2 3.66Å; E480-R484 PolarHBondContact OE2-NH2 3.28Å
481	A	96.5	Very high	93.3	Very high	34 Å²	34	102.5 Å²	102.5	28%	0.281	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-49.6	174.4	0	0	0	0	0	111.1	S477 D478 K483 R484 E485	S477-A481 WeakPolarHBondContact O-CB 3.39Å; S477-A481 PolarHBondContact O-N 3.47Å; D478-A481 PolarHBondContact O-N 3.29Å; A481-K483 VanDerWaalsContact C-N 3.3Å; A481-K483 PolarHBondContact O-N 3.27Å; A481-R484 WeakPolarHBondContact O-CB 3.4Å; A481-R484 PolarHBondContact O-N 3.4Å; A481-R484 VanDerWaalsContact O-N 3.08Å; A481-E485 PolarHBondContact O-N 3.07Å
482	L	96.9	Very high	94.2	Very high	109 Å²	109	104.3 Å²	104.3	57%	0.571	51%	0.509	S	S	*	.	H	α-helix	trans	-60.8	-37.2	177.1	-70.2	173.4	0	0	0	112.7	D478 E485 L486	D478-L482 WeakPolarHBondContact O-CG 3.48Å; D478-L482 PolarHBondContact O-N 2.92Å; L482-E485 PolarHBondContact O-N 3.21Å; L482-L486 VanDerWaalsContact O-CB 3.3Å; L482-L486 WeakPolarHBondContact O-CB 3.27Å; L482-L486 PolarHBondContact O-N 2.96Å
483	K	96.4	Very high	95.1	Very high	137 Å²	137	104 Å²	104	60%	0.596	51%	0.509	S	S	*	.	H	α-helix	trans	-63.1	-42	174.3	-78.1	172.8	-179	177.4	0	112	V479 E480 A481 Q487	V479-K483 HydrophobicContact CG1-CD 4.28Å; V479-K483 WeakPolarHBondContact O-CB 3.47Å; V479-K483 VanDerWaalsContact O-CG 3.26Å; V479-K483 WeakPolarHBondContact O-CG 3.41Å; V479-K483 PolarHBondContact O-N 2.91Å; E480-K483 PolarHBondContact O-N 2.93Å; A481-K483 VanDerWaalsContact C-N 3.3Å; A481-K483 PolarHBondContact O-N 3.27Å; K483-Q487 WeakPolarHBondContact O-CB 3.48Å; K483-Q487 PolarHBondContact O-N 3.4Å
484	R	97.5	Very high	95.7	Very high	135 Å²	135	99.6 Å²	99.6	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-44.7	176.6	-67.7	178.8	-157.1	98.8	2.6	111.1	E480 A481 Q487 V488	E480-R484 VanDerWaalsContact C-NH1 3.31Å; E480-R484 WeakPolarHBondContact O-CG 3.46Å; E480-R484 PolarHBondContact O-N 3.48Å; E480-R484 VanDerWaalsContact O-N 3.09Å; E480-R484 PolarHBondContact O-NH1 2.97Å; E480-R484 IonicContact OE2-NH2 3.66Å; E480-R484 PolarHBondContact OE2-NH2 3.28Å; A481-R484 WeakPolarHBondContact O-CB 3.4Å; A481-R484 PolarHBondContact O-N 3.4Å; A481-R484 VanDerWaalsContact O-N 3.08Å; R484-Q487 PolarHBondContact O-N 3.47Å; R484-V488 WeakPolarHBondContact O-CG2 3.4Å; R484-V488 PolarHBondContact O-N 2.94Å
485	E	97.4	Very high	96.3	Very high	119 Å²	119	100.2 Å²	100.2	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-61	-46.1	176.9	-72	176	-162.8	0	0	111.9	A481 L482 Q487 V488 L489	A481-E485 PolarHBondContact O-N 3.07Å; L482-E485 PolarHBondContact O-N 3.21Å; E485-Q487 VanDerWaalsContact C-N 3.3Å; E485-Q487 PolarHBondContact O-N 2.82Å; E485-V488 PolarHBondContact O-N 2.96Å; E485-L489 WeakPolarHBondContact O-CB 3.36Å; E485-L489 WeakPolarHBondContact O-CG 3.47Å; E485-L489 PolarHBondContact O-N 2.97Å
486	L	98.1	Very high	96.8	Very high	123 Å²	123	99.3 Å²	99.3	64%	0.644	50%	0.495	S	S	*	.	H	α-helix	trans	-61.6	-39.4	176.5	-177	64.5	0	0	0	111.8	L482 L489 S490	L482-L486 VanDerWaalsContact O-CB 3.3Å; L482-L486 WeakPolarHBondContact O-CB 3.27Å; L482-L486 PolarHBondContact O-N 2.96Å; L486-L489 PolarHBondContact O-N 3.23Å; L486-S490 VanDerWaalsContact O-CB 3.3Å; L486-S490 WeakPolarHBondContact O-CB 3.5Å; L486-S490 PolarHBondContact O-N 3.01Å
487	Q	97.9	Very high	97	Very high	115 Å²	115	96.4 Å²	96.4	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-47.6	177	-176.7	175.3	-11.5	0	0	111.3	K483 R484 E485 L489 S490 E491	K483-Q487 WeakPolarHBondContact O-CB 3.48Å; K483-Q487 PolarHBondContact O-N 3.4Å; R484-Q487 PolarHBondContact O-N 3.47Å; E485-Q487 VanDerWaalsContact C-N 3.3Å; E485-Q487 PolarHBondContact O-N 2.82Å; Q487-L489 VanDerWaalsContact C-N 3.33Å; Q487-L489 PolarHBondContact O-N 3.17Å; Q487-S490 WeakPolarHBondContact O-CB 3.47Å; Q487-S490 PolarHBondContact O-N 2.99Å; Q487-E491 WeakPolarHBondContact CG-OE1 3.33Å; Q487-E491 PolarHBondContact NE2-OE1 3.18Å; Q487-E491 WeakPolarHBondContact O-CG 3.32Å; Q487-E491 PolarHBondContact O-N 3.44Å
488	V	97.8	Very high	97.3	Very high	70 Å²	70	99 Å²	99	42%	0.424	50%	0.496	S	S	.	.	H	α-helix	trans	-60.2	-43.8	176.8	171.1	0	0	0	0	111	R484 E485 E491 Q492	R484-V488 WeakPolarHBondContact O-CG2 3.4Å; R484-V488 PolarHBondContact O-N 2.94Å; E485-V488 PolarHBondContact O-N 2.96Å; V488-E491 PolarHBondContact O-N 3.02Å; V488-Q492 VanDerWaalsContact CG1-NE2 3.28Å; V488-Q492 WeakPolarHBondContact O-CB 3.44Å; V488-Q492 VanDerWaalsContact O-CG 3.29Å; V488-Q492 WeakPolarHBondContact O-CG 3.43Å; V488-Q492 PolarHBondContact O-N 3.01Å
489	L	97.8	Very high	97.5	Very high	106 Å²	106	99.8 Å²	99.8	56%	0.555	50%	0.497	S	S	*	.	H	α-helix	trans	-64.1	-40.9	176.6	-73.4	171.9	0	0	0	112.3	E485 L486 Q487 Q492 Y493	E485-L489 WeakPolarHBondContact O-CB 3.36Å; E485-L489 WeakPolarHBondContact O-CG 3.47Å; E485-L489 PolarHBondContact O-N 2.97Å; L486-L489 PolarHBondContact O-N 3.23Å; Q487-L489 VanDerWaalsContact C-N 3.33Å; Q487-L489 PolarHBondContact O-N 3.17Å; L489-Q492 PolarHBondContact O-N 3.38Å; L489-Y493 WeakPolarHBondContact O-CB 3.45Å; L489-Y493 PolarHBondContact O-N 3.48Å
490	S	97.6	Very high	97.6	Very high	73 Å²	73	101.7 Å²	101.7	51%	0.51	50%	0.504	S	S	.	.	H	α-helix	trans	-63.2	-42.7	175.9	-177.8	0	0	0	0	111.6	L486 Q487 Y493 S494	L486-S490 VanDerWaalsContact O-CB 3.3Å; L486-S490 WeakPolarHBondContact O-CB 3.5Å; L486-S490 PolarHBondContact O-N 3.01Å; Q487-S490 WeakPolarHBondContact O-CB 3.47Å; Q487-S490 PolarHBondContact O-N 2.99Å; S490-Y493 PolarHBondContact O-N 3.03Å; S490-S494 WeakPolarHBondContact O-CB 3.46Å; S490-S494 PolarHBondContact O-N 3.5Å; S490-S494 PolarHBondContact O-OG 3.33Å
491	E	97.9	Very high	97.7	Very high	103 Å²	103	99.3 Å²	99.3	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-62.8	-48.4	176	-74.4	171.3	-166.6	0	0	110.7	Q487 V488 Y493 S494 Q495	Q487-E491 WeakPolarHBondContact CG-OE1 3.33Å; Q487-E491 PolarHBondContact NE2-OE1 3.18Å; Q487-E491 WeakPolarHBondContact O-CG 3.32Å; Q487-E491 PolarHBondContact O-N 3.44Å; V488-E491 PolarHBondContact O-N 3.02Å; E491-Y493 VanDerWaalsContact C-N 3.34Å; E491-Y493 PolarHBondContact O-N 3.19Å; E491-S494 PolarHBondContact O-N 2.93Å; E491-S494 PolarHBondContact O-OG 2.91Å; E491-Q495 WeakPolarHBondContact O-CB 3.43Å; E491-Q495 PolarHBondContact O-N 2.76Å
492	Q	97.4	Very high	97.8	Very high	123 Å²	123	99.8 Å²	99.8	58%	0.575	51%	0.505	S	S	*	.	H	α-helix	trans	-60.2	-41.8	176.4	-72	179.6	26.4	0	0	112.5	V488 L489 Q495 K496	V488-Q492 VanDerWaalsContact CG1-NE2 3.28Å; V488-Q492 WeakPolarHBondContact O-CB 3.44Å; V488-Q492 VanDerWaalsContact O-CG 3.29Å; V488-Q492 WeakPolarHBondContact O-CG 3.43Å; V488-Q492 PolarHBondContact O-N 3.01Å; L489-Q492 PolarHBondContact O-N 3.38Å; Q492-Q495 PolarHBondContact O-N 3.04Å; Q492-K496 WeakPolarHBondContact O-CB 3.43Å; Q492-K496 PolarHBondContact O-N 3.35Å
493	Y	97.9	Very high	97.8	Very high	174 Å²	174	99 Å²	99	68%	0.682	50%	0.501	S	S	*	.	H	α-helix	trans	-63.9	-45.4	176.6	-173.5	-95.9	0	0	0	111.3	L489 S490 E491 Q495 K496 C497	L489-Y493 WeakPolarHBondContact O-CB 3.45Å; L489-Y493 PolarHBondContact O-N 3.48Å; S490-Y493 PolarHBondContact O-N 3.03Å; E491-Y493 VanDerWaalsContact C-N 3.34Å; E491-Y493 PolarHBondContact O-N 3.19Å; Y493-Q495 VanDerWaalsContact C-N 3.32Å; Y493-Q495 PolarHBondContact O-N 2.81Å; Y493-K496 WeakPolarHBondContact O-CB 3.32Å; Y493-K496 PolarHBondContact O-N 3.07Å; Y493-K496 VanDerWaalsContact O-N 3.15Å; Y493-C497 VanDerWaalsContact CE1-SG 3.55Å; Y493-C497 PolarHBondContact O-N 3.01Å; Y493-C497 PolarHBondContact O-SG 3.49Å; Y493-C497 VanDerWaalsContact O-SG 3.34Å
494	S	97.9	Very high	97.9	Very high	61 Å²	61	95.6 Å²	95.6	43%	0.427	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-41.1	177.2	74.6	0	0	0	0	112.1	S490 E491 K496 C497 L498	S490-S494 WeakPolarHBondContact O-CB 3.46Å; S490-S494 PolarHBondContact O-N 3.5Å; S490-S494 PolarHBondContact O-OG 3.33Å; E491-S494 PolarHBondContact O-N 2.93Å; E491-S494 PolarHBondContact O-OG 2.91Å; S494-K496 VanDerWaalsContact C-N 3.33Å; S494-K496 PolarHBondContact O-N 2.75Å; S494-C497 WeakPolarHBondContact O-CB 3.42Å; S494-C497 PolarHBondContact O-N 3.31Å; S494-L498 WeakPolarHBondContact O-CG 3.38Å; S494-L498 PolarHBondContact O-N 2.94Å; S494-L498 VanDerWaalsContact O-N 3.08Å
495	Q	98	Very high	97.9	Very high	122 Å²	122	96.2 Å²	96.2	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-62.9	-41.2	175.1	-175.9	60.7	24.6	0	0	111.1	E491 Q492 Y493 C497 L498 E499	E491-Q495 WeakPolarHBondContact O-CB 3.43Å; E491-Q495 PolarHBondContact O-N 2.76Å; Q492-Q495 PolarHBondContact O-N 3.04Å; Y493-Q495 VanDerWaalsContact C-N 3.32Å; Y493-Q495 PolarHBondContact O-N 2.81Å; Q495-C497 VanDerWaalsContact C-N 3.35Å; Q495-C497 PolarHBondContact O-N 3.45Å; Q495-L498 PolarHBondContact O-N 3.5Å; Q495-E499 PolarHBondContact O-N 3.39Å
496	K	98.1	Very high	98	Very high	106 Å²	106	94.4 Å²	94.4	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-64.1	-39.6	176.4	-164.2	72.1	-167.3	166.5	0	111.9	Q492 Y493 S494 L498 E499 I500	Q492-K496 WeakPolarHBondContact O-CB 3.43Å; Q492-K496 PolarHBondContact O-N 3.35Å; Y493-K496 WeakPolarHBondContact O-CB 3.32Å; Y493-K496 PolarHBondContact O-N 3.07Å; Y493-K496 VanDerWaalsContact O-N 3.15Å; S494-K496 VanDerWaalsContact C-N 3.33Å; S494-K496 PolarHBondContact O-N 2.75Å; K496-L498 VanDerWaalsContact C-N 3.33Å; K496-L498 PolarHBondContact O-N 2.98Å; K496-E499 WeakPolarHBondContact CD-OE2 3.2Å; K496-E499 WeakPolarHBondContact CE-OE2 3.39Å; K496-E499 IonicContact NZ-OE1 3.25Å; K496-E499 IonicContact NZ-OE2 3.99Å; K496-E499 PolarHBondContact NZ-OE2 2.99Å; K496-E499 PolarHBondContact O-N 2.73Å; K496-I500 HydrophobicContact CG-CD1 4.11Å; K496-I500 VanDerWaalsContact O-CG1 3.26Å; K496-I500 WeakPolarHBondContact O-CG1 3.41Å; K496-I500 PolarHBondContact O-N 3.14Å
497	C	97.8	Very high	97.9	Very high	59 Å²	59	91.2 Å²	91.2	40%	0.399	48%	0.476	S	S	.	.	H	α-helix	trans	-60.9	-41.4	174.1	-67.4	0	0	0	0	112.2	Y493 S494 Q495 G501	Y493-C497 VanDerWaalsContact CE1-SG 3.55Å; Y493-C497 PolarHBondContact O-N 3.01Å; Y493-C497 PolarHBondContact O-SG 3.49Å; Y493-C497 VanDerWaalsContact O-SG 3.34Å; S494-C497 WeakPolarHBondContact O-CB 3.42Å; S494-C497 PolarHBondContact O-N 3.31Å; Q495-C497 VanDerWaalsContact C-N 3.35Å; Q495-C497 PolarHBondContact O-N 3.45Å; C497-G501 PolarHBondContact O-N 3.07Å
498	L	98.3	Very high	97.9	Very high	114 Å²	114	90.3 Å²	90.3	60%	0.597	47%	0.472	S	S	*	.	H	α-helix	trans	-65.4	-42.4	176.5	-67.5	175.5	0	0	0	112.1	S494 Q495 K496 G501 A502	S494-L498 WeakPolarHBondContact O-CG 3.38Å; S494-L498 PolarHBondContact O-N 2.94Å; S494-L498 VanDerWaalsContact O-N 3.08Å; Q495-L498 PolarHBondContact O-N 3.5Å; K496-L498 VanDerWaalsContact C-N 3.33Å; K496-L498 PolarHBondContact O-N 2.98Å; L498-G501 PolarHBondContact O-N 3.36Å; L498-A502 PolarHBondContact O-N 3.1Å
499	E	98.2	Very high	97.9	Very high	87 Å²	87	92.9 Å²	92.9	41%	0.407	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-47.8	176.1	-171.1	-169.2	177.6	0	0	111.3	Q495 K496 G501 A502 L503	Q495-E499 PolarHBondContact O-N 3.39Å; K496-E499 WeakPolarHBondContact CD-OE2 3.2Å; K496-E499 WeakPolarHBondContact CE-OE2 3.39Å; K496-E499 IonicContact NZ-OE1 3.25Å; K496-E499 IonicContact NZ-OE2 3.99Å; K496-E499 PolarHBondContact NZ-OE2 2.99Å; K496-E499 PolarHBondContact O-N 2.73Å; E499-G501 VanDerWaalsContact C-N 3.31Å; E499-G501 PolarHBondContact O-N 3.37Å; E499-A502 PolarHBondContact O-N 2.94Å; E499-A502 VanDerWaalsContact O-N 3.14Å; E499-L503 HydrophobicContact CG-CD1 4.26Å; E499-L503 WeakPolarHBondContact O-CG 3.36Å; E499-L503 PolarHBondContact O-N 2.89Å
500	I	97.9	Very high	97.9	Very high	88 Å²	88	94.4 Å²	94.4	45%	0.451	48%	0.478	S	S	.	.	H	α-helix	trans	-58	-46.8	176	-68.5	165.8	0	0	0	109.9	K496 A502 L503 T504	K496-I500 HydrophobicContact CG-CD1 4.11Å; K496-I500 VanDerWaalsContact O-CG1 3.26Å; K496-I500 WeakPolarHBondContact O-CG1 3.41Å; K496-I500 PolarHBondContact O-N 3.14Å; I500-A502 VanDerWaalsContact C-N 3.29Å; I500-A502 PolarHBondContact O-N 3.38Å; I500-L503 PolarHBondContact O-N 3.45Å; I500-T504 PolarHBondContact O-N 2.84Å; I500-T504 PolarHBondContact O-OG1 2.86Å
501	G	98.2	Very high	98	Very high	27 Å²	27	95.3 Å²	95.3	28%	0.278	47%	0.474	S	S	.	.	H	α-helix	trans	-62.5	-32.4	178	0	0	0	0	0	113.9	C497 L498 E499 R505	C497-G501 PolarHBondContact O-N 3.07Å; L498-G501 PolarHBondContact O-N 3.36Å; E499-G501 VanDerWaalsContact C-N 3.31Å; E499-G501 PolarHBondContact O-N 3.37Å; G501-R505 WeakPolarHBondContact O-CG 3.33Å; G501-R505 PolarHBondContact O-N 3.32Å; G501-R505 PolarHBondContact O-NE 3.39Å
502	A	98.1	Very high	98	Very high	45 Å²	45	95.8 Å²	95.8	37%	0.372	48%	0.476	S	S	.	.	H	α-helix	trans	-71.3	-43.5	173.6	0	0	0	0	0	111.8	L498 E499 I500 R505 Q506	L498-A502 PolarHBondContact O-N 3.1Å; E499-A502 PolarHBondContact O-N 2.94Å; E499-A502 VanDerWaalsContact O-N 3.14Å; I500-A502 VanDerWaalsContact C-N 3.29Å; I500-A502 PolarHBondContact O-N 3.38Å; A502-R505 PolarHBondContact O-N 2.86Å; A502-Q506 PolarHBondContact O-N 3.38Å
503	L	98.2	Very high	98	Very high	93 Å²	93	92.9 Å²	92.9	49%	0.487	47%	0.467	S	S	.	.	H	α-helix	trans	-63.8	-40	176.8	-69.1	172.9	0	0	0	111.9	E499 I500 Q506 A507	E499-L503 HydrophobicContact CG-CD1 4.26Å; E499-L503 WeakPolarHBondContact O-CG 3.36Å; E499-L503 PolarHBondContact O-N 2.89Å; I500-L503 PolarHBondContact O-N 3.45Å; L503-Q506 PolarHBondContact O-N 2.91Å; L503-A507 WeakPolarHBondContact O-CB 3.4Å; L503-A507 PolarHBondContact O-N 3.32Å
504	T	98	Very high	98	Very high	65 Å²	65	89.7 Å²	89.7	40%	0.399	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-48.6	175.4	-59.5	0	0	0	0	111.3	I500 Q506 A507 E508	I500-T504 PolarHBondContact O-N 2.84Å; I500-T504 PolarHBondContact O-OG1 2.86Å; T504-Q506 VanDerWaalsContact C-N 3.31Å; T504-Q506 PolarHBondContact O-N 3.27Å; T504-A507 WeakPolarHBondContact O-CB 3.27Å; T504-A507 PolarHBondContact O-N 3.47Å; T504-A507 VanDerWaalsContact O-N 3.08Å; T504-E508 WeakPolarHBondContact O-CG 3.29Å; T504-E508 PolarHBondContact O-N 3.06Å
505	R	98	Very high	98	Very high	147 Å²	147	92 Å²	92	56%	0.555	46%	0.461	S	S	*	.	H	α-helix	trans	-58.2	-43.5	176	-78.1	178.5	-80.1	138.4	-10.2	112	G501 A502 A507 E508 E509	G501-R505 WeakPolarHBondContact O-CG 3.33Å; G501-R505 PolarHBondContact O-N 3.32Å; G501-R505 PolarHBondContact O-NE 3.39Å; A502-R505 PolarHBondContact O-N 2.86Å; R505-A507 VanDerWaalsContact C-N 3.3Å; R505-A507 PolarHBondContact O-N 3.01Å; R505-E508 PolarHBondContact O-N 2.83Å; R505-E509 WeakPolarHBondContact O-CG 3.48Å; R505-E509 PolarHBondContact O-N 3.16Å
506	Q	98	Very high	98	Very high	82 Å²	82	92.5 Å²	92.5	38%	0.383	46%	0.457	S	S	.	.	H	α-helix	trans	-64.7	-34.7	177.2	-158.2	-169.3	38	0	0	112.4	A502 L503 T504 R510	A502-Q506 PolarHBondContact O-N 3.38Å; L503-Q506 PolarHBondContact O-N 2.91Å; T504-Q506 VanDerWaalsContact C-N 3.31Å; T504-Q506 PolarHBondContact O-N 3.27Å; Q506-R510 VanDerWaalsContact CD-CZ 3.49Å; Q506-R510 VanDerWaalsContact CD-NH2 3.28Å; Q506-R510 VanDerWaalsContact CG-NH1 3.31Å; Q506-R510 WeakPolarHBondContact O-CG 3.45Å; Q506-R510 PolarHBondContact O-N 2.92Å; Q506-R510 VanDerWaalsContact O-N 3.14Å
507	A	97.2	Very high	97.9	Very high	55 Å²	55	90.5 Å²	90.5	46%	0.455	46%	0.456	S	S	.	.	H	α-helix	trans	-68	-44.1	175.1	0	0	0	0	0	111.5	L503 T504 R505 R510 E511	L503-A507 WeakPolarHBondContact O-CB 3.4Å; L503-A507 PolarHBondContact O-N 3.32Å; T504-A507 WeakPolarHBondContact O-CB 3.27Å; T504-A507 PolarHBondContact O-N 3.47Å; T504-A507 VanDerWaalsContact O-N 3.08Å; R505-A507 VanDerWaalsContact C-N 3.3Å; R505-A507 PolarHBondContact O-N 3.01Å; A507-R510 PolarHBondContact O-N 2.94Å; A507-E511 PolarHBondContact O-N 3.38Å
508	E	98.3	Very high	97.9	Very high	96 Å²	96	93.5 Å²	93.5	45%	0.449	46%	0.464	S	S	.	.	H	α-helix	trans	-60.2	-45.9	175.5	-70.4	170	176.9	0	0	111.3	T504 R505 R510 E511 H512	T504-E508 WeakPolarHBondContact O-CG 3.29Å; T504-E508 PolarHBondContact O-N 3.06Å; R505-E508 PolarHBondContact O-N 2.83Å; E508-R510 VanDerWaalsContact C-N 3.33Å; E508-R510 PolarHBondContact O-N 2.9Å; E508-E511 PolarHBondContact O-N 2.98Å; E508-E511 VanDerWaalsContact O-N 3.16Å; E508-H512 PolarHBondContact O-CD2 3.41Å; E508-H512 PolarHBondContact O-N 3.49Å
509	E	98.2	Very high	97.9	Very high	125 Å²	125	93.4 Å²	93.4	58%	0.584	46%	0.461	S	S	*	.	H	α-helix	trans	-59.7	-41.1	176.3	-74.4	171.5	-174.1	0	0	112.6	R505 H512 T513	R505-E509 WeakPolarHBondContact O-CG 3.48Å; R505-E509 PolarHBondContact O-N 3.16Å; E509-H512 PolarHBondContact O-N 2.92Å; E509-T513 WeakPolarHBondContact O-CB 3.44Å; E509-T513 PolarHBondContact O-N 2.93Å; E509-T513 PolarHBondContact O-OG1 2.93Å
510	R	97.6	Very high	97.9	Very high	138 Å²	138	93.7 Å²	93.7	52%	0.521	46%	0.462	S	S	.	.	H	α-helix	trans	-64.9	-42.4	174.4	-75.8	-175.3	-178.4	107	2.7	111.4	Q506 A507 E508 T513 L514	Q506-R510 VanDerWaalsContact CD-CZ 3.49Å; Q506-R510 VanDerWaalsContact CD-NH2 3.28Å; Q506-R510 VanDerWaalsContact CG-NH1 3.31Å; Q506-R510 WeakPolarHBondContact O-CG 3.45Å; Q506-R510 PolarHBondContact O-N 2.92Å; Q506-R510 VanDerWaalsContact O-N 3.14Å; A507-R510 PolarHBondContact O-N 2.94Å; E508-R510 VanDerWaalsContact C-N 3.33Å; E508-R510 PolarHBondContact O-N 2.9Å; R510-T513 PolarHBondContact O-N 2.97Å; R510-L514 VanDerWaalsContact O-CG 3.32Å; R510-L514 WeakPolarHBondContact O-CG 3.46Å; R510-L514 PolarHBondContact O-N 3.36Å
511	E	98	Very high	97.8	Very high	91 Å²	91	90.9 Å²	90.9	43%	0.425	46%	0.455	S	S	.	.	H	α-helix	trans	-63.8	-44.1	177	-169.1	-178.6	-174.9	0	0	111.7	A507 E508 T513 L514 R515	A507-E511 PolarHBondContact O-N 3.38Å; E508-E511 PolarHBondContact O-N 2.98Å; E508-E511 VanDerWaalsContact O-N 3.16Å; E511-T513 VanDerWaalsContact C-N 3.31Å; E511-T513 PolarHBondContact O-N 3.43Å; E511-L514 PolarHBondContact O-N 2.88Å; E511-R515 WeakPolarHBondContact O-CG 3.47Å; E511-R515 PolarHBondContact O-N 3.39Å; E511-R515 IonicContact OE1-CZ 3.02Å; E511-R515 VanDerWaalsContact OE1-CZ 3.25Å; E511-R515 IonicContact OE1-NE 3.46Å; E511-R515 PolarHBondContact OE1-NE 2.77Å; E511-R515 IonicContact OE1-NH2 2.8Å; E511-R515 PolarHBondContact OE1-NH2 3.48Å; E511-R515 IonicContact OE2-CZ 3.02Å; E511-R515 IonicContact OE2-NH2 3.58Å; E511-R515 PolarHBondContact OE2-NH2 2.98Å
512	H	98.4	Very high	97.8	Very high	114 Å²	114	96 Å²	96	53%	0.528	47%	0.472	S	S	.	.	H	α-helix	trans	-58.7	-43.3	174.2	-79	-64.4	0	0	0	112	E508 E509 R515 R516	E508-H512 PolarHBondContact O-CD2 3.41Å; E508-H512 PolarHBondContact O-N 3.49Å; E509-H512 PolarHBondContact O-N 2.92Å; H512-R515 PolarHBondContact O-N 3.32Å; H512-R516 PolarHBondContact O-N 2.89Å
513	T	98	Very high	97.8	Very high	62 Å²	62	99.5 Å²	99.5	38%	0.38	48%	0.48	S	S	.	.	H	α-helix	trans	-63.8	-43.4	176.6	-59.7	0	0	0	0	111.6	E509 R510 E511 R516 C517	E509-T513 WeakPolarHBondContact O-CB 3.44Å; E509-T513 PolarHBondContact O-N 2.93Å; E509-T513 PolarHBondContact O-OG1 2.93Å; R510-T513 PolarHBondContact O-N 2.97Å; E511-T513 VanDerWaalsContact C-N 3.31Å; E511-T513 PolarHBondContact O-N 3.43Å; T513-R516 PolarHBondContact O-N 3.34Å; T513-C517 PolarHBondContact O-N 2.91Å; T513-C517 PolarHBondContact O-SG 3.45Å; T513-C517 VanDerWaalsContact O-SG 3.39Å
514	L	97.8	Very high	97.7	Very high	107 Å²	107	100.9 Å²	100.9	56%	0.56	49%	0.488	S	S	*	.	H	α-helix	trans	-61.3	-45.7	176	-74.5	170.1	0	0	0	111.8	R510 E511 R516 C517 Q518	R510-L514 VanDerWaalsContact O-CG 3.32Å; R510-L514 WeakPolarHBondContact O-CG 3.46Å; R510-L514 PolarHBondContact O-N 3.36Å; E511-L514 PolarHBondContact O-N 2.88Å; L514-R516 VanDerWaalsContact C-N 3.32Å; L514-R516 PolarHBondContact O-N 3.22Å; L514-C517 PolarHBondContact O-N 2.87Å; L514-Q518 VanDerWaalsContact O-CG 3.32Å; L514-Q518 WeakPolarHBondContact O-CG 3.44Å; L514-Q518 PolarHBondContact O-N 2.92Å
515	R	98.2	Very high	97.7	Very high	110 Å²	110	103 Å²	103	42%	0.415	50%	0.496	S	S	.	.	H	α-helix	trans	-59.3	-42.8	176.6	-72.4	174.3	-174.5	161.6	-3.4	111.6	E511 H512 Q518 Q519	E511-R515 WeakPolarHBondContact O-CG 3.47Å; E511-R515 PolarHBondContact O-N 3.39Å; E511-R515 IonicContact OE1-CZ 3.02Å; E511-R515 VanDerWaalsContact OE1-CZ 3.25Å; E511-R515 IonicContact OE1-NE 3.46Å; E511-R515 PolarHBondContact OE1-NE 2.77Å; E511-R515 IonicContact OE1-NH2 2.8Å; E511-R515 PolarHBondContact OE1-NH2 3.48Å; E511-R515 IonicContact OE2-CZ 3.02Å; E511-R515 IonicContact OE2-NH2 3.58Å; E511-R515 PolarHBondContact OE2-NH2 2.98Å; H512-R515 PolarHBondContact O-N 3.32Å; R515-Q518 PolarHBondContact O-N 3.34Å; R515-Q519 WeakPolarHBondContact O-CG 3.42Å; R515-Q519 PolarHBondContact O-N 3.02Å
516	R	98	Very high	97.7	Very high	131 Å²	131	103.1 Å²	103.1	49%	0.494	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-48.5	175.6	-175	179.5	62.4	-137.6	-6.2	111.5	H512 T513 L514 Q518 Q519 E520	H512-R516 PolarHBondContact O-N 2.89Å; T513-R516 PolarHBondContact O-N 3.34Å; L514-R516 VanDerWaalsContact C-N 3.32Å; L514-R516 PolarHBondContact O-N 3.22Å; R516-Q518 VanDerWaalsContact C-N 3.27Å; R516-Q518 PolarHBondContact O-N 3.46Å; R516-Q519 PolarHBondContact O-N 3.43Å; R516-Q519 VanDerWaalsContact O-N 3.17Å; R516-E520 WeakPolarHBondContact CG-OE1 3.33Å; R516-E520 IonicContact NE-OE1 2.77Å; R516-E520 WeakPolarHBondContact O-CG 3.45Å; R516-E520 PolarHBondContact O-N 2.99Å
517	C	96.4	Very high	97.7	Very high	65 Å²	65	103.6 Å²	103.6	44%	0.439	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-34.5	177.2	-68.1	0	0	0	0	112.7	T513 L514 G521	T513-C517 PolarHBondContact O-N 2.91Å; T513-C517 PolarHBondContact O-SG 3.45Å; T513-C517 VanDerWaalsContact O-SG 3.39Å; L514-C517 PolarHBondContact O-N 2.87Å; C517-G521 PolarHBondContact O-N 3.45Å
518	Q	97.1	Very high	97.7	Very high	121 Å²	121	104.9 Å²	104.9	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-66	-43.4	174.2	-74.7	174.1	3.8	0	0	111.9	L514 R515 R516 G521 Q522	L514-Q518 VanDerWaalsContact O-CG 3.32Å; L514-Q518 WeakPolarHBondContact O-CG 3.44Å; L514-Q518 PolarHBondContact O-N 2.92Å; R515-Q518 PolarHBondContact O-N 3.34Å; R516-Q518 VanDerWaalsContact C-N 3.27Å; R516-Q518 PolarHBondContact O-N 3.46Å; Q518-G521 PolarHBondContact O-N 2.86Å; Q518-Q522 WeakPolarHBondContact O-CG 3.37Å; Q518-Q522 PolarHBondContact O-N 3.04Å
519	Q	98.2	Very high	97.6	Very high	113 Å²	113	106.6 Å²	106.6	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-62.1	-48.4	176.1	-72.1	170.4	-9.1	0	0	111.1	R515 R516 G521 Q522 E523	R515-Q519 WeakPolarHBondContact O-CG 3.42Å; R515-Q519 PolarHBondContact O-N 3.02Å; R516-Q519 PolarHBondContact O-N 3.43Å; R516-Q519 VanDerWaalsContact O-N 3.17Å; Q519-G521 VanDerWaalsContact C-N 3.28Å; Q519-G521 PolarHBondContact O-N 3.33Å; Q519-Q522 WeakPolarHBondContact O-CB 3.34Å; Q519-Q522 PolarHBondContact O-N 3.04Å; Q519-Q522 VanDerWaalsContact O-N 3.1Å; Q519-E523 WeakPolarHBondContact O-CG 3.32Å; Q519-E523 PolarHBondContact O-N 3.05Å
520	E	97.6	Very high	97.6	Very high	92 Å²	92	104.2 Å²	104.2	43%	0.43	49%	0.494	S	S	.	.	H	α-helix	trans	-57.1	-42.6	174.8	-70.5	169.4	-173.3	0	0	111.2	R516 Q522 E523 L524	R516-E520 WeakPolarHBondContact CG-OE1 3.33Å; R516-E520 IonicContact NE-OE1 2.77Å; R516-E520 WeakPolarHBondContact O-CG 3.45Å; R516-E520 PolarHBondContact O-N 2.99Å; E520-Q522 PolarHBondContact O-N 2.93Å; E520-E523 PolarHBondContact O-N 2.92Å; E520-L524 WeakPolarHBondContact O-CB 3.35Å; E520-L524 VanDerWaalsContact O-CG 3.29Å; E520-L524 WeakPolarHBondContact O-CG 3.48Å; E520-L524 PolarHBondContact O-N 3.32Å
521	G	96.8	Very high	97.6	Very high	30 Å²	30	101.2 Å²	101.2	31%	0.309	49%	0.488	S	S	.	.	H	α-helix	trans	-61.2	-42	174.8	0	0	0	0	0	113.4	C517 Q518 Q519 L525	C517-G521 PolarHBondContact O-N 3.45Å; Q518-G521 PolarHBondContact O-N 2.86Å; Q519-G521 VanDerWaalsContact C-N 3.28Å; Q519-G521 PolarHBondContact O-N 3.33Å; G521-L525 WeakPolarHBondContact O-CG 3.34Å; G521-L525 PolarHBondContact O-N 3.11Å
522	Q	97.9	Very high	97.5	Very high	134 Å²	134	102.8 Å²	102.8	63%	0.626	50%	0.495	S	S	*	.	H	α-helix	trans	-66.7	-41.3	175.9	-72.4	176.8	6.3	0	0	112.1	Q518 Q519 E520 L525 R526	Q518-Q522 WeakPolarHBondContact O-CG 3.37Å; Q518-Q522 PolarHBondContact O-N 3.04Å; Q519-Q522 WeakPolarHBondContact O-CB 3.34Å; Q519-Q522 PolarHBondContact O-N 3.04Å; Q519-Q522 VanDerWaalsContact O-N 3.1Å; E520-Q522 PolarHBondContact O-N 2.93Å; Q522-L525 PolarHBondContact O-N 2.91Å; Q522-R526 PolarHBondContact O-N 3.26Å
523	E	97.5	Very high	97.4	Very high	119 Å²	119	98.8 Å²	98.8	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-63.3	-43.1	176.4	-72.9	177.5	-178.7	0	0	111.7	Q519 E520 L525 R526 H527	Q519-E523 WeakPolarHBondContact O-CG 3.32Å; Q519-E523 PolarHBondContact O-N 3.05Å; E520-E523 PolarHBondContact O-N 2.92Å; E523-L525 VanDerWaalsContact C-N 3.35Å; E523-R526 PolarHBondContact O-N 3.05Å; E523-H527 WeakPolarHBondContact O-CB 3.38Å; E523-H527 PolarHBondContact O-N 3.18Å
524	L	97.5	Very high	97.3	Very high	122 Å²	122	102.8 Å²	102.8	64%	0.639	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-41	174.7	-73.3	173.9	0	0	0	111.9	E520 H527 N528	E520-L524 WeakPolarHBondContact O-CB 3.35Å; E520-L524 VanDerWaalsContact O-CG 3.29Å; E520-L524 WeakPolarHBondContact O-CG 3.48Å; E520-L524 PolarHBondContact O-N 3.32Å; L524-H527 PolarHBondContact O-N 3.34Å; L524-N528 VanDerWaalsContact O-CB 3.29Å; L524-N528 WeakPolarHBondContact O-CB 3.39Å; L524-N528 PolarHBondContact O-N 3Å
525	L	97.6	Very high	97.2	Very high	108 Å²	108	102.4 Å²	102.4	57%	0.565	49%	0.491	S	S	*	.	H	α-helix	trans	-61.5	-45.7	174.7	-78.4	168.4	0	0	0	111.6	G521 Q522 E523 H527 N528 Q529	G521-L525 WeakPolarHBondContact O-CG 3.34Å; G521-L525 PolarHBondContact O-N 3.11Å; Q522-L525 PolarHBondContact O-N 2.91Å; E523-L525 VanDerWaalsContact C-N 3.35Å; L525-H527 VanDerWaalsContact C-N 3.35Å; L525-H527 PolarHBondContact O-N 2.84Å; L525-N528 PolarHBondContact O-N 3.37Å; L525-Q529 WeakPolarHBondContact O-CG 3.44Å; L525-Q529 PolarHBondContact O-N 2.88Å
526	R	97.8	Very high	97.1	Very high	150 Å²	150	100 Å²	100	57%	0.566	49%	0.491	S	S	*	.	H	α-helix	trans	-60.1	-46.3	175.6	-175.5	-176.6	66.2	131.3	-3.7	111.1	Q522 E523 N528 Q529 E530	Q522-R526 PolarHBondContact O-N 3.26Å; E523-R526 PolarHBondContact O-N 3.05Å; R526-N528 VanDerWaalsContact C-N 3.3Å; R526-N528 PolarHBondContact O-N 2.65Å; R526-Q529 WeakPolarHBondContact O-CB 3.48Å; R526-Q529 PolarHBondContact O-N 3.13Å; R526-E530 IonicContact CZ-OE1 2.73Å; R526-E530 IonicContact NE-OE1 3.99Å; R526-E530 IonicContact NH1-OE1 3.7Å; R526-E530 WeakPolarHBondContact O-CG 3.3Å; R526-E530 PolarHBondContact O-N 3.27Å
527	H	97.3	Very high	97	Very high	92 Å²	92	99.3 Å²	99.3	43%	0.426	49%	0.493	S	S	.	.	H	α-helix	trans	-63.7	-38.5	178.8	-168.2	54.2	0	0	0	112	E523 L524 L525 Q529 E530 L531	E523-H527 WeakPolarHBondContact O-CB 3.38Å; E523-H527 PolarHBondContact O-N 3.18Å; L524-H527 PolarHBondContact O-N 3.34Å; L525-H527 VanDerWaalsContact C-N 3.35Å; L525-H527 PolarHBondContact O-N 2.84Å; H527-Q529 VanDerWaalsContact C-N 3.35Å; H527-E530 IonicContact ND1-OE2 2.74Å; H527-E530 PolarHBondContact O-N 2.96Å; H527-L531 WeakPolarHBondContact O-CB 3.18Å; H527-L531 WeakPolarHBondContact O-CG 3.45Å; H527-L531 PolarHBondContact O-N 3.46Å
528	N	96.9	Very high	97	Very high	83 Å²	83	101.8 Å²	101.8	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-64.4	-39.4	175.3	-168.3	-98.4	0	0	0	111.9	L524 L525 R526 L531 H532	L524-N528 VanDerWaalsContact O-CB 3.29Å; L524-N528 WeakPolarHBondContact O-CB 3.39Å; L524-N528 PolarHBondContact O-N 3Å; L525-N528 PolarHBondContact O-N 3.37Å; R526-N528 VanDerWaalsContact C-N 3.3Å; R526-N528 PolarHBondContact O-N 2.65Å; N528-L531 PolarHBondContact O-N 2.97Å; N528-H532 WeakPolarHBondContact O-CB 3.45Å; N528-H532 PolarHBondContact O-CD2 3.25Å; N528-H532 VanDerWaalsContact O-CD2 3.29Å; N528-H532 PolarHBondContact O-N 2.88Å; N528-H532 PolarHBondContact OD1-CD2 3.16Å; N528-H532 PolarHBondContact OD1-NE2 3.3Å
529	Q	97.2	Very high	96.8	Very high	131 Å²	131	99.4 Å²	99.4	61%	0.612	49%	0.489	S	S	*	.	H	α-helix	trans	-64.2	-43.7	172.9	-70.7	169.1	7.9	0	0	112.1	L525 R526 H527 H532 G533	L525-Q529 WeakPolarHBondContact O-CG 3.44Å; L525-Q529 PolarHBondContact O-N 2.88Å; R526-Q529 WeakPolarHBondContact O-CB 3.48Å; R526-Q529 PolarHBondContact O-N 3.13Å; H527-Q529 VanDerWaalsContact C-N 3.35Å; Q529-H532 PolarHBondContact O-N 3.47Å; Q529-G533 PolarHBondContact O-N 2.61Å
530	E	97.5	Very high	96.5	Very high	75 Å²	75	98.6 Å²	98.6	35%	0.35	49%	0.488	S	S	.	.	H	α-helix	trans	-60.7	-44.7	175.6	-72.8	171.2	-170.7	0	0	111.5	R526 H527 G533 R534	R526-E530 IonicContact CZ-OE1 2.73Å; R526-E530 IonicContact NE-OE1 3.99Å; R526-E530 IonicContact NH1-OE1 3.7Å; R526-E530 WeakPolarHBondContact O-CG 3.3Å; R526-E530 PolarHBondContact O-N 3.27Å; H527-E530 IonicContact ND1-OE2 2.74Å; H527-E530 PolarHBondContact O-N 2.96Å; E530-G533 PolarHBondContact O-N 3.03Å; E530-R534 WeakPolarHBondContact O-CG 3.41Å; E530-R534 PolarHBondContact O-N 2.77Å
531	L	97.3	Very high	96.4	Very high	76 Å²	76	100.7 Å²	100.7	40%	0.398	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-45.3	175.5	-73.1	174.3	0	0	0	111.3	H527 N528 G533 R534 L535	H527-L531 WeakPolarHBondContact O-CB 3.18Å; H527-L531 WeakPolarHBondContact O-CG 3.45Å; H527-L531 PolarHBondContact O-N 3.46Å; N528-L531 PolarHBondContact O-N 2.97Å; L531-G533 VanDerWaalsContact C-N 3.29Å; L531-G533 PolarHBondContact O-N 3.41Å; L531-R534 PolarHBondContact O-N 3.24Å; L531-L535 WeakPolarHBondContact O-CB 3.49Å; L531-L535 PolarHBondContact O-N 3.14Å
532	H	95.9	Very high	96	Very high	123 Å²	123	104.4 Å²	104.4	57%	0.569	51%	0.51	S	S	*	.	H	α-helix	trans	-58.7	-40.3	174.1	-89.8	-59.1	0	0	0	112.4	N528 Q529 L535 S536	N528-H532 WeakPolarHBondContact O-CB 3.45Å; N528-H532 PolarHBondContact O-CD2 3.25Å; N528-H532 VanDerWaalsContact O-CD2 3.29Å; N528-H532 PolarHBondContact O-N 2.88Å; N528-H532 PolarHBondContact OD1-CD2 3.16Å; N528-H532 PolarHBondContact OD1-NE2 3.3Å; Q529-H532 PolarHBondContact O-N 3.47Å; H532-L535 PolarHBondContact O-N 3.32Å; H532-S536 WeakPolarHBondContact O-CB 3.36Å; H532-S536 PolarHBondContact O-N 3.31Å
533	G	96.6	Very high	95.7	Very high	30 Å²	30	106 Å²	106	31%	0.309	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-52.5	174.1	0	0	0	0	0	112	Q529 E530 L531 L535 S536 E537	Q529-G533 PolarHBondContact O-N 2.61Å; E530-G533 PolarHBondContact O-N 3.03Å; L531-G533 VanDerWaalsContact C-N 3.29Å; L531-G533 PolarHBondContact O-N 3.41Å; G533-L535 VanDerWaalsContact C-N 3.31Å; G533-L535 PolarHBondContact O-N 3.43Å; G533-S536 WeakPolarHBondContact O-CB 3.38Å; G533-S536 PolarHBondContact O-N 3.49Å; G533-S536 VanDerWaalsContact O-N 3.13Å; G533-E537 WeakPolarHBondContact O-CG 3.48Å; G533-E537 PolarHBondContact O-N 2.88Å
534	R	97	Very high	95.2	Very high	147 Å²	147	102.2 Å²	102.2	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-58.9	-42.1	177	-68.4	177.7	-171.5	-172	3.6	112.5	E530 L531 S536 E537 E538	E530-R534 WeakPolarHBondContact O-CG 3.41Å; E530-R534 PolarHBondContact O-N 2.77Å; L531-R534 PolarHBondContact O-N 3.24Å; R534-S536 VanDerWaalsContact C-N 3.32Å; R534-S536 PolarHBondContact O-N 3.41Å; R534-E537 PolarHBondContact O-N 2.9Å; R534-E538 WeakPolarHBondContact O-CG 3.48Å; R534-E538 PolarHBondContact O-N 2.99Å
535	L	95.3	Very high	94.6	Very high	98 Å²	98	101.8 Å²	101.8	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-65.9	-38	178.6	-134.8	145.3	0	0	0	110.9	L531 H532 G533 I539	L531-L535 WeakPolarHBondContact O-CB 3.49Å; L531-L535 PolarHBondContact O-N 3.14Å; H532-L535 PolarHBondContact O-N 3.32Å; G533-L535 VanDerWaalsContact C-N 3.31Å; G533-L535 PolarHBondContact O-N 3.43Å; L535-I539 HydrophobicContact CD2-CD1 3.92Å; L535-I539 HydrophobicContact CD2-CG1 4.48Å; L535-I539 WeakPolarHBondContact O-CB 3.21Å; L535-I539 WeakPolarHBondContact O-CD1 3.32Å; L535-I539 WeakPolarHBondContact O-CG1 3.36Å; L535-I539 PolarHBondContact O-N 3.39Å
536	S	96.2	Very high	93.8	Very high	59 Å²	59	102 Å²	102	41%	0.413	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-45.5	172.7	-164.4	0	0	0	0	111.6	H532 G533 R534 E538 I539 D540	H532-S536 WeakPolarHBondContact O-CB 3.36Å; H532-S536 PolarHBondContact O-N 3.31Å; G533-S536 WeakPolarHBondContact O-CB 3.38Å; G533-S536 PolarHBondContact O-N 3.49Å; G533-S536 VanDerWaalsContact O-N 3.13Å; R534-S536 VanDerWaalsContact C-N 3.32Å; R534-S536 PolarHBondContact O-N 3.41Å; S536-E538 VanDerWaalsContact C-N 3.35Å; S536-E538 PolarHBondContact O-N 3.29Å; S536-I539 WeakPolarHBondContact O-CB 3.43Å; S536-I539 PolarHBondContact O-N 2.96Å; S536-D540 WeakPolarHBondContact O-CB 3.41Å; S536-D540 VanDerWaalsContact O-CG 3.29Å; S536-D540 PolarHBondContact O-N 2.93Å
537	E	96.4	Very high	92.9	Very high	117 Å²	117	98.7 Å²	98.7	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-59.6	-43.4	176.2	-71.1	169.3	-173.1	0	0	111.7	G533 R534 D540 Q541	G533-E537 WeakPolarHBondContact O-CG 3.48Å; G533-E537 PolarHBondContact O-N 2.88Å; R534-E537 PolarHBondContact O-N 2.9Å; E537-D540 PolarHBondContact O-N 2.87Å; E537-Q541 WeakPolarHBondContact O-CB 3.44Å; E537-Q541 VanDerWaalsContact O-CG 3.26Å; E537-Q541 WeakPolarHBondContact O-CG 3.4Å; E537-Q541 PolarHBondContact O-N 3.47Å
538	E	95.1	Very high	91.6	Very high	118 Å²	118	98.1 Å²	98.1	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-63.6	-42.2	174.6	-76.4	-178.5	-173.2	0	0	111.9	R534 S536 D540 Q541 L542	R534-E538 WeakPolarHBondContact O-CG 3.48Å; R534-E538 PolarHBondContact O-N 2.99Å; S536-E538 VanDerWaalsContact C-N 3.35Å; S536-E538 PolarHBondContact O-N 3.29Å; E538-D540 VanDerWaalsContact C-N 3.32Å; E538-D540 PolarHBondContact O-N 3.44Å; E538-Q541 PolarHBondContact O-N 3.43Å; E538-L542 WeakPolarHBondContact O-CB 3.45Å; E538-L542 VanDerWaalsContact O-CG 3.29Å; E538-L542 WeakPolarHBondContact O-CG 3.19Å; E538-L542 PolarHBondContact O-N 2.91Å
539	I	92.6	Very high	89.9	Confident	70 Å²	70	99.6 Å²	99.6	36%	0.359	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-43.7	174.2	-73.3	166.2	0	0	0	110.4	L535 S536 L542 R543	L535-I539 HydrophobicContact CD2-CD1 3.92Å; L535-I539 HydrophobicContact CD2-CG1 4.48Å; L535-I539 WeakPolarHBondContact O-CB 3.21Å; L535-I539 WeakPolarHBondContact O-CD1 3.32Å; L535-I539 WeakPolarHBondContact O-CG1 3.36Å; L535-I539 PolarHBondContact O-N 3.39Å; S536-I539 WeakPolarHBondContact O-CB 3.43Å; S536-I539 PolarHBondContact O-N 2.96Å; I539-L542 PolarHBondContact O-N 3.25Å; I539-R543 HydrophobicContact CG2-CG 4.42Å; I539-R543 VanDerWaalsContact CG2-NE 3.32Å; I539-R543 WeakPolarHBondContact O-CB 3.44Å; I539-R543 VanDerWaalsContact O-CG 3.23Å; I539-R543 WeakPolarHBondContact O-CG 3.13Å; I539-R543 PolarHBondContact O-N 3.5Å
540	D	92.7	Very high	87.8	Confident	96 Å²	96	96.8 Å²	96.8	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-68.1	-38.7	179.6	-70.1	-29.7	0	0	0	111.8	S536 E537 E538 R543 G544	S536-D540 WeakPolarHBondContact O-CB 3.41Å; S536-D540 VanDerWaalsContact O-CG 3.29Å; S536-D540 PolarHBondContact O-N 2.93Å; E537-D540 PolarHBondContact O-N 2.87Å; E538-D540 VanDerWaalsContact C-N 3.32Å; E538-D540 PolarHBondContact O-N 3.44Å; D540-R543 PolarHBondContact O-N 2.91Å; D540-G544 PolarHBondContact O-N 3.15Å
541	Q	94.6	Very high	85.7	Confident	136 Å²	136	101.9 Å²	101.9	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-61.9	-45.8	171.5	-74.3	173.8	20.1	0	0	111.8	E537 E538 G544 F545	E537-Q541 WeakPolarHBondContact O-CB 3.44Å; E537-Q541 VanDerWaalsContact O-CG 3.26Å; E537-Q541 WeakPolarHBondContact O-CG 3.4Å; E537-Q541 PolarHBondContact O-N 3.47Å; E538-Q541 PolarHBondContact O-N 3.43Å; Q541-G544 PolarHBondContact O-N 3.22Å; Q541-F545 WeakPolarHBondContact O-CB 3.43Å; Q541-F545 PolarHBondContact O-N 3.45Å
542	L	90.3	Very high	83.3	Confident	109 Å²	109	100.8 Å²	100.8	57%	0.571	55%	0.552	S	S	*	*	H	α-helix	trans	-63.2	-41.8	176.4	-73.6	172.8	0	0	0	111.4	E538 I539 F545 I546	E538-L542 WeakPolarHBondContact O-CB 3.45Å; E538-L542 VanDerWaalsContact O-CG 3.29Å; E538-L542 WeakPolarHBondContact O-CG 3.19Å; E538-L542 PolarHBondContact O-N 2.91Å; I539-L542 PolarHBondContact O-N 3.25Å; L542-F545 PolarHBondContact O-N 3.22Å; L542-I546 WeakPolarHBondContact O-CB 3.32Å; L542-I546 WeakPolarHBondContact O-CD1 3.38Å; L542-I546 VanDerWaalsContact O-CG1 3.23Å; L542-I546 WeakPolarHBondContact O-CG1 3.47Å; L542-I546 PolarHBondContact O-N 3.17Å
543	R	89.9	Confident	80.9	Confident	166 Å²	166	103.1 Å²	103.1	63%	0.626	57%	0.569	S	S	*	*	H	α-helix	trans	-62.8	-43.4	174.4	-73.9	174.4	-173.6	-75.4	-0.9	111.7	I539 D540 I546 A547	I539-R543 HydrophobicContact CG2-CG 4.42Å; I539-R543 VanDerWaalsContact CG2-NE 3.32Å; I539-R543 WeakPolarHBondContact O-CB 3.44Å; I539-R543 VanDerWaalsContact O-CG 3.23Å; I539-R543 WeakPolarHBondContact O-CG 3.13Å; I539-R543 PolarHBondContact O-N 3.5Å; D540-R543 PolarHBondContact O-N 2.91Å; R543-I546 PolarHBondContact O-N 2.83Å; R543-A547 WeakPolarHBondContact O-CB 3.33Å; R543-A547 PolarHBondContact O-N 2.93Å
544	G	87.3	Confident	78.9	Confident	41 Å²	41	105.1 Å²	105.1	42%	0.423	59%	0.589	S	S	.	*	H	α-helix	trans	-63.4	-41.5	174.8	0	0	0	0	0	112.4	D540 Q541 A547 S548	D540-G544 PolarHBondContact O-N 3.15Å; Q541-G544 PolarHBondContact O-N 3.22Å; G544-A547 PolarHBondContact O-N 3.11Å; G544-S548 WeakPolarHBondContact O-CB 3.46Å; G544-S548 PolarHBondContact O-N 2.89Å; G544-S548 PolarHBondContact O-OG 3.31Å
545	F	85.7	Confident	76.1	Confident	113 Å²	113	103 Å²	103	50%	0.496	60%	0.596	S	S	.	*	H	α-helix	trans	-61.6	-48.1	174.1	-175.3	-100	0	0	0	111.2	Q541 L542 A547 S548 Q549	Q541-F545 WeakPolarHBondContact O-CB 3.43Å; Q541-F545 PolarHBondContact O-N 3.45Å; L542-F545 PolarHBondContact O-N 3.22Å; F545-A547 VanDerWaalsContact C-N 3.33Å; F545-A547 PolarHBondContact O-N 2.95Å; F545-S548 WeakPolarHBondContact CA-OG 3.43Å; F545-S548 CarbonylContact O-C 3.48Å; F545-S548 PolarHBondContact O-N 3.06Å; F545-S548 VanDerWaalsContact O-N 3.14Å; F545-S548 PolarHBondContact O-OG 2.88Å; F545-Q549 VanDerWaalsContact O-CB 3.24Å; F545-Q549 WeakPolarHBondContact O-CB 3.18Å; F545-Q549 PolarHBondContact O-N 3.26Å
546	I	79.9	Confident	74.1	Confident	113 Å²	113	102.1 Å²	102.1	58%	0.579	61%	0.61	S	S	*	*	H	α-helix	trans	-59.7	-43	175.5	-69	164.4	0	0	0	111.2	L542 R543 S548 Q549 G550	L542-I546 WeakPolarHBondContact O-CB 3.32Å; L542-I546 WeakPolarHBondContact O-CD1 3.38Å; L542-I546 VanDerWaalsContact O-CG1 3.23Å; L542-I546 WeakPolarHBondContact O-CG1 3.47Å; L542-I546 PolarHBondContact O-N 3.17Å; R543-I546 PolarHBondContact O-N 2.83Å; I546-S548 VanDerWaalsContact C-N 3.32Å; I546-S548 PolarHBondContact O-N 3.33Å; I546-Q549 PolarHBondContact O-N 2.94Å; I546-G550 PolarHBondContact O-N 3.36Å; I546-G550 VanDerWaalsContact O-N 3.07Å
547	A	79.1	Confident	72	Confident	79 Å²	79	110.1 Å²	110.1	65%	0.653	63%	0.631	S	S	*	*	H	α-helix	trans	-63	-37.4	176.4	0	0	0	0	0	112.2	R543 G544 F545	R543-A547 WeakPolarHBondContact O-CB 3.33Å; R543-A547 PolarHBondContact O-N 2.93Å; G544-A547 PolarHBondContact O-N 3.11Å; F545-A547 VanDerWaalsContact C-N 3.33Å; F545-A547 PolarHBondContact O-N 2.95Å
548	S	70.3	Confident	69.8	Low	81 Å²	81	108.5 Å²	108.5	57%	0.566	63%	0.633	S	S	*	*	H	α-helix	trans	-74.8	-27.6	174.4	71.6	0	0	0	0	113.7	G544 F545 I546 G550	G544-S548 WeakPolarHBondContact O-CB 3.46Å; G544-S548 PolarHBondContact O-N 2.89Å; G544-S548 PolarHBondContact O-OG 3.31Å; F545-S548 WeakPolarHBondContact CA-OG 3.43Å; F545-S548 CarbonylContact O-C 3.48Å; F545-S548 PolarHBondContact O-N 3.06Å; F545-S548 VanDerWaalsContact O-N 3.14Å; F545-S548 PolarHBondContact O-OG 2.88Å; I546-S548 VanDerWaalsContact C-N 3.32Å; I546-S548 PolarHBondContact O-N 3.33Å; S548-G550 VanDerWaalsContact C-N 3.33Å
549	Q	60.1	Low	67.9	Low	114 Å²	114	109 Å²	109	53%	0.533	64%	0.64	S	S	.	*	H	α-helix	trans	-82.5	-10.5	178.7	-165.3	166.7	68.4	0	0	112.7	F545 I546 M551	F545-Q549 VanDerWaalsContact O-CB 3.24Å; F545-Q549 WeakPolarHBondContact O-CB 3.18Å; F545-Q549 PolarHBondContact O-N 3.26Å; I546-Q549 PolarHBondContact O-N 2.94Å; Q549-M551 PolarHBondContact O-N 3.17Å
550	G	53.5	Low	66.1	Low	71 Å²	71	113.1 Å²	113.1	73%	0.732	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-2.7	168.5	0	0	0	0	0	114.7	I546 S548	I546-G550 PolarHBondContact O-N 3.36Å; I546-G550 VanDerWaalsContact O-N 3.07Å; S548-G550 VanDerWaalsContact C-N 3.33Å
551	M	53.4	Low	64.2	Low	182 Å²	182	117.9 Å²	117.9	90%	0.897	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.3	58.8	176.5	-146.3	152.8	75.3	0	0	111.4	Q549	Q549-M551 PolarHBondContact O-N 3.17Å
552	G	47.5	Very low	62.8	Low	54 Å²	54	113.2 Å²	113.2	56%	0.557	65%	0.651	S	S	*	*	S	Bend	trans	156	94	165.9	0	0	0	0	0	116.5
553	N	45.6	Very low	61.8	Low	172 Å²	172	110.8 Å²	110.8	92%	0.92	64%	0.643	S	S	*	*			trans	53.2	112	140.5	-144.7	22.8	0	0	0	120.4
554	G	54.9	Low	61.2	Low	71 Å²	71	106.7 Å²	106.7	73%	0.732	64%	0.639	S	S	*	*				77.7	96.6	123.9	0	0	0	0	0	119.6
555	C	37.7	Very low	60.9	Low	104 Å²	104	110.9 Å²	110.9	70%	0.703	65%	0.647	S	S	*	*			trans	-161.8	93	139.5	-160.4	0	0	0	0	112.5	R557	C555-R557 PolarHBondContact O-N 3.43Å
556	G	53.1	Low	60.8	Low	79 Å²	79	111 Å²	111	81%	0.814	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	26.1	177.9	0	0	0	0	0	116.1
557	R	51.6	Low	61.1	Low	226 Å²	226	110 Å²	110	85%	0.853	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-3.6	179.2	-78.8	176.7	71	-171.4	2.2	115.2	C555	C555-R557 PolarHBondContact O-N 3.43Å
558	S	51.5	Low	61.6	Low	84 Å²	84	110.3 Å²	110.3	59%	0.587	64%	0.639	S	S	*	*	S	Bend	trans	-88.2	-19.5	176.1	-179.3	0	0	0	0	113.7	S562	S558-S562 PolarHBondContact O-OG 2.99Å
559	N	54.8	Low	62.7	Low	128 Å²	128	111.1 Å²	111.1	68%	0.684	64%	0.636	S	S	*	*	H	α-helix	trans	-79.1	-22.8	-165.2	-144.7	34.2	0	0	0	113.8	S562 S563	N559-S562 PolarHBondContact O-OG 3.22Å; N559-S562 VanDerWaalsContact O-OG 3.13Å; N559-S563 VanDerWaalsContact O-CB 3.3Å; N559-S563 WeakPolarHBondContact O-CB 3.48Å; N559-S563 PolarHBondContact O-N 3.46Å
560	E	54	Low	64.2	Low	157 Å²	157	110.5 Å²	110.5	73%	0.734	64%	0.636	S	S	*	*	H	α-helix	trans	-79.1	-33.6	179.1	-66.3	179	164.6	0	0	111.9	S563 C564	E560-S563 PolarHBondContact O-N 2.92Å; E560-C564 PolarHBondContact O-N 3.44Å; E560-C564 VanDerWaalsContact O-N 3.14Å; E560-C564 PolarHBondContact O-SG 2.88Å
561	R	53.8	Low	66.1	Low	195 Å²	195	114 Å²	114	74%	0.736	63%	0.627	S	S	*	*	H	α-helix	trans	-74	-39.3	179.9	-151.3	173.6	-170.6	173.6	1.8	111.9	E565	R561-E565 WeakPolarHBondContact O-CG 3.45Å; R561-E565 PolarHBondContact O-N 3.35Å
562	S	65.9	Low	68.1	Low	39 Å²	39	108.6 Å²	108.6	27%	0.273	60%	0.604	S	S	.	*	H	α-helix	trans	-68.9	-31.9	171.5	55.7	0	0	0	0	112.8	S558 N559 E565 L566	S558-S562 PolarHBondContact O-OG 2.99Å; N559-S562 PolarHBondContact O-OG 3.22Å; N559-S562 VanDerWaalsContact O-OG 3.13Å; S562-E565 PolarHBondContact O-N 2.95Å; S562-L566 WeakPolarHBondContact O-CB 3.45Å; S562-L566 WeakPolarHBondContact O-CG 3.36Å; S562-L566 PolarHBondContact O-N 3.41Å
563	S	68.9	Low	70.3	Confident	58 Å²	58	110.8 Å²	110.8	41%	0.406	60%	0.599	S	S	.	*	H	α-helix	trans	-64	-45.7	173.5	-173.3	0	0	0	0	112	N559 E560 E565 L566 E567	N559-S563 VanDerWaalsContact O-CB 3.3Å; N559-S563 WeakPolarHBondContact O-CB 3.48Å; N559-S563 PolarHBondContact O-N 3.46Å; E560-S563 PolarHBondContact O-N 2.92Å; S563-E565 VanDerWaalsContact C-N 3.35Å; S563-E565 PolarHBondContact O-N 3.22Å; S563-L566 PolarHBondContact O-N 2.98Å; S563-E567 PolarHBondContact O-N 3.06Å
564	C	76.7	Confident	72.5	Confident	79 Å²	79	107.3 Å²	107.3	53%	0.534	58%	0.577	S	S	.	*	H	α-helix	trans	-63.2	-38.8	175.7	-68.8	0	0	0	0	112.6	E560 E567 V568	E560-C564 PolarHBondContact O-N 3.44Å; E560-C564 VanDerWaalsContact O-N 3.14Å; E560-C564 PolarHBondContact O-SG 2.88Å; C564-E567 PolarHBondContact O-N 3.3Å; C564-V568 WeakPolarHBondContact O-CG2 3.49Å; C564-V568 PolarHBondContact O-N 3.41Å; C564-V568 VanDerWaalsContact O-N 3.09Å
565	E	80.1	Confident	74.4	Confident	129 Å²	129	108.6 Å²	108.6	60%	0.603	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-40.8	176.4	-72.9	170.8	-169.6	0	0	112.1	R561 S562 S563 V568 L569	R561-E565 WeakPolarHBondContact O-CG 3.45Å; R561-E565 PolarHBondContact O-N 3.35Å; S562-E565 PolarHBondContact O-N 2.95Å; S563-E565 VanDerWaalsContact C-N 3.35Å; S563-E565 PolarHBondContact O-N 3.22Å; E565-V568 PolarHBondContact O-N 2.92Å; E565-L569 PolarHBondContact O-N 2.93Å
566	L	84.6	Confident	77.2	Confident	116 Å²	116	107.6 Å²	107.6	61%	0.607	55%	0.552	S	S	*	*	H	α-helix	trans	-65.9	-39.7	174.7	-77.2	165.3	0	0	0	112.4	S562 S563 V568 L569 L570	S562-L566 WeakPolarHBondContact O-CB 3.45Å; S562-L566 WeakPolarHBondContact O-CG 3.36Å; S562-L566 PolarHBondContact O-N 3.41Å; S563-L566 PolarHBondContact O-N 2.98Å; L566-V568 VanDerWaalsContact C-N 3.32Å; L566-V568 PolarHBondContact O-N 3.18Å; L566-L569 PolarHBondContact O-N 2.95Å; L566-L570 WeakPolarHBondContact O-CB 3.18Å; L566-L570 PolarHBondContact O-N 3.08Å
567	E	86.4	Confident	79.2	Confident	92 Å²	92	108.7 Å²	108.7	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-38.8	173.6	-90.3	-168.4	-162	0	0	112.7	S563 C564 R571	S563-E567 PolarHBondContact O-N 3.06Å; C564-E567 PolarHBondContact O-N 3.3Å; E567-R571 WeakPolarHBondContact O-CB 3.38Å; E567-R571 VanDerWaalsContact O-CG 3.3Å; E567-R571 WeakPolarHBondContact O-CG 3.45Å; E567-R571 PolarHBondContact O-N 3.11Å; E567-R571 IonicContact OE2-CZ 3.54Å; E567-R571 IonicContact OE2-NH1 3.41Å; E567-R571 PolarHBondContact OE2-NH1 2.88Å; E567-R571 IonicContact OE2-NH2 3.29Å
568	V	89.8	Confident	81.3	Confident	86 Å²	86	102.8 Å²	102.8	52%	0.521	52%	0.521	S	S	.	.	H	α-helix	trans	-66.4	-44.5	176	171.3	0	0	0	0	110.3	C564 E565 L566 R571 V572	C564-V568 WeakPolarHBondContact O-CG2 3.49Å; C564-V568 PolarHBondContact O-N 3.41Å; C564-V568 VanDerWaalsContact O-N 3.09Å; E565-V568 PolarHBondContact O-N 2.92Å; L566-V568 VanDerWaalsContact C-N 3.32Å; L566-V568 PolarHBondContact O-N 3.18Å; V568-R571 PolarHBondContact O-N 2.84Å; V568-V572 WeakPolarHBondContact O-CG2 3.48Å; V568-V572 PolarHBondContact O-N 3.1Å
569	L	92.1	Very high	83.4	Confident	97 Å²	97	105.9 Å²	105.9	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-40.5	177.9	-171.6	64.7	0	0	0	112	E565 L566 R571 V572 K573	E565-L569 PolarHBondContact O-N 2.93Å; L566-L569 PolarHBondContact O-N 2.95Å; L569-R571 VanDerWaalsContact C-N 3.35Å; L569-R571 PolarHBondContact O-N 3.37Å; L569-V572 PolarHBondContact O-N 3.19Å; L569-K573 WeakPolarHBondContact O-CG 3.42Å; L569-K573 PolarHBondContact O-N 3.49Å
570	L	92.1	Very high	85.4	Confident	101 Å²	101	104.4 Å²	104.4	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-58.3	-47.8	173.8	-170.2	82.8	0	0	0	110.5	L566 V572 K573 E574	L566-L570 WeakPolarHBondContact O-CB 3.18Å; L566-L570 PolarHBondContact O-N 3.08Å; L570-V572 VanDerWaalsContact C-N 3.32Å; L570-V572 PolarHBondContact O-N 3.34Å; L570-K573 PolarHBondContact O-N 3.31Å; L570-E574 WeakPolarHBondContact O-CB 3.29Å; L570-E574 VanDerWaalsContact O-CG 3.31Å; L570-E574 WeakPolarHBondContact O-CG 3.45Å; L570-E574 PolarHBondContact O-N 2.93Å
571	R	94.5	Very high	87.4	Confident	144 Å²	144	103.4 Å²	103.4	54%	0.543	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-37.4	176.6	-76.1	173.1	174.7	116.5	1.9	112.8	E567 V568 L569 N575	E567-R571 WeakPolarHBondContact O-CB 3.38Å; E567-R571 VanDerWaalsContact O-CG 3.3Å; E567-R571 WeakPolarHBondContact O-CG 3.45Å; E567-R571 PolarHBondContact O-N 3.11Å; E567-R571 IonicContact OE2-CZ 3.54Å; E567-R571 IonicContact OE2-NH1 3.41Å; E567-R571 PolarHBondContact OE2-NH1 2.88Å; E567-R571 IonicContact OE2-NH2 3.29Å; V568-R571 PolarHBondContact O-N 2.84Å; L569-R571 VanDerWaalsContact C-N 3.35Å; L569-R571 PolarHBondContact O-N 3.37Å; R571-N575 WeakPolarHBondContact O-CB 3.29Å; R571-N575 PolarHBondContact O-N 3.02Å
572	V	94.7	Very high	89.5	Confident	69 Å²	69	100.4 Å²	100.4	42%	0.418	50%	0.498	S	S	.	.	H	α-helix	trans	-66.9	-45.1	174.9	171.6	0	0	0	0	110.6	V568 L569 L570 N575 E576	V568-V572 WeakPolarHBondContact O-CG2 3.48Å; V568-V572 PolarHBondContact O-N 3.1Å; L569-V572 PolarHBondContact O-N 3.19Å; L570-V572 VanDerWaalsContact C-N 3.32Å; L570-V572 PolarHBondContact O-N 3.34Å; V572-N575 CarbonylContact O-C 3.5Å; V572-N575 WeakPolarHBondContact O-CA 3.31Å; V572-N575 WeakPolarHBondContact O-CB 3.32Å; V572-N575 PolarHBondContact O-N 2.94Å; V572-N575 VanDerWaalsContact O-N 3.12Å; V572-E576 WeakPolarHBondContact O-CG 3.47Å; V572-E576 PolarHBondContact O-N 2.89Å
573	K	94.5	Very high	90.9	Very high	101 Å²	101	103.4 Å²	103.4	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-66.9	-36.9	177.9	-68.5	-64.4	169.1	-159.1	0	112.8	L569 L570 N575 E576 L577	L569-K573 WeakPolarHBondContact O-CG 3.42Å; L569-K573 PolarHBondContact O-N 3.49Å; L570-K573 PolarHBondContact O-N 3.31Å; K573-N575 VanDerWaalsContact C-N 3.32Å; K573-E576 WeakPolarHBondContact CD-OE2 3.46Å; K573-E576 IonicContact NZ-OE1 3.61Å; K573-E576 PolarHBondContact NZ-OE1 3.38Å; K573-E576 IonicContact NZ-OE2 3.68Å; K573-E576 PolarHBondContact NZ-OE2 3.05Å; K573-E576 PolarHBondContact O-N 3.33Å; K573-L577 WeakPolarHBondContact O-CB 3.42Å; K573-L577 WeakPolarHBondContact O-CG 3.47Å; K573-L577 PolarHBondContact O-N 2.93Å
574	E	91.9	Very high	92.2	Very high	98 Å²	98	104 Å²	104	46%	0.458	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-41.6	169.5	-75.5	166.3	172.6	0	0	111	L570 L577 Q578	L570-E574 WeakPolarHBondContact O-CB 3.29Å; L570-E574 VanDerWaalsContact O-CG 3.31Å; L570-E574 WeakPolarHBondContact O-CG 3.45Å; L570-E574 PolarHBondContact O-N 2.93Å; E574-L577 PolarHBondContact O-N 3.14Å; E574-Q578 WeakPolarHBondContact O-CG 3.36Å; E574-Q578 PolarHBondContact O-N 2.98Å
575	N	94.8	Very high	93.2	Very high	99 Å²	99	104.6 Å²	104.6	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-44	174.7	-121.6	-81.3	0	0	0	112.8	R571 V572 K573 L577 Q578 Y579	R571-N575 WeakPolarHBondContact O-CB 3.29Å; R571-N575 PolarHBondContact O-N 3.02Å; V572-N575 CarbonylContact O-C 3.5Å; V572-N575 WeakPolarHBondContact O-CA 3.31Å; V572-N575 WeakPolarHBondContact O-CB 3.32Å; V572-N575 PolarHBondContact O-N 2.94Å; V572-N575 VanDerWaalsContact O-N 3.12Å; K573-N575 VanDerWaalsContact C-N 3.32Å; N575-L577 VanDerWaalsContact C-N 3.33Å; N575-L577 PolarHBondContact O-N 3.41Å; N575-Q578 WeakPolarHBondContact O-CB 3.2Å; N575-Q578 PolarHBondContact O-N 3.37Å; N575-Y579 PolarHBondContact O-N 3.33Å
576	E	96.1	Very high	94	Very high	83 Å²	83	101.8 Å²	101.8	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-59.2	-44.9	174.8	-74	175.3	-163.2	0	0	111	V572 K573 Q578 Y579 L580	V572-E576 WeakPolarHBondContact O-CG 3.47Å; V572-E576 PolarHBondContact O-N 2.89Å; K573-E576 WeakPolarHBondContact CD-OE2 3.46Å; K573-E576 IonicContact NZ-OE1 3.61Å; K573-E576 PolarHBondContact NZ-OE1 3.38Å; K573-E576 IonicContact NZ-OE2 3.68Å; K573-E576 PolarHBondContact NZ-OE2 3.05Å; K573-E576 PolarHBondContact O-N 3.33Å; E576-Q578 VanDerWaalsContact C-N 3.31Å; E576-Q578 PolarHBondContact O-N 3.24Å; E576-Y579 WeakPolarHBondContact O-CB 3.29Å; E576-Y579 PolarHBondContact O-N 2.93Å; E576-Y579 VanDerWaalsContact O-N 3.16Å; E576-L580 WeakPolarHBondContact O-CG 3.43Å; E576-L580 PolarHBondContact O-N 3Å
577	L	94.2	Very high	94.5	Very high	102 Å²	102	100.9 Å²	100.9	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-61.9	-38.2	174.9	-76	172.9	0	0	0	112.3	K573 E574 N575 K581	K573-L577 WeakPolarHBondContact O-CB 3.42Å; K573-L577 WeakPolarHBondContact O-CG 3.47Å; K573-L577 PolarHBondContact O-N 2.93Å; E574-L577 PolarHBondContact O-N 3.14Å; N575-L577 VanDerWaalsContact C-N 3.33Å; N575-L577 PolarHBondContact O-N 3.41Å; L577-K581 WeakPolarHBondContact O-CB 3.28Å; L577-K581 WeakPolarHBondContact O-CG 3.46Å; L577-K581 PolarHBondContact O-N 3.27Å
578	Q	95.3	Very high	95	Very high	102 Å²	102	104 Å²	104	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-66.3	-38	174.4	-69.2	-65.8	-18.3	0	0	111.9	E574 N575 E576 K581 K582	E574-Q578 WeakPolarHBondContact O-CG 3.36Å; E574-Q578 PolarHBondContact O-N 2.98Å; N575-Q578 WeakPolarHBondContact O-CB 3.2Å; N575-Q578 PolarHBondContact O-N 3.37Å; E576-Q578 VanDerWaalsContact C-N 3.31Å; E576-Q578 PolarHBondContact O-N 3.24Å; Q578-K581 PolarHBondContact O-N 2.88Å; Q578-K582 WeakPolarHBondContact O-CG 3.32Å; Q578-K582 PolarHBondContact O-N 3.19Å
579	Y	96.2	Very high	95.4	Very high	148 Å²	148	103.3 Å²	103.3	58%	0.58	49%	0.494	S	S	*	.	H	α-helix	trans	-64.8	-48	174	-99.6	-81.7	0	0	0	112	N575 E576 K581 K582 E583	N575-Y579 PolarHBondContact O-N 3.33Å; E576-Y579 WeakPolarHBondContact O-CB 3.29Å; E576-Y579 PolarHBondContact O-N 2.93Å; E576-Y579 VanDerWaalsContact O-N 3.16Å; Y579-K581 VanDerWaalsContact C-N 3.3Å; Y579-K581 PolarHBondContact O-N 2.9Å; Y579-K582 WeakPolarHBondContact O-CB 3.35Å; Y579-K582 PolarHBondContact O-N 3.18Å; Y579-K582 VanDerWaalsContact O-N 3.11Å; Y579-E583 PolarHBondContact O-N 2.92Å
580	L	96.8	Very high	95.6	Very high	97 Å²	97	104 Å²	104	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-39.6	177.2	-70.4	171.8	0	0	0	111.4	E576 K582 E583 V584	E576-L580 WeakPolarHBondContact O-CG 3.43Å; E576-L580 PolarHBondContact O-N 3Å; L580-K582 VanDerWaalsContact C-N 3.35Å; L580-K582 PolarHBondContact O-N 3.27Å; L580-E583 PolarHBondContact O-N 3.36Å; L580-V584 WeakPolarHBondContact O-CB 3.34Å; L580-V584 VanDerWaalsContact O-CG2 3.28Å; L580-V584 WeakPolarHBondContact O-CG2 3.38Å; L580-V584 PolarHBondContact O-N 2.85Å
581	K	96.7	Very high	95.8	Very high	137 Å²	137	104.1 Å²	104.1	60%	0.596	50%	0.495	S	S	*	.	H	α-helix	trans	-60.1	-42.8	173.1	-81.2	178.2	178.5	178.7	0	112.3	L577 Q578 Y579 Q585	L577-K581 WeakPolarHBondContact O-CB 3.28Å; L577-K581 WeakPolarHBondContact O-CG 3.46Å; L577-K581 PolarHBondContact O-N 3.27Å; Q578-K581 PolarHBondContact O-N 2.88Å; Y579-K581 VanDerWaalsContact C-N 3.3Å; Y579-K581 PolarHBondContact O-N 2.9Å; K581-Q585 PolarHBondContact O-N 3.36Å
582	K	96.8	Very high	95.9	Very high	131 Å²	131	102 Å²	102	57%	0.57	49%	0.491	S	S	*	.	H	α-helix	trans	-65.5	-42.7	176.1	-72.2	173	-177.4	178.4	0	111.7	Q578 Y579 L580 Q585 C586	Q578-K582 WeakPolarHBondContact O-CG 3.32Å; Q578-K582 PolarHBondContact O-N 3.19Å; Y579-K582 WeakPolarHBondContact O-CB 3.35Å; Y579-K582 PolarHBondContact O-N 3.18Å; Y579-K582 VanDerWaalsContact O-N 3.11Å; L580-K582 VanDerWaalsContact C-N 3.35Å; L580-K582 PolarHBondContact O-N 3.27Å; K582-Q585 WeakPolarHBondContact O-CB 3.46Å; K582-Q585 PolarHBondContact O-N 3.31Å; K582-C586 PolarHBondContact O-N 3.01Å; K582-C586 PolarHBondContact O-SG 3.49Å; K582-C586 VanDerWaalsContact O-SG 3.33Å
583	E	96.3	Very high	95.9	Very high	102 Å²	102	104.2 Å²	104.2	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-45.4	177.7	-173.9	168.5	-163.5	0	0	111.6	Y579 L580 Q585 C586 L587	Y579-E583 PolarHBondContact O-N 2.92Å; L580-E583 PolarHBondContact O-N 3.36Å; E583-Q585 VanDerWaalsContact C-N 3.26Å; E583-Q585 PolarHBondContact O-N 2.94Å; E583-C586 PolarHBondContact O-N 3.3Å; E583-L587 HydrophobicContact CG-CD1 4.27Å; E583-L587 VanDerWaalsContact O-CG 3.31Å; E583-L587 WeakPolarHBondContact O-CG 3.46Å; E583-L587 PolarHBondContact O-N 3.49Å
584	V	96.4	Very high	96	Very high	72 Å²	72	105.4 Å²	105.4	44%	0.436	51%	0.507	S	S	.	.	H	α-helix	trans	-59.1	-38.7	173.4	170.3	0	0	0	0	111.4	L580 R588	L580-V584 WeakPolarHBondContact O-CB 3.34Å; L580-V584 VanDerWaalsContact O-CG2 3.28Å; L580-V584 WeakPolarHBondContact O-CG2 3.38Å; L580-V584 PolarHBondContact O-N 2.85Å; V584-R588 VanDerWaalsContact O-CG 3.29Å; V584-R588 WeakPolarHBondContact O-CG 3.36Å; V584-R588 PolarHBondContact O-N 2.9Å
585	Q	97.2	Very high	96.2	Very high	90 Å²	90	105.4 Å²	105.4	42%	0.421	51%	0.507	S	S	.	.	H	α-helix	trans	-66.5	-46.3	176.5	-172.7	58.1	47.3	0	0	111.9	K581 K582 E583 L587 R588 D589	K581-Q585 PolarHBondContact O-N 3.36Å; K582-Q585 WeakPolarHBondContact O-CB 3.46Å; K582-Q585 PolarHBondContact O-N 3.31Å; E583-Q585 VanDerWaalsContact C-N 3.26Å; E583-Q585 PolarHBondContact O-N 2.94Å; Q585-L587 VanDerWaalsContact C-N 3.33Å; Q585-L587 PolarHBondContact O-N 3.08Å; Q585-R588 WeakPolarHBondContact O-CB 3.44Å; Q585-R588 PolarHBondContact O-N 3.13Å; Q585-R588 VanDerWaalsContact O-N 3.14Å; Q585-D589 PolarHBondContact NE2-OD1 2.87Å; Q585-D589 VanDerWaalsContact O-CG 3.31Å; Q585-D589 PolarHBondContact O-N 3.11Å
586	C	95.9	Very high	96.3	Very high	70 Å²	70	106 Å²	106	47%	0.473	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-44.1	176.2	-67	0	0	0	0	111.9	K582 E583 R588 D589 E590	K582-C586 PolarHBondContact O-N 3.01Å; K582-C586 PolarHBondContact O-SG 3.49Å; K582-C586 VanDerWaalsContact O-SG 3.33Å; E583-C586 PolarHBondContact O-N 3.3Å; C586-R588 VanDerWaalsContact C-N 3.29Å; C586-R588 PolarHBondContact O-N 2.87Å; C586-D589 PolarHBondContact O-N 3.21Å; C586-E590 WeakPolarHBondContact O-CG 3.29Å; C586-E590 PolarHBondContact O-N 3.4Å
587	L	96.6	Very high	96.3	Very high	97 Å²	97	106.2 Å²	106.2	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-34.9	177.1	-69.3	173.1	0	0	0	112.3	E583 Q585 L591	E583-L587 HydrophobicContact CG-CD1 4.27Å; E583-L587 VanDerWaalsContact O-CG 3.31Å; E583-L587 WeakPolarHBondContact O-CG 3.46Å; E583-L587 PolarHBondContact O-N 3.49Å; Q585-L587 VanDerWaalsContact C-N 3.33Å; Q585-L587 PolarHBondContact O-N 3.08Å; L587-L591 WeakPolarHBondContact O-CB 3.32Å; L587-L591 PolarHBondContact O-N 3.32Å
588	R	97	Very high	96.4	Very high	157 Å²	157	108.7 Å²	108.7	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-66.1	-42.5	173.6	-76.9	173.4	179	-170.6	-0.7	111.9	V584 Q585 C586 L591 Q592	V584-R588 VanDerWaalsContact O-CG 3.29Å; V584-R588 WeakPolarHBondContact O-CG 3.36Å; V584-R588 PolarHBondContact O-N 2.9Å; Q585-R588 WeakPolarHBondContact O-CB 3.44Å; Q585-R588 PolarHBondContact O-N 3.13Å; Q585-R588 VanDerWaalsContact O-N 3.14Å; C586-R588 VanDerWaalsContact C-N 3.29Å; C586-R588 PolarHBondContact O-N 2.87Å; R588-L591 PolarHBondContact O-N 2.91Å; R588-Q592 WeakPolarHBondContact O-CB 3.44Å; R588-Q592 PolarHBondContact O-N 3.46Å
589	D	96.9	Very high	96.5	Very high	72 Å²	72	111.3 Å²	111.3	39%	0.385	52%	0.521	S	S	.	.	H	α-helix	trans	-66.5	-43.1	179.4	-62.4	-19.3	0	0	0	110.8	Q585 C586 Q592 M593	Q585-D589 PolarHBondContact NE2-OD1 2.87Å; Q585-D589 VanDerWaalsContact O-CG 3.31Å; Q585-D589 PolarHBondContact O-N 3.11Å; C586-D589 PolarHBondContact O-N 3.21Å; D589-Q592 WeakPolarHBondContact O-CB 3.36Å; D589-Q592 PolarHBondContact O-N 2.89Å; D589-M593 WeakPolarHBondContact O-CG 3.42Å; D589-M593 PolarHBondContact O-N 3.03Å
590	E	96.8	Very high	96.5	Very high	112 Å²	112	110.1 Å²	110.1	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-60.2	-46.7	173.4	-75	178.8	-166.9	0	0	111.9	C586 Q592 M593 M594	C586-E590 WeakPolarHBondContact O-CG 3.29Å; C586-E590 PolarHBondContact O-N 3.4Å; E590-Q592 VanDerWaalsContact C-N 3.27Å; E590-Q592 PolarHBondContact O-N 3.07Å; E590-M593 PolarHBondContact O-N 2.89Å; E590-M594 WeakPolarHBondContact O-CG 3.36Å; E590-M594 PolarHBondContact O-N 3.2Å
591	L	95.7	Very high	96.3	Very high	103 Å²	103	109.5 Å²	109.5	54%	0.539	52%	0.519	S	S	.	.	H	α-helix	trans	-59.3	-40.2	175.8	-178	66.3	0	0	0	111.4	L587 R588 M594 Q595	L587-L591 WeakPolarHBondContact O-CB 3.32Å; L587-L591 PolarHBondContact O-N 3.32Å; R588-L591 PolarHBondContact O-N 2.91Å; L591-M594 PolarHBondContact O-N 3.28Å; L591-Q595 WeakPolarHBondContact O-CB 3.4Å; L591-Q595 WeakPolarHBondContact O-CG 3.39Å; L591-Q595 PolarHBondContact O-N 3.5Å
592	Q	97.7	Very high	96.1	Very high	99 Å²	99	106.5 Å²	106.5	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-66.4	-39.7	177.5	-165.5	-173.9	24.9	0	0	111.9	R588 D589 E590 Q595 K596	R588-Q592 WeakPolarHBondContact O-CB 3.44Å; R588-Q592 PolarHBondContact O-N 3.46Å; D589-Q592 WeakPolarHBondContact O-CB 3.36Å; D589-Q592 PolarHBondContact O-N 2.89Å; E590-Q592 VanDerWaalsContact C-N 3.27Å; E590-Q592 PolarHBondContact O-N 3.07Å; Q592-Q595 PolarHBondContact O-N 2.9Å; Q592-K596 WeakPolarHBondContact O-CG 3.49Å; Q592-K596 PolarHBondContact O-N 3.49Å
593	M	94.5	Very high	96.1	Very high	116 Å²	116	101.8 Å²	101.8	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-63.4	-48.4	173.6	-69.5	-154	-63.9	0	0	111.2	D589 E590 Q595 K596 D597	D589-M593 WeakPolarHBondContact O-CG 3.42Å; D589-M593 PolarHBondContact O-N 3.03Å; E590-M593 PolarHBondContact O-N 2.89Å; M593-Q595 VanDerWaalsContact C-N 3.26Å; M593-Q595 PolarHBondContact O-N 2.91Å; M593-K596 WeakPolarHBondContact O-CA 3.47Å; M593-K596 WeakPolarHBondContact O-CB 3.23Å; M593-K596 PolarHBondContact O-N 3.41Å; M593-D597 PolarHBondContact O-N 2.94Å
594	M	95.7	Very high	96.2	Very high	126 Å²	126	102.3 Å²	102.3	62%	0.621	51%	0.505	S	S	*	.	H	α-helix	trans	-59	-36.3	176.3	-70.4	-58.8	-63	0	0	112.4	E590 L591 D597 K598	E590-M594 WeakPolarHBondContact O-CG 3.36Å; E590-M594 PolarHBondContact O-N 3.2Å; L591-M594 PolarHBondContact O-N 3.28Å; M594-D597 PolarHBondContact O-N 3.06Å; M594-K598 WeakPolarHBondContact O-CB 3.42Å; M594-K598 PolarHBondContact O-N 2.83Å
595	Q	95.9	Very high	96.1	Very high	98 Å²	98	106.5 Å²	106.5	46%	0.458	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-34	173.4	-78.4	179.6	-3.1	0	0	113.2	L591 Q592 M593 R599	L591-Q595 WeakPolarHBondContact O-CB 3.4Å; L591-Q595 WeakPolarHBondContact O-CG 3.39Å; L591-Q595 PolarHBondContact O-N 3.5Å; Q592-Q595 PolarHBondContact O-N 2.9Å; M593-Q595 VanDerWaalsContact C-N 3.26Å; M593-Q595 PolarHBondContact O-N 2.91Å; Q595-R599 WeakPolarHBondContact O-CG 3.37Å; Q595-R599 PolarHBondContact O-N 2.74Å; Q595-R599 PolarHBondContact O-NE 3.33Å
596	K	96.8	Very high	96.1	Very high	112 Å²	112	107 Å²	107	49%	0.487	52%	0.516	S	S	.	.	H	α-helix	trans	-67.4	-44.9	172.4	-72.6	174.6	179.8	174.8	0	110.5	Q592 M593 K598 R599 F600	Q592-K596 WeakPolarHBondContact O-CG 3.49Å; Q592-K596 PolarHBondContact O-N 3.49Å; M593-K596 WeakPolarHBondContact O-CA 3.47Å; M593-K596 WeakPolarHBondContact O-CB 3.23Å; M593-K596 PolarHBondContact O-N 3.41Å; K596-K598 PolarHBondContact O-N 3.47Å; K596-R599 PolarHBondContact O-N 2.92Å; K596-R599 VanDerWaalsContact O-N 3.15Å; K596-F600 WeakPolarHBondContact O-CB 3.45Å; K596-F600 PolarHBondContact O-N 2.84Å
597	D	96.1	Very high	96.1	Very high	88 Å²	88	108.5 Å²	108.5	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-40.5	178.3	-69.2	-12.2	0	0	0	112.1	M593 M594 R599 F600 T601	M593-D597 PolarHBondContact O-N 2.94Å; M594-D597 PolarHBondContact O-N 3.06Å; D597-R599 VanDerWaalsContact C-N 3.35Å; D597-R599 PolarHBondContact O-N 3.47Å; D597-F600 PolarHBondContact O-N 3.2Å; D597-T601 WeakPolarHBondContact O-CB 3.36Å; D597-T601 WeakPolarHBondContact O-CG2 3.49Å; D597-T601 PolarHBondContact O-N 2.92Å; D597-T601 PolarHBondContact O-OG1 3.34Å
598	K	97.2	Very high	96.2	Very high	153 Å²	153	108.1 Å²	108.1	67%	0.665	52%	0.521	S	S	*	.	H	α-helix	trans	-57.3	-45.8	171.5	179.5	-178.5	174.5	178.4	0	111.8	M594 K596 T601 S602	M594-K598 WeakPolarHBondContact O-CB 3.42Å; M594-K598 PolarHBondContact O-N 2.83Å; K596-K598 PolarHBondContact O-N 3.47Å; K598-T601 WeakPolarHBondContact CA-OG1 3.39Å; K598-T601 PolarHBondContact O-OG1 2.92Å; K598-S602 WeakPolarHBondContact O-CB 3.34Å; K598-S602 PolarHBondContact O-N 3.37Å
599	R	96.4	Very high	96.2	Very high	157 Å²	157	107 Å²	107	59%	0.592	52%	0.518	S	S	*	.	H	α-helix	trans	-65.9	-41.2	178.4	-76.8	-178.2	-70.8	-158.6	-1.6	111.8	Q595 K596 D597 S602 G603	Q595-R599 WeakPolarHBondContact O-CG 3.37Å; Q595-R599 PolarHBondContact O-N 2.74Å; Q595-R599 PolarHBondContact O-NE 3.33Å; K596-R599 PolarHBondContact O-N 2.92Å; K596-R599 VanDerWaalsContact O-N 3.15Å; D597-R599 VanDerWaalsContact C-N 3.35Å; D597-R599 PolarHBondContact O-N 3.47Å; R599-S602 PolarHBondContact O-N 3.26Å; R599-G603 PolarHBondContact O-N 3.46Å
600	F	96.8	Very high	96.2	Very high	124 Å²	124	106.4 Å²	106.4	54%	0.544	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-46	178.3	179.5	-108.5	0	0	0	112.4	K596 D597 G603 K604	K596-F600 WeakPolarHBondContact O-CB 3.45Å; K596-F600 PolarHBondContact O-N 2.84Å; D597-F600 PolarHBondContact O-N 3.2Å; F600-G603 PolarHBondContact O-N 3.44Å; F600-K604 HydrophobicContact CD1-CD 4.41Å; F600-K604 HydrophobicContact CE1-CD 3.98Å; F600-K604 HydrophobicContact CZ-CD 4.21Å; F600-K604 VanDerWaalsContact CZ-NZ 3.33Å; F600-K604 PolarHBondContact O-N 3.18Å
601	T	93.5	Very high	96.2	Very high	84 Å²	84	107.1 Å²	107.1	52%	0.515	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-40.9	177	48.6	0	0	0	0	112	D597 K598 G603 K604 Y605	D597-T601 WeakPolarHBondContact O-CB 3.36Å; D597-T601 WeakPolarHBondContact O-CG2 3.49Å; D597-T601 PolarHBondContact O-N 2.92Å; D597-T601 PolarHBondContact O-OG1 3.34Å; K598-T601 WeakPolarHBondContact CA-OG1 3.39Å; K598-T601 PolarHBondContact O-OG1 2.92Å; T601-G603 VanDerWaalsContact C-N 3.32Å; T601-G603 PolarHBondContact O-N 3.48Å; T601-K604 PolarHBondContact O-N 3.44Å; T601-Y605 PolarHBondContact O-N 2.9Å
602	S	92.9	Very high	96.3	Very high	74 Å²	74	107.6 Å²	107.6	52%	0.517	52%	0.522	S	S	.	.	H	α-helix	trans	-61.8	-38.6	173.2	-174.7	0	0	0	0	112.4	K598 R599 Y605 Q606	K598-S602 WeakPolarHBondContact O-CB 3.34Å; K598-S602 PolarHBondContact O-N 3.37Å; R599-S602 PolarHBondContact O-N 3.26Å; S602-Y605 PolarHBondContact O-N 3.37Å; S602-Q606 PolarHBondContact O-N 2.81Å
603	G	96.3	Very high	96.3	Very high	32 Å²	32	105.6 Å²	105.6	33%	0.33	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-49.9	174.5	0	0	0	0	0	111.5	R599 F600 T601 Y605 Q606 D607	R599-G603 PolarHBondContact O-N 3.46Å; F600-G603 PolarHBondContact O-N 3.44Å; T601-G603 VanDerWaalsContact C-N 3.32Å; T601-G603 PolarHBondContact O-N 3.48Å; G603-Y605 VanDerWaalsContact C-N 3.3Å; G603-Y605 PolarHBondContact O-N 3.45Å; G603-Q606 WeakPolarHBondContact O-CA 3.45Å; G603-Q606 WeakPolarHBondContact O-CB 3.48Å; G603-Q606 PolarHBondContact O-N 3.11Å; G603-D607 PolarHBondContact O-N 2.95Å
604	K	97.1	Very high	96.4	Very high	112 Å²	112	106 Å²	106	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-58.3	-40.4	175.4	-73.2	-175.4	169.8	-177.9	0	113.4	F600 T601 Q606 D607 V608	F600-K604 HydrophobicContact CD1-CD 4.41Å; F600-K604 HydrophobicContact CE1-CD 3.98Å; F600-K604 HydrophobicContact CZ-CD 4.21Å; F600-K604 VanDerWaalsContact CZ-NZ 3.33Å; F600-K604 PolarHBondContact O-N 3.18Å; T601-K604 PolarHBondContact O-N 3.44Å; K604-Q606 VanDerWaalsContact C-N 3.3Å; K604-Q606 PolarHBondContact O-N 3.32Å; K604-D607 PolarHBondContact O-N 3.1Å; K604-V608 WeakPolarHBondContact O-CG2 3.32Å; K604-V608 PolarHBondContact O-N 3.41Å
605	Y	95.2	Very high	96.5	Very high	160 Å²	160	105.2 Å²	105.2	63%	0.627	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-42.5	175.4	176.2	-92.5	0	0	0	111.1	T601 S602 G603 V608 Y609	T601-Y605 PolarHBondContact O-N 2.9Å; S602-Y605 PolarHBondContact O-N 3.37Å; G603-Y605 VanDerWaalsContact C-N 3.3Å; G603-Y605 PolarHBondContact O-N 3.45Å; Y605-V608 PolarHBondContact O-N 3.39Å; Y605-Y609 WeakPolarHBondContact O-CB 3.39Å; Y605-Y609 PolarHBondContact O-N 2.84Å
606	Q	97.6	Very high	96.6	Very high	101 Å²	101	106.3 Å²	106.3	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-42.9	176.1	-171.3	64.3	23.6	0	0	111.8	S602 G603 K604 Y609 V610	S602-Q606 PolarHBondContact O-N 2.81Å; G603-Q606 WeakPolarHBondContact O-CA 3.45Å; G603-Q606 WeakPolarHBondContact O-CB 3.48Å; G603-Q606 PolarHBondContact O-N 3.11Å; K604-Q606 VanDerWaalsContact C-N 3.3Å; K604-Q606 PolarHBondContact O-N 3.32Å; Q606-Y609 WeakPolarHBondContact O-CB 3.43Å; Q606-Y609 PolarHBondContact O-N 3.19Å; Q606-V610 VanDerWaalsContact O-CG2 3.3Å; Q606-V610 WeakPolarHBondContact O-CG2 3.22Å; Q606-V610 PolarHBondContact O-N 3.04Å
607	D	96.3	Very high	96.6	Very high	101 Å²	101	103.2 Å²	103.2	54%	0.54	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-48.7	177.9	-63.1	-25	0	0	0	111	G603 K604 Y609 V610 E611	G603-D607 PolarHBondContact O-N 2.95Å; K604-D607 PolarHBondContact O-N 3.1Å; D607-Y609 VanDerWaalsContact C-N 3.32Å; D607-Y609 PolarHBondContact O-N 2.91Å; D607-V610 PolarHBondContact O-N 3.35Å; D607-E611 WeakPolarHBondContact O-CG 3.41Å; D607-E611 PolarHBondContact O-N 3.09Å
608	V	97.3	Very high	96.7	Very high	90 Å²	90	106.9 Å²	106.9	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-40.5	176.6	172.5	0	0	0	0	111.5	K604 Y605 V610 E611 L612	K604-V608 WeakPolarHBondContact O-CG2 3.32Å; K604-V608 PolarHBondContact O-N 3.41Å; Y605-V608 PolarHBondContact O-N 3.39Å; V608-V610 VanDerWaalsContact C-N 3.33Å; V608-V610 PolarHBondContact O-N 3.33Å; V608-E611 PolarHBondContact O-N 2.9Å; V608-L612 WeakPolarHBondContact O-CB 3.36Å; V608-L612 PolarHBondContact O-N 2.72Å
609	Y	96.8	Very high	96.6	Very high	133 Å²	133	101.7 Å²	101.7	52%	0.522	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-42.5	176.6	-178.8	-92.1	0	0	0	111.7	Y605 Q606 D607 L612 S613	Y605-Y609 WeakPolarHBondContact O-CB 3.39Å; Y605-Y609 PolarHBondContact O-N 2.84Å; Q606-Y609 WeakPolarHBondContact O-CB 3.43Å; Q606-Y609 PolarHBondContact O-N 3.19Å; D607-Y609 VanDerWaalsContact C-N 3.32Å; D607-Y609 PolarHBondContact O-N 2.91Å; Y609-L612 PolarHBondContact O-N 3.22Å; Y609-S613 WeakPolarHBondContact O-CB 3.35Å; Y609-S613 PolarHBondContact O-N 2.91Å
610	V	98	Very high	96.6	Very high	59 Å²	59	98 Å²	98	36%	0.358	49%	0.49	S	S	.	.	H	α-helix	trans	-65.4	-46.7	176.8	171.9	0	0	0	0	110.6	Q606 D607 V608 L612 S613 H614	Q606-V610 VanDerWaalsContact O-CG2 3.3Å; Q606-V610 WeakPolarHBondContact O-CG2 3.22Å; Q606-V610 PolarHBondContact O-N 3.04Å; D607-V610 PolarHBondContact O-N 3.35Å; V608-V610 VanDerWaalsContact C-N 3.33Å; V608-V610 PolarHBondContact O-N 3.33Å; V610-L612 VanDerWaalsContact C-N 3.35Å; V610-L612 PolarHBondContact O-N 2.74Å; V610-S613 WeakPolarHBondContact O-CB 3.33Å; V610-S613 PolarHBondContact O-N 3.12Å; V610-H614 WeakPolarHBondContact CG1-CE1 3.26Å; V610-H614 WeakPolarHBondContact CG1-ND1 3.48Å; V610-H614 PolarHBondContact O-N 3.48Å; V610-H614 PolarHBondContact O-ND1 3.39Å
611	E	97.4	Very high	96.6	Very high	127 Å²	127	99.2 Å²	99.2	59%	0.593	49%	0.492	S	S	*	.	H	α-helix	trans	-58.4	-45.6	176	-73.4	-177.4	170.7	0	0	111.8	D607 V608 S613 H614 I615	D607-E611 WeakPolarHBondContact O-CG 3.41Å; D607-E611 PolarHBondContact O-N 3.09Å; V608-E611 PolarHBondContact O-N 2.9Å; E611-S613 VanDerWaalsContact C-N 3.32Å; E611-S613 PolarHBondContact O-N 3.23Å; E611-H614 PolarHBondContact O-N 2.96Å; E611-H614 VanDerWaalsContact O-N 3.13Å; E611-I615 WeakPolarHBondContact O-CG1 3.42Å; E611-I615 PolarHBondContact O-N 3.41Å
612	L	97	Very high	96.8	Very high	113 Å²	113	99.1 Å²	99.1	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-61.7	-40.9	177.5	-172.7	67.9	0	0	0	111.6	V608 Y609 V610 H614 I615 K616	V608-L612 WeakPolarHBondContact O-CB 3.36Å; V608-L612 PolarHBondContact O-N 2.72Å; Y609-L612 PolarHBondContact O-N 3.22Å; V610-L612 VanDerWaalsContact C-N 3.35Å; V610-L612 PolarHBondContact O-N 2.74Å; L612-H614 VanDerWaalsContact C-N 3.34Å; L612-H614 PolarHBondContact O-N 3.37Å; L612-I615 PolarHBondContact O-N 3.16Å; L612-K616 VanDerWaalsContact O-CB 3.28Å; L612-K616 WeakPolarHBondContact O-CB 3.18Å; L612-K616 PolarHBondContact O-N 2.85Å
613	S	96.7	Very high	97	Very high	57 Å²	57	99.6 Å²	99.6	40%	0.399	48%	0.481	S	S	.	.	H	α-helix	trans	-62.2	-41.2	174.4	-171.8	0	0	0	0	111.7	Y609 V610 E611 K616 T617	Y609-S613 WeakPolarHBondContact O-CB 3.35Å; Y609-S613 PolarHBondContact O-N 2.91Å; V610-S613 WeakPolarHBondContact O-CB 3.33Å; V610-S613 PolarHBondContact O-N 3.12Å; E611-S613 VanDerWaalsContact C-N 3.32Å; E611-S613 PolarHBondContact O-N 3.23Å; S613-K616 PolarHBondContact O-N 3.23Å; S613-T617 PolarHBondContact O-N 2.98Å; S613-T617 PolarHBondContact O-OG1 3.28Å
614	H	98	Very high	97	Very high	125 Å²	125	102.5 Å²	102.5	58%	0.579	49%	0.486	S	S	*	.	H	α-helix	trans	-65.9	-45.2	177.7	-76.8	83.8	0	0	0	111.8	V610 E611 L612 K616 T617 R618	V610-H614 WeakPolarHBondContact CG1-CE1 3.26Å; V610-H614 WeakPolarHBondContact CG1-ND1 3.48Å; V610-H614 PolarHBondContact O-N 3.48Å; V610-H614 PolarHBondContact O-ND1 3.39Å; E611-H614 PolarHBondContact O-N 2.96Å; E611-H614 VanDerWaalsContact O-N 3.13Å; L612-H614 VanDerWaalsContact C-N 3.34Å; L612-H614 PolarHBondContact O-N 3.37Å; H614-K616 VanDerWaalsContact C-N 3.33Å; H614-T617 PolarHBondContact O-N 3.17Å; H614-R618 WeakPolarHBondContact O-CB 3.41Å; H614-R618 PolarHBondContact O-N 2.85Å
615	I	97.6	Very high	97	Very high	109 Å²	109	102.8 Å²	102.8	56%	0.559	49%	0.489	S	S	*	.	H	α-helix	trans	-60.8	-45.7	176.5	-67.4	167.2	0	0	0	110	E611 L612 T617 R618 S619	E611-I615 WeakPolarHBondContact O-CG1 3.42Å; E611-I615 PolarHBondContact O-N 3.41Å; L612-I615 PolarHBondContact O-N 3.16Å; I615-T617 PolarHBondContact O-N 2.94Å; I615-R618 PolarHBondContact O-N 3.4Å; I615-S619 WeakPolarHBondContact O-CB 3.38Å; I615-S619 PolarHBondContact O-N 2.88Å; I615-S619 PolarHBondContact O-OG 3.29Å
616	K	97.5	Very high	97.1	Very high	122 Å²	122	100.8 Å²	100.8	53%	0.53	49%	0.489	S	S	.	.	H	α-helix	trans	-55.5	-55.2	176.7	179.1	-179.4	171.9	-177.5	0	111	L612 S613 H614 R618 S619 E620	L612-K616 VanDerWaalsContact O-CB 3.28Å; L612-K616 WeakPolarHBondContact O-CB 3.18Å; L612-K616 PolarHBondContact O-N 2.85Å; S613-K616 PolarHBondContact O-N 3.23Å; H614-K616 VanDerWaalsContact C-N 3.33Å; K616-R618 VanDerWaalsContact C-N 3.27Å; K616-R618 PolarHBondContact O-N 3.31Å; K616-S619 PolarHBondContact O-N 3.45Å; K616-S619 VanDerWaalsContact O-N 3.14Å; K616-S619 PolarHBondContact O-OG 2.89Å; K616-E620 WeakPolarHBondContact CE-OE1 3.3Å; K616-E620 IonicContact NZ-OE1 3.68Å; K616-E620 WeakPolarHBondContact O-CG 3.35Å; K616-E620 PolarHBondContact O-N 3.1Å
617	T	97.5	Very high	97.1	Very high	47 Å²	47	101.9 Å²	101.9	29%	0.288	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-33.1	-178.9	-49.7	0	0	0	0	112.4	S613 H614 I615 R621	S613-T617 PolarHBondContact O-N 2.98Å; S613-T617 PolarHBondContact O-OG1 3.28Å; H614-T617 PolarHBondContact O-N 3.17Å; I615-T617 PolarHBondContact O-N 2.94Å; T617-R621 VanDerWaalsContact CG2-CZ 3.5Å; T617-R621 VanDerWaalsContact CG2-NH2 3.34Å; T617-R621 WeakPolarHBondContact O-CG 3.47Å; T617-R621 PolarHBondContact O-N 3.42Å
618	R	97.4	Very high	97.1	Very high	164 Å²	164	101 Å²	101	62%	0.619	48%	0.484	S	S	*	.	H	α-helix	trans	-65.2	-48.6	172.7	179.4	178.9	174.3	162.3	1.3	111.6	H614 I615 K616 E620 R621 E622	H614-R618 WeakPolarHBondContact O-CB 3.41Å; H614-R618 PolarHBondContact O-N 2.85Å; I615-R618 PolarHBondContact O-N 3.4Å; K616-R618 VanDerWaalsContact C-N 3.27Å; K616-R618 PolarHBondContact O-N 3.31Å; R618-E620 VanDerWaalsContact C-N 3.31Å; R618-E620 PolarHBondContact O-N 3.3Å; R618-R621 PolarHBondContact O-N 3.19Å; R618-E622 WeakPolarHBondContact CG-OE1 3.4Å; R618-E622 IonicContact CZ-OE1 2.75Å; R618-E622 IonicContact NE-OE1 2.81Å; R618-E622 PolarHBondContact NE-OE1 3.23Å; R618-E622 IonicContact NH2-OE1 2.73Å; R618-E622 PolarHBondContact NH2-OE1 3.49Å; R618-E622 WeakPolarHBondContact O-CG 3.31Å; R618-E622 PolarHBondContact O-N 3.02Å
619	S	95	Very high	97.1	Very high	45 Å²	45	102.5 Å²	102.5	32%	0.315	49%	0.485	S	S	.	.	H	α-helix	trans	-62.4	-38	179.7	67.8	0	0	0	0	112.3	I615 K616 E622 I623	I615-S619 WeakPolarHBondContact O-CB 3.38Å; I615-S619 PolarHBondContact O-N 2.88Å; I615-S619 PolarHBondContact O-OG 3.29Å; K616-S619 PolarHBondContact O-N 3.45Å; K616-S619 VanDerWaalsContact O-N 3.14Å; K616-S619 PolarHBondContact O-OG 2.89Å; S619-E622 PolarHBondContact O-N 2.98Å; S619-I623 WeakPolarHBondContact O-CB 3.42Å; S619-I623 WeakPolarHBondContact O-CD1 3.46Å; S619-I623 WeakPolarHBondContact O-CG1 3.46Å; S619-I623 PolarHBondContact O-N 2.88Å
620	E	96.6	Very high	97.1	Very high	78 Å²	78	101.4 Å²	101.4	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-58	-54.3	172.2	-73	168.5	168.9	0	0	109.8	K616 R618 E622 I623 E624	K616-E620 WeakPolarHBondContact CE-OE1 3.3Å; K616-E620 IonicContact NZ-OE1 3.68Å; K616-E620 WeakPolarHBondContact O-CG 3.35Å; K616-E620 PolarHBondContact O-N 3.1Å; R618-E620 VanDerWaalsContact C-N 3.31Å; R618-E620 PolarHBondContact O-N 3.3Å; E620-E622 VanDerWaalsContact C-N 3.31Å; E620-E622 PolarHBondContact O-N 3.28Å; E620-I623 WeakPolarHBondContact O-CA 3.38Å; E620-I623 WeakPolarHBondContact O-CB 3.41Å; E620-I623 PolarHBondContact O-N 3.18Å; E620-E624 VanDerWaalsContact O-CD 3.24Å; E620-E624 PolarHBondContact O-N 3.42Å
621	R	96.6	Very high	97.1	Very high	151 Å²	151	105.2 Å²	105.2	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-57.1	-41	177.7	-68.2	-177.3	-161	111.8	-4.6	113.7	T617 R618 E624 Q625	T617-R621 VanDerWaalsContact CG2-CZ 3.5Å; T617-R621 VanDerWaalsContact CG2-NH2 3.34Å; T617-R621 WeakPolarHBondContact O-CG 3.47Å; T617-R621 PolarHBondContact O-N 3.42Å; R618-R621 PolarHBondContact O-N 3.19Å; R621-E624 PolarHBondContact O-N 2.96Å; R621-Q625 VanDerWaalsContact O-CG 3.31Å; R621-Q625 WeakPolarHBondContact O-CG 3.21Å; R621-Q625 PolarHBondContact O-N 2.95Å
622	E	97.3	Very high	97.1	Very high	81 Å²	81	103.1 Å²	103.1	38%	0.379	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-41.1	177	-73	172	-175.4	0	0	111.1	R618 S619 E620 Q625 L626	R618-E622 WeakPolarHBondContact CG-OE1 3.4Å; R618-E622 IonicContact CZ-OE1 2.75Å; R618-E622 IonicContact NE-OE1 2.81Å; R618-E622 PolarHBondContact NE-OE1 3.23Å; R618-E622 IonicContact NH2-OE1 2.73Å; R618-E622 PolarHBondContact NH2-OE1 3.49Å; R618-E622 WeakPolarHBondContact O-CG 3.31Å; R618-E622 PolarHBondContact O-N 3.02Å; S619-E622 PolarHBondContact O-N 2.98Å; E620-E622 VanDerWaalsContact C-N 3.31Å; E620-E622 PolarHBondContact O-N 3.28Å; E622-Q625 PolarHBondContact O-N 3.32Å; E622-L626 WeakPolarHBondContact O-CB 3.48Å; E622-L626 VanDerWaalsContact O-CG 3.29Å; E622-L626 WeakPolarHBondContact O-CG 3.42Å; E622-L626 PolarHBondContact O-N 2.84Å
623	I	97.2	Very high	97	Very high	85 Å²	85	100.1 Å²	100.1	44%	0.436	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-45.3	173.4	-70.6	164.1	0	0	0	110.7	S619 E620 Q625 L626 K627	S619-I623 WeakPolarHBondContact O-CB 3.42Å; S619-I623 WeakPolarHBondContact O-CD1 3.46Å; S619-I623 WeakPolarHBondContact O-CG1 3.46Å; S619-I623 PolarHBondContact O-N 2.88Å; E620-I623 WeakPolarHBondContact O-CA 3.38Å; E620-I623 WeakPolarHBondContact O-CB 3.41Å; E620-I623 PolarHBondContact O-N 3.18Å; I623-Q625 VanDerWaalsContact C-N 3.35Å; I623-Q625 PolarHBondContact O-N 3.09Å; I623-L626 PolarHBondContact O-N 3.02Å; I623-K627 HydrophobicContact CG2-CD 4.18Å; I623-K627 VanDerWaalsContact CG2-CE 3.46Å; I623-K627 VanDerWaalsContact O-CG 3.29Å; I623-K627 WeakPolarHBondContact O-CG 3.35Å; I623-K627 PolarHBondContact O-N 2.88Å
624	E	97	Very high	96.9	Very high	93 Å²	93	102.2 Å²	102.2	44%	0.435	48%	0.484	S	S	.	.	H	α-helix	trans	-62	-40.9	176.6	-89.6	69.9	-106.5	0	0	112.3	E620 R621 K627 E628	E620-E624 VanDerWaalsContact O-CD 3.24Å; E620-E624 PolarHBondContact O-N 3.42Å; R621-E624 PolarHBondContact O-N 2.96Å; E624-K627 PolarHBondContact O-N 3.29Å; E624-K627 IonicContact OE1-NZ 2.71Å; E624-K627 PolarHBondContact OE1-NZ 2.88Å; E624-E628 PolarHBondContact O-N 3.13Å
625	Q	97.4	Very high	96.7	Very high	117 Å²	117	98.1 Å²	98.1	55%	0.547	47%	0.473	S	S	.	.	H	α-helix	trans	-64.5	-43.5	174.6	-73.9	173.4	-2	0	0	112.2	R621 E622 I623 K627 E628 H629	R621-Q625 VanDerWaalsContact O-CG 3.31Å; R621-Q625 WeakPolarHBondContact O-CG 3.21Å; R621-Q625 PolarHBondContact O-N 2.95Å; E622-Q625 PolarHBondContact O-N 3.32Å; I623-Q625 VanDerWaalsContact C-N 3.35Å; I623-Q625 PolarHBondContact O-N 3.09Å; Q625-K627 VanDerWaalsContact C-N 3.35Å; Q625-E628 PolarHBondContact O-N 3.36Å; Q625-H629 PolarHBondContact O-CD2 3.28Å; Q625-H629 PolarHBondContact O-N 3.37Å
626	L	97.4	Very high	96.5	Very high	119 Å²	119	95.5 Å²	95.5	62%	0.623	47%	0.467	S	S	*	.	H	α-helix	trans	-64.2	-39.4	177.3	-73.1	171.9	0	0	0	111.9	E622 I623 E628 H629 L630	E622-L626 WeakPolarHBondContact O-CB 3.48Å; E622-L626 VanDerWaalsContact O-CG 3.29Å; E622-L626 WeakPolarHBondContact O-CG 3.42Å; E622-L626 PolarHBondContact O-N 2.84Å; I623-L626 PolarHBondContact O-N 3.02Å; L626-E628 VanDerWaalsContact C-N 3.31Å; L626-E628 PolarHBondContact O-N 3.43Å; L626-H629 PolarHBondContact O-N 2.79Å; L626-L630 WeakPolarHBondContact O-CB 3.45Å; L626-L630 PolarHBondContact O-N 3.49Å
627	K	97	Very high	96.2	Very high	123 Å²	123	94.4 Å²	94.4	54%	0.535	47%	0.466	S	S	.	.	H	α-helix	trans	-59.6	-43	172.3	-73.5	169.5	-175	162.2	0	111.3	I623 E624 Q625 L630 R631	I623-K627 HydrophobicContact CG2-CD 4.18Å; I623-K627 VanDerWaalsContact CG2-CE 3.46Å; I623-K627 VanDerWaalsContact O-CG 3.29Å; I623-K627 WeakPolarHBondContact O-CG 3.35Å; I623-K627 PolarHBondContact O-N 2.88Å; E624-K627 PolarHBondContact O-N 3.29Å; E624-K627 IonicContact OE1-NZ 2.71Å; E624-K627 PolarHBondContact OE1-NZ 2.88Å; Q625-K627 VanDerWaalsContact C-N 3.35Å; K627-L630 PolarHBondContact O-N 2.89Å; K627-R631 PolarHBondContact O-N 3.45Å
628	E	97.3	Very high	95.9	Very high	82 Å²	82	95.2 Å²	95.2	38%	0.383	47%	0.467	S	S	.	.	H	α-helix	trans	-69.5	-41.3	178.8	-177	57.8	-163.2	0	0	112.3	E624 Q625 L626 L630 R631 L632	E624-E628 PolarHBondContact O-N 3.13Å; Q625-E628 PolarHBondContact O-N 3.36Å; L626-E628 VanDerWaalsContact C-N 3.31Å; L626-E628 PolarHBondContact O-N 3.43Å; E628-L630 VanDerWaalsContact C-N 3.32Å; E628-L630 PolarHBondContact O-N 2.95Å; E628-R631 VanDerWaalsContact CD-NE 3.33Å; E628-R631 WeakPolarHBondContact O-CB 3.33Å; E628-R631 PolarHBondContact O-N 3Å; E628-R631 IonicContact OE1-CZ 3.11Å; E628-R631 VanDerWaalsContact OE1-CZ 3.3Å; E628-R631 IonicContact OE1-NE 2.64Å; E628-R631 PolarHBondContact OE1-NE 3.33Å; E628-R631 VanDerWaalsContact OE1-NE 3.11Å; E628-R631 IonicContact OE1-NH2 2.95Å; E628-R631 PolarHBondContact OE1-NH2 3.33Å; E628-R631 IonicContact OE2-CZ 3.09Å; E628-R631 IonicContact OE2-NE 3.11Å; E628-R631 PolarHBondContact OE2-NE 2.89Å; E628-R631 IonicContact OE2-NH2 3.59Å; E628-L632 HydrophobicContact CG-CD1 4.42Å; E628-L632 WeakPolarHBondContact O-CG 3.26Å; E628-L632 PolarHBondContact O-N 3.47Å
629	H	97.1	Very high	95.5	Very high	123 Å²	123	93.8 Å²	93.8	57%	0.569	47%	0.467	S	S	*	.	H	α-helix	trans	-60.9	-41.6	172.9	-78.9	-57	0	0	0	112.2	Q625 L626 L632 A633	Q625-H629 PolarHBondContact O-CD2 3.28Å; Q625-H629 PolarHBondContact O-N 3.37Å; L626-H629 PolarHBondContact O-N 2.79Å; H629-L632 PolarHBondContact O-N 3.44Å; H629-A633 VanDerWaalsContact O-CB 3.3Å; H629-A633 WeakPolarHBondContact O-CB 3.45Å; H629-A633 PolarHBondContact O-N 3.14Å
630	L	96.8	Very high	95.2	Very high	109 Å²	109	98.7 Å²	98.7	57%	0.571	48%	0.483	S	S	*	.	H	α-helix	trans	-61.6	-45.2	174.4	-179	62.5	0	0	0	110.8	L626 K627 E628 L632 A633 M634	L626-L630 WeakPolarHBondContact O-CB 3.45Å; L626-L630 PolarHBondContact O-N 3.49Å; K627-L630 PolarHBondContact O-N 2.89Å; E628-L630 VanDerWaalsContact C-N 3.32Å; E628-L630 PolarHBondContact O-N 2.95Å; L630-L632 VanDerWaalsContact C-N 3.34Å; L630-L632 PolarHBondContact O-N 3.22Å; L630-A633 PolarHBondContact O-N 3.45Å; L630-M634 HydrophobicContact CD1-CG 4.36Å; L630-M634 HydrophobicContact CD1-SD 4.43Å; L630-M634 HydrophobicContact CG-SD 4.16Å; L630-M634 WeakPolarHBondContact O-CB 3.29Å; L630-M634 VanDerWaalsContact O-CG 3.27Å; L630-M634 WeakPolarHBondContact O-CG 3.42Å; L630-M634 PolarHBondContact O-N 2.94Å
631	R	97.6	Very high	94.6	Very high	139 Å²	139	99.4 Å²	99.4	53%	0.525	49%	0.486	S	S	.	.	H	α-helix	trans	-57	-46	175.8	-168.5	-168.5	73.1	78.8	0.9	111.8	K627 E628 A635	K627-R631 PolarHBondContact O-N 3.45Å; E628-R631 VanDerWaalsContact CD-NE 3.33Å; E628-R631 WeakPolarHBondContact O-CB 3.33Å; E628-R631 PolarHBondContact O-N 3Å; E628-R631 IonicContact OE1-CZ 3.11Å; E628-R631 VanDerWaalsContact OE1-CZ 3.3Å; E628-R631 IonicContact OE1-NE 2.64Å; E628-R631 PolarHBondContact OE1-NE 3.33Å; E628-R631 VanDerWaalsContact OE1-NE 3.11Å; E628-R631 IonicContact OE1-NH2 2.95Å; E628-R631 PolarHBondContact OE1-NH2 3.33Å; E628-R631 IonicContact OE2-CZ 3.09Å; E628-R631 IonicContact OE2-NE 3.11Å; E628-R631 PolarHBondContact OE2-NE 2.89Å; E628-R631 IonicContact OE2-NH2 3.59Å; R631-A635 PolarHBondContact O-N 3.2Å
632	L	97.3	Very high	93.8	Very high	84 Å²	84	94.8 Å²	94.8	44%	0.44	48%	0.477	S	S	.	.	H	α-helix	trans	-68.8	-39.1	178	-69	173.7	0	0	0	112.6	E628 H629 L630 A635 A636	E628-L632 HydrophobicContact CG-CD1 4.42Å; E628-L632 WeakPolarHBondContact O-CG 3.26Å; E628-L632 PolarHBondContact O-N 3.47Å; H629-L632 PolarHBondContact O-N 3.44Å; L630-L632 VanDerWaalsContact C-N 3.34Å; L630-L632 PolarHBondContact O-N 3.22Å; L632-A635 PolarHBondContact O-N 2.87Å; L632-A636 WeakPolarHBondContact O-CB 3.49Å; L632-A636 PolarHBondContact O-N 3.37Å
633	A	95.1	Very high	93	Very high	50 Å²	50	96.5 Å²	96.5	41%	0.413	49%	0.486	S	S	.	.	H	α-helix	trans	-65.6	-40.8	176.5	0	0	0	0	0	111.5	H629 L630 A636 L637	H629-A633 VanDerWaalsContact O-CB 3.3Å; H629-A633 WeakPolarHBondContact O-CB 3.45Å; H629-A633 PolarHBondContact O-N 3.14Å; L630-A633 PolarHBondContact O-N 3.45Å; A633-A636 PolarHBondContact O-N 3.44Å; A633-L637 WeakPolarHBondContact O-CG 3.23Å; A633-L637 PolarHBondContact O-N 3.47Å
634	M	95.1	Very high	92	Very high	100 Å²	100	101.6 Å²	101.6	49%	0.493	50%	0.5	S	S	.	.	H	α-helix	trans	-59.8	-47	171.3	-70.9	176.2	69.5	0	0	110.6	L630 A636 L637 Q638	L630-M634 HydrophobicContact CD1-CG 4.36Å; L630-M634 HydrophobicContact CD1-SD 4.43Å; L630-M634 HydrophobicContact CG-SD 4.16Å; L630-M634 WeakPolarHBondContact O-CB 3.29Å; L630-M634 VanDerWaalsContact O-CG 3.27Å; L630-M634 WeakPolarHBondContact O-CG 3.42Å; L630-M634 PolarHBondContact O-N 2.94Å; M634-A636 PolarHBondContact O-N 3.29Å; M634-L637 PolarHBondContact O-N 3.46Å; M634-Q638 VanDerWaalsContact O-CG 3.24Å; M634-Q638 WeakPolarHBondContact O-CG 3.3Å; M634-Q638 PolarHBondContact O-N 3.37Å
635	A	93.8	Very high	90.7	Very high	40 Å²	40	102 Å²	102	33%	0.331	51%	0.506	S	S	.	.	H	α-helix	trans	-60.4	-41.1	176.6	0	0	0	0	0	113	R631 L632 Q638 E639	R631-A635 PolarHBondContact O-N 3.2Å; L632-A635 PolarHBondContact O-N 2.87Å; A635-Q638 WeakPolarHBondContact O-CB 3.49Å; A635-Q638 PolarHBondContact O-N 2.87Å; A635-E639 PolarHBondContact O-N 3.3Å
636	A	93.3	Very high	89.4	Confident	53 Å²	53	100.2 Å²	100.2	44%	0.438	51%	0.506	S	S	.	.	H	α-helix	trans	-68.9	-34.4	177.7	0	0	0	0	0	112.9	L632 A633 M634 E639 K640	L632-A636 WeakPolarHBondContact O-CB 3.49Å; L632-A636 PolarHBondContact O-N 3.37Å; A633-A636 PolarHBondContact O-N 3.44Å; M634-A636 PolarHBondContact O-N 3.29Å; A636-E639 PolarHBondContact O-N 3.13Å; A636-K640 WeakPolarHBondContact O-CB 3.5Å; A636-K640 PolarHBondContact O-N 3.44Å
637	L	91.4	Very high	88	Confident	100 Å²	100	101.5 Å²	101.5	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-44.1	172.7	-75.1	171.9	0	0	0	110.9	A633 M634 E639 K640 E641	A633-L637 WeakPolarHBondContact O-CG 3.23Å; A633-L637 PolarHBondContact O-N 3.47Å; M634-L637 PolarHBondContact O-N 3.46Å; L637-E639 VanDerWaalsContact C-N 3.33Å; L637-E639 PolarHBondContact O-N 2.85Å; L637-K640 PolarHBondContact O-N 3.29Å; L637-E641 WeakPolarHBondContact O-CB 3.42Å; L637-E641 WeakPolarHBondContact O-CG 3.23Å; L637-E641 PolarHBondContact O-N 2.85Å
638	Q	90.8	Very high	86	Confident	64 Å²	64	99.9 Å²	99.9	30%	0.299	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-40.9	175.1	-66.5	173.3	-17.3	0	0	111.9	W430 M634 A635 E641 S642	W430-Q638 HydrophobicContact CH2-CB 4.45Å; W430-Q638 HydrophobicContact CH2-CG 3.89Å; W430-Q638 VanDerWaalsContact CH2-NE2 3.25Å; W430-Q638 HydrophobicContact CZ2-CB 3.65Å; W430-Q638 VanDerWaalsContact CZ2-CD 3.44Å; W430-Q638 HydrophobicContact CZ2-CG 3.46Å; W430-Q638 VanDerWaalsContact CZ2-CG 3.46Å; M634-Q638 VanDerWaalsContact O-CG 3.24Å; M634-Q638 WeakPolarHBondContact O-CG 3.3Å; M634-Q638 PolarHBondContact O-N 3.37Å; A635-Q638 WeakPolarHBondContact O-CB 3.49Å; A635-Q638 PolarHBondContact O-N 2.87Å; Q638-E641 PolarHBondContact O-N 3.21Å; Q638-S642 WeakPolarHBondContact O-CB 3.48Å; Q638-S642 PolarHBondContact O-N 2.79Å
639	E	88.6	Confident	83.5	Confident	133 Å²	133	107 Å²	107	62%	0.621	56%	0.555	S	S	*	*	H	α-helix	trans	-65.8	-41	175.5	-169.7	-179	-176.6	0	0	112	A635 A636 L637 S642 M643	A635-E639 PolarHBondContact O-N 3.3Å; A636-E639 PolarHBondContact O-N 3.13Å; L637-E639 VanDerWaalsContact C-N 3.33Å; L637-E639 PolarHBondContact O-N 2.85Å; E639-S642 WeakPolarHBondContact O-CB 3.42Å; E639-S642 PolarHBondContact O-N 3.36Å; E639-M643 WeakPolarHBondContact O-CB 3.47Å; E639-M643 VanDerWaalsContact O-CG 3.27Å; E639-M643 WeakPolarHBondContact O-CG 3.34Å; E639-M643 PolarHBondContact O-N 3.31Å
640	K	88.1	Confident	82.8	Confident	148 Å²	148	106.2 Å²	106.2	64%	0.643	56%	0.555	S	S	*	*	H	α-helix	trans	-64.8	-40.7	175.7	-179.5	-175.6	174.7	-173.8	0	112	A636 L637 M643 R644	A636-K640 WeakPolarHBondContact O-CB 3.5Å; A636-K640 PolarHBondContact O-N 3.44Å; L637-K640 PolarHBondContact O-N 3.29Å; K640-M643 PolarHBondContact O-N 2.84Å; K640-R644 WeakPolarHBondContact O-CB 3.4Å; K640-R644 PolarHBondContact O-N 2.88Å
641	E	84.4	Confident	82.1	Confident	94 Å²	94	106.1 Å²	106.1	44%	0.439	55%	0.554	S	S	.	*	H	α-helix	trans	-65.9	-42.9	175.7	-75.5	170.6	173.5	0	0	110.9	L637 Q638 M643 R644 N645	L637-E641 WeakPolarHBondContact O-CB 3.42Å; L637-E641 WeakPolarHBondContact O-CG 3.23Å; L637-E641 PolarHBondContact O-N 2.85Å; Q638-E641 PolarHBondContact O-N 3.21Å; E641-M643 PolarHBondContact O-N 3.39Å; E641-R644 PolarHBondContact O-N 2.71Å; E641-N645 PolarHBondContact O-N 2.9Å; E641-N645 PolarHBondContact O-ND2 2.8Å; E641-N645 PolarHBondContact O-OD1 3.22Å
642	S	79.1	Confident	81.2	Confident	54 Å²	54	104.2 Å²	104.2	38%	0.378	56%	0.555	S	S	.	*	H	α-helix	trans	-55.7	-51.5	171.7	-176.9	0	0	0	0	111.8	Q638 E639 R644 N645 S646	Q638-S642 WeakPolarHBondContact O-CB 3.48Å; Q638-S642 PolarHBondContact O-N 2.79Å; E639-S642 WeakPolarHBondContact O-CB 3.42Å; E639-S642 PolarHBondContact O-N 3.36Å; S642-R644 VanDerWaalsContact C-N 3.35Å; S642-R644 PolarHBondContact O-N 3.34Å; S642-N645 WeakPolarHBondContact O-CB 3.24Å; S642-N645 PolarHBondContact O-N 3.44Å; S642-N645 VanDerWaalsContact O-N 3.16Å; S642-S646 PolarHBondContact O-N 3.42Å; S642-S646 PolarHBondContact O-OG 3.07Å
643	M	80.9	Confident	80.3	Confident	116 Å²	116	105.4 Å²	105.4	57%	0.571	56%	0.562	S	S	*	*	H	α-helix	trans	-63.1	-36.4	178.1	-71	-112.6	-70.7	0	0	113.5	E639 K640 E641 N645 S646 L647	E639-M643 WeakPolarHBondContact O-CB 3.47Å; E639-M643 VanDerWaalsContact O-CG 3.27Å; E639-M643 WeakPolarHBondContact O-CG 3.34Å; E639-M643 PolarHBondContact O-N 3.31Å; K640-M643 PolarHBondContact O-N 2.84Å; E641-M643 PolarHBondContact O-N 3.39Å; M643-N645 VanDerWaalsContact C-N 3.31Å; M643-S646 PolarHBondContact O-N 2.91Å; M643-L647 PolarHBondContact O-N 3.41Å
644	R	76.5	Confident	79.4	Confident	192 Å²	192	108.9 Å²	108.9	73%	0.725	57%	0.572	S	S	*	*	H	α-helix	trans	-66.2	-37.6	176.2	-174.9	-178.6	179.2	177.8	-1	111.2	K640 E641 S642 L647 A648	K640-R644 WeakPolarHBondContact O-CB 3.4Å; K640-R644 PolarHBondContact O-N 2.88Å; E641-R644 PolarHBondContact O-N 2.71Å; S642-R644 VanDerWaalsContact C-N 3.35Å; S642-R644 PolarHBondContact O-N 3.34Å; R644-L647 PolarHBondContact O-N 3.03Å; R644-A648 PolarHBondContact O-N 3Å
645	N	71	Confident	78.3	Confident	103 Å²	103	109.5 Å²	109.5	55%	0.551	58%	0.577	S	S	*	*	H	α-helix	trans	-68.7	-37.8	176.3	-64.5	-19	0	0	0	110.9	E641 S642 M643 L647 A648	E641-N645 PolarHBondContact O-N 2.9Å; E641-N645 PolarHBondContact O-ND2 2.8Å; E641-N645 PolarHBondContact O-OD1 3.22Å; S642-N645 WeakPolarHBondContact O-CB 3.24Å; S642-N645 PolarHBondContact O-N 3.44Å; S642-N645 VanDerWaalsContact O-N 3.16Å; M643-N645 VanDerWaalsContact C-N 3.31Å; N645-L647 VanDerWaalsContact C-N 3.28Å; N645-L647 PolarHBondContact O-N 3.14Å; N645-A648 PolarHBondContact O-N 3.33Å
646	S	70.1	Confident	77.2	Confident	78 Å²	78	114.4 Å²	114.4	55%	0.545	59%	0.594	S	S	.	*	H	α-helix	trans	-69.3	-17.7	175.6	-46.6	0	0	0	0	115.3	S642 M643	S642-S646 PolarHBondContact O-N 3.42Å; S642-S646 PolarHBondContact O-OG 3.07Å; M643-S646 PolarHBondContact O-N 2.91Å
647	L	66.5	Low	76	Confident	146 Å²	146	119.2 Å²	119.2	76%	0.764	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-10	177	-87.8	157.7	0	0	0	113.1	M643 R644 N645	M643-L647 PolarHBondContact O-N 3.41Å; R644-L647 PolarHBondContact O-N 3.03Å; N645-L647 VanDerWaalsContact C-N 3.28Å; N645-L647 PolarHBondContact O-N 3.14Å
648	A	56.1	Low	74.7	Confident	90 Å²	90	120.8 Å²	120.8	74%	0.744	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-10.2	179	0	0	0	0	0	112.9	R644 N645	R644-A648 PolarHBondContact O-N 3Å; N645-A648 PolarHBondContact O-N 3.33Å
649	E	44.1	Very low	73.2	Confident	231 Å²	231	125.9 Å²	125.9	100%	1.079	64%	0.642	S	S	*	*			trans	-87.8	0	160.4	-70	-172.6	149.4	0	0	110.6

Retrieved 649 of 649 residues in 975.1 ms (Link to these results)

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